USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1221 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 NoAdj-H: A 125 HIS HD1 : A 125 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 146 HIS HD1 : A 146 HIS ND1 : A 202 ZNZN :(H bumps) USER MOD Set 1.1: A 94 GLN : amide:sc= -0.133 X(o=-2.3,f=-2.8!) USER MOD Set 1.2: A 104 GLN : amide:sc= -2.17 K(o=-2.3,f=-0.29) USER MOD Set 2.1: A 5 THR OG1 : rot 180:sc= -1.22 USER MOD Set 2.2: A 39 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.208) USER MOD Set 3.1: A 1 MET CE :methyl 175:sc= -0.197 (180deg=-0.312) USER MOD Set 3.2: A 3 SER OG : rot 84:sc= 1.73 USER MOD Set 3.3: A 40 ASN : amide:sc= 0.222 K(o=1.7,f=-2) USER MOD Set 3.4: A 43 THR OG1 : rot -140:sc= -0.0493 USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 82:sc= 1.28 USER MOD Single : A 12 GLN : amide:sc= 1.62 K(o=1.6,f=-6!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 173:sc= 1.15 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 75:sc= -1.15 USER MOD Single : A 33 GLN : amide:sc= -2.61! K(o=-2.6!,f=-2) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.896 K(o=-0.9,f=-3.8!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 ASN : amide:sc= 0.175 K(o=0.18,f=-0.93) USER MOD Single : A 52 ASN : amide:sc= -0.782 K(o=-0.78,f=-6!) USER MOD Single : A 55 CYS SG : rot -113:sc= -2.31! USER MOD Single : A 56 LYS NZ :NH3+ 159:sc= 1.31 (180deg=0.938) USER MOD Single : A 57 THR OG1 : rot 99:sc= 1.22 USER MOD Single : A 60 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0102) USER MOD Single : A 67 THR OG1 : rot 79:sc= 1.17 USER MOD Single : A 71 MET CE :methyl 176:sc= -1.31 (180deg=-1.4) USER MOD Single : A 72 MET CE :methyl -166:sc= -0.253 (180deg=-0.659) USER MOD Single : A 73 THR OG1 : rot 79:sc= 0.781 USER MOD Single : A 75 CYS SG : rot 87:sc= -0.615 USER MOD Single : A 76 GLN : amide:sc= -3.43! K(o=-3.4!,f=-2.6) USER MOD Single : A 83 HIS : no HD1:sc= -1.45 X(o=-1.5,f=-1.2) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot -86:sc= 1.24 USER MOD Single : A 97 ASN : amide:sc= -1.13 K(o=-1.1,f=-0.014) USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.016 USER MOD Single : A 102 MET CE :methyl -121:sc= 0 (180deg=-0.508) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc=-0.00311 K(o=-0.0031,f=-1.9) USER MOD Single : A 110 ASN : amide:sc= -0.123 K(o=-0.12,f=-1.1) USER MOD Single : A 111 GLN : amide:sc= -1.17 K(o=-1.2,f=-5.8!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot -5:sc= 0.426 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -3.92 K(o=-3.9,f=-11!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0554) USER MOD Single : A 129 ASN : amide:sc= -1.08 K(o=-1.1,f=-4.9!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -173:sc= -2.43! (180deg=-2.78!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ 171:sc=-0.00101 (180deg=-0.0947) USER MOD Single : A 147 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 148 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= 0.466 K(o=0.47,f=-0.24) USER MOD Single : A 157 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 27.586 -14.769 3.626 1.00 20.39 N ATOM 2 CA MET A 1 27.098 -13.645 2.796 1.00 19.96 C ATOM 3 C MET A 1 27.845 -13.585 1.467 1.00 19.35 C ATOM 4 O MET A 1 27.230 -13.733 0.412 1.00 19.23 O ATOM 5 CB MET A 1 27.250 -12.318 3.547 1.00 20.24 C ATOM 6 CG MET A 1 26.738 -11.115 2.763 1.00 20.56 C ATOM 7 SD MET A 1 26.622 -9.616 3.763 1.00 20.81 S ATOM 8 CE MET A 1 28.311 -9.444 4.334 1.00 20.97 C ATOM 0 H1 MET A 1 27.063 -14.789 4.525 1.00 20.39 H new ATOM 0 H2 MET A 1 27.438 -15.665 3.119 1.00 20.39 H new ATOM 0 H3 MET A 1 28.600 -14.644 3.818 1.00 20.39 H new ATOM 0 HA MET A 1 26.041 -13.813 2.589 1.00 19.96 H new ATOM 0 HB2 MET A 1 26.712 -12.381 4.493 1.00 20.24 H new ATOM 0 HB3 MET A 1 28.302 -12.164 3.788 1.00 20.24 H new ATOM 0 HG2 MET A 1 27.401 -10.931 1.918 1.00 20.56 H new ATOM 0 HG3 MET A 1 25.756 -11.348 2.352 1.00 20.56 H new ATOM 0 HE1 MET A 1 28.414 -8.513 4.891 1.00 20.97 H new ATOM 0 HE2 MET A 1 28.563 -10.284 4.982 1.00 20.97 H new ATOM 0 HE3 MET A 1 28.985 -9.431 3.478 1.00 20.97 H new ATOM 20 N TYR A 2 29.169 -13.381 1.533 1.00 19.08 N ATOM 21 CA TYR A 2 30.019 -13.234 0.340 1.00 18.61 C ATOM 22 C TYR A 2 29.709 -11.926 -0.393 1.00 17.62 C ATOM 23 O TYR A 2 28.557 -11.641 -0.722 1.00 17.34 O ATOM 24 CB TYR A 2 29.860 -14.415 -0.629 1.00 19.12 C ATOM 25 CG TYR A 2 30.274 -15.761 -0.082 1.00 19.80 C ATOM 26 CD1 TYR A 2 31.600 -16.169 -0.114 1.00 19.93 C ATOM 27 CD2 TYR A 2 29.342 -16.616 0.485 1.00 20.43 C ATOM 28 CE1 TYR A 2 31.982 -17.391 0.402 1.00 20.67 C ATOM 29 CE2 TYR A 2 29.714 -17.838 1.001 1.00 21.16 C ATOM 30 CZ TYR A 2 31.035 -18.249 0.889 1.00 21.27 C ATOM 31 OH TYR A 2 31.406 -19.443 1.475 1.00 22.10 O ATOM 0 H TYR A 2 29.681 -13.313 2.413 1.00 19.08 H new ATOM 0 HA TYR A 2 31.051 -13.217 0.690 1.00 18.61 H new ATOM 0 HB2 TYR A 2 28.816 -14.472 -0.937 1.00 19.12 H new ATOM 0 HB3 TYR A 2 30.446 -14.210 -1.525 1.00 19.12 H new ATOM 0 HD1 TYR A 2 32.345 -15.520 -0.550 1.00 19.93 H new ATOM 0 HD2 TYR A 2 28.304 -16.319 0.523 1.00 20.43 H new ATOM 0 HE1 TYR A 2 33.026 -17.669 0.421 1.00 20.67 H new ATOM 0 HE2 TYR A 2 28.985 -18.470 1.488 1.00 21.16 H new ATOM 0 HH TYR A 2 30.605 -19.927 1.766 1.00 22.10 H new ATOM 41 N SER A 3 30.737 -11.135 -0.664 1.00 17.23 N ATOM 42 CA SER A 3 30.543 -9.836 -1.292 1.00 16.40 C ATOM 43 C SER A 3 31.617 -9.570 -2.355 1.00 15.74 C ATOM 44 O SER A 3 32.736 -10.074 -2.250 1.00 15.62 O ATOM 45 CB SER A 3 30.568 -8.749 -0.216 1.00 16.48 C ATOM 46 OG SER A 3 29.629 -9.026 0.812 1.00 16.86 O ATOM 0 H SER A 3 31.709 -11.368 -0.460 1.00 17.23 H new ATOM 0 HA SER A 3 29.576 -9.827 -1.795 1.00 16.40 H new ATOM 0 HB2 SER A 3 31.569 -8.678 0.211 1.00 16.48 H new ATOM 0 HB3 SER A 3 30.344 -7.782 -0.666 1.00 16.48 H new ATOM 0 HG SER A 3 30.029 -9.638 1.464 1.00 16.86 H new ATOM 52 N PRO A 4 31.265 -8.820 -3.420 1.00 15.46 N ATOM 53 CA PRO A 4 32.186 -8.425 -4.484 1.00 15.00 C ATOM 54 C PRO A 4 32.728 -7.001 -4.327 1.00 14.24 C ATOM 55 O PRO A 4 32.565 -6.372 -3.287 1.00 13.43 O ATOM 56 CB PRO A 4 31.280 -8.487 -5.697 1.00 15.20 C ATOM 57 CG PRO A 4 29.954 -8.019 -5.195 1.00 15.47 C ATOM 58 CD PRO A 4 29.911 -8.335 -3.715 1.00 15.76 C ATOM 0 HA PRO A 4 33.075 -9.054 -4.514 1.00 15.00 H new ATOM 0 HB2 PRO A 4 31.648 -7.849 -6.501 1.00 15.20 H new ATOM 0 HB3 PRO A 4 31.219 -9.500 -6.096 1.00 15.20 H new ATOM 0 HG2 PRO A 4 29.831 -6.949 -5.366 1.00 15.47 H new ATOM 0 HG3 PRO A 4 29.142 -8.521 -5.721 1.00 15.47 H new ATOM 0 HD2 PRO A 4 29.665 -7.452 -3.125 1.00 15.76 H new ATOM 0 HD3 PRO A 4 29.158 -9.090 -3.489 1.00 15.76 H new ATOM 66 N THR A 5 33.348 -6.490 -5.388 1.00 14.65 N ATOM 67 CA THR A 5 33.946 -5.162 -5.363 1.00 14.22 C ATOM 68 C THR A 5 33.023 -4.100 -5.972 1.00 13.17 C ATOM 69 O THR A 5 33.100 -2.922 -5.623 1.00 12.56 O ATOM 70 CB THR A 5 35.286 -5.153 -6.118 1.00 15.22 C ATOM 71 OG1 THR A 5 36.107 -6.236 -5.662 1.00 15.79 O ATOM 72 CG2 THR A 5 36.012 -3.837 -5.899 1.00 15.33 C ATOM 0 H THR A 5 33.448 -6.979 -6.277 1.00 14.65 H new ATOM 0 HA THR A 5 34.110 -4.915 -4.314 1.00 14.22 H new ATOM 0 HB THR A 5 35.085 -5.270 -7.183 1.00 15.22 H new ATOM 0 HG1 THR A 5 36.959 -6.227 -6.147 1.00 15.79 H new ATOM 0 HG21 THR A 5 36.958 -3.849 -6.441 1.00 15.33 H new ATOM 0 HG22 THR A 5 35.395 -3.016 -6.264 1.00 15.33 H new ATOM 0 HG23 THR A 5 36.205 -3.701 -4.835 1.00 15.33 H new ATOM 80 N SER A 6 32.144 -4.521 -6.871 1.00 13.06 N ATOM 81 CA SER A 6 31.241 -3.601 -7.563 1.00 12.17 C ATOM 82 C SER A 6 30.281 -2.906 -6.599 1.00 11.07 C ATOM 83 O SER A 6 29.639 -1.914 -6.947 1.00 10.23 O ATOM 84 CB SER A 6 30.477 -4.329 -8.663 1.00 12.55 C ATOM 85 OG SER A 6 31.369 -4.785 -9.666 1.00 13.32 O ATOM 0 H SER A 6 32.034 -5.498 -7.142 1.00 13.06 H new ATOM 0 HA SER A 6 31.853 -2.823 -8.020 1.00 12.17 H new ATOM 0 HB2 SER A 6 29.934 -5.174 -8.239 1.00 12.55 H new ATOM 0 HB3 SER A 6 29.736 -3.662 -9.103 1.00 12.55 H new ATOM 0 HG SER A 6 31.773 -5.632 -9.384 1.00 13.32 H new ATOM 91 N ILE A 7 30.181 -3.431 -5.389 1.00 11.18 N ATOM 92 CA ILE A 7 29.341 -2.818 -4.370 1.00 10.37 C ATOM 93 C ILE A 7 29.951 -1.505 -3.889 1.00 9.98 C ATOM 94 O ILE A 7 29.307 -0.733 -3.196 1.00 9.20 O ATOM 95 CB ILE A 7 29.100 -3.754 -3.167 1.00 10.88 C ATOM 96 CG1 ILE A 7 30.425 -4.178 -2.530 1.00 11.65 C ATOM 97 CG2 ILE A 7 28.298 -4.968 -3.607 1.00 10.56 C ATOM 98 CD1 ILE A 7 30.257 -4.980 -1.257 1.00 12.15 C ATOM 0 H ILE A 7 30.668 -4.275 -5.088 1.00 11.18 H new ATOM 0 HA ILE A 7 28.375 -2.621 -4.835 1.00 10.37 H new ATOM 0 HB ILE A 7 28.529 -3.212 -2.413 1.00 10.88 H new ATOM 0 HG12 ILE A 7 30.992 -4.769 -3.250 1.00 11.65 H new ATOM 0 HG13 ILE A 7 31.015 -3.288 -2.313 1.00 11.65 H new ATOM 0 HG21 ILE A 7 28.132 -5.624 -2.752 1.00 10.56 H new ATOM 0 HG22 ILE A 7 27.337 -4.644 -4.008 1.00 10.56 H new ATOM 0 HG23 ILE A 7 28.849 -5.508 -4.377 1.00 10.56 H new ATOM 0 HD11 ILE A 7 31.238 -5.245 -0.862 1.00 12.15 H new ATOM 0 HD12 ILE A 7 29.718 -4.384 -0.520 1.00 12.15 H new ATOM 0 HD13 ILE A 7 29.694 -5.888 -1.471 1.00 12.15 H new ATOM 110 N LEU A 8 31.211 -1.275 -4.238 1.00 10.74 N ATOM 111 CA LEU A 8 31.898 -0.044 -3.872 1.00 10.77 C ATOM 112 C LEU A 8 31.500 1.119 -4.781 1.00 10.46 C ATOM 113 O LEU A 8 31.637 2.282 -4.397 1.00 10.30 O ATOM 114 CB LEU A 8 33.415 -0.243 -3.939 1.00 11.94 C ATOM 115 CG LEU A 8 34.083 -0.869 -2.706 1.00 12.47 C ATOM 116 CD1 LEU A 8 33.376 -2.143 -2.269 1.00 12.44 C ATOM 117 CD2 LEU A 8 35.537 -1.164 -3.011 1.00 13.09 C ATOM 0 H LEU A 8 31.779 -1.929 -4.777 1.00 10.74 H new ATOM 0 HA LEU A 8 31.602 0.202 -2.852 1.00 10.77 H new ATOM 0 HB2 LEU A 8 33.638 -0.870 -4.802 1.00 11.94 H new ATOM 0 HB3 LEU A 8 33.878 0.727 -4.121 1.00 11.94 H new ATOM 0 HG LEU A 8 34.014 -0.154 -1.886 1.00 12.47 H new ATOM 0 HD11 LEU A 8 33.878 -2.556 -1.394 1.00 12.44 H new ATOM 0 HD12 LEU A 8 32.339 -1.917 -2.019 1.00 12.44 H new ATOM 0 HD13 LEU A 8 33.403 -2.871 -3.080 1.00 12.44 H new ATOM 0 HD21 LEU A 8 36.010 -1.608 -2.135 1.00 13.09 H new ATOM 0 HD22 LEU A 8 35.599 -1.859 -3.848 1.00 13.09 H new ATOM 0 HD23 LEU A 8 36.050 -0.238 -3.269 1.00 13.09 H new ATOM 129 N ASP A 9 31.009 0.820 -5.982 1.00 10.57 N ATOM 130 CA ASP A 9 30.748 1.877 -6.960 1.00 10.51 C ATOM 131 C ASP A 9 29.255 2.160 -7.156 1.00 9.48 C ATOM 132 O ASP A 9 28.847 2.671 -8.200 1.00 9.50 O ATOM 133 CB ASP A 9 31.429 1.582 -8.311 1.00 11.48 C ATOM 134 CG ASP A 9 30.975 0.294 -8.975 1.00 12.16 C ATOM 135 OD1 ASP A 9 29.987 0.336 -9.742 1.00 12.46 O ATOM 136 OD2 ASP A 9 31.573 -0.771 -8.706 1.00 12.54 O ATOM 0 H ASP A 9 30.787 -0.124 -6.298 1.00 10.57 H new ATOM 0 HA ASP A 9 31.188 2.783 -6.542 1.00 10.51 H new ATOM 0 HB2 ASP A 9 31.238 2.413 -8.990 1.00 11.48 H new ATOM 0 HB3 ASP A 9 32.507 1.537 -8.158 1.00 11.48 H new ATOM 141 N ILE A 10 28.438 1.852 -6.153 1.00 8.74 N ATOM 142 CA ILE A 10 27.034 2.263 -6.188 1.00 7.86 C ATOM 143 C ILE A 10 26.902 3.622 -5.500 1.00 7.43 C ATOM 144 O ILE A 10 27.676 3.929 -4.595 1.00 6.73 O ATOM 145 CB ILE A 10 26.067 1.231 -5.522 1.00 7.25 C ATOM 146 CG1 ILE A 10 25.926 1.445 -4.002 1.00 7.42 C ATOM 147 CG2 ILE A 10 26.518 -0.194 -5.810 1.00 7.55 C ATOM 148 CD1 ILE A 10 27.199 1.261 -3.206 1.00 7.84 C ATOM 0 H ILE A 10 28.714 1.330 -5.321 1.00 8.74 H new ATOM 0 HA ILE A 10 26.738 2.324 -7.235 1.00 7.86 H new ATOM 0 HB ILE A 10 25.084 1.395 -5.965 1.00 7.25 H new ATOM 0 HG12 ILE A 10 25.549 2.452 -3.826 1.00 7.42 H new ATOM 0 HG13 ILE A 10 25.175 0.753 -3.622 1.00 7.42 H new ATOM 0 HG21 ILE A 10 25.831 -0.896 -5.337 1.00 7.55 H new ATOM 0 HG22 ILE A 10 26.525 -0.363 -6.887 1.00 7.55 H new ATOM 0 HG23 ILE A 10 27.522 -0.345 -5.413 1.00 7.55 H new ATOM 0 HD11 ILE A 10 26.995 1.433 -2.149 1.00 7.84 H new ATOM 0 HD12 ILE A 10 27.570 0.245 -3.343 1.00 7.84 H new ATOM 0 HD13 ILE A 10 27.950 1.972 -3.551 1.00 7.84 H new ATOM 160 N ARG A 11 25.988 4.465 -5.957 1.00 8.07 N ATOM 161 CA ARG A 11 25.728 5.716 -5.261 1.00 7.96 C ATOM 162 C ARG A 11 24.242 6.040 -5.246 1.00 7.79 C ATOM 163 O ARG A 11 23.466 5.510 -6.046 1.00 8.29 O ATOM 164 CB ARG A 11 26.480 6.874 -5.905 1.00 9.08 C ATOM 165 CG ARG A 11 25.898 7.295 -7.237 1.00 9.98 C ATOM 166 CD ARG A 11 26.182 8.754 -7.516 1.00 10.66 C ATOM 167 NE ARG A 11 25.620 9.627 -6.478 1.00 11.50 N ATOM 168 CZ ARG A 11 26.067 10.853 -6.207 1.00 12.34 C ATOM 169 NH1 ARG A 11 27.104 11.352 -6.872 1.00 12.46 N ATOM 170 NH2 ARG A 11 25.476 11.579 -5.263 1.00 13.19 N ATOM 0 H ARG A 11 25.423 4.310 -6.792 1.00 8.07 H new ATOM 0 HA ARG A 11 26.078 5.586 -4.237 1.00 7.96 H new ATOM 0 HB2 ARG A 11 26.471 7.727 -5.226 1.00 9.08 H new ATOM 0 HB3 ARG A 11 27.523 6.589 -6.045 1.00 9.08 H new ATOM 0 HG2 ARG A 11 26.319 6.680 -8.032 1.00 9.98 H new ATOM 0 HG3 ARG A 11 24.822 7.124 -7.238 1.00 9.98 H new ATOM 0 HD2 ARG A 11 27.259 8.909 -7.578 1.00 10.66 H new ATOM 0 HD3 ARG A 11 25.765 9.027 -8.485 1.00 10.66 H new ATOM 0 HE ARG A 11 24.837 9.272 -5.929 1.00 11.50 H new ATOM 0 HH11 ARG A 11 27.562 10.796 -7.594 1.00 12.46 H new ATOM 0 HH12 ARG A 11 27.442 12.291 -6.660 1.00 12.46 H new ATOM 0 HH21 ARG A 11 24.682 11.197 -4.748 1.00 13.19 H new ATOM 0 HH22 ARG A 11 25.816 12.518 -5.054 1.00 13.19 H new ATOM 184 N GLN A 12 23.858 6.927 -4.343 1.00 7.29 N ATOM 185 CA GLN A 12 22.485 7.396 -4.269 1.00 7.16 C ATOM 186 C GLN A 12 22.429 8.871 -4.645 1.00 7.82 C ATOM 187 O GLN A 12 23.284 9.661 -4.228 1.00 8.10 O ATOM 188 CB GLN A 12 21.911 7.177 -2.865 1.00 6.33 C ATOM 189 CG GLN A 12 20.434 7.531 -2.751 1.00 6.44 C ATOM 190 CD GLN A 12 19.856 7.245 -1.378 1.00 6.33 C ATOM 191 OE1 GLN A 12 20.566 7.275 -0.375 1.00 6.37 O ATOM 192 NE2 GLN A 12 18.558 6.985 -1.323 1.00 6.60 N ATOM 0 H GLN A 12 24.481 7.338 -3.648 1.00 7.29 H new ATOM 0 HA GLN A 12 21.878 6.825 -4.972 1.00 7.16 H new ATOM 0 HB2 GLN A 12 22.049 6.133 -2.583 1.00 6.33 H new ATOM 0 HB3 GLN A 12 22.476 7.777 -2.152 1.00 6.33 H new ATOM 0 HG2 GLN A 12 20.301 8.588 -2.981 1.00 6.44 H new ATOM 0 HG3 GLN A 12 19.874 6.969 -3.498 1.00 6.44 H new ATOM 0 HE21 GLN A 12 18.004 6.970 -2.179 1.00 6.60 H new ATOM 0 HE22 GLN A 12 18.113 6.800 -0.424 1.00 6.60 H new ATOM 201 N GLY A 13 21.451 9.226 -5.463 1.00 8.30 N ATOM 202 CA GLY A 13 21.287 10.603 -5.878 1.00 9.01 C ATOM 203 C GLY A 13 20.370 11.381 -4.954 1.00 8.63 C ATOM 204 O GLY A 13 20.285 11.078 -3.764 1.00 7.84 O ATOM 0 H GLY A 13 20.763 8.580 -5.850 1.00 8.30 H new ATOM 0 HA2 GLY A 13 22.262 11.088 -5.910 1.00 9.01 H new ATOM 0 HA3 GLY A 13 20.885 10.629 -6.891 1.00 9.01 H new ATOM 208 N PRO A 14 19.664 12.393 -5.480 1.00 9.33 N ATOM 209 CA PRO A 14 18.770 13.239 -4.684 1.00 9.17 C ATOM 210 C PRO A 14 17.535 12.493 -4.184 1.00 8.90 C ATOM 211 O PRO A 14 17.363 12.281 -2.983 1.00 8.50 O ATOM 212 CB PRO A 14 18.351 14.353 -5.660 1.00 10.25 C ATOM 213 CG PRO A 14 19.286 14.247 -6.817 1.00 10.91 C ATOM 214 CD PRO A 14 19.693 12.806 -6.889 1.00 10.46 C ATOM 0 HA PRO A 14 19.269 13.601 -3.785 1.00 9.17 H new ATOM 0 HB2 PRO A 14 17.317 14.225 -5.979 1.00 10.25 H new ATOM 0 HB3 PRO A 14 18.421 15.333 -5.189 1.00 10.25 H new ATOM 0 HG2 PRO A 14 18.801 14.562 -7.741 1.00 10.91 H new ATOM 0 HG3 PRO A 14 20.154 14.891 -6.677 1.00 10.91 H new ATOM 0 HD2 PRO A 14 19.004 12.220 -7.497 1.00 10.46 H new ATOM 0 HD3 PRO A 14 20.684 12.686 -7.326 1.00 10.46 H new ATOM 222 N LYS A 15 16.680 12.093 -5.114 1.00 9.36 N ATOM 223 CA LYS A 15 15.418 11.455 -4.775 1.00 9.53 C ATOM 224 C LYS A 15 15.453 9.973 -5.114 1.00 9.20 C ATOM 225 O LYS A 15 14.415 9.314 -5.166 1.00 9.66 O ATOM 226 CB LYS A 15 14.287 12.125 -5.545 1.00 10.67 C ATOM 227 CG LYS A 15 14.432 11.980 -7.050 1.00 11.41 C ATOM 228 CD LYS A 15 13.260 12.597 -7.774 1.00 12.05 C ATOM 229 CE LYS A 15 13.276 12.254 -9.253 1.00 12.96 C ATOM 230 NZ LYS A 15 12.025 12.680 -9.933 1.00 13.55 N ATOM 0 H LYS A 15 16.840 12.200 -6.116 1.00 9.36 H new ATOM 0 HA LYS A 15 15.252 11.562 -3.703 1.00 9.53 H new ATOM 0 HB2 LYS A 15 13.336 11.693 -5.233 1.00 10.67 H new ATOM 0 HB3 LYS A 15 14.256 13.184 -5.288 1.00 10.67 H new ATOM 0 HG2 LYS A 15 15.356 12.457 -7.376 1.00 11.41 H new ATOM 0 HG3 LYS A 15 14.509 10.924 -7.310 1.00 11.41 H new ATOM 0 HD2 LYS A 15 12.330 12.245 -7.328 1.00 12.05 H new ATOM 0 HD3 LYS A 15 13.284 13.680 -7.650 1.00 12.05 H new ATOM 0 HE2 LYS A 15 14.130 12.736 -9.728 1.00 12.96 H new ATOM 0 HE3 LYS A 15 13.408 11.179 -9.375 1.00 12.96 H new ATOM 0 HZ1 LYS A 15 12.075 12.428 -10.941 1.00 13.55 H new ATOM 0 HZ2 LYS A 15 11.212 12.201 -9.496 1.00 13.55 H new ATOM 0 HZ3 LYS A 15 11.912 13.709 -9.839 1.00 13.55 H new ATOM 244 N GLU A 16 16.656 9.471 -5.371 1.00 8.57 N ATOM 245 CA GLU A 16 16.859 8.066 -5.703 1.00 8.39 C ATOM 246 C GLU A 16 16.201 7.163 -4.666 1.00 7.72 C ATOM 247 O GLU A 16 16.544 7.218 -3.481 1.00 6.94 O ATOM 248 CB GLU A 16 18.353 7.740 -5.766 1.00 8.10 C ATOM 249 CG GLU A 16 18.655 6.354 -6.321 1.00 8.26 C ATOM 250 CD GLU A 16 18.485 6.293 -7.825 1.00 9.36 C ATOM 251 OE1 GLU A 16 17.327 6.253 -8.292 1.00 9.85 O ATOM 252 OE2 GLU A 16 19.502 6.257 -8.544 1.00 9.91 O ATOM 0 H GLU A 16 17.513 10.023 -5.355 1.00 8.57 H new ATOM 0 HA GLU A 16 16.404 7.888 -6.677 1.00 8.39 H new ATOM 0 HB2 GLU A 16 18.853 8.486 -6.384 1.00 8.10 H new ATOM 0 HB3 GLU A 16 18.776 7.821 -4.765 1.00 8.10 H new ATOM 0 HG2 GLU A 16 19.676 6.074 -6.060 1.00 8.26 H new ATOM 0 HG3 GLU A 16 17.995 5.624 -5.852 1.00 8.26 H new ATOM 259 N PRO A 17 15.234 6.337 -5.095 1.00 8.28 N ATOM 260 CA PRO A 17 14.597 5.361 -4.218 1.00 8.07 C ATOM 261 C PRO A 17 15.638 4.467 -3.563 1.00 7.31 C ATOM 262 O PRO A 17 16.445 3.838 -4.245 1.00 7.39 O ATOM 263 CB PRO A 17 13.712 4.543 -5.163 1.00 9.21 C ATOM 264 CG PRO A 17 13.465 5.437 -6.327 1.00 9.95 C ATOM 265 CD PRO A 17 14.693 6.291 -6.465 1.00 9.45 C ATOM 0 HA PRO A 17 14.037 5.827 -3.407 1.00 8.07 H new ATOM 0 HB2 PRO A 17 14.208 3.622 -5.470 1.00 9.21 H new ATOM 0 HB3 PRO A 17 12.778 4.256 -4.680 1.00 9.21 H new ATOM 0 HG2 PRO A 17 13.290 4.857 -7.233 1.00 9.95 H new ATOM 0 HG3 PRO A 17 12.579 6.051 -6.165 1.00 9.95 H new ATOM 0 HD2 PRO A 17 15.407 5.857 -7.165 1.00 9.45 H new ATOM 0 HD3 PRO A 17 14.450 7.287 -6.835 1.00 9.45 H new ATOM 273 N PHE A 18 15.628 4.428 -2.238 1.00 6.75 N ATOM 274 CA PHE A 18 16.609 3.658 -1.493 1.00 6.11 C ATOM 275 C PHE A 18 16.519 2.181 -1.859 1.00 6.56 C ATOM 276 O PHE A 18 17.513 1.466 -1.820 1.00 6.14 O ATOM 277 CB PHE A 18 16.410 3.853 0.012 1.00 6.14 C ATOM 278 CG PHE A 18 17.580 3.394 0.835 1.00 5.98 C ATOM 279 CD1 PHE A 18 17.526 2.196 1.528 1.00 6.36 C ATOM 280 CD2 PHE A 18 18.732 4.156 0.915 1.00 5.83 C ATOM 281 CE1 PHE A 18 18.598 1.767 2.284 1.00 6.55 C ATOM 282 CE2 PHE A 18 19.808 3.735 1.670 1.00 6.04 C ATOM 283 CZ PHE A 18 19.742 2.553 2.363 1.00 6.38 C ATOM 0 H PHE A 18 14.950 4.922 -1.658 1.00 6.75 H new ATOM 0 HA PHE A 18 17.604 4.016 -1.758 1.00 6.11 H new ATOM 0 HB2 PHE A 18 16.227 4.909 0.213 1.00 6.14 H new ATOM 0 HB3 PHE A 18 15.519 3.309 0.326 1.00 6.14 H new ATOM 0 HD1 PHE A 18 16.634 1.590 1.476 1.00 6.36 H new ATOM 0 HD2 PHE A 18 18.790 5.092 0.380 1.00 5.83 H new ATOM 0 HE1 PHE A 18 18.548 0.826 2.811 1.00 6.55 H new ATOM 0 HE2 PHE A 18 20.703 4.337 1.715 1.00 6.04 H new ATOM 0 HZ PHE A 18 20.577 2.234 2.969 1.00 6.38 H new ATOM 293 N ARG A 19 15.325 1.735 -2.246 1.00 7.57 N ATOM 294 CA ARG A 19 15.132 0.352 -2.663 1.00 8.30 C ATOM 295 C ARG A 19 15.842 0.083 -3.986 1.00 8.53 C ATOM 296 O ARG A 19 16.179 -1.055 -4.297 1.00 8.98 O ATOM 297 CB ARG A 19 13.641 0.014 -2.787 1.00 9.53 C ATOM 298 CG ARG A 19 12.922 0.736 -3.917 1.00 10.28 C ATOM 299 CD ARG A 19 11.497 0.228 -4.073 1.00 11.35 C ATOM 300 NE ARG A 19 11.460 -1.211 -4.328 1.00 12.03 N ATOM 301 CZ ARG A 19 10.393 -1.983 -4.121 1.00 13.02 C ATOM 302 NH1 ARG A 19 9.262 -1.455 -3.669 1.00 13.43 N ATOM 303 NH2 ARG A 19 10.459 -3.283 -4.373 1.00 13.72 N ATOM 0 H ARG A 19 14.483 2.309 -2.279 1.00 7.57 H new ATOM 0 HA ARG A 19 15.566 -0.289 -1.895 1.00 8.30 H new ATOM 0 HB2 ARG A 19 13.536 -1.061 -2.935 1.00 9.53 H new ATOM 0 HB3 ARG A 19 13.147 0.256 -1.846 1.00 9.53 H new ATOM 0 HG2 ARG A 19 12.909 1.808 -3.718 1.00 10.28 H new ATOM 0 HG3 ARG A 19 13.467 0.591 -4.850 1.00 10.28 H new ATOM 0 HD2 ARG A 19 10.930 0.452 -3.169 1.00 11.35 H new ATOM 0 HD3 ARG A 19 11.011 0.755 -4.894 1.00 11.35 H new ATOM 0 HE ARG A 19 12.306 -1.653 -4.688 1.00 12.03 H new ATOM 0 HH11 ARG A 19 9.207 -0.454 -3.479 1.00 13.43 H new ATOM 0 HH12 ARG A 19 8.448 -2.050 -3.512 1.00 13.43 H new ATOM 0 HH21 ARG A 19 11.325 -3.691 -4.725 1.00 13.72 H new ATOM 0 HH22 ARG A 19 9.644 -3.875 -4.215 1.00 13.72 H new ATOM 317 N ASP A 20 16.078 1.140 -4.759 1.00 8.44 N ATOM 318 CA ASP A 20 16.782 1.015 -6.028 1.00 9.01 C ATOM 319 C ASP A 20 18.279 1.142 -5.794 1.00 8.27 C ATOM 320 O ASP A 20 19.083 0.429 -6.396 1.00 8.68 O ATOM 321 CB ASP A 20 16.322 2.090 -7.011 1.00 9.59 C ATOM 322 CG ASP A 20 16.925 1.901 -8.390 1.00 10.55 C ATOM 323 OD1 ASP A 20 16.243 1.347 -9.272 1.00 11.24 O ATOM 324 OD2 ASP A 20 18.086 2.313 -8.597 1.00 10.78 O ATOM 0 H ASP A 20 15.791 2.091 -4.527 1.00 8.44 H new ATOM 0 HA ASP A 20 16.558 0.038 -6.455 1.00 9.01 H new ATOM 0 HB2 ASP A 20 15.235 2.070 -7.086 1.00 9.59 H new ATOM 0 HB3 ASP A 20 16.597 3.072 -6.627 1.00 9.59 H new ATOM 329 N TYR A 21 18.639 2.063 -4.905 1.00 7.30 N ATOM 330 CA TYR A 21 20.016 2.213 -4.456 1.00 6.73 C ATOM 331 C TYR A 21 20.528 0.888 -3.903 1.00 6.19 C ATOM 332 O TYR A 21 21.655 0.474 -4.168 1.00 6.24 O ATOM 333 CB TYR A 21 20.097 3.301 -3.383 1.00 6.06 C ATOM 334 CG TYR A 21 21.447 3.408 -2.714 1.00 5.92 C ATOM 335 CD1 TYR A 21 22.576 3.755 -3.440 1.00 6.01 C ATOM 336 CD2 TYR A 21 21.593 3.170 -1.353 1.00 6.13 C ATOM 337 CE1 TYR A 21 23.810 3.863 -2.833 1.00 6.36 C ATOM 338 CE2 TYR A 21 22.826 3.274 -0.739 1.00 6.47 C ATOM 339 CZ TYR A 21 23.932 3.620 -1.486 1.00 6.60 C ATOM 340 OH TYR A 21 25.162 3.732 -0.881 1.00 7.29 O ATOM 0 H TYR A 21 17.987 2.722 -4.479 1.00 7.30 H new ATOM 0 HA TYR A 21 20.639 2.505 -5.301 1.00 6.73 H new ATOM 0 HB2 TYR A 21 19.851 4.262 -3.835 1.00 6.06 H new ATOM 0 HB3 TYR A 21 19.341 3.103 -2.623 1.00 6.06 H new ATOM 0 HD1 TYR A 21 22.488 3.944 -4.500 1.00 6.01 H new ATOM 0 HD2 TYR A 21 20.728 2.899 -0.765 1.00 6.13 H new ATOM 0 HE1 TYR A 21 24.678 4.138 -3.415 1.00 6.36 H new ATOM 0 HE2 TYR A 21 22.923 3.085 0.320 1.00 6.47 H new ATOM 0 HH TYR A 21 25.059 3.642 0.089 1.00 7.29 H new ATOM 350 N VAL A 22 19.667 0.222 -3.159 1.00 5.96 N ATOM 351 CA VAL A 22 19.990 -1.082 -2.592 1.00 5.81 C ATOM 352 C VAL A 22 19.916 -2.159 -3.668 1.00 6.77 C ATOM 353 O VAL A 22 20.704 -3.099 -3.673 1.00 6.77 O ATOM 354 CB VAL A 22 19.050 -1.440 -1.417 1.00 5.93 C ATOM 355 CG1 VAL A 22 19.238 -2.884 -0.973 1.00 6.61 C ATOM 356 CG2 VAL A 22 19.292 -0.502 -0.246 1.00 5.41 C ATOM 0 H VAL A 22 18.733 0.561 -2.930 1.00 5.96 H new ATOM 0 HA VAL A 22 21.007 -1.031 -2.204 1.00 5.81 H new ATOM 0 HB VAL A 22 18.024 -1.325 -1.766 1.00 5.93 H new ATOM 0 HG11 VAL A 22 18.562 -3.101 -0.146 1.00 6.61 H new ATOM 0 HG12 VAL A 22 19.019 -3.552 -1.806 1.00 6.61 H new ATOM 0 HG13 VAL A 22 20.268 -3.034 -0.649 1.00 6.61 H new ATOM 0 HG21 VAL A 22 18.624 -0.765 0.574 1.00 5.41 H new ATOM 0 HG22 VAL A 22 20.327 -0.593 0.085 1.00 5.41 H new ATOM 0 HG23 VAL A 22 19.099 0.525 -0.556 1.00 5.41 H new ATOM 366 N ASP A 23 18.976 -1.997 -4.589 1.00 7.71 N ATOM 367 CA ASP A 23 18.796 -2.938 -5.692 1.00 8.82 C ATOM 368 C ASP A 23 20.087 -3.133 -6.480 1.00 8.87 C ATOM 369 O ASP A 23 20.504 -4.265 -6.726 1.00 9.30 O ATOM 370 CB ASP A 23 17.688 -2.452 -6.627 1.00 9.88 C ATOM 371 CG ASP A 23 17.637 -3.220 -7.931 1.00 11.09 C ATOM 372 OD1 ASP A 23 18.043 -2.655 -8.967 1.00 11.57 O ATOM 373 OD2 ASP A 23 17.188 -4.382 -7.932 1.00 11.68 O ATOM 0 H ASP A 23 18.320 -1.216 -4.596 1.00 7.71 H new ATOM 0 HA ASP A 23 18.514 -3.899 -5.262 1.00 8.82 H new ATOM 0 HB2 ASP A 23 16.727 -2.542 -6.121 1.00 9.88 H new ATOM 0 HB3 ASP A 23 17.838 -1.394 -6.840 1.00 9.88 H new ATOM 378 N ARG A 24 20.735 -2.030 -6.845 1.00 8.57 N ATOM 379 CA ARG A 24 21.936 -2.091 -7.670 1.00 8.91 C ATOM 380 C ARG A 24 23.091 -2.662 -6.856 1.00 8.10 C ATOM 381 O ARG A 24 23.933 -3.398 -7.370 1.00 8.53 O ATOM 382 CB ARG A 24 22.288 -0.697 -8.209 1.00 9.20 C ATOM 383 CG ARG A 24 22.716 0.290 -7.135 1.00 9.35 C ATOM 384 CD ARG A 24 22.048 1.644 -7.303 1.00 9.42 C ATOM 385 NE ARG A 24 22.388 2.280 -8.573 1.00 10.13 N ATOM 386 CZ ARG A 24 21.738 3.326 -9.077 1.00 10.62 C ATOM 387 NH1 ARG A 24 20.656 3.791 -8.466 1.00 10.53 N ATOM 388 NH2 ARG A 24 22.157 3.887 -10.204 1.00 11.36 N ATOM 0 H ARG A 24 20.449 -1.087 -6.583 1.00 8.57 H new ATOM 0 HA ARG A 24 21.750 -2.745 -8.522 1.00 8.91 H new ATOM 0 HB2 ARG A 24 23.090 -0.793 -8.940 1.00 9.20 H new ATOM 0 HB3 ARG A 24 21.423 -0.293 -8.736 1.00 9.20 H new ATOM 0 HG2 ARG A 24 22.471 -0.115 -6.153 1.00 9.35 H new ATOM 0 HG3 ARG A 24 23.798 0.414 -7.168 1.00 9.35 H new ATOM 0 HD2 ARG A 24 20.967 1.523 -7.239 1.00 9.42 H new ATOM 0 HD3 ARG A 24 22.345 2.297 -6.482 1.00 9.42 H new ATOM 0 HE ARG A 24 23.170 1.900 -9.105 1.00 10.13 H new ATOM 0 HH11 ARG A 24 20.323 3.347 -7.610 1.00 10.53 H new ATOM 0 HH12 ARG A 24 20.157 4.593 -8.852 1.00 10.53 H new ATOM 0 HH21 ARG A 24 22.977 3.516 -10.684 1.00 11.36 H new ATOM 0 HH22 ARG A 24 21.659 4.689 -10.590 1.00 11.36 H new ATOM 402 N PHE A 25 23.094 -2.326 -5.577 1.00 7.02 N ATOM 403 CA PHE A 25 24.076 -2.819 -4.634 1.00 6.32 C ATOM 404 C PHE A 25 23.951 -4.327 -4.440 1.00 6.59 C ATOM 405 O PHE A 25 24.944 -5.051 -4.434 1.00 6.62 O ATOM 406 CB PHE A 25 23.858 -2.100 -3.303 1.00 5.33 C ATOM 407 CG PHE A 25 24.775 -2.535 -2.198 1.00 4.98 C ATOM 408 CD1 PHE A 25 26.005 -1.930 -2.020 1.00 4.85 C ATOM 409 CD2 PHE A 25 24.396 -3.547 -1.329 1.00 5.26 C ATOM 410 CE1 PHE A 25 26.842 -2.322 -0.996 1.00 4.99 C ATOM 411 CE2 PHE A 25 25.230 -3.945 -0.307 1.00 5.43 C ATOM 412 CZ PHE A 25 26.452 -3.332 -0.139 1.00 5.29 C ATOM 0 H PHE A 25 22.406 -1.697 -5.163 1.00 7.02 H new ATOM 0 HA PHE A 25 25.077 -2.622 -5.018 1.00 6.32 H new ATOM 0 HB2 PHE A 25 23.983 -1.029 -3.460 1.00 5.33 H new ATOM 0 HB3 PHE A 25 22.827 -2.258 -2.985 1.00 5.33 H new ATOM 0 HD1 PHE A 25 26.314 -1.142 -2.690 1.00 4.85 H new ATOM 0 HD2 PHE A 25 23.437 -4.028 -1.455 1.00 5.26 H new ATOM 0 HE1 PHE A 25 27.800 -1.840 -0.865 1.00 4.99 H new ATOM 0 HE2 PHE A 25 24.926 -4.737 0.362 1.00 5.43 H new ATOM 0 HZ PHE A 25 27.105 -3.641 0.663 1.00 5.29 H new ATOM 422 N TYR A 26 22.722 -4.795 -4.317 1.00 7.06 N ATOM 423 CA TYR A 26 22.463 -6.162 -3.903 1.00 7.60 C ATOM 424 C TYR A 26 22.525 -7.109 -5.092 1.00 8.54 C ATOM 425 O TYR A 26 22.862 -8.285 -4.949 1.00 8.87 O ATOM 426 CB TYR A 26 21.095 -6.248 -3.220 1.00 8.10 C ATOM 427 CG TYR A 26 20.856 -7.548 -2.487 1.00 8.84 C ATOM 428 CD1 TYR A 26 20.035 -8.528 -3.028 1.00 9.57 C ATOM 429 CD2 TYR A 26 21.451 -7.797 -1.258 1.00 9.04 C ATOM 430 CE1 TYR A 26 19.811 -9.720 -2.365 1.00 10.37 C ATOM 431 CE2 TYR A 26 21.234 -8.985 -0.590 1.00 9.88 C ATOM 432 CZ TYR A 26 20.422 -9.935 -1.131 1.00 10.50 C ATOM 433 OH TYR A 26 20.187 -11.127 -0.478 1.00 11.44 O ATOM 0 H TYR A 26 21.883 -4.244 -4.499 1.00 7.06 H new ATOM 0 HA TYR A 26 23.234 -6.463 -3.193 1.00 7.60 H new ATOM 0 HB2 TYR A 26 20.999 -5.422 -2.515 1.00 8.10 H new ATOM 0 HB3 TYR A 26 20.316 -6.118 -3.971 1.00 8.10 H new ATOM 0 HD1 TYR A 26 19.563 -8.356 -3.984 1.00 9.57 H new ATOM 0 HD2 TYR A 26 22.094 -7.049 -0.818 1.00 9.04 H new ATOM 0 HE1 TYR A 26 19.171 -10.475 -2.798 1.00 10.37 H new ATOM 0 HE2 TYR A 26 21.709 -9.162 0.364 1.00 9.88 H new ATOM 0 HH TYR A 26 20.679 -11.138 0.370 1.00 11.44 H new ATOM 443 N LYS A 27 22.220 -6.586 -6.269 1.00 9.08 N ATOM 444 CA LYS A 27 22.175 -7.406 -7.466 1.00 10.12 C ATOM 445 C LYS A 27 23.581 -7.807 -7.902 1.00 10.01 C ATOM 446 O LYS A 27 23.788 -8.905 -8.418 1.00 10.69 O ATOM 447 CB LYS A 27 21.427 -6.675 -8.584 1.00 10.87 C ATOM 448 CG LYS A 27 22.221 -5.573 -9.273 1.00 11.19 C ATOM 449 CD LYS A 27 21.377 -4.847 -10.312 1.00 12.15 C ATOM 450 CE LYS A 27 20.940 -5.776 -11.437 1.00 12.87 C ATOM 451 NZ LYS A 27 19.972 -5.120 -12.352 1.00 13.47 N ATOM 0 H LYS A 27 22.001 -5.601 -6.419 1.00 9.08 H new ATOM 0 HA LYS A 27 21.630 -8.322 -7.241 1.00 10.12 H new ATOM 0 HB2 LYS A 27 21.120 -7.405 -9.333 1.00 10.87 H new ATOM 0 HB3 LYS A 27 20.517 -6.242 -8.169 1.00 10.87 H new ATOM 0 HG2 LYS A 27 22.578 -4.860 -8.529 1.00 11.19 H new ATOM 0 HG3 LYS A 27 23.101 -6.002 -9.752 1.00 11.19 H new ATOM 0 HD2 LYS A 27 20.497 -4.420 -9.831 1.00 12.15 H new ATOM 0 HD3 LYS A 27 21.948 -4.017 -10.728 1.00 12.15 H new ATOM 0 HE2 LYS A 27 21.814 -6.097 -12.003 1.00 12.87 H new ATOM 0 HE3 LYS A 27 20.488 -6.673 -11.013 1.00 12.87 H new ATOM 0 HZ1 LYS A 27 19.699 -5.785 -13.104 1.00 13.47 H new ATOM 0 HZ2 LYS A 27 19.126 -4.836 -11.817 1.00 13.47 H new ATOM 0 HZ3 LYS A 27 20.411 -4.279 -12.777 1.00 13.47 H new ATOM 465 N THR A 28 24.547 -6.930 -7.678 1.00 9.28 N ATOM 466 CA THR A 28 25.932 -7.254 -7.967 1.00 9.35 C ATOM 467 C THR A 28 26.545 -8.001 -6.783 1.00 8.90 C ATOM 468 O THR A 28 27.446 -8.826 -6.952 1.00 9.29 O ATOM 469 CB THR A 28 26.759 -5.989 -8.300 1.00 9.07 C ATOM 470 OG1 THR A 28 28.105 -6.346 -8.628 1.00 9.27 O ATOM 471 CG2 THR A 28 26.769 -5.003 -7.140 1.00 8.30 C ATOM 0 H THR A 28 24.398 -5.995 -7.299 1.00 9.28 H new ATOM 0 HA THR A 28 25.954 -7.895 -8.848 1.00 9.35 H new ATOM 0 HB THR A 28 26.286 -5.509 -9.157 1.00 9.07 H new ATOM 0 HG1 THR A 28 28.129 -6.743 -9.524 1.00 9.27 H new ATOM 0 HG21 THR A 28 27.359 -4.128 -7.411 1.00 8.30 H new ATOM 0 HG22 THR A 28 25.748 -4.696 -6.915 1.00 8.30 H new ATOM 0 HG23 THR A 28 27.207 -5.478 -6.262 1.00 8.30 H new ATOM 479 N LEU A 29 26.002 -7.738 -5.593 1.00 8.24 N ATOM 480 CA LEU A 29 26.481 -8.347 -4.354 1.00 8.03 C ATOM 481 C LEU A 29 26.376 -9.866 -4.422 1.00 8.87 C ATOM 482 O LEU A 29 27.246 -10.586 -3.937 1.00 9.09 O ATOM 483 CB LEU A 29 25.657 -7.821 -3.167 1.00 7.48 C ATOM 484 CG LEU A 29 26.057 -8.343 -1.781 1.00 7.10 C ATOM 485 CD1 LEU A 29 27.446 -7.871 -1.408 1.00 6.93 C ATOM 486 CD2 LEU A 29 25.062 -7.888 -0.727 1.00 6.99 C ATOM 0 H LEU A 29 25.219 -7.098 -5.463 1.00 8.24 H new ATOM 0 HA LEU A 29 27.529 -8.080 -4.219 1.00 8.03 H new ATOM 0 HB2 LEU A 29 25.727 -6.733 -3.157 1.00 7.48 H new ATOM 0 HB3 LEU A 29 24.610 -8.072 -3.339 1.00 7.48 H new ATOM 0 HG LEU A 29 26.055 -9.432 -1.823 1.00 7.10 H new ATOM 0 HD11 LEU A 29 27.708 -8.254 -0.421 1.00 6.93 H new ATOM 0 HD12 LEU A 29 28.164 -8.238 -2.142 1.00 6.93 H new ATOM 0 HD13 LEU A 29 27.468 -6.781 -1.392 1.00 6.93 H new ATOM 0 HD21 LEU A 29 25.365 -8.269 0.248 1.00 6.99 H new ATOM 0 HD22 LEU A 29 25.035 -6.799 -0.698 1.00 6.99 H new ATOM 0 HD23 LEU A 29 24.071 -8.269 -0.974 1.00 6.99 H new ATOM 498 N ARG A 30 25.307 -10.337 -5.039 1.00 9.50 N ATOM 499 CA ARG A 30 25.002 -11.759 -5.066 1.00 10.45 C ATOM 500 C ARG A 30 25.758 -12.507 -6.155 1.00 10.98 C ATOM 501 O ARG A 30 26.112 -13.669 -5.987 1.00 11.61 O ATOM 502 CB ARG A 30 23.501 -11.955 -5.254 1.00 11.14 C ATOM 503 CG ARG A 30 22.989 -11.505 -6.614 1.00 11.16 C ATOM 504 CD ARG A 30 21.480 -11.636 -6.727 1.00 11.94 C ATOM 505 NE ARG A 30 20.999 -11.165 -8.023 1.00 12.66 N ATOM 506 CZ ARG A 30 19.741 -10.802 -8.270 1.00 13.44 C ATOM 507 NH1 ARG A 30 18.811 -10.925 -7.328 1.00 13.60 N ATOM 508 NH2 ARG A 30 19.409 -10.336 -9.468 1.00 14.19 N ATOM 0 H ARG A 30 24.631 -9.753 -5.531 1.00 9.50 H new ATOM 0 HA ARG A 30 25.325 -12.175 -4.112 1.00 10.45 H new ATOM 0 HB2 ARG A 30 23.262 -13.010 -5.117 1.00 11.14 H new ATOM 0 HB3 ARG A 30 22.972 -11.404 -4.476 1.00 11.14 H new ATOM 0 HG2 ARG A 30 23.276 -10.467 -6.784 1.00 11.16 H new ATOM 0 HG3 ARG A 30 23.464 -12.099 -7.395 1.00 11.16 H new ATOM 0 HD2 ARG A 30 21.192 -12.678 -6.587 1.00 11.94 H new ATOM 0 HD3 ARG A 30 21.003 -11.064 -5.931 1.00 11.94 H new ATOM 0 HE ARG A 30 21.670 -11.110 -8.789 1.00 12.66 H new ATOM 0 HH11 ARG A 30 19.059 -11.298 -6.412 1.00 13.60 H new ATOM 0 HH12 ARG A 30 17.849 -10.646 -7.521 1.00 13.60 H new ATOM 0 HH21 ARG A 30 20.117 -10.256 -10.198 1.00 14.19 H new ATOM 0 HH22 ARG A 30 18.446 -10.058 -9.658 1.00 14.19 H new ATOM 522 N ALA A 31 25.996 -11.857 -7.271 1.00 10.87 N ATOM 523 CA ALA A 31 26.537 -12.562 -8.425 1.00 11.56 C ATOM 524 C ALA A 31 28.057 -12.693 -8.382 1.00 11.34 C ATOM 525 O ALA A 31 28.588 -13.804 -8.341 1.00 11.93 O ATOM 526 CB ALA A 31 26.104 -11.861 -9.704 1.00 11.84 C ATOM 0 H ALA A 31 25.830 -10.860 -7.410 1.00 10.87 H new ATOM 0 HA ALA A 31 26.136 -13.575 -8.401 1.00 11.56 H new ATOM 0 HB1 ALA A 31 26.511 -12.391 -10.565 1.00 11.84 H new ATOM 0 HB2 ALA A 31 25.016 -11.853 -9.764 1.00 11.84 H new ATOM 0 HB3 ALA A 31 26.475 -10.836 -9.701 1.00 11.84 H new ATOM 532 N GLU A 32 28.752 -11.567 -8.363 1.00 10.61 N ATOM 533 CA GLU A 32 30.211 -11.564 -8.510 1.00 10.60 C ATOM 534 C GLU A 32 30.936 -11.581 -7.167 1.00 10.54 C ATOM 535 O GLU A 32 32.045 -11.061 -7.047 1.00 10.89 O ATOM 536 CB GLU A 32 30.668 -10.379 -9.359 1.00 10.22 C ATOM 537 CG GLU A 32 30.179 -9.036 -8.857 1.00 9.56 C ATOM 538 CD GLU A 32 30.679 -7.896 -9.711 1.00 9.48 C ATOM 539 OE1 GLU A 32 31.749 -7.333 -9.398 1.00 9.47 O ATOM 540 OE2 GLU A 32 30.007 -7.557 -10.709 1.00 9.62 O ATOM 0 H GLU A 32 28.337 -10.642 -8.248 1.00 10.61 H new ATOM 0 HA GLU A 32 30.478 -12.487 -9.024 1.00 10.60 H new ATOM 0 HB2 GLU A 32 31.757 -10.368 -9.392 1.00 10.22 H new ATOM 0 HB3 GLU A 32 30.319 -10.522 -10.382 1.00 10.22 H new ATOM 0 HG2 GLU A 32 29.089 -9.029 -8.845 1.00 9.56 H new ATOM 0 HG3 GLU A 32 30.510 -8.891 -7.829 1.00 9.56 H new ATOM 547 N GLN A 33 30.307 -12.180 -6.170 1.00 10.31 N ATOM 548 CA GLN A 33 30.812 -12.162 -4.797 1.00 10.45 C ATOM 549 C GLN A 33 32.067 -13.041 -4.619 1.00 10.39 C ATOM 550 O GLN A 33 32.024 -14.090 -3.975 1.00 10.09 O ATOM 551 CB GLN A 33 29.689 -12.613 -3.861 1.00 10.44 C ATOM 552 CG GLN A 33 29.164 -14.017 -4.151 1.00 10.76 C ATOM 553 CD GLN A 33 27.833 -14.319 -3.482 1.00 11.12 C ATOM 554 OE1 GLN A 33 27.082 -15.184 -3.935 1.00 11.23 O ATOM 555 NE2 GLN A 33 27.506 -13.592 -2.430 1.00 11.52 N ATOM 0 H GLN A 33 29.433 -12.693 -6.283 1.00 10.31 H new ATOM 0 HA GLN A 33 31.120 -11.145 -4.552 1.00 10.45 H new ATOM 0 HB2 GLN A 33 30.050 -12.577 -2.833 1.00 10.44 H new ATOM 0 HB3 GLN A 33 28.863 -11.905 -3.934 1.00 10.44 H new ATOM 0 HG2 GLN A 33 29.056 -14.140 -5.229 1.00 10.76 H new ATOM 0 HG3 GLN A 33 29.902 -14.748 -3.819 1.00 10.76 H new ATOM 0 HE21 GLN A 33 28.151 -12.883 -2.079 1.00 11.52 H new ATOM 0 HE22 GLN A 33 26.609 -13.739 -1.968 1.00 11.52 H new ATOM 564 N ALA A 34 33.189 -12.604 -5.181 1.00 10.90 N ATOM 565 CA ALA A 34 34.405 -13.410 -5.168 1.00 11.19 C ATOM 566 C ALA A 34 35.230 -13.215 -3.895 1.00 11.09 C ATOM 567 O ALA A 34 35.389 -14.141 -3.104 1.00 11.27 O ATOM 568 CB ALA A 34 35.248 -13.104 -6.398 1.00 11.97 C ATOM 0 H ALA A 34 33.282 -11.702 -5.648 1.00 10.90 H new ATOM 0 HA ALA A 34 34.097 -14.455 -5.186 1.00 11.19 H new ATOM 0 HB1 ALA A 34 36.153 -13.711 -6.379 1.00 11.97 H new ATOM 0 HB2 ALA A 34 34.676 -13.334 -7.297 1.00 11.97 H new ATOM 0 HB3 ALA A 34 35.519 -12.048 -6.400 1.00 11.97 H new ATOM 574 N SER A 35 35.751 -12.010 -3.702 1.00 11.05 N ATOM 575 CA SER A 35 36.649 -11.726 -2.580 1.00 11.21 C ATOM 576 C SER A 35 35.880 -11.390 -1.302 1.00 10.64 C ATOM 577 O SER A 35 35.989 -10.284 -0.781 1.00 10.19 O ATOM 578 CB SER A 35 37.580 -10.575 -2.958 1.00 11.48 C ATOM 579 OG SER A 35 38.222 -10.840 -4.195 1.00 12.02 O ATOM 0 H SER A 35 35.569 -11.209 -4.307 1.00 11.05 H new ATOM 0 HA SER A 35 37.233 -12.624 -2.376 1.00 11.21 H new ATOM 0 HB2 SER A 35 37.011 -9.648 -3.028 1.00 11.48 H new ATOM 0 HB3 SER A 35 38.327 -10.432 -2.177 1.00 11.48 H new ATOM 0 HG SER A 35 38.813 -10.093 -4.423 1.00 12.02 H new ATOM 585 N GLN A 36 35.152 -12.369 -0.777 1.00 10.85 N ATOM 586 CA GLN A 36 34.241 -12.156 0.351 1.00 10.51 C ATOM 587 C GLN A 36 34.877 -11.396 1.517 1.00 10.66 C ATOM 588 O GLN A 36 34.287 -10.451 2.028 1.00 10.26 O ATOM 589 CB GLN A 36 33.682 -13.489 0.864 1.00 11.11 C ATOM 590 CG GLN A 36 34.724 -14.465 1.407 1.00 11.25 C ATOM 591 CD GLN A 36 35.463 -15.215 0.319 1.00 11.80 C ATOM 592 OE1 GLN A 36 34.909 -15.499 -0.741 1.00 12.14 O ATOM 593 NE2 GLN A 36 36.716 -15.544 0.574 1.00 12.09 N ATOM 0 H GLN A 36 35.173 -13.331 -1.117 1.00 10.85 H new ATOM 0 HA GLN A 36 33.435 -11.536 -0.040 1.00 10.51 H new ATOM 0 HB2 GLN A 36 32.957 -13.282 1.651 1.00 11.11 H new ATOM 0 HB3 GLN A 36 33.141 -13.975 0.052 1.00 11.11 H new ATOM 0 HG2 GLN A 36 35.444 -13.917 2.015 1.00 11.25 H new ATOM 0 HG3 GLN A 36 34.233 -15.182 2.064 1.00 11.25 H new ATOM 0 HE21 GLN A 36 37.139 -15.289 1.467 1.00 12.09 H new ATOM 0 HE22 GLN A 36 37.261 -16.053 -0.122 1.00 12.09 H new ATOM 602 N GLU A 37 36.078 -11.797 1.907 1.00 11.37 N ATOM 603 CA GLU A 37 36.694 -11.342 3.146 1.00 11.85 C ATOM 604 C GLU A 37 36.671 -9.822 3.331 1.00 11.40 C ATOM 605 O GLU A 37 36.110 -9.320 4.304 1.00 11.56 O ATOM 606 CB GLU A 37 38.124 -11.869 3.212 1.00 12.76 C ATOM 607 CG GLU A 37 38.993 -11.118 4.186 1.00 12.82 C ATOM 608 CD GLU A 37 40.256 -11.870 4.539 1.00 13.79 C ATOM 609 OE1 GLU A 37 41.141 -11.996 3.668 1.00 14.44 O ATOM 610 OE2 GLU A 37 40.377 -12.329 5.693 1.00 13.98 O ATOM 0 H GLU A 37 36.654 -12.448 1.373 1.00 11.37 H new ATOM 0 HA GLU A 37 36.097 -11.742 3.966 1.00 11.85 H new ATOM 0 HB2 GLU A 37 38.103 -12.922 3.492 1.00 12.76 H new ATOM 0 HB3 GLU A 37 38.571 -11.812 2.219 1.00 12.76 H new ATOM 0 HG2 GLU A 37 39.258 -10.151 3.759 1.00 12.82 H new ATOM 0 HG3 GLU A 37 38.426 -10.921 5.096 1.00 12.82 H new ATOM 617 N VAL A 38 37.254 -9.089 2.403 1.00 11.01 N ATOM 618 CA VAL A 38 37.389 -7.648 2.568 1.00 10.78 C ATOM 619 C VAL A 38 36.115 -6.934 2.150 1.00 9.91 C ATOM 620 O VAL A 38 35.813 -5.835 2.623 1.00 9.82 O ATOM 621 CB VAL A 38 38.591 -7.101 1.771 1.00 10.99 C ATOM 622 CG1 VAL A 38 38.676 -5.584 1.858 1.00 11.05 C ATOM 623 CG2 VAL A 38 39.872 -7.722 2.286 1.00 11.61 C ATOM 0 H VAL A 38 37.639 -9.459 1.534 1.00 11.01 H new ATOM 0 HA VAL A 38 37.567 -7.456 3.626 1.00 10.78 H new ATOM 0 HB VAL A 38 38.450 -7.367 0.723 1.00 10.99 H new ATOM 0 HG11 VAL A 38 39.535 -5.234 1.285 1.00 11.05 H new ATOM 0 HG12 VAL A 38 37.765 -5.145 1.452 1.00 11.05 H new ATOM 0 HG13 VAL A 38 38.789 -5.285 2.900 1.00 11.05 H new ATOM 0 HG21 VAL A 38 40.718 -7.333 1.720 1.00 11.61 H new ATOM 0 HG22 VAL A 38 39.997 -7.477 3.341 1.00 11.61 H new ATOM 0 HG23 VAL A 38 39.824 -8.805 2.169 1.00 11.61 H new ATOM 633 N LYS A 39 35.345 -7.580 1.300 1.00 9.40 N ATOM 634 CA LYS A 39 34.167 -6.945 0.740 1.00 8.62 C ATOM 635 C LYS A 39 33.009 -6.996 1.728 1.00 8.49 C ATOM 636 O LYS A 39 32.228 -6.058 1.807 1.00 8.00 O ATOM 637 CB LYS A 39 33.765 -7.599 -0.579 1.00 8.48 C ATOM 638 CG LYS A 39 34.912 -7.803 -1.554 1.00 8.87 C ATOM 639 CD LYS A 39 35.680 -6.530 -1.846 1.00 8.96 C ATOM 640 CE LYS A 39 36.844 -6.820 -2.778 1.00 9.53 C ATOM 641 NZ LYS A 39 37.676 -5.616 -3.033 1.00 9.78 N ATOM 0 H LYS A 39 35.510 -8.535 0.983 1.00 9.40 H new ATOM 0 HA LYS A 39 34.413 -5.902 0.542 1.00 8.62 H new ATOM 0 HB2 LYS A 39 33.308 -8.566 -0.367 1.00 8.48 H new ATOM 0 HB3 LYS A 39 33.002 -6.985 -1.058 1.00 8.48 H new ATOM 0 HG2 LYS A 39 35.597 -8.548 -1.149 1.00 8.87 H new ATOM 0 HG3 LYS A 39 34.519 -8.205 -2.488 1.00 8.87 H new ATOM 0 HD2 LYS A 39 35.017 -5.793 -2.299 1.00 8.96 H new ATOM 0 HD3 LYS A 39 36.049 -6.098 -0.916 1.00 8.96 H new ATOM 0 HE2 LYS A 39 37.466 -7.604 -2.346 1.00 9.53 H new ATOM 0 HE3 LYS A 39 36.462 -7.202 -3.725 1.00 9.53 H new ATOM 0 HZ1 LYS A 39 38.255 -5.768 -3.884 1.00 9.78 H new ATOM 0 HZ2 LYS A 39 37.059 -4.792 -3.177 1.00 9.78 H new ATOM 0 HZ3 LYS A 39 38.298 -5.445 -2.217 1.00 9.78 H new ATOM 655 N ASN A 40 32.915 -8.091 2.487 1.00 9.12 N ATOM 656 CA ASN A 40 31.880 -8.246 3.516 1.00 9.38 C ATOM 657 C ASN A 40 31.896 -7.081 4.498 1.00 9.55 C ATOM 658 O ASN A 40 30.849 -6.648 4.985 1.00 9.39 O ATOM 659 CB ASN A 40 32.063 -9.552 4.297 1.00 10.35 C ATOM 660 CG ASN A 40 31.728 -10.792 3.492 1.00 10.85 C ATOM 661 OD1 ASN A 40 30.892 -10.763 2.587 1.00 10.92 O ATOM 662 ND2 ASN A 40 32.373 -11.897 3.825 1.00 11.43 N ATOM 0 H ASN A 40 33.546 -8.888 2.408 1.00 9.12 H new ATOM 0 HA ASN A 40 30.922 -8.267 2.996 1.00 9.38 H new ATOM 0 HB2 ASN A 40 33.096 -9.619 4.639 1.00 10.35 H new ATOM 0 HB3 ASN A 40 31.433 -9.525 5.186 1.00 10.35 H new ATOM 0 HD21 ASN A 40 32.186 -12.767 3.326 1.00 11.43 H new ATOM 0 HD22 ASN A 40 33.058 -11.880 4.580 1.00 11.43 H new ATOM 669 N ALA A 41 33.088 -6.586 4.797 1.00 10.04 N ATOM 670 CA ALA A 41 33.235 -5.454 5.696 1.00 10.52 C ATOM 671 C ALA A 41 32.753 -4.178 5.018 1.00 9.85 C ATOM 672 O ALA A 41 32.256 -3.260 5.670 1.00 10.08 O ATOM 673 CB ALA A 41 34.683 -5.312 6.138 1.00 11.43 C ATOM 0 H ALA A 41 33.967 -6.951 4.430 1.00 10.04 H new ATOM 0 HA ALA A 41 32.623 -5.628 6.581 1.00 10.52 H new ATOM 0 HB1 ALA A 41 34.776 -4.460 6.811 1.00 11.43 H new ATOM 0 HB2 ALA A 41 34.996 -6.219 6.656 1.00 11.43 H new ATOM 0 HB3 ALA A 41 35.316 -5.156 5.265 1.00 11.43 H new ATOM 679 N ALA A 42 32.886 -4.143 3.699 1.00 9.19 N ATOM 680 CA ALA A 42 32.457 -2.996 2.914 1.00 8.71 C ATOM 681 C ALA A 42 30.939 -2.983 2.756 1.00 7.86 C ATOM 682 O ALA A 42 30.322 -1.928 2.766 1.00 7.82 O ATOM 683 CB ALA A 42 33.135 -3.007 1.552 1.00 8.58 C ATOM 0 H ALA A 42 33.290 -4.901 3.149 1.00 9.19 H new ATOM 0 HA ALA A 42 32.750 -2.089 3.443 1.00 8.71 H new ATOM 0 HB1 ALA A 42 32.805 -2.143 0.974 1.00 8.58 H new ATOM 0 HB2 ALA A 42 34.216 -2.964 1.683 1.00 8.58 H new ATOM 0 HB3 ALA A 42 32.870 -3.921 1.021 1.00 8.58 H new ATOM 689 N THR A 43 30.352 -4.167 2.652 1.00 7.35 N ATOM 690 CA THR A 43 28.924 -4.349 2.423 1.00 6.63 C ATOM 691 C THR A 43 28.072 -3.493 3.362 1.00 6.87 C ATOM 692 O THR A 43 27.050 -2.933 2.964 1.00 6.42 O ATOM 693 CB THR A 43 28.559 -5.831 2.632 1.00 6.60 C ATOM 694 OG1 THR A 43 29.624 -6.656 2.160 1.00 6.93 O ATOM 695 CG2 THR A 43 27.293 -6.198 1.892 1.00 6.92 C ATOM 0 H THR A 43 30.864 -5.046 2.726 1.00 7.35 H new ATOM 0 HA THR A 43 28.714 -4.036 1.400 1.00 6.63 H new ATOM 0 HB THR A 43 28.397 -5.989 3.698 1.00 6.60 H new ATOM 0 HG1 THR A 43 29.253 -7.438 1.700 1.00 6.93 H new ATOM 0 HG21 THR A 43 27.065 -7.250 2.061 1.00 6.92 H new ATOM 0 HG22 THR A 43 26.468 -5.585 2.255 1.00 6.92 H new ATOM 0 HG23 THR A 43 27.432 -6.024 0.825 1.00 6.92 H new ATOM 703 N GLU A 44 28.507 -3.393 4.605 1.00 7.76 N ATOM 704 CA GLU A 44 27.759 -2.678 5.624 1.00 8.32 C ATOM 705 C GLU A 44 28.040 -1.180 5.577 1.00 8.48 C ATOM 706 O GLU A 44 27.126 -0.358 5.668 1.00 8.35 O ATOM 707 CB GLU A 44 28.117 -3.232 6.996 1.00 9.53 C ATOM 708 CG GLU A 44 27.814 -4.710 7.141 1.00 10.03 C ATOM 709 CD GLU A 44 27.941 -5.197 8.569 1.00 11.07 C ATOM 710 OE1 GLU A 44 28.929 -5.898 8.871 1.00 11.69 O ATOM 711 OE2 GLU A 44 27.053 -4.884 9.392 1.00 11.42 O ATOM 0 H GLU A 44 29.381 -3.801 4.935 1.00 7.76 H new ATOM 0 HA GLU A 44 26.696 -2.822 5.432 1.00 8.32 H new ATOM 0 HB2 GLU A 44 29.178 -3.065 7.182 1.00 9.53 H new ATOM 0 HB3 GLU A 44 27.569 -2.679 7.758 1.00 9.53 H new ATOM 0 HG2 GLU A 44 26.803 -4.906 6.784 1.00 10.03 H new ATOM 0 HG3 GLU A 44 28.493 -5.279 6.506 1.00 10.03 H new ATOM 718 N THR A 45 29.301 -0.832 5.415 1.00 8.95 N ATOM 719 CA THR A 45 29.723 0.557 5.503 1.00 9.49 C ATOM 720 C THR A 45 29.537 1.282 4.172 1.00 8.79 C ATOM 721 O THR A 45 29.442 2.505 4.133 1.00 9.04 O ATOM 722 CB THR A 45 31.195 0.675 5.963 1.00 10.61 C ATOM 723 OG1 THR A 45 31.557 2.053 6.128 1.00 11.34 O ATOM 724 CG2 THR A 45 32.138 0.019 4.966 1.00 11.01 C ATOM 0 H THR A 45 30.055 -1.491 5.221 1.00 8.95 H new ATOM 0 HA THR A 45 29.088 1.033 6.250 1.00 9.49 H new ATOM 0 HB THR A 45 31.285 0.158 6.918 1.00 10.61 H new ATOM 0 HG1 THR A 45 32.490 2.113 6.421 1.00 11.34 H new ATOM 0 HG21 THR A 45 33.165 0.118 5.317 1.00 11.01 H new ATOM 0 HG22 THR A 45 31.888 -1.038 4.870 1.00 11.01 H new ATOM 0 HG23 THR A 45 32.038 0.505 3.996 1.00 11.01 H new ATOM 732 N LEU A 46 29.486 0.525 3.089 1.00 8.07 N ATOM 733 CA LEU A 46 29.360 1.097 1.758 1.00 7.71 C ATOM 734 C LEU A 46 27.945 1.591 1.515 1.00 6.77 C ATOM 735 O LEU A 46 27.745 2.636 0.894 1.00 6.93 O ATOM 736 CB LEU A 46 29.744 0.063 0.701 1.00 7.55 C ATOM 737 CG LEU A 46 30.916 0.455 -0.197 1.00 7.70 C ATOM 738 CD1 LEU A 46 30.574 1.685 -1.020 1.00 7.76 C ATOM 739 CD2 LEU A 46 32.159 0.710 0.642 1.00 8.22 C ATOM 0 H LEU A 46 29.530 -0.494 3.106 1.00 8.07 H new ATOM 0 HA LEU A 46 30.038 1.947 1.686 1.00 7.71 H new ATOM 0 HB2 LEU A 46 29.989 -0.873 1.203 1.00 7.55 H new ATOM 0 HB3 LEU A 46 28.875 -0.131 0.073 1.00 7.55 H new ATOM 0 HG LEU A 46 31.117 -0.370 -0.881 1.00 7.70 H new ATOM 0 HD11 LEU A 46 31.422 1.947 -1.652 1.00 7.76 H new ATOM 0 HD12 LEU A 46 29.706 1.475 -1.645 1.00 7.76 H new ATOM 0 HD13 LEU A 46 30.348 2.517 -0.354 1.00 7.76 H new ATOM 0 HD21 LEU A 46 32.987 0.988 -0.010 1.00 8.22 H new ATOM 0 HD22 LEU A 46 31.963 1.519 1.346 1.00 8.22 H new ATOM 0 HD23 LEU A 46 32.419 -0.195 1.192 1.00 8.22 H new ATOM 751 N LEU A 47 26.969 0.839 2.013 1.00 5.99 N ATOM 752 CA LEU A 47 25.567 1.239 1.895 1.00 5.15 C ATOM 753 C LEU A 47 25.338 2.645 2.449 1.00 5.48 C ATOM 754 O LEU A 47 24.648 3.449 1.835 1.00 5.21 O ATOM 755 CB LEU A 47 24.645 0.243 2.603 1.00 4.73 C ATOM 756 CG LEU A 47 24.280 -0.997 1.784 1.00 4.22 C ATOM 757 CD1 LEU A 47 23.467 -1.966 2.626 1.00 4.20 C ATOM 758 CD2 LEU A 47 23.500 -0.603 0.535 1.00 4.34 C ATOM 0 H LEU A 47 27.119 -0.045 2.499 1.00 5.99 H new ATOM 0 HA LEU A 47 25.325 1.244 0.832 1.00 5.15 H new ATOM 0 HB2 LEU A 47 25.125 -0.079 3.527 1.00 4.73 H new ATOM 0 HB3 LEU A 47 23.726 0.758 2.883 1.00 4.73 H new ATOM 0 HG LEU A 47 25.203 -1.489 1.476 1.00 4.22 H new ATOM 0 HD11 LEU A 47 23.215 -2.843 2.030 1.00 4.20 H new ATOM 0 HD12 LEU A 47 24.051 -2.273 3.494 1.00 4.20 H new ATOM 0 HD13 LEU A 47 22.551 -1.478 2.959 1.00 4.20 H new ATOM 0 HD21 LEU A 47 23.249 -1.498 -0.035 1.00 4.34 H new ATOM 0 HD22 LEU A 47 22.584 -0.089 0.825 1.00 4.34 H new ATOM 0 HD23 LEU A 47 24.109 0.060 -0.080 1.00 4.34 H new ATOM 770 N VAL A 48 25.921 2.940 3.601 1.00 6.32 N ATOM 771 CA VAL A 48 25.779 4.267 4.194 1.00 6.92 C ATOM 772 C VAL A 48 26.763 5.267 3.589 1.00 7.62 C ATOM 773 O VAL A 48 26.505 6.465 3.567 1.00 7.93 O ATOM 774 CB VAL A 48 25.956 4.238 5.727 1.00 7.91 C ATOM 775 CG1 VAL A 48 24.804 3.496 6.381 1.00 7.84 C ATOM 776 CG2 VAL A 48 27.283 3.607 6.118 1.00 8.67 C ATOM 0 H VAL A 48 26.491 2.289 4.141 1.00 6.32 H new ATOM 0 HA VAL A 48 24.763 4.591 3.967 1.00 6.92 H new ATOM 0 HB VAL A 48 25.957 5.268 6.083 1.00 7.91 H new ATOM 0 HG11 VAL A 48 24.945 3.485 7.462 1.00 7.84 H new ATOM 0 HG12 VAL A 48 23.866 3.997 6.142 1.00 7.84 H new ATOM 0 HG13 VAL A 48 24.773 2.472 6.009 1.00 7.84 H new ATOM 0 HG21 VAL A 48 27.377 3.602 7.204 1.00 8.67 H new ATOM 0 HG22 VAL A 48 27.323 2.584 5.745 1.00 8.67 H new ATOM 0 HG23 VAL A 48 28.101 4.183 5.686 1.00 8.67 H new ATOM 786 N GLN A 49 27.878 4.763 3.088 1.00 8.03 N ATOM 787 CA GLN A 49 28.941 5.606 2.556 1.00 8.97 C ATOM 788 C GLN A 49 28.457 6.438 1.369 1.00 8.65 C ATOM 789 O GLN A 49 28.502 7.668 1.401 1.00 9.36 O ATOM 790 CB GLN A 49 30.126 4.733 2.138 1.00 9.65 C ATOM 791 CG GLN A 49 31.363 5.517 1.742 1.00 10.72 C ATOM 792 CD GLN A 49 32.520 4.614 1.361 1.00 11.48 C ATOM 793 OE1 GLN A 49 32.688 4.259 0.193 1.00 11.55 O ATOM 794 NE2 GLN A 49 33.316 4.228 2.343 1.00 12.22 N ATOM 0 H GLN A 49 28.074 3.763 3.037 1.00 8.03 H new ATOM 0 HA GLN A 49 29.252 6.297 3.339 1.00 8.97 H new ATOM 0 HB2 GLN A 49 30.380 4.065 2.961 1.00 9.65 H new ATOM 0 HB3 GLN A 49 29.823 4.105 1.300 1.00 9.65 H new ATOM 0 HG2 GLN A 49 31.123 6.170 0.903 1.00 10.72 H new ATOM 0 HG3 GLN A 49 31.664 6.159 2.570 1.00 10.72 H new ATOM 0 HE21 GLN A 49 33.141 4.546 3.296 1.00 12.22 H new ATOM 0 HE22 GLN A 49 34.106 3.613 2.147 1.00 12.22 H new ATOM 803 N ASN A 50 27.969 5.763 0.336 1.00 7.73 N ATOM 804 CA ASN A 50 27.618 6.436 -0.916 1.00 7.72 C ATOM 805 C ASN A 50 26.143 6.802 -0.982 1.00 7.17 C ATOM 806 O ASN A 50 25.630 7.167 -2.046 1.00 7.27 O ATOM 807 CB ASN A 50 27.983 5.563 -2.113 1.00 7.34 C ATOM 808 CG ASN A 50 29.477 5.348 -2.254 1.00 7.66 C ATOM 809 OD1 ASN A 50 30.283 6.173 -1.822 1.00 8.30 O ATOM 810 ND2 ASN A 50 29.855 4.251 -2.885 1.00 7.49 N ATOM 0 H ASN A 50 27.807 4.756 0.336 1.00 7.73 H new ATOM 0 HA ASN A 50 28.192 7.362 -0.948 1.00 7.72 H new ATOM 0 HB2 ASN A 50 27.490 4.596 -2.015 1.00 7.34 H new ATOM 0 HB3 ASN A 50 27.600 6.025 -3.023 1.00 7.34 H new ATOM 0 HD21 ASN A 50 30.847 4.062 -3.030 1.00 7.49 H new ATOM 0 HD22 ASN A 50 29.155 3.593 -3.227 1.00 7.49 H new ATOM 817 N ALA A 51 25.461 6.715 0.146 1.00 6.83 N ATOM 818 CA ALA A 51 24.052 7.063 0.203 1.00 6.42 C ATOM 819 C ALA A 51 23.872 8.576 0.228 1.00 7.39 C ATOM 820 O ALA A 51 24.845 9.331 0.350 1.00 8.36 O ATOM 821 CB ALA A 51 23.395 6.436 1.420 1.00 5.86 C ATOM 0 H ALA A 51 25.859 6.407 1.033 1.00 6.83 H new ATOM 0 HA ALA A 51 23.570 6.671 -0.693 1.00 6.42 H new ATOM 0 HB1 ALA A 51 22.340 6.708 1.445 1.00 5.86 H new ATOM 0 HB2 ALA A 51 23.488 5.351 1.366 1.00 5.86 H new ATOM 0 HB3 ALA A 51 23.884 6.797 2.324 1.00 5.86 H new ATOM 827 N ASN A 52 22.628 9.012 0.098 1.00 7.23 N ATOM 828 CA ASN A 52 22.295 10.429 0.178 1.00 8.14 C ATOM 829 C ASN A 52 22.571 10.935 1.587 1.00 8.57 C ATOM 830 O ASN A 52 22.229 10.254 2.556 1.00 8.09 O ATOM 831 CB ASN A 52 20.823 10.650 -0.189 1.00 7.94 C ATOM 832 CG ASN A 52 20.427 12.116 -0.186 1.00 8.81 C ATOM 833 OD1 ASN A 52 20.056 12.673 0.850 1.00 9.40 O ATOM 834 ND2 ASN A 52 20.484 12.745 -1.350 1.00 9.07 N ATOM 0 H ASN A 52 21.827 8.402 -0.064 1.00 7.23 H new ATOM 0 HA ASN A 52 22.912 10.984 -0.529 1.00 8.14 H new ATOM 0 HB2 ASN A 52 20.633 10.230 -1.177 1.00 7.94 H new ATOM 0 HB3 ASN A 52 20.193 10.107 0.515 1.00 7.94 H new ATOM 0 HD21 ASN A 52 20.215 13.727 -1.413 1.00 9.07 H new ATOM 0 HD22 ASN A 52 20.797 12.248 -2.184 1.00 9.07 H new ATOM 841 N PRO A 53 23.227 12.105 1.717 1.00 9.68 N ATOM 842 CA PRO A 53 23.613 12.680 3.011 1.00 10.41 C ATOM 843 C PRO A 53 22.572 12.475 4.112 1.00 10.13 C ATOM 844 O PRO A 53 22.889 11.963 5.185 1.00 10.29 O ATOM 845 CB PRO A 53 23.765 14.160 2.686 1.00 11.56 C ATOM 846 CG PRO A 53 24.238 14.189 1.272 1.00 11.66 C ATOM 847 CD PRO A 53 23.664 12.964 0.597 1.00 10.51 C ATOM 0 HA PRO A 53 24.510 12.206 3.410 1.00 10.41 H new ATOM 0 HB2 PRO A 53 22.819 14.690 2.798 1.00 11.56 H new ATOM 0 HB3 PRO A 53 24.480 14.641 3.353 1.00 11.56 H new ATOM 0 HG2 PRO A 53 23.906 15.098 0.771 1.00 11.66 H new ATOM 0 HG3 PRO A 53 25.327 14.181 1.228 1.00 11.66 H new ATOM 0 HD2 PRO A 53 22.830 13.223 -0.056 1.00 10.51 H new ATOM 0 HD3 PRO A 53 24.409 12.464 -0.021 1.00 10.51 H new ATOM 855 N ASP A 54 21.328 12.836 3.827 1.00 9.86 N ATOM 856 CA ASP A 54 20.264 12.781 4.828 1.00 9.76 C ATOM 857 C ASP A 54 19.818 11.346 5.065 1.00 8.93 C ATOM 858 O ASP A 54 19.560 10.940 6.197 1.00 9.26 O ATOM 859 CB ASP A 54 19.072 13.610 4.367 1.00 9.71 C ATOM 860 CG ASP A 54 18.173 14.031 5.516 1.00 9.98 C ATOM 861 OD1 ASP A 54 18.434 15.080 6.134 1.00 10.64 O ATOM 862 OD2 ASP A 54 17.201 13.303 5.811 1.00 9.67 O ATOM 0 H ASP A 54 21.028 13.171 2.911 1.00 9.86 H new ATOM 0 HA ASP A 54 20.654 13.187 5.761 1.00 9.76 H new ATOM 0 HB2 ASP A 54 19.431 14.498 3.848 1.00 9.71 H new ATOM 0 HB3 ASP A 54 18.490 13.034 3.648 1.00 9.71 H new ATOM 867 N CYS A 55 19.755 10.585 3.985 1.00 8.04 N ATOM 868 CA CYS A 55 19.268 9.208 4.029 1.00 7.30 C ATOM 869 C CYS A 55 20.130 8.335 4.938 1.00 7.57 C ATOM 870 O CYS A 55 19.610 7.580 5.753 1.00 7.74 O ATOM 871 CB CYS A 55 19.215 8.617 2.618 1.00 6.46 C ATOM 872 SG CYS A 55 18.054 9.455 1.511 1.00 6.30 S ATOM 0 H CYS A 55 20.037 10.898 3.056 1.00 8.04 H new ATOM 0 HA CYS A 55 18.261 9.226 4.445 1.00 7.30 H new ATOM 0 HB2 CYS A 55 20.212 8.658 2.180 1.00 6.46 H new ATOM 0 HB3 CYS A 55 18.940 7.564 2.686 1.00 6.46 H new ATOM 0 HG CYS A 55 17.078 8.649 1.216 1.00 6.30 H new ATOM 878 N LYS A 56 21.448 8.444 4.819 1.00 7.87 N ATOM 879 CA LYS A 56 22.328 7.652 5.670 1.00 8.36 C ATOM 880 C LYS A 56 22.357 8.219 7.076 1.00 9.50 C ATOM 881 O LYS A 56 22.644 7.510 8.043 1.00 10.04 O ATOM 882 CB LYS A 56 23.737 7.571 5.088 1.00 8.58 C ATOM 883 CG LYS A 56 24.463 8.902 4.980 1.00 8.84 C ATOM 884 CD LYS A 56 25.087 9.046 3.607 1.00 8.68 C ATOM 885 CE LYS A 56 26.249 10.021 3.597 1.00 9.50 C ATOM 886 NZ LYS A 56 26.949 10.026 2.283 1.00 9.81 N ATOM 0 H LYS A 56 21.923 9.058 4.157 1.00 7.87 H new ATOM 0 HA LYS A 56 21.931 6.638 5.714 1.00 8.36 H new ATOM 0 HB2 LYS A 56 24.332 6.899 5.706 1.00 8.58 H new ATOM 0 HB3 LYS A 56 23.679 7.124 4.096 1.00 8.58 H new ATOM 0 HG2 LYS A 56 23.766 9.721 5.159 1.00 8.84 H new ATOM 0 HG3 LYS A 56 25.235 8.967 5.747 1.00 8.84 H new ATOM 0 HD2 LYS A 56 25.432 8.071 3.264 1.00 8.68 H new ATOM 0 HD3 LYS A 56 24.329 9.382 2.900 1.00 8.68 H new ATOM 0 HE2 LYS A 56 25.885 11.024 3.820 1.00 9.50 H new ATOM 0 HE3 LYS A 56 26.954 9.756 4.385 1.00 9.50 H new ATOM 0 HZ1 LYS A 56 27.482 10.913 2.177 1.00 9.81 H new ATOM 0 HZ2 LYS A 56 27.605 9.220 2.236 1.00 9.81 H new ATOM 0 HZ3 LYS A 56 26.250 9.948 1.517 1.00 9.81 H new ATOM 900 N THR A 57 22.045 9.499 7.181 1.00 9.98 N ATOM 901 CA THR A 57 21.938 10.159 8.472 1.00 11.08 C ATOM 902 C THR A 57 20.815 9.528 9.305 1.00 11.16 C ATOM 903 O THR A 57 20.992 9.245 10.492 1.00 12.08 O ATOM 904 CB THR A 57 21.683 11.671 8.291 1.00 11.53 C ATOM 905 OG1 THR A 57 22.855 12.309 7.763 1.00 12.00 O ATOM 906 CG2 THR A 57 21.290 12.332 9.598 1.00 12.46 C ATOM 0 H THR A 57 21.860 10.106 6.382 1.00 9.98 H new ATOM 0 HA THR A 57 22.882 10.028 9.002 1.00 11.08 H new ATOM 0 HB THR A 57 20.855 11.784 7.591 1.00 11.53 H new ATOM 0 HG1 THR A 57 22.755 12.427 6.795 1.00 12.00 H new ATOM 0 HG21 THR A 57 21.119 13.395 9.431 1.00 12.46 H new ATOM 0 HG22 THR A 57 20.377 11.873 9.978 1.00 12.46 H new ATOM 0 HG23 THR A 57 22.091 12.204 10.326 1.00 12.46 H new ATOM 914 N ILE A 58 19.679 9.279 8.663 1.00 10.34 N ATOM 915 CA ILE A 58 18.518 8.719 9.350 1.00 10.60 C ATOM 916 C ILE A 58 18.590 7.196 9.452 1.00 10.65 C ATOM 917 O ILE A 58 18.063 6.622 10.399 1.00 11.46 O ATOM 918 CB ILE A 58 17.204 9.108 8.654 1.00 9.96 C ATOM 919 CG1 ILE A 58 17.269 8.735 7.176 1.00 8.86 C ATOM 920 CG2 ILE A 58 16.934 10.597 8.828 1.00 10.22 C ATOM 921 CD1 ILE A 58 15.957 8.872 6.450 1.00 8.44 C ATOM 0 H ILE A 58 19.536 9.455 7.669 1.00 10.34 H new ATOM 0 HA ILE A 58 18.533 9.142 10.355 1.00 10.60 H new ATOM 0 HB ILE A 58 16.381 8.560 9.113 1.00 9.96 H new ATOM 0 HG12 ILE A 58 18.011 9.365 6.685 1.00 8.86 H new ATOM 0 HG13 ILE A 58 17.616 7.705 7.087 1.00 8.86 H new ATOM 0 HG21 ILE A 58 16.000 10.858 8.330 1.00 10.22 H new ATOM 0 HG22 ILE A 58 16.857 10.831 9.890 1.00 10.22 H new ATOM 0 HG23 ILE A 58 17.752 11.169 8.389 1.00 10.22 H new ATOM 0 HD11 ILE A 58 16.088 8.588 5.406 1.00 8.44 H new ATOM 0 HD12 ILE A 58 15.215 8.221 6.913 1.00 8.44 H new ATOM 0 HD13 ILE A 58 15.617 9.906 6.505 1.00 8.44 H new ATOM 933 N LEU A 59 19.240 6.553 8.476 1.00 9.90 N ATOM 934 CA LEU A 59 19.395 5.087 8.468 1.00 9.98 C ATOM 935 C LEU A 59 19.785 4.547 9.839 1.00 11.20 C ATOM 936 O LEU A 59 19.152 3.632 10.362 1.00 11.84 O ATOM 937 CB LEU A 59 20.466 4.650 7.459 1.00 9.07 C ATOM 938 CG LEU A 59 20.025 4.570 5.997 1.00 7.91 C ATOM 939 CD1 LEU A 59 21.194 4.162 5.116 1.00 7.28 C ATOM 940 CD2 LEU A 59 18.885 3.577 5.841 1.00 7.92 C ATOM 0 H LEU A 59 19.669 7.022 7.678 1.00 9.90 H new ATOM 0 HA LEU A 59 18.424 4.680 8.185 1.00 9.98 H new ATOM 0 HB2 LEU A 59 21.304 5.344 7.526 1.00 9.07 H new ATOM 0 HB3 LEU A 59 20.839 3.670 7.758 1.00 9.07 H new ATOM 0 HG LEU A 59 19.676 5.555 5.687 1.00 7.91 H new ATOM 0 HD11 LEU A 59 20.866 4.109 4.078 1.00 7.28 H new ATOM 0 HD12 LEU A 59 21.993 4.898 5.207 1.00 7.28 H new ATOM 0 HD13 LEU A 59 21.563 3.186 5.430 1.00 7.28 H new ATOM 0 HD21 LEU A 59 18.583 3.532 4.795 1.00 7.92 H new ATOM 0 HD22 LEU A 59 19.215 2.590 6.167 1.00 7.92 H new ATOM 0 HD23 LEU A 59 18.039 3.896 6.450 1.00 7.92 H new ATOM 952 N LYS A 60 20.816 5.133 10.423 1.00 11.67 N ATOM 953 CA LYS A 60 21.340 4.664 11.697 1.00 12.90 C ATOM 954 C LYS A 60 20.475 5.128 12.863 1.00 13.86 C ATOM 955 O LYS A 60 20.511 4.543 13.943 1.00 14.91 O ATOM 956 CB LYS A 60 22.776 5.154 11.869 1.00 13.23 C ATOM 957 CG LYS A 60 22.909 6.668 11.830 1.00 13.20 C ATOM 958 CD LYS A 60 24.278 7.096 11.332 1.00 13.44 C ATOM 959 CE LYS A 60 25.398 6.595 12.235 1.00 14.35 C ATOM 960 NZ LYS A 60 25.398 7.268 13.561 1.00 14.91 N ATOM 0 H LYS A 60 21.309 5.937 10.035 1.00 11.67 H new ATOM 0 HA LYS A 60 21.325 3.574 11.695 1.00 12.90 H new ATOM 0 HB2 LYS A 60 23.165 4.787 12.819 1.00 13.23 H new ATOM 0 HB3 LYS A 60 23.395 4.722 11.083 1.00 13.23 H new ATOM 0 HG2 LYS A 60 22.139 7.085 11.181 1.00 13.20 H new ATOM 0 HG3 LYS A 60 22.740 7.074 12.827 1.00 13.20 H new ATOM 0 HD2 LYS A 60 24.431 6.717 10.321 1.00 13.44 H new ATOM 0 HD3 LYS A 60 24.319 8.184 11.274 1.00 13.44 H new ATOM 0 HE2 LYS A 60 25.294 5.519 12.376 1.00 14.35 H new ATOM 0 HE3 LYS A 60 26.358 6.761 11.746 1.00 14.35 H new ATOM 0 HZ1 LYS A 60 26.197 6.919 14.127 1.00 14.91 H new ATOM 0 HZ2 LYS A 60 25.490 8.295 13.429 1.00 14.91 H new ATOM 0 HZ3 LYS A 60 24.507 7.061 14.056 1.00 14.91 H new ATOM 974 N ALA A 61 19.685 6.166 12.635 1.00 13.54 N ATOM 975 CA ALA A 61 18.838 6.721 13.678 1.00 14.41 C ATOM 976 C ALA A 61 17.573 5.888 13.851 1.00 14.65 C ATOM 977 O ALA A 61 17.135 5.634 14.973 1.00 15.64 O ATOM 978 CB ALA A 61 18.486 8.167 13.364 1.00 14.06 C ATOM 0 H ALA A 61 19.613 6.641 11.735 1.00 13.54 H new ATOM 0 HA ALA A 61 19.392 6.695 14.616 1.00 14.41 H new ATOM 0 HB1 ALA A 61 17.852 8.567 14.155 1.00 14.06 H new ATOM 0 HB2 ALA A 61 19.400 8.758 13.298 1.00 14.06 H new ATOM 0 HB3 ALA A 61 17.954 8.214 12.414 1.00 14.06 H new ATOM 984 N LEU A 62 16.997 5.448 12.741 1.00 13.84 N ATOM 985 CA LEU A 62 15.758 4.679 12.785 1.00 14.21 C ATOM 986 C LEU A 62 16.029 3.186 12.682 1.00 14.97 C ATOM 987 O LEU A 62 15.120 2.372 12.828 1.00 15.72 O ATOM 988 CB LEU A 62 14.788 5.134 11.684 1.00 13.37 C ATOM 989 CG LEU A 62 15.387 5.357 10.290 1.00 12.15 C ATOM 990 CD1 LEU A 62 15.592 4.041 9.555 1.00 11.39 C ATOM 991 CD2 LEU A 62 14.496 6.283 9.476 1.00 12.25 C ATOM 0 H LEU A 62 17.364 5.608 11.803 1.00 13.84 H new ATOM 0 HA LEU A 62 15.289 4.867 13.751 1.00 14.21 H new ATOM 0 HB2 LEU A 62 13.996 4.390 11.599 1.00 13.37 H new ATOM 0 HB3 LEU A 62 14.319 6.064 12.006 1.00 13.37 H new ATOM 0 HG LEU A 62 16.364 5.823 10.417 1.00 12.15 H new ATOM 0 HD11 LEU A 62 16.018 4.236 8.571 1.00 11.39 H new ATOM 0 HD12 LEU A 62 16.272 3.408 10.125 1.00 11.39 H new ATOM 0 HD13 LEU A 62 14.634 3.534 9.442 1.00 11.39 H new ATOM 0 HD21 LEU A 62 14.933 6.433 8.489 1.00 12.25 H new ATOM 0 HD22 LEU A 62 13.507 5.837 9.371 1.00 12.25 H new ATOM 0 HD23 LEU A 62 14.409 7.243 9.984 1.00 12.25 H new ATOM 1003 N GLY A 63 17.287 2.851 12.436 1.00 14.89 N ATOM 1004 CA GLY A 63 17.721 1.461 12.337 1.00 15.66 C ATOM 1005 C GLY A 63 17.200 0.556 13.450 1.00 16.04 C ATOM 1006 O GLY A 63 16.684 -0.522 13.160 1.00 16.17 O ATOM 0 H GLY A 63 18.035 3.531 12.299 1.00 14.89 H new ATOM 0 HA2 GLY A 63 17.396 1.059 11.377 1.00 15.66 H new ATOM 0 HA3 GLY A 63 18.811 1.432 12.342 1.00 15.66 H new ATOM 1010 N PRO A 64 17.339 0.949 14.737 1.00 16.36 N ATOM 1011 CA PRO A 64 16.831 0.172 15.876 1.00 16.89 C ATOM 1012 C PRO A 64 15.420 -0.380 15.661 1.00 16.41 C ATOM 1013 O PRO A 64 15.171 -1.569 15.879 1.00 16.65 O ATOM 1014 CB PRO A 64 16.828 1.178 17.038 1.00 17.44 C ATOM 1015 CG PRO A 64 17.292 2.481 16.467 1.00 16.99 C ATOM 1016 CD PRO A 64 18.036 2.151 15.207 1.00 16.40 C ATOM 0 HA PRO A 64 17.450 -0.709 16.047 1.00 16.89 H new ATOM 0 HB2 PRO A 64 15.830 1.274 17.466 1.00 17.44 H new ATOM 0 HB3 PRO A 64 17.488 0.848 17.840 1.00 17.44 H new ATOM 0 HG2 PRO A 64 16.446 3.136 16.258 1.00 16.99 H new ATOM 0 HG3 PRO A 64 17.936 3.006 17.172 1.00 16.99 H new ATOM 0 HD2 PRO A 64 17.984 2.962 14.480 1.00 16.40 H new ATOM 0 HD3 PRO A 64 19.092 1.960 15.397 1.00 16.40 H new ATOM 1024 N GLY A 65 14.503 0.477 15.231 1.00 15.83 N ATOM 1025 CA GLY A 65 13.131 0.053 15.040 1.00 15.53 C ATOM 1026 C GLY A 65 12.845 -0.377 13.617 1.00 14.59 C ATOM 1027 O GLY A 65 11.863 -1.070 13.356 1.00 14.42 O ATOM 0 H GLY A 65 14.685 1.456 15.012 1.00 15.83 H new ATOM 0 HA2 GLY A 65 12.913 -0.774 15.716 1.00 15.53 H new ATOM 0 HA3 GLY A 65 12.462 0.870 15.310 1.00 15.53 H new ATOM 1031 N ALA A 66 13.702 0.032 12.697 1.00 14.15 N ATOM 1032 CA ALA A 66 13.520 -0.280 11.287 1.00 13.39 C ATOM 1033 C ALA A 66 14.470 -1.391 10.857 1.00 13.11 C ATOM 1034 O ALA A 66 15.661 -1.168 10.655 1.00 12.58 O ATOM 1035 CB ALA A 66 13.736 0.969 10.450 1.00 12.24 C ATOM 0 H ALA A 66 14.535 0.584 12.901 1.00 14.15 H new ATOM 0 HA ALA A 66 12.500 -0.632 11.132 1.00 13.39 H new ATOM 0 HB1 ALA A 66 13.598 0.729 9.396 1.00 12.24 H new ATOM 0 HB2 ALA A 66 13.017 1.733 10.745 1.00 12.24 H new ATOM 0 HB3 ALA A 66 14.748 1.342 10.608 1.00 12.24 H new ATOM 1041 N THR A 67 13.915 -2.586 10.705 1.00 13.60 N ATOM 1042 CA THR A 67 14.694 -3.787 10.445 1.00 13.52 C ATOM 1043 C THR A 67 15.351 -3.779 9.061 1.00 12.33 C ATOM 1044 O THR A 67 16.571 -3.678 8.953 1.00 11.64 O ATOM 1045 CB THR A 67 13.810 -5.040 10.584 1.00 14.67 C ATOM 1046 OG1 THR A 67 13.014 -4.936 11.773 1.00 15.33 O ATOM 1047 CG2 THR A 67 14.657 -6.302 10.642 1.00 15.45 C ATOM 0 H THR A 67 12.910 -2.749 10.759 1.00 13.60 H new ATOM 0 HA THR A 67 15.491 -3.807 11.188 1.00 13.52 H new ATOM 0 HB THR A 67 13.162 -5.104 9.710 1.00 14.67 H new ATOM 0 HG1 THR A 67 12.252 -4.343 11.606 1.00 15.33 H new ATOM 0 HG21 THR A 67 14.008 -7.172 10.740 1.00 15.45 H new ATOM 0 HG22 THR A 67 15.244 -6.389 9.728 1.00 15.45 H new ATOM 0 HG23 THR A 67 15.327 -6.251 11.500 1.00 15.45 H new ATOM 1055 N LEU A 68 14.552 -3.899 8.004 1.00 12.22 N ATOM 1056 CA LEU A 68 15.108 -3.968 6.657 1.00 11.25 C ATOM 1057 C LEU A 68 14.302 -3.111 5.685 1.00 11.10 C ATOM 1058 O LEU A 68 14.803 -2.108 5.176 1.00 10.12 O ATOM 1059 CB LEU A 68 15.162 -5.434 6.189 1.00 11.69 C ATOM 1060 CG LEU A 68 15.999 -5.728 4.928 1.00 10.84 C ATOM 1061 CD1 LEU A 68 15.249 -5.351 3.657 1.00 10.70 C ATOM 1062 CD2 LEU A 68 17.335 -5.001 4.989 1.00 9.79 C ATOM 0 H LEU A 68 13.534 -3.950 8.052 1.00 12.22 H new ATOM 0 HA LEU A 68 16.122 -3.570 6.677 1.00 11.25 H new ATOM 0 HB2 LEU A 68 15.555 -6.038 7.007 1.00 11.69 H new ATOM 0 HB3 LEU A 68 14.142 -5.771 6.006 1.00 11.69 H new ATOM 0 HG LEU A 68 16.184 -6.802 4.900 1.00 10.84 H new ATOM 0 HD11 LEU A 68 15.870 -5.572 2.789 1.00 10.70 H new ATOM 0 HD12 LEU A 68 14.324 -5.924 3.597 1.00 10.70 H new ATOM 0 HD13 LEU A 68 15.016 -4.286 3.674 1.00 10.70 H new ATOM 0 HD21 LEU A 68 17.911 -5.222 4.090 1.00 9.79 H new ATOM 0 HD22 LEU A 68 17.162 -3.927 5.055 1.00 9.79 H new ATOM 0 HD23 LEU A 68 17.890 -5.333 5.866 1.00 9.79 H new ATOM 1074 N GLU A 69 13.047 -3.471 5.448 1.00 12.16 N ATOM 1075 CA GLU A 69 12.240 -2.736 4.484 1.00 12.26 C ATOM 1076 C GLU A 69 11.735 -1.451 5.113 1.00 11.96 C ATOM 1077 O GLU A 69 11.441 -0.476 4.427 1.00 11.57 O ATOM 1078 CB GLU A 69 11.065 -3.575 3.971 1.00 13.61 C ATOM 1079 CG GLU A 69 10.116 -4.046 5.058 1.00 14.60 C ATOM 1080 CD GLU A 69 8.858 -4.667 4.494 1.00 15.86 C ATOM 1081 OE1 GLU A 69 8.880 -5.865 4.154 1.00 16.53 O ATOM 1082 OE2 GLU A 69 7.834 -3.959 4.385 1.00 16.24 O ATOM 0 H GLU A 69 12.573 -4.253 5.901 1.00 12.16 H new ATOM 0 HA GLU A 69 12.870 -2.499 3.627 1.00 12.26 H new ATOM 0 HB2 GLU A 69 10.504 -2.988 3.244 1.00 13.61 H new ATOM 0 HB3 GLU A 69 11.457 -4.445 3.444 1.00 13.61 H new ATOM 0 HG2 GLU A 69 10.625 -4.773 5.691 1.00 14.60 H new ATOM 0 HG3 GLU A 69 9.848 -3.202 5.694 1.00 14.60 H new ATOM 1089 N GLU A 70 11.669 -1.461 6.432 1.00 12.26 N ATOM 1090 CA GLU A 70 11.231 -0.306 7.193 1.00 12.19 C ATOM 1091 C GLU A 70 12.206 0.853 6.998 1.00 10.92 C ATOM 1092 O GLU A 70 11.802 1.973 6.692 1.00 10.57 O ATOM 1093 CB GLU A 70 11.130 -0.672 8.672 1.00 13.06 C ATOM 1094 CG GLU A 70 10.458 -2.015 8.916 1.00 14.21 C ATOM 1095 CD GLU A 70 10.356 -2.369 10.384 1.00 15.02 C ATOM 1096 OE1 GLU A 70 9.335 -2.030 11.015 1.00 15.56 O ATOM 1097 OE2 GLU A 70 11.293 -3.001 10.915 1.00 15.23 O ATOM 0 H GLU A 70 11.917 -2.268 7.004 1.00 12.26 H new ATOM 0 HA GLU A 70 10.249 0.005 6.837 1.00 12.19 H new ATOM 0 HB2 GLU A 70 12.131 -0.691 9.103 1.00 13.06 H new ATOM 0 HB3 GLU A 70 10.572 0.105 9.194 1.00 13.06 H new ATOM 0 HG2 GLU A 70 9.458 -1.999 8.482 1.00 14.21 H new ATOM 0 HG3 GLU A 70 11.018 -2.794 8.398 1.00 14.21 H new ATOM 1104 N MET A 71 13.496 0.561 7.150 1.00 10.30 N ATOM 1105 CA MET A 71 14.541 1.569 6.982 1.00 9.14 C ATOM 1106 C MET A 71 14.734 1.900 5.510 1.00 8.31 C ATOM 1107 O MET A 71 15.172 2.994 5.159 1.00 7.58 O ATOM 1108 CB MET A 71 15.864 1.090 7.604 1.00 8.85 C ATOM 1109 CG MET A 71 16.450 -0.153 6.949 1.00 8.69 C ATOM 1110 SD MET A 71 17.839 -0.846 7.868 1.00 8.41 S ATOM 1111 CE MET A 71 19.025 0.493 7.788 1.00 8.50 C ATOM 0 H MET A 71 13.843 -0.368 7.390 1.00 10.30 H new ATOM 0 HA MET A 71 14.227 2.475 7.501 1.00 9.14 H new ATOM 0 HB2 MET A 71 16.594 1.897 7.543 1.00 8.85 H new ATOM 0 HB3 MET A 71 15.702 0.887 8.662 1.00 8.85 H new ATOM 0 HG2 MET A 71 15.670 -0.909 6.855 1.00 8.69 H new ATOM 0 HG3 MET A 71 16.777 0.095 5.939 1.00 8.69 H new ATOM 0 HE1 MET A 71 19.906 0.234 8.375 1.00 8.50 H new ATOM 0 HE2 MET A 71 19.316 0.660 6.751 1.00 8.50 H new ATOM 0 HE3 MET A 71 18.576 1.401 8.190 1.00 8.50 H new ATOM 1121 N MET A 72 14.391 0.951 4.650 1.00 8.67 N ATOM 1122 CA MET A 72 14.491 1.144 3.212 1.00 8.32 C ATOM 1123 C MET A 72 13.432 2.127 2.740 1.00 8.63 C ATOM 1124 O MET A 72 13.729 3.115 2.066 1.00 8.10 O ATOM 1125 CB MET A 72 14.326 -0.194 2.490 1.00 9.08 C ATOM 1126 CG MET A 72 14.433 -0.097 0.978 1.00 9.10 C ATOM 1127 SD MET A 72 14.120 -1.674 0.162 1.00 10.28 S ATOM 1128 CE MET A 72 15.399 -2.692 0.891 1.00 11.15 C ATOM 0 H MET A 72 14.039 0.035 4.927 1.00 8.67 H new ATOM 0 HA MET A 72 15.475 1.551 2.980 1.00 8.32 H new ATOM 0 HB2 MET A 72 15.084 -0.888 2.854 1.00 9.08 H new ATOM 0 HB3 MET A 72 13.356 -0.618 2.749 1.00 9.08 H new ATOM 0 HG2 MET A 72 13.722 0.645 0.613 1.00 9.10 H new ATOM 0 HG3 MET A 72 15.428 0.256 0.709 1.00 9.10 H new ATOM 0 HE1 MET A 72 15.501 -3.614 0.318 1.00 11.15 H new ATOM 0 HE2 MET A 72 16.345 -2.151 0.880 1.00 11.15 H new ATOM 0 HE3 MET A 72 15.131 -2.932 1.920 1.00 11.15 H new ATOM 1138 N THR A 73 12.198 1.844 3.114 1.00 9.62 N ATOM 1139 CA THR A 73 11.067 2.699 2.787 1.00 10.09 C ATOM 1140 C THR A 73 11.230 4.079 3.423 1.00 9.53 C ATOM 1141 O THR A 73 10.865 5.098 2.835 1.00 9.49 O ATOM 1142 CB THR A 73 9.753 2.049 3.266 1.00 11.37 C ATOM 1143 OG1 THR A 73 9.610 0.760 2.657 1.00 12.02 O ATOM 1144 CG2 THR A 73 8.544 2.906 2.927 1.00 11.93 C ATOM 0 H THR A 73 11.949 1.015 3.653 1.00 9.62 H new ATOM 0 HA THR A 73 11.031 2.820 1.704 1.00 10.09 H new ATOM 0 HB THR A 73 9.802 1.952 4.351 1.00 11.37 H new ATOM 0 HG1 THR A 73 10.171 0.111 3.130 1.00 12.02 H new ATOM 0 HG21 THR A 73 7.638 2.414 3.281 1.00 11.93 H new ATOM 0 HG22 THR A 73 8.641 3.879 3.410 1.00 11.93 H new ATOM 0 HG23 THR A 73 8.485 3.041 1.847 1.00 11.93 H new ATOM 1152 N ALA A 74 11.822 4.105 4.612 1.00 9.27 N ATOM 1153 CA ALA A 74 12.016 5.343 5.352 1.00 9.02 C ATOM 1154 C ALA A 74 12.991 6.284 4.644 1.00 8.01 C ATOM 1155 O ALA A 74 12.993 7.488 4.896 1.00 8.00 O ATOM 1156 CB ALA A 74 12.514 5.026 6.751 1.00 9.32 C ATOM 0 H ALA A 74 12.178 3.275 5.086 1.00 9.27 H new ATOM 0 HA ALA A 74 11.056 5.855 5.410 1.00 9.02 H new ATOM 0 HB1 ALA A 74 12.659 5.954 7.304 1.00 9.32 H new ATOM 0 HB2 ALA A 74 11.780 4.407 7.267 1.00 9.32 H new ATOM 0 HB3 ALA A 74 13.461 4.490 6.687 1.00 9.32 H new ATOM 1162 N CYS A 75 13.811 5.735 3.754 1.00 7.31 N ATOM 1163 CA CYS A 75 14.860 6.518 3.117 1.00 6.51 C ATOM 1164 C CYS A 75 14.676 6.626 1.609 1.00 6.63 C ATOM 1165 O CYS A 75 15.574 7.088 0.902 1.00 6.46 O ATOM 1166 CB CYS A 75 16.216 5.899 3.419 1.00 5.86 C ATOM 1167 SG CYS A 75 16.548 5.715 5.183 1.00 6.16 S ATOM 0 H CYS A 75 13.769 4.759 3.460 1.00 7.31 H new ATOM 0 HA CYS A 75 14.802 7.527 3.526 1.00 6.51 H new ATOM 0 HB2 CYS A 75 16.274 4.920 2.943 1.00 5.86 H new ATOM 0 HB3 CYS A 75 16.996 6.517 2.973 1.00 5.86 H new ATOM 0 HG CYS A 75 16.073 4.578 5.598 1.00 6.16 H new ATOM 1173 N GLN A 76 13.528 6.211 1.101 1.00 7.27 N ATOM 1174 CA GLN A 76 13.278 6.326 -0.325 1.00 7.76 C ATOM 1175 C GLN A 76 12.392 7.531 -0.612 1.00 8.19 C ATOM 1176 O GLN A 76 11.248 7.602 -0.164 1.00 8.73 O ATOM 1177 CB GLN A 76 12.680 5.030 -0.897 1.00 8.60 C ATOM 1178 CG GLN A 76 11.272 4.698 -0.429 1.00 9.19 C ATOM 1179 CD GLN A 76 10.776 3.382 -0.996 1.00 10.10 C ATOM 1180 OE1 GLN A 76 11.217 2.948 -2.061 1.00 10.49 O ATOM 1181 NE2 GLN A 76 9.840 2.752 -0.311 1.00 10.66 N ATOM 0 H GLN A 76 12.768 5.799 1.642 1.00 7.27 H new ATOM 0 HA GLN A 76 14.232 6.482 -0.829 1.00 7.76 H new ATOM 0 HB2 GLN A 76 12.675 5.101 -1.985 1.00 8.60 H new ATOM 0 HB3 GLN A 76 13.337 4.200 -0.635 1.00 8.60 H new ATOM 0 HG2 GLN A 76 11.254 4.652 0.660 1.00 9.19 H new ATOM 0 HG3 GLN A 76 10.594 5.498 -0.726 1.00 9.19 H new ATOM 0 HE21 GLN A 76 9.500 3.143 0.567 1.00 10.66 H new ATOM 0 HE22 GLN A 76 9.456 1.874 -0.660 1.00 10.66 H new ATOM 1190 N GLY A 77 12.947 8.490 -1.342 1.00 8.13 N ATOM 1191 CA GLY A 77 12.229 9.712 -1.636 1.00 8.58 C ATOM 1192 C GLY A 77 11.941 10.514 -0.385 1.00 8.30 C ATOM 1193 O GLY A 77 10.786 10.785 -0.061 1.00 8.85 O ATOM 0 H GLY A 77 13.886 8.441 -1.737 1.00 8.13 H new ATOM 0 HA2 GLY A 77 12.813 10.318 -2.329 1.00 8.58 H new ATOM 0 HA3 GLY A 77 11.291 9.470 -2.136 1.00 8.58 H new ATOM 1197 N VAL A 78 12.997 10.896 0.322 1.00 7.65 N ATOM 1198 CA VAL A 78 12.860 11.652 1.564 1.00 7.69 C ATOM 1199 C VAL A 78 12.738 13.146 1.263 1.00 8.18 C ATOM 1200 O VAL A 78 12.941 13.995 2.130 1.00 8.24 O ATOM 1201 CB VAL A 78 14.068 11.409 2.507 1.00 7.30 C ATOM 1202 CG1 VAL A 78 13.740 11.798 3.941 1.00 7.56 C ATOM 1203 CG2 VAL A 78 14.527 9.964 2.449 1.00 7.23 C ATOM 0 H VAL A 78 13.961 10.695 0.057 1.00 7.65 H new ATOM 0 HA VAL A 78 11.956 11.306 2.065 1.00 7.69 H new ATOM 0 HB VAL A 78 14.882 12.045 2.158 1.00 7.30 H new ATOM 0 HG11 VAL A 78 14.608 11.615 4.575 1.00 7.56 H new ATOM 0 HG12 VAL A 78 13.478 12.855 3.980 1.00 7.56 H new ATOM 0 HG13 VAL A 78 12.899 11.202 4.296 1.00 7.56 H new ATOM 0 HG21 VAL A 78 15.375 9.824 3.120 1.00 7.23 H new ATOM 0 HG22 VAL A 78 13.710 9.310 2.755 1.00 7.23 H new ATOM 0 HG23 VAL A 78 14.826 9.718 1.430 1.00 7.23 H new ATOM 1213 N GLY A 79 12.393 13.462 0.024 1.00 8.79 N ATOM 1214 CA GLY A 79 12.387 14.841 -0.410 1.00 9.46 C ATOM 1215 C GLY A 79 13.770 15.272 -0.827 1.00 9.86 C ATOM 1216 O GLY A 79 13.986 16.417 -1.223 1.00 10.49 O ATOM 0 H GLY A 79 12.117 12.786 -0.689 1.00 8.79 H new ATOM 0 HA2 GLY A 79 11.696 14.962 -1.244 1.00 9.46 H new ATOM 0 HA3 GLY A 79 12.029 15.480 0.397 1.00 9.46 H new ATOM 1220 N GLY A 80 14.705 14.332 -0.744 1.00 9.69 N ATOM 1221 CA GLY A 80 16.090 14.609 -1.080 1.00 10.31 C ATOM 1222 C GLY A 80 16.690 15.729 -0.243 1.00 10.42 C ATOM 1223 O GLY A 80 17.174 16.716 -0.796 1.00 10.24 O ATOM 0 H GLY A 80 14.526 13.373 -0.447 1.00 9.69 H new ATOM 0 HA2 GLY A 80 16.680 13.703 -0.942 1.00 10.31 H new ATOM 0 HA3 GLY A 80 16.156 14.875 -2.135 1.00 10.31 H new ATOM 1227 N PRO A 81 16.696 15.595 1.097 1.00 10.92 N ATOM 1228 CA PRO A 81 17.180 16.639 1.999 1.00 11.29 C ATOM 1229 C PRO A 81 18.700 16.668 2.070 1.00 11.16 C ATOM 1230 O PRO A 81 19.292 17.579 2.645 1.00 11.39 O ATOM 1231 CB PRO A 81 16.586 16.258 3.362 1.00 12.10 C ATOM 1232 CG PRO A 81 15.748 15.043 3.125 1.00 12.10 C ATOM 1233 CD PRO A 81 16.244 14.425 1.851 1.00 11.39 C ATOM 0 HA PRO A 81 16.884 17.633 1.664 1.00 11.29 H new ATOM 0 HB2 PRO A 81 17.374 16.052 4.087 1.00 12.10 H new ATOM 0 HB3 PRO A 81 15.985 17.073 3.767 1.00 12.10 H new ATOM 0 HG2 PRO A 81 15.836 14.343 3.956 1.00 12.10 H new ATOM 0 HG3 PRO A 81 14.694 15.309 3.043 1.00 12.10 H new ATOM 0 HD2 PRO A 81 17.054 13.718 2.030 1.00 11.39 H new ATOM 0 HD3 PRO A 81 15.457 13.882 1.328 1.00 11.39 H new ATOM 1241 N GLY A 82 19.325 15.653 1.493 1.00 10.99 N ATOM 1242 CA GLY A 82 20.764 15.644 1.375 1.00 11.07 C ATOM 1243 C GLY A 82 21.207 16.355 0.118 1.00 10.54 C ATOM 1244 O GLY A 82 22.386 16.638 -0.069 1.00 10.90 O ATOM 0 H GLY A 82 18.858 14.834 1.104 1.00 10.99 H new ATOM 0 HA2 GLY A 82 21.207 16.127 2.246 1.00 11.07 H new ATOM 0 HA3 GLY A 82 21.125 14.616 1.362 1.00 11.07 H new ATOM 1248 N HIS A 83 20.241 16.649 -0.740 1.00 9.87 N ATOM 1249 CA HIS A 83 20.499 17.353 -1.982 1.00 9.50 C ATOM 1250 C HIS A 83 20.157 18.831 -1.799 1.00 9.01 C ATOM 1251 O HIS A 83 19.136 19.317 -2.282 1.00 8.60 O ATOM 1252 CB HIS A 83 19.649 16.716 -3.093 1.00 9.28 C ATOM 1253 CG HIS A 83 19.757 17.363 -4.443 1.00 9.71 C ATOM 1254 ND1 HIS A 83 18.717 18.060 -5.023 1.00 9.88 N ATOM 1255 CD2 HIS A 83 20.765 17.378 -5.345 1.00 10.26 C ATOM 1256 CE1 HIS A 83 19.083 18.474 -6.221 1.00 10.48 C ATOM 1257 NE2 HIS A 83 20.319 18.074 -6.440 1.00 10.71 N ATOM 0 H HIS A 83 19.261 16.406 -0.593 1.00 9.87 H new ATOM 0 HA HIS A 83 21.550 17.279 -2.261 1.00 9.50 H new ATOM 0 HB2 HIS A 83 19.934 15.668 -3.188 1.00 9.28 H new ATOM 0 HB3 HIS A 83 18.604 16.736 -2.783 1.00 9.28 H new ATOM 0 HD2 HIS A 83 21.739 16.927 -5.226 1.00 10.26 H new ATOM 0 HE1 HIS A 83 18.473 19.044 -6.906 1.00 10.48 H new ATOM 0 HE2 HIS A 83 20.858 18.253 -7.287 1.00 10.71 H new ATOM 1266 N LYS A 84 21.019 19.536 -1.081 1.00 9.30 N ATOM 1267 CA LYS A 84 20.811 20.951 -0.805 1.00 9.11 C ATOM 1268 C LYS A 84 21.894 21.784 -1.467 1.00 8.52 C ATOM 1269 O LYS A 84 21.613 22.637 -2.300 1.00 8.22 O ATOM 1270 CB LYS A 84 20.798 21.214 0.700 1.00 9.97 C ATOM 1271 CG LYS A 84 19.829 20.334 1.470 1.00 10.46 C ATOM 1272 CD LYS A 84 18.396 20.479 0.976 1.00 11.30 C ATOM 1273 CE LYS A 84 17.850 21.874 1.227 1.00 11.85 C ATOM 1274 NZ LYS A 84 16.421 21.987 0.837 1.00 12.21 N ATOM 0 H LYS A 84 21.872 19.150 -0.677 1.00 9.30 H new ATOM 0 HA LYS A 84 19.843 21.237 -1.216 1.00 9.11 H new ATOM 0 HB2 LYS A 84 21.803 21.062 1.094 1.00 9.97 H new ATOM 0 HB3 LYS A 84 20.542 22.259 0.874 1.00 9.97 H new ATOM 0 HG2 LYS A 84 20.138 19.293 1.380 1.00 10.46 H new ATOM 0 HG3 LYS A 84 19.873 20.589 2.529 1.00 10.46 H new ATOM 0 HD2 LYS A 84 18.356 20.260 -0.091 1.00 11.30 H new ATOM 0 HD3 LYS A 84 17.763 19.746 1.476 1.00 11.30 H new ATOM 0 HE2 LYS A 84 17.959 22.122 2.283 1.00 11.85 H new ATOM 0 HE3 LYS A 84 18.438 22.601 0.666 1.00 11.85 H new ATOM 0 HZ1 LYS A 84 16.086 22.954 1.024 1.00 12.21 H new ATOM 0 HZ2 LYS A 84 16.320 21.775 -0.176 1.00 12.21 H new ATOM 0 HZ3 LYS A 84 15.856 21.312 1.390 1.00 12.21 H new ATOM 1288 N ALA A 85 23.140 21.505 -1.105 1.00 8.58 N ATOM 1289 CA ALA A 85 24.282 22.245 -1.628 1.00 8.36 C ATOM 1290 C ALA A 85 24.319 22.186 -3.150 1.00 7.63 C ATOM 1291 O ALA A 85 24.766 23.125 -3.809 1.00 7.43 O ATOM 1292 CB ALA A 85 25.574 21.691 -1.048 1.00 8.99 C ATOM 0 H ALA A 85 23.386 20.766 -0.446 1.00 8.58 H new ATOM 0 HA ALA A 85 24.178 23.289 -1.331 1.00 8.36 H new ATOM 0 HB1 ALA A 85 26.421 22.251 -1.445 1.00 8.99 H new ATOM 0 HB2 ALA A 85 25.555 21.784 0.038 1.00 8.99 H new ATOM 0 HB3 ALA A 85 25.674 20.640 -1.320 1.00 8.99 H new ATOM 1298 N ARG A 86 23.824 21.086 -3.695 1.00 7.48 N ATOM 1299 CA ARG A 86 23.806 20.879 -5.135 1.00 7.14 C ATOM 1300 C ARG A 86 22.856 21.834 -5.853 1.00 6.68 C ATOM 1301 O ARG A 86 23.108 22.207 -6.995 1.00 6.49 O ATOM 1302 CB ARG A 86 23.439 19.433 -5.462 1.00 7.54 C ATOM 1303 CG ARG A 86 24.638 18.508 -5.576 1.00 7.94 C ATOM 1304 CD ARG A 86 25.515 18.901 -6.752 1.00 8.47 C ATOM 1305 NE ARG A 86 26.592 17.945 -6.984 1.00 9.09 N ATOM 1306 CZ ARG A 86 27.203 17.794 -8.156 1.00 9.85 C ATOM 1307 NH1 ARG A 86 26.847 18.538 -9.200 1.00 10.10 N ATOM 1308 NH2 ARG A 86 28.179 16.904 -8.285 1.00 10.56 N ATOM 0 H ARG A 86 23.426 20.316 -3.157 1.00 7.48 H new ATOM 0 HA ARG A 86 24.812 21.091 -5.496 1.00 7.14 H new ATOM 0 HB2 ARG A 86 22.771 19.054 -4.689 1.00 7.54 H new ATOM 0 HB3 ARG A 86 22.885 19.412 -6.400 1.00 7.54 H new ATOM 0 HG2 ARG A 86 25.220 18.545 -4.655 1.00 7.94 H new ATOM 0 HG3 ARG A 86 24.299 17.479 -5.698 1.00 7.94 H new ATOM 0 HD2 ARG A 86 24.902 18.979 -7.650 1.00 8.47 H new ATOM 0 HD3 ARG A 86 25.941 19.888 -6.571 1.00 8.47 H new ATOM 0 HE ARG A 86 26.893 17.360 -6.205 1.00 9.09 H new ATOM 0 HH11 ARG A 86 26.102 19.228 -9.104 1.00 10.10 H new ATOM 0 HH12 ARG A 86 27.319 18.418 -10.096 1.00 10.10 H new ATOM 0 HH21 ARG A 86 28.460 16.336 -7.486 1.00 10.56 H new ATOM 0 HH22 ARG A 86 28.648 16.788 -9.183 1.00 10.56 H new ATOM 1322 N VAL A 87 21.771 22.240 -5.202 1.00 6.80 N ATOM 1323 CA VAL A 87 20.811 23.130 -5.850 1.00 6.75 C ATOM 1324 C VAL A 87 21.373 24.545 -5.926 1.00 6.55 C ATOM 1325 O VAL A 87 20.996 25.332 -6.793 1.00 6.49 O ATOM 1326 CB VAL A 87 19.433 23.146 -5.141 1.00 7.42 C ATOM 1327 CG1 VAL A 87 18.932 21.731 -4.903 1.00 7.80 C ATOM 1328 CG2 VAL A 87 19.474 23.928 -3.835 1.00 7.90 C ATOM 0 H VAL A 87 21.536 21.974 -4.246 1.00 6.80 H new ATOM 0 HA VAL A 87 20.650 22.741 -6.855 1.00 6.75 H new ATOM 0 HB VAL A 87 18.734 23.656 -5.804 1.00 7.42 H new ATOM 0 HG11 VAL A 87 17.963 21.767 -4.404 1.00 7.80 H new ATOM 0 HG12 VAL A 87 18.829 21.216 -5.858 1.00 7.80 H new ATOM 0 HG13 VAL A 87 19.643 21.194 -4.276 1.00 7.80 H new ATOM 0 HG21 VAL A 87 18.488 23.914 -3.371 1.00 7.90 H new ATOM 0 HG22 VAL A 87 20.199 23.472 -3.161 1.00 7.90 H new ATOM 0 HG23 VAL A 87 19.765 24.959 -4.037 1.00 7.90 H new ATOM 1338 N LEU A 88 22.290 24.848 -5.018 1.00 6.74 N ATOM 1339 CA LEU A 88 22.944 26.147 -4.990 1.00 6.96 C ATOM 1340 C LEU A 88 24.161 26.146 -5.898 1.00 6.75 C ATOM 1341 O LEU A 88 24.365 27.068 -6.686 1.00 6.87 O ATOM 1342 CB LEU A 88 23.352 26.502 -3.559 1.00 7.72 C ATOM 1343 CG LEU A 88 22.201 26.566 -2.555 1.00 8.06 C ATOM 1344 CD1 LEU A 88 22.721 26.862 -1.157 1.00 8.65 C ATOM 1345 CD2 LEU A 88 21.188 27.614 -2.982 1.00 8.66 C ATOM 0 H LEU A 88 22.599 24.207 -4.287 1.00 6.74 H new ATOM 0 HA LEU A 88 22.242 26.898 -5.351 1.00 6.96 H new ATOM 0 HB2 LEU A 88 24.077 25.766 -3.211 1.00 7.72 H new ATOM 0 HB3 LEU A 88 23.858 27.467 -3.571 1.00 7.72 H new ATOM 0 HG LEU A 88 21.708 25.594 -2.534 1.00 8.06 H new ATOM 0 HD11 LEU A 88 21.885 26.903 -0.459 1.00 8.65 H new ATOM 0 HD12 LEU A 88 23.411 26.075 -0.851 1.00 8.65 H new ATOM 0 HD13 LEU A 88 23.241 27.820 -1.157 1.00 8.65 H new ATOM 0 HD21 LEU A 88 20.374 27.649 -2.258 1.00 8.66 H new ATOM 0 HD22 LEU A 88 21.672 28.589 -3.031 1.00 8.66 H new ATOM 0 HD23 LEU A 88 20.790 27.357 -3.964 1.00 8.66 H new ATOM 1357 N ALA A 89 24.957 25.092 -5.793 1.00 6.75 N ATOM 1358 CA ALA A 89 26.160 24.954 -6.601 1.00 6.99 C ATOM 1359 C ALA A 89 25.822 24.891 -8.086 1.00 6.71 C ATOM 1360 O ALA A 89 26.595 25.346 -8.930 1.00 7.11 O ATOM 1361 CB ALA A 89 26.935 23.715 -6.182 1.00 7.41 C ATOM 0 H ALA A 89 24.790 24.316 -5.153 1.00 6.75 H new ATOM 0 HA ALA A 89 26.782 25.834 -6.435 1.00 6.99 H new ATOM 0 HB1 ALA A 89 27.832 23.623 -6.794 1.00 7.41 H new ATOM 0 HB2 ALA A 89 27.218 23.800 -5.133 1.00 7.41 H new ATOM 0 HB3 ALA A 89 26.311 22.832 -6.319 1.00 7.41 H new ATOM 1367 N GLU A 90 24.659 24.336 -8.402 1.00 6.35 N ATOM 1368 CA GLU A 90 24.222 24.230 -9.787 1.00 6.46 C ATOM 1369 C GLU A 90 23.650 25.557 -10.269 1.00 6.45 C ATOM 1370 O GLU A 90 23.691 25.865 -11.459 1.00 6.84 O ATOM 1371 CB GLU A 90 23.182 23.120 -9.942 1.00 6.55 C ATOM 1372 CG GLU A 90 23.666 21.935 -10.767 1.00 7.09 C ATOM 1373 CD GLU A 90 24.913 21.282 -10.203 1.00 7.80 C ATOM 1374 OE1 GLU A 90 24.781 20.307 -9.429 1.00 8.05 O ATOM 1375 OE2 GLU A 90 26.029 21.750 -10.517 1.00 8.34 O ATOM 0 H GLU A 90 24.004 23.954 -7.720 1.00 6.35 H new ATOM 0 HA GLU A 90 25.089 23.980 -10.399 1.00 6.46 H new ATOM 0 HB2 GLU A 90 22.891 22.767 -8.953 1.00 6.55 H new ATOM 0 HB3 GLU A 90 22.288 23.535 -10.408 1.00 6.55 H new ATOM 0 HG2 GLU A 90 22.870 21.193 -10.826 1.00 7.09 H new ATOM 0 HG3 GLU A 90 23.867 22.268 -11.785 1.00 7.09 H new ATOM 1382 N ALA A 91 23.151 26.353 -9.332 1.00 6.32 N ATOM 1383 CA ALA A 91 22.560 27.642 -9.659 1.00 6.63 C ATOM 1384 C ALA A 91 23.651 28.679 -9.855 1.00 6.98 C ATOM 1385 O ALA A 91 23.478 29.649 -10.589 1.00 7.39 O ATOM 1386 CB ALA A 91 21.592 28.080 -8.570 1.00 6.88 C ATOM 0 H ALA A 91 23.144 26.127 -8.337 1.00 6.32 H new ATOM 0 HA ALA A 91 22.000 27.544 -10.589 1.00 6.63 H new ATOM 0 HB1 ALA A 91 21.161 29.046 -8.833 1.00 6.88 H new ATOM 0 HB2 ALA A 91 20.796 27.342 -8.472 1.00 6.88 H new ATOM 0 HB3 ALA A 91 22.125 28.167 -7.623 1.00 6.88 H new ATOM 1392 N MET A 92 24.783 28.451 -9.203 1.00 7.07 N ATOM 1393 CA MET A 92 25.934 29.340 -9.324 1.00 7.77 C ATOM 1394 C MET A 92 26.442 29.364 -10.762 1.00 8.07 C ATOM 1395 O MET A 92 26.817 30.413 -11.285 1.00 8.75 O ATOM 1396 CB MET A 92 27.058 28.899 -8.381 1.00 8.13 C ATOM 1397 CG MET A 92 28.274 29.810 -8.424 1.00 8.95 C ATOM 1398 SD MET A 92 29.626 29.222 -7.385 1.00 9.67 S ATOM 1399 CE MET A 92 30.831 30.524 -7.638 1.00 10.32 C ATOM 0 H MET A 92 24.931 27.655 -8.582 1.00 7.07 H new ATOM 0 HA MET A 92 25.617 30.345 -9.045 1.00 7.77 H new ATOM 0 HB2 MET A 92 26.674 28.865 -7.361 1.00 8.13 H new ATOM 0 HB3 MET A 92 27.363 27.885 -8.641 1.00 8.13 H new ATOM 0 HG2 MET A 92 28.623 29.894 -9.453 1.00 8.95 H new ATOM 0 HG3 MET A 92 27.984 30.811 -8.103 1.00 8.95 H new ATOM 0 HE1 MET A 92 31.729 30.306 -7.060 1.00 10.32 H new ATOM 0 HE2 MET A 92 31.086 30.583 -8.696 1.00 10.32 H new ATOM 0 HE3 MET A 92 30.412 31.476 -7.313 1.00 10.32 H new ATOM 1409 N SER A 93 26.439 28.201 -11.400 1.00 7.80 N ATOM 1410 CA SER A 93 26.876 28.087 -12.784 1.00 8.38 C ATOM 1411 C SER A 93 25.825 28.662 -13.733 1.00 8.44 C ATOM 1412 O SER A 93 26.123 29.012 -14.873 1.00 9.14 O ATOM 1413 CB SER A 93 27.143 26.621 -13.119 1.00 8.44 C ATOM 1414 OG SER A 93 27.974 26.023 -12.134 1.00 8.68 O ATOM 0 H SER A 93 26.138 27.322 -10.980 1.00 7.80 H new ATOM 0 HA SER A 93 27.796 28.659 -12.909 1.00 8.38 H new ATOM 0 HB2 SER A 93 26.199 26.080 -13.183 1.00 8.44 H new ATOM 0 HB3 SER A 93 27.619 26.547 -14.097 1.00 8.44 H new ATOM 0 HG SER A 93 28.132 25.084 -12.366 1.00 8.68 H new ATOM 1420 N GLN A 94 24.594 28.764 -13.245 1.00 7.90 N ATOM 1421 CA GLN A 94 23.498 29.297 -14.041 1.00 8.16 C ATOM 1422 C GLN A 94 23.464 30.818 -13.971 1.00 8.55 C ATOM 1423 O GLN A 94 23.401 31.492 -14.996 1.00 9.08 O ATOM 1424 CB GLN A 94 22.162 28.728 -13.559 1.00 7.85 C ATOM 1425 CG GLN A 94 22.021 27.232 -13.773 1.00 8.03 C ATOM 1426 CD GLN A 94 22.058 26.847 -15.239 1.00 8.38 C ATOM 1427 OE1 GLN A 94 21.642 27.615 -16.105 1.00 8.64 O ATOM 1428 NE2 GLN A 94 22.559 25.657 -15.525 1.00 8.68 N ATOM 0 H GLN A 94 24.331 28.484 -12.300 1.00 7.90 H new ATOM 0 HA GLN A 94 23.661 29.000 -15.077 1.00 8.16 H new ATOM 0 HB2 GLN A 94 22.046 28.946 -12.497 1.00 7.85 H new ATOM 0 HB3 GLN A 94 21.351 29.238 -14.079 1.00 7.85 H new ATOM 0 HG2 GLN A 94 22.823 26.716 -13.245 1.00 8.03 H new ATOM 0 HG3 GLN A 94 21.082 26.893 -13.336 1.00 8.03 H new ATOM 0 HE21 GLN A 94 22.893 25.051 -14.776 1.00 8.68 H new ATOM 0 HE22 GLN A 94 22.611 25.345 -16.495 1.00 8.68 H new ATOM 1437 N VAL A 95 23.526 31.355 -12.757 1.00 8.52 N ATOM 1438 CA VAL A 95 23.420 32.797 -12.543 1.00 9.16 C ATOM 1439 C VAL A 95 24.590 33.543 -13.189 1.00 9.86 C ATOM 1440 O VAL A 95 24.480 34.721 -13.527 1.00 10.49 O ATOM 1441 CB VAL A 95 23.344 33.134 -11.033 1.00 9.36 C ATOM 1442 CG1 VAL A 95 24.662 32.835 -10.332 1.00 9.64 C ATOM 1443 CG2 VAL A 95 22.935 34.585 -10.819 1.00 9.49 C ATOM 0 H VAL A 95 23.650 30.812 -11.902 1.00 8.52 H new ATOM 0 HA VAL A 95 22.497 33.127 -13.019 1.00 9.16 H new ATOM 0 HB VAL A 95 22.579 32.496 -10.590 1.00 9.36 H new ATOM 0 HG11 VAL A 95 24.576 33.082 -9.274 1.00 9.64 H new ATOM 0 HG12 VAL A 95 24.899 31.777 -10.439 1.00 9.64 H new ATOM 0 HG13 VAL A 95 25.456 33.432 -10.780 1.00 9.64 H new ATOM 0 HG21 VAL A 95 22.889 34.796 -9.751 1.00 9.49 H new ATOM 0 HG22 VAL A 95 23.667 35.242 -11.288 1.00 9.49 H new ATOM 0 HG23 VAL A 95 21.955 34.757 -11.265 1.00 9.49 H new ATOM 1453 N THR A 96 25.703 32.849 -13.378 1.00 9.91 N ATOM 1454 CA THR A 96 26.875 33.446 -14.001 1.00 10.78 C ATOM 1455 C THR A 96 26.776 33.389 -15.525 1.00 11.00 C ATOM 1456 O THR A 96 27.581 33.994 -16.236 1.00 11.80 O ATOM 1457 CB THR A 96 28.165 32.751 -13.534 1.00 11.07 C ATOM 1458 OG1 THR A 96 27.991 31.330 -13.562 1.00 10.84 O ATOM 1459 CG2 THR A 96 28.543 33.193 -12.127 1.00 11.70 C ATOM 0 H THR A 96 25.819 31.872 -13.109 1.00 9.91 H new ATOM 0 HA THR A 96 26.911 34.491 -13.693 1.00 10.78 H new ATOM 0 HB THR A 96 28.969 33.034 -14.213 1.00 11.07 H new ATOM 0 HG1 THR A 96 27.583 31.034 -12.722 1.00 10.84 H new ATOM 0 HG21 THR A 96 29.459 32.687 -11.820 1.00 11.70 H new ATOM 0 HG22 THR A 96 28.703 34.271 -12.115 1.00 11.70 H new ATOM 0 HG23 THR A 96 27.739 32.938 -11.437 1.00 11.70 H new ATOM 1467 N ASN A 97 25.776 32.670 -16.022 1.00 10.45 N ATOM 1468 CA ASN A 97 25.516 32.595 -17.451 1.00 10.82 C ATOM 1469 C ASN A 97 24.066 32.975 -17.724 1.00 10.83 C ATOM 1470 O ASN A 97 23.225 32.108 -17.960 1.00 10.47 O ATOM 1471 CB ASN A 97 25.790 31.184 -18.000 1.00 10.70 C ATOM 1472 CG ASN A 97 27.255 30.776 -17.959 1.00 11.05 C ATOM 1473 OD1 ASN A 97 27.574 29.589 -17.873 1.00 11.34 O ATOM 1474 ND2 ASN A 97 28.155 31.745 -18.025 1.00 11.26 N ATOM 0 H ASN A 97 25.129 32.128 -15.450 1.00 10.45 H new ATOM 0 HA ASN A 97 26.187 33.290 -17.955 1.00 10.82 H new ATOM 0 HB2 ASN A 97 25.207 30.463 -17.427 1.00 10.70 H new ATOM 0 HB3 ASN A 97 25.438 31.132 -19.030 1.00 10.70 H new ATOM 0 HD21 ASN A 97 29.150 31.519 -18.005 1.00 11.26 H new ATOM 0 HD22 ASN A 97 27.854 32.717 -18.096 1.00 11.26 H new ATOM 1481 N PRO A 98 23.750 34.284 -17.687 1.00 11.40 N ATOM 1482 CA PRO A 98 22.382 34.785 -17.892 1.00 11.59 C ATOM 1483 C PRO A 98 21.787 34.339 -19.222 1.00 11.38 C ATOM 1484 O PRO A 98 20.567 34.298 -19.387 1.00 11.57 O ATOM 1485 CB PRO A 98 22.542 36.306 -17.858 1.00 12.45 C ATOM 1486 CG PRO A 98 23.799 36.538 -17.093 1.00 12.70 C ATOM 1487 CD PRO A 98 24.697 35.382 -17.427 1.00 12.08 C ATOM 0 HA PRO A 98 21.697 34.401 -17.136 1.00 11.59 H new ATOM 0 HB2 PRO A 98 22.609 36.720 -18.864 1.00 12.45 H new ATOM 0 HB3 PRO A 98 21.690 36.783 -17.373 1.00 12.45 H new ATOM 0 HG2 PRO A 98 24.259 37.485 -17.374 1.00 12.70 H new ATOM 0 HG3 PRO A 98 23.603 36.584 -16.022 1.00 12.70 H new ATOM 0 HD2 PRO A 98 25.318 35.593 -18.298 1.00 12.08 H new ATOM 0 HD3 PRO A 98 25.372 35.145 -16.604 1.00 12.08 H new ATOM 1495 N ALA A 99 22.655 33.979 -20.159 1.00 11.13 N ATOM 1496 CA ALA A 99 22.213 33.487 -21.454 1.00 11.14 C ATOM 1497 C ALA A 99 21.517 32.142 -21.291 1.00 10.78 C ATOM 1498 O ALA A 99 20.610 31.798 -22.047 1.00 10.91 O ATOM 1499 CB ALA A 99 23.387 33.369 -22.414 1.00 11.25 C ATOM 0 H ALA A 99 23.668 34.019 -20.045 1.00 11.13 H new ATOM 0 HA ALA A 99 21.504 34.200 -21.874 1.00 11.14 H new ATOM 0 HB1 ALA A 99 23.034 32.999 -23.377 1.00 11.25 H new ATOM 0 HB2 ALA A 99 23.847 34.348 -22.548 1.00 11.25 H new ATOM 0 HB3 ALA A 99 24.122 32.675 -22.006 1.00 11.25 H new ATOM 1505 N THR A 100 21.936 31.399 -20.279 1.00 10.51 N ATOM 1506 CA THR A 100 21.351 30.106 -19.986 1.00 10.39 C ATOM 1507 C THR A 100 20.115 30.282 -19.106 1.00 10.51 C ATOM 1508 O THR A 100 19.221 29.443 -19.096 1.00 10.58 O ATOM 1509 CB THR A 100 22.368 29.179 -19.289 1.00 10.40 C ATOM 1510 OG1 THR A 100 23.640 29.285 -19.943 1.00 10.60 O ATOM 1511 CG2 THR A 100 21.902 27.731 -19.327 1.00 10.63 C ATOM 0 H THR A 100 22.685 31.675 -19.644 1.00 10.51 H new ATOM 0 HA THR A 100 21.061 29.642 -20.929 1.00 10.39 H new ATOM 0 HB THR A 100 22.456 29.488 -18.247 1.00 10.40 H new ATOM 0 HG1 THR A 100 24.286 28.697 -19.499 1.00 10.60 H new ATOM 0 HG21 THR A 100 22.637 27.099 -18.829 1.00 10.63 H new ATOM 0 HG22 THR A 100 20.943 27.644 -18.816 1.00 10.63 H new ATOM 0 HG23 THR A 100 21.791 27.411 -20.363 1.00 10.63 H new ATOM 1519 N ILE A 101 20.068 31.394 -18.382 1.00 10.71 N ATOM 1520 CA ILE A 101 18.931 31.714 -17.523 1.00 11.06 C ATOM 1521 C ILE A 101 17.674 31.948 -18.350 1.00 11.17 C ATOM 1522 O ILE A 101 16.625 31.353 -18.093 1.00 11.41 O ATOM 1523 CB ILE A 101 19.205 32.974 -16.674 1.00 11.57 C ATOM 1524 CG1 ILE A 101 20.375 32.736 -15.719 1.00 11.88 C ATOM 1525 CG2 ILE A 101 17.960 33.387 -15.899 1.00 11.78 C ATOM 1526 CD1 ILE A 101 20.096 31.689 -14.663 1.00 12.53 C ATOM 0 H ILE A 101 20.809 32.095 -18.372 1.00 10.71 H new ATOM 0 HA ILE A 101 18.783 30.860 -16.862 1.00 11.06 H new ATOM 0 HB ILE A 101 19.471 33.786 -17.350 1.00 11.57 H new ATOM 0 HG12 ILE A 101 21.248 32.433 -16.297 1.00 11.88 H new ATOM 0 HG13 ILE A 101 20.629 33.676 -15.228 1.00 11.88 H new ATOM 0 HG21 ILE A 101 18.178 34.277 -15.308 1.00 11.78 H new ATOM 0 HG22 ILE A 101 17.152 33.604 -16.598 1.00 11.78 H new ATOM 0 HG23 ILE A 101 17.659 32.576 -15.236 1.00 11.78 H new ATOM 0 HD11 ILE A 101 20.971 31.575 -14.023 1.00 12.53 H new ATOM 0 HD12 ILE A 101 19.243 31.999 -14.059 1.00 12.53 H new ATOM 0 HD13 ILE A 101 19.872 30.737 -15.145 1.00 12.53 H new ATOM 1538 N MET A 102 17.794 32.815 -19.345 1.00 11.16 N ATOM 1539 CA MET A 102 16.661 33.178 -20.197 1.00 11.48 C ATOM 1540 C MET A 102 16.087 31.961 -20.927 1.00 11.29 C ATOM 1541 O MET A 102 14.884 31.884 -21.164 1.00 11.61 O ATOM 1542 CB MET A 102 17.065 34.266 -21.203 1.00 11.78 C ATOM 1543 CG MET A 102 18.139 33.838 -22.191 1.00 12.25 C ATOM 1544 SD MET A 102 18.624 35.170 -23.306 1.00 12.74 S ATOM 1545 CE MET A 102 19.800 34.316 -24.355 1.00 13.25 C ATOM 0 H MET A 102 18.667 33.284 -19.586 1.00 11.16 H new ATOM 0 HA MET A 102 15.879 33.573 -19.548 1.00 11.48 H new ATOM 0 HB2 MET A 102 16.180 34.577 -21.758 1.00 11.78 H new ATOM 0 HB3 MET A 102 17.420 35.138 -20.654 1.00 11.78 H new ATOM 0 HG2 MET A 102 19.015 33.491 -21.643 1.00 12.25 H new ATOM 0 HG3 MET A 102 17.774 32.994 -22.776 1.00 12.25 H new ATOM 0 HE1 MET A 102 20.769 34.811 -24.293 1.00 13.25 H new ATOM 0 HE2 MET A 102 19.899 33.282 -24.024 1.00 13.25 H new ATOM 0 HE3 MET A 102 19.448 34.335 -25.387 1.00 13.25 H new ATOM 1555 N ILE A 103 16.943 31.012 -21.284 1.00 10.93 N ATOM 1556 CA ILE A 103 16.494 29.800 -21.962 1.00 10.95 C ATOM 1557 C ILE A 103 16.112 28.712 -20.961 1.00 10.91 C ATOM 1558 O ILE A 103 15.442 27.737 -21.310 1.00 11.12 O ATOM 1559 CB ILE A 103 17.556 29.262 -22.939 1.00 10.89 C ATOM 1560 CG1 ILE A 103 18.870 28.976 -22.207 1.00 11.10 C ATOM 1561 CG2 ILE A 103 17.770 30.258 -24.066 1.00 11.06 C ATOM 1562 CD1 ILE A 103 19.976 28.470 -23.105 1.00 11.41 C ATOM 0 H ILE A 103 17.948 31.056 -21.117 1.00 10.93 H new ATOM 0 HA ILE A 103 15.610 30.074 -22.537 1.00 10.95 H new ATOM 0 HB ILE A 103 17.201 28.323 -23.364 1.00 10.89 H new ATOM 0 HG12 ILE A 103 19.205 29.888 -21.714 1.00 11.10 H new ATOM 0 HG13 ILE A 103 18.686 28.240 -21.425 1.00 11.10 H new ATOM 0 HG21 ILE A 103 18.522 29.873 -24.754 1.00 11.06 H new ATOM 0 HG22 ILE A 103 16.832 30.409 -24.601 1.00 11.06 H new ATOM 0 HG23 ILE A 103 18.109 31.208 -23.653 1.00 11.06 H new ATOM 0 HD11 ILE A 103 20.873 28.291 -22.512 1.00 11.41 H new ATOM 0 HD12 ILE A 103 19.663 27.540 -23.579 1.00 11.41 H new ATOM 0 HD13 ILE A 103 20.191 29.214 -23.872 1.00 11.41 H new ATOM 1574 N GLN A 104 16.543 28.892 -19.718 1.00 10.83 N ATOM 1575 CA GLN A 104 16.276 27.941 -18.644 1.00 11.03 C ATOM 1576 C GLN A 104 14.782 27.866 -18.345 1.00 11.28 C ATOM 1577 O GLN A 104 14.319 26.934 -17.688 1.00 11.50 O ATOM 1578 CB GLN A 104 17.053 28.338 -17.386 1.00 11.19 C ATOM 1579 CG GLN A 104 17.044 27.292 -16.286 1.00 11.48 C ATOM 1580 CD GLN A 104 17.840 27.727 -15.070 1.00 11.71 C ATOM 1581 OE1 GLN A 104 17.521 27.355 -13.941 1.00 11.93 O ATOM 1582 NE2 GLN A 104 18.885 28.508 -15.288 1.00 11.88 N ATOM 0 H GLN A 104 17.088 29.703 -19.425 1.00 10.83 H new ATOM 0 HA GLN A 104 16.607 26.954 -18.967 1.00 11.03 H new ATOM 0 HB2 GLN A 104 18.086 28.547 -17.663 1.00 11.19 H new ATOM 0 HB3 GLN A 104 16.635 29.265 -16.993 1.00 11.19 H new ATOM 0 HG2 GLN A 104 16.015 27.089 -15.990 1.00 11.48 H new ATOM 0 HG3 GLN A 104 17.455 26.359 -16.672 1.00 11.48 H new ATOM 0 HE21 GLN A 104 19.118 28.795 -16.239 1.00 11.88 H new ATOM 0 HE22 GLN A 104 19.458 28.823 -14.505 1.00 11.88 H new ATOM 1591 N LYS A 105 14.033 28.852 -18.844 1.00 11.41 N ATOM 1592 CA LYS A 105 12.576 28.886 -18.683 1.00 11.86 C ATOM 1593 C LYS A 105 11.938 27.605 -19.226 1.00 11.85 C ATOM 1594 O LYS A 105 10.812 27.253 -18.869 1.00 12.20 O ATOM 1595 CB LYS A 105 11.986 30.087 -19.417 1.00 12.25 C ATOM 1596 CG LYS A 105 12.479 31.431 -18.915 1.00 12.76 C ATOM 1597 CD LYS A 105 11.861 32.558 -19.720 1.00 13.39 C ATOM 1598 CE LYS A 105 12.374 33.917 -19.283 1.00 14.09 C ATOM 1599 NZ LYS A 105 11.852 35.004 -20.152 1.00 14.37 N ATOM 0 H LYS A 105 14.413 29.642 -19.366 1.00 11.41 H new ATOM 0 HA LYS A 105 12.362 28.968 -17.617 1.00 11.86 H new ATOM 0 HB2 LYS A 105 12.221 30.001 -20.478 1.00 12.25 H new ATOM 0 HB3 LYS A 105 10.900 30.055 -19.327 1.00 12.25 H new ATOM 0 HG2 LYS A 105 12.226 31.547 -17.861 1.00 12.76 H new ATOM 0 HG3 LYS A 105 13.566 31.477 -18.989 1.00 12.76 H new ATOM 0 HD2 LYS A 105 12.080 32.411 -20.777 1.00 13.39 H new ATOM 0 HD3 LYS A 105 10.777 32.528 -19.612 1.00 13.39 H new ATOM 0 HE2 LYS A 105 12.079 34.103 -18.250 1.00 14.09 H new ATOM 0 HE3 LYS A 105 13.464 33.921 -19.309 1.00 14.09 H new ATOM 0 HZ1 LYS A 105 12.223 35.919 -19.824 1.00 14.37 H new ATOM 0 HZ2 LYS A 105 12.154 34.839 -21.133 1.00 14.37 H new ATOM 0 HZ3 LYS A 105 10.813 35.016 -20.107 1.00 14.37 H new ATOM 1613 N GLY A 106 12.678 26.927 -20.097 1.00 11.60 N ATOM 1614 CA GLY A 106 12.251 25.655 -20.646 1.00 11.77 C ATOM 1615 C GLY A 106 11.967 24.611 -19.579 1.00 11.76 C ATOM 1616 O GLY A 106 11.304 23.608 -19.851 1.00 12.03 O ATOM 0 H GLY A 106 13.585 27.246 -20.438 1.00 11.60 H new ATOM 0 HA2 GLY A 106 11.353 25.807 -21.245 1.00 11.77 H new ATOM 0 HA3 GLY A 106 13.022 25.279 -21.318 1.00 11.77 H new ATOM 1620 N ASN A 107 12.493 24.828 -18.374 1.00 11.60 N ATOM 1621 CA ASN A 107 12.292 23.899 -17.261 1.00 11.78 C ATOM 1622 C ASN A 107 10.806 23.732 -16.937 1.00 12.07 C ATOM 1623 O ASN A 107 10.412 22.750 -16.311 1.00 12.33 O ATOM 1624 CB ASN A 107 13.051 24.355 -16.004 1.00 11.85 C ATOM 1625 CG ASN A 107 12.448 25.582 -15.336 1.00 11.96 C ATOM 1626 OD1 ASN A 107 11.892 26.462 -15.991 1.00 11.97 O ATOM 1627 ND2 ASN A 107 12.554 25.643 -14.018 1.00 12.28 N ATOM 0 H ASN A 107 13.063 25.641 -18.143 1.00 11.60 H new ATOM 0 HA ASN A 107 12.691 22.935 -17.576 1.00 11.78 H new ATOM 0 HB2 ASN A 107 13.072 23.535 -15.286 1.00 11.85 H new ATOM 0 HB3 ASN A 107 14.085 24.570 -16.273 1.00 11.85 H new ATOM 0 HD21 ASN A 107 12.167 26.439 -13.512 1.00 12.28 H new ATOM 0 HD22 ASN A 107 13.022 24.894 -13.509 1.00 12.28 H new ATOM 1634 N PHE A 108 9.989 24.694 -17.361 1.00 12.19 N ATOM 1635 CA PHE A 108 8.541 24.591 -17.214 1.00 12.69 C ATOM 1636 C PHE A 108 8.029 23.360 -17.953 1.00 12.92 C ATOM 1637 O PHE A 108 7.176 22.626 -17.452 1.00 13.36 O ATOM 1638 CB PHE A 108 7.861 25.857 -17.750 1.00 13.02 C ATOM 1639 CG PHE A 108 6.361 25.820 -17.676 1.00 13.41 C ATOM 1640 CD1 PHE A 108 5.707 26.061 -16.477 1.00 13.60 C ATOM 1641 CD2 PHE A 108 5.607 25.547 -18.805 1.00 13.76 C ATOM 1642 CE1 PHE A 108 4.327 26.034 -16.409 1.00 14.16 C ATOM 1643 CE2 PHE A 108 4.228 25.517 -18.742 1.00 14.30 C ATOM 1644 CZ PHE A 108 3.589 25.742 -17.539 1.00 14.51 C ATOM 0 H PHE A 108 10.306 25.554 -17.809 1.00 12.19 H new ATOM 0 HA PHE A 108 8.300 24.491 -16.156 1.00 12.69 H new ATOM 0 HB2 PHE A 108 8.222 26.718 -17.187 1.00 13.02 H new ATOM 0 HB3 PHE A 108 8.160 26.007 -18.787 1.00 13.02 H new ATOM 0 HD1 PHE A 108 6.282 26.272 -15.587 1.00 13.60 H new ATOM 0 HD2 PHE A 108 6.103 25.355 -19.745 1.00 13.76 H new ATOM 0 HE1 PHE A 108 3.827 26.241 -15.474 1.00 14.16 H new ATOM 0 HE2 PHE A 108 3.650 25.318 -19.632 1.00 14.30 H new ATOM 0 HZ PHE A 108 2.512 25.690 -17.482 1.00 14.51 H new ATOM 1654 N ARG A 109 8.569 23.134 -19.144 1.00 12.75 N ATOM 1655 CA ARG A 109 8.246 21.948 -19.925 1.00 13.13 C ATOM 1656 C ARG A 109 8.836 20.718 -19.253 1.00 13.11 C ATOM 1657 O ARG A 109 8.173 19.688 -19.133 1.00 13.55 O ATOM 1658 CB ARG A 109 8.816 22.069 -21.338 1.00 13.21 C ATOM 1659 CG ARG A 109 8.244 23.220 -22.147 1.00 13.63 C ATOM 1660 CD ARG A 109 8.923 23.318 -23.504 1.00 13.95 C ATOM 1661 NE ARG A 109 8.839 22.062 -24.246 1.00 14.26 N ATOM 1662 CZ ARG A 109 9.837 21.549 -24.965 1.00 14.71 C ATOM 1663 NH1 ARG A 109 11.001 22.184 -25.046 1.00 14.89 N ATOM 1664 NH2 ARG A 109 9.671 20.396 -25.599 1.00 15.12 N ATOM 0 H ARG A 109 9.237 23.761 -19.592 1.00 12.75 H new ATOM 0 HA ARG A 109 7.162 21.855 -19.984 1.00 13.13 H new ATOM 0 HB2 ARG A 109 9.897 22.189 -21.272 1.00 13.21 H new ATOM 0 HB3 ARG A 109 8.631 21.137 -21.873 1.00 13.21 H new ATOM 0 HG2 ARG A 109 7.172 23.078 -22.282 1.00 13.63 H new ATOM 0 HG3 ARG A 109 8.376 24.154 -21.601 1.00 13.63 H new ATOM 0 HD2 ARG A 109 8.460 24.115 -24.085 1.00 13.95 H new ATOM 0 HD3 ARG A 109 9.970 23.590 -23.368 1.00 13.95 H new ATOM 0 HE ARG A 109 7.960 21.545 -24.211 1.00 14.26 H new ATOM 0 HH11 ARG A 109 11.134 23.069 -24.556 1.00 14.89 H new ATOM 0 HH12 ARG A 109 11.761 21.787 -25.598 1.00 14.89 H new ATOM 0 HH21 ARG A 109 8.780 19.903 -25.536 1.00 15.12 H new ATOM 0 HH22 ARG A 109 10.434 20.002 -26.150 1.00 15.12 H new ATOM 1678 N ASN A 110 10.081 20.849 -18.805 1.00 12.73 N ATOM 1679 CA ASN A 110 10.801 19.758 -18.153 1.00 12.86 C ATOM 1680 C ASN A 110 10.876 18.538 -19.068 1.00 12.47 C ATOM 1681 O ASN A 110 10.491 17.428 -18.699 1.00 12.44 O ATOM 1682 CB ASN A 110 10.143 19.397 -16.815 1.00 13.08 C ATOM 1683 CG ASN A 110 10.989 18.452 -15.978 1.00 13.55 C ATOM 1684 OD1 ASN A 110 12.218 18.447 -16.070 1.00 13.74 O ATOM 1685 ND2 ASN A 110 10.339 17.657 -15.143 1.00 13.93 N ATOM 0 H ASN A 110 10.619 21.712 -18.883 1.00 12.73 H new ATOM 0 HA ASN A 110 11.818 20.093 -17.951 1.00 12.86 H new ATOM 0 HB2 ASN A 110 9.958 20.310 -16.249 1.00 13.08 H new ATOM 0 HB3 ASN A 110 9.173 18.937 -17.005 1.00 13.08 H new ATOM 0 HD21 ASN A 110 10.856 17.011 -14.547 1.00 13.93 H new ATOM 0 HD22 ASN A 110 9.321 17.690 -15.096 1.00 13.93 H new ATOM 1692 N GLN A 111 11.356 18.770 -20.281 1.00 12.38 N ATOM 1693 CA GLN A 111 11.578 17.700 -21.242 1.00 12.20 C ATOM 1694 C GLN A 111 13.080 17.494 -21.416 1.00 11.61 C ATOM 1695 O GLN A 111 13.535 16.586 -22.119 1.00 11.50 O ATOM 1696 CB GLN A 111 10.914 18.045 -22.584 1.00 12.57 C ATOM 1697 CG GLN A 111 11.015 16.946 -23.637 1.00 13.05 C ATOM 1698 CD GLN A 111 10.203 15.706 -23.298 1.00 13.63 C ATOM 1699 OE1 GLN A 111 9.972 15.387 -22.131 1.00 13.90 O ATOM 1700 NE2 GLN A 111 9.777 14.986 -24.323 1.00 14.01 N ATOM 0 H GLN A 111 11.601 19.698 -20.625 1.00 12.38 H new ATOM 0 HA GLN A 111 11.130 16.776 -20.876 1.00 12.20 H new ATOM 0 HB2 GLN A 111 9.862 18.268 -22.408 1.00 12.57 H new ATOM 0 HB3 GLN A 111 11.370 18.953 -22.979 1.00 12.57 H new ATOM 0 HG2 GLN A 111 10.678 17.340 -24.596 1.00 13.05 H new ATOM 0 HG3 GLN A 111 12.061 16.664 -23.758 1.00 13.05 H new ATOM 0 HE21 GLN A 111 9.988 15.281 -25.276 1.00 14.01 H new ATOM 0 HE22 GLN A 111 9.238 14.136 -24.160 1.00 14.01 H new ATOM 1709 N ARG A 112 13.851 18.334 -20.729 1.00 11.45 N ATOM 1710 CA ARG A 112 15.306 18.306 -20.823 1.00 11.12 C ATOM 1711 C ARG A 112 15.865 17.006 -20.251 1.00 10.61 C ATOM 1712 O ARG A 112 17.023 16.685 -20.454 1.00 10.60 O ATOM 1713 CB ARG A 112 15.921 19.502 -20.087 1.00 11.41 C ATOM 1714 CG ARG A 112 15.928 19.351 -18.574 1.00 11.96 C ATOM 1715 CD ARG A 112 16.590 20.538 -17.892 1.00 12.50 C ATOM 1716 NE ARG A 112 16.877 20.262 -16.485 1.00 13.09 N ATOM 1717 CZ ARG A 112 16.631 21.104 -15.482 1.00 13.79 C ATOM 1718 NH1 ARG A 112 16.089 22.293 -15.713 1.00 14.01 N ATOM 1719 NH2 ARG A 112 16.928 20.748 -14.241 1.00 14.43 N ATOM 0 H ARG A 112 13.487 19.047 -20.097 1.00 11.45 H new ATOM 0 HA ARG A 112 15.571 18.366 -21.879 1.00 11.12 H new ATOM 0 HB2 ARG A 112 16.945 19.643 -20.434 1.00 11.41 H new ATOM 0 HB3 ARG A 112 15.368 20.403 -20.351 1.00 11.41 H new ATOM 0 HG2 ARG A 112 14.904 19.249 -18.214 1.00 11.96 H new ATOM 0 HG3 ARG A 112 16.454 18.436 -18.302 1.00 11.96 H new ATOM 0 HD2 ARG A 112 17.516 20.786 -18.411 1.00 12.50 H new ATOM 0 HD3 ARG A 112 15.940 21.410 -17.967 1.00 12.50 H new ATOM 0 HE ARG A 112 17.295 19.361 -16.255 1.00 13.09 H new ATOM 0 HH11 ARG A 112 15.856 22.571 -16.666 1.00 14.01 H new ATOM 0 HH12 ARG A 112 15.905 22.929 -14.937 1.00 14.01 H new ATOM 0 HH21 ARG A 112 17.342 19.834 -14.058 1.00 14.43 H new ATOM 0 HH22 ARG A 112 16.742 21.388 -13.469 1.00 14.43 H new ATOM 1733 N LYS A 113 15.044 16.271 -19.521 1.00 10.40 N ATOM 1734 CA LYS A 113 15.460 14.996 -18.956 1.00 10.14 C ATOM 1735 C LYS A 113 15.311 13.859 -19.967 1.00 9.74 C ATOM 1736 O LYS A 113 14.968 12.738 -19.597 1.00 9.59 O ATOM 1737 CB LYS A 113 14.682 14.694 -17.671 1.00 10.36 C ATOM 1738 CG LYS A 113 13.173 14.611 -17.849 1.00 10.98 C ATOM 1739 CD LYS A 113 12.470 14.358 -16.523 1.00 11.43 C ATOM 1740 CE LYS A 113 12.999 13.104 -15.841 1.00 11.95 C ATOM 1741 NZ LYS A 113 12.337 12.852 -14.534 1.00 12.41 N ATOM 0 H LYS A 113 14.083 16.535 -19.304 1.00 10.40 H new ATOM 0 HA LYS A 113 16.518 15.073 -18.706 1.00 10.14 H new ATOM 0 HB2 LYS A 113 15.039 13.750 -17.259 1.00 10.36 H new ATOM 0 HB3 LYS A 113 14.906 15.467 -16.936 1.00 10.36 H new ATOM 0 HG2 LYS A 113 12.805 15.539 -18.286 1.00 10.98 H new ATOM 0 HG3 LYS A 113 12.931 13.811 -18.549 1.00 10.98 H new ATOM 0 HD2 LYS A 113 12.610 15.217 -15.866 1.00 11.43 H new ATOM 0 HD3 LYS A 113 11.398 14.257 -16.692 1.00 11.43 H new ATOM 0 HE2 LYS A 113 12.846 12.245 -16.495 1.00 11.95 H new ATOM 0 HE3 LYS A 113 14.074 13.202 -15.689 1.00 11.95 H new ATOM 0 HZ1 LYS A 113 12.729 11.989 -14.107 1.00 12.41 H new ATOM 0 HZ2 LYS A 113 12.504 13.659 -13.899 1.00 12.41 H new ATOM 0 HZ3 LYS A 113 11.314 12.732 -14.680 1.00 12.41 H new ATOM 1755 N THR A 114 15.572 14.161 -21.243 1.00 9.83 N ATOM 1756 CA THR A 114 15.343 13.215 -22.334 1.00 9.78 C ATOM 1757 C THR A 114 15.960 11.835 -22.046 1.00 9.62 C ATOM 1758 O THR A 114 15.219 10.870 -21.851 1.00 9.64 O ATOM 1759 CB THR A 114 15.877 13.780 -23.662 1.00 10.31 C ATOM 1760 OG1 THR A 114 15.312 15.082 -23.890 1.00 10.49 O ATOM 1761 CG2 THR A 114 15.531 12.865 -24.828 1.00 10.80 C ATOM 0 H THR A 114 15.945 15.061 -21.545 1.00 9.83 H new ATOM 0 HA THR A 114 14.265 13.075 -22.418 1.00 9.78 H new ATOM 0 HB THR A 114 16.963 13.850 -23.593 1.00 10.31 H new ATOM 0 HG1 THR A 114 14.656 15.281 -23.190 1.00 10.49 H new ATOM 0 HG21 THR A 114 15.921 13.290 -25.753 1.00 10.80 H new ATOM 0 HG22 THR A 114 15.975 11.883 -24.664 1.00 10.80 H new ATOM 0 HG23 THR A 114 14.448 12.765 -24.903 1.00 10.80 H new ATOM 1769 N VAL A 115 17.289 11.713 -22.015 1.00 9.74 N ATOM 1770 CA VAL A 115 17.886 10.476 -21.507 1.00 9.92 C ATOM 1771 C VAL A 115 19.239 10.705 -20.816 1.00 9.30 C ATOM 1772 O VAL A 115 19.437 10.259 -19.684 1.00 9.52 O ATOM 1773 CB VAL A 115 18.015 9.395 -22.618 1.00 10.85 C ATOM 1774 CG1 VAL A 115 18.786 9.910 -23.824 1.00 11.22 C ATOM 1775 CG2 VAL A 115 18.659 8.130 -22.068 1.00 11.44 C ATOM 0 H VAL A 115 17.951 12.426 -22.323 1.00 9.74 H new ATOM 0 HA VAL A 115 17.196 10.105 -20.749 1.00 9.92 H new ATOM 0 HB VAL A 115 17.007 9.154 -22.955 1.00 10.85 H new ATOM 0 HG11 VAL A 115 18.853 9.124 -24.576 1.00 11.22 H new ATOM 0 HG12 VAL A 115 18.269 10.772 -24.245 1.00 11.22 H new ATOM 0 HG13 VAL A 115 19.789 10.204 -23.516 1.00 11.22 H new ATOM 0 HG21 VAL A 115 18.739 7.388 -22.862 1.00 11.44 H new ATOM 0 HG22 VAL A 115 19.653 8.364 -21.688 1.00 11.44 H new ATOM 0 HG23 VAL A 115 18.046 7.732 -21.260 1.00 11.44 H new ATOM 1785 N LYS A 116 20.162 11.406 -21.469 1.00 8.75 N ATOM 1786 CA LYS A 116 21.456 11.690 -20.870 1.00 8.35 C ATOM 1787 C LYS A 116 22.109 12.909 -21.509 1.00 7.64 C ATOM 1788 O LYS A 116 22.089 13.070 -22.727 1.00 7.40 O ATOM 1789 CB LYS A 116 22.379 10.472 -20.970 1.00 8.50 C ATOM 1790 CG LYS A 116 22.577 9.940 -22.383 1.00 9.04 C ATOM 1791 CD LYS A 116 23.429 8.679 -22.389 1.00 9.56 C ATOM 1792 CE LYS A 116 22.757 7.548 -21.624 1.00 10.24 C ATOM 1793 NZ LYS A 116 23.541 6.284 -21.679 1.00 10.72 N ATOM 0 H LYS A 116 20.036 11.785 -22.408 1.00 8.75 H new ATOM 0 HA LYS A 116 21.290 11.914 -19.816 1.00 8.35 H new ATOM 0 HB2 LYS A 116 23.352 10.735 -20.555 1.00 8.50 H new ATOM 0 HB3 LYS A 116 21.973 9.673 -20.349 1.00 8.50 H new ATOM 0 HG2 LYS A 116 21.607 9.727 -22.832 1.00 9.04 H new ATOM 0 HG3 LYS A 116 23.052 10.705 -22.998 1.00 9.04 H new ATOM 0 HD2 LYS A 116 23.611 8.366 -23.417 1.00 9.56 H new ATOM 0 HD3 LYS A 116 24.401 8.893 -21.944 1.00 9.56 H new ATOM 0 HE2 LYS A 116 22.624 7.845 -20.584 1.00 10.24 H new ATOM 0 HE3 LYS A 116 21.763 7.374 -22.036 1.00 10.24 H new ATOM 0 HZ1 LYS A 116 23.044 5.544 -21.144 1.00 10.72 H new ATOM 0 HZ2 LYS A 116 23.647 5.984 -22.669 1.00 10.72 H new ATOM 0 HZ3 LYS A 116 24.481 6.440 -21.262 1.00 10.72 H new ATOM 1807 N CYS A 117 22.663 13.774 -20.678 1.00 7.61 N ATOM 1808 CA CYS A 117 23.410 14.927 -21.158 1.00 7.28 C ATOM 1809 C CYS A 117 24.811 14.512 -21.575 1.00 6.81 C ATOM 1810 O CYS A 117 25.456 13.724 -20.879 1.00 6.94 O ATOM 1811 CB CYS A 117 23.523 15.969 -20.051 1.00 7.77 C ATOM 1812 SG CYS A 117 24.190 17.554 -20.601 1.00 8.16 S ATOM 0 H CYS A 117 22.610 13.700 -19.662 1.00 7.61 H new ATOM 0 HA CYS A 117 22.881 15.345 -22.014 1.00 7.28 H new ATOM 0 HB2 CYS A 117 22.536 16.132 -19.618 1.00 7.77 H new ATOM 0 HB3 CYS A 117 24.158 15.574 -19.258 1.00 7.77 H new ATOM 1817 N PHE A 118 25.305 15.055 -22.679 1.00 6.60 N ATOM 1818 CA PHE A 118 26.670 14.778 -23.090 1.00 6.49 C ATOM 1819 C PHE A 118 27.617 15.777 -22.422 1.00 6.66 C ATOM 1820 O PHE A 118 28.302 16.555 -23.084 1.00 6.96 O ATOM 1821 CB PHE A 118 26.790 14.839 -24.617 1.00 6.75 C ATOM 1822 CG PHE A 118 27.959 14.078 -25.179 1.00 6.84 C ATOM 1823 CD1 PHE A 118 29.219 14.654 -25.215 1.00 7.09 C ATOM 1824 CD2 PHE A 118 27.806 12.787 -25.664 1.00 7.05 C ATOM 1825 CE1 PHE A 118 30.301 13.960 -25.724 1.00 7.55 C ATOM 1826 CE2 PHE A 118 28.883 12.090 -26.174 1.00 7.50 C ATOM 1827 CZ PHE A 118 30.108 12.662 -26.230 1.00 7.76 C ATOM 0 H PHE A 118 24.788 15.681 -23.297 1.00 6.60 H new ATOM 0 HA PHE A 118 26.946 13.772 -22.775 1.00 6.49 H new ATOM 0 HB2 PHE A 118 25.872 14.449 -25.057 1.00 6.75 H new ATOM 0 HB3 PHE A 118 26.871 15.882 -24.922 1.00 6.75 H new ATOM 0 HD1 PHE A 118 29.357 15.658 -24.841 1.00 7.09 H new ATOM 0 HD2 PHE A 118 26.832 12.321 -25.642 1.00 7.05 H new ATOM 0 HE1 PHE A 118 31.283 14.409 -25.733 1.00 7.55 H new ATOM 0 HE2 PHE A 118 28.747 11.080 -26.531 1.00 7.50 H new ATOM 0 HZ PHE A 118 30.937 12.122 -26.663 1.00 7.76 H new ATOM 1837 N ASN A 119 27.626 15.723 -21.092 1.00 6.83 N ATOM 1838 CA ASN A 119 28.555 16.477 -20.244 1.00 7.37 C ATOM 1839 C ASN A 119 28.170 16.318 -18.775 1.00 7.84 C ATOM 1840 O ASN A 119 29.037 16.188 -17.915 1.00 8.35 O ATOM 1841 CB ASN A 119 28.685 17.975 -20.634 1.00 7.76 C ATOM 1842 CG ASN A 119 27.430 18.831 -20.475 1.00 8.38 C ATOM 1843 OD1 ASN A 119 26.599 18.619 -19.600 1.00 8.64 O ATOM 1844 ND2 ASN A 119 27.301 19.837 -21.324 1.00 8.90 N ATOM 0 H ASN A 119 26.976 15.144 -20.560 1.00 6.83 H new ATOM 0 HA ASN A 119 29.544 16.050 -20.408 1.00 7.37 H new ATOM 0 HB2 ASN A 119 29.478 18.417 -20.031 1.00 7.76 H new ATOM 0 HB3 ASN A 119 29.006 18.030 -21.674 1.00 7.76 H new ATOM 0 HD21 ASN A 119 26.495 20.459 -21.259 1.00 8.90 H new ATOM 0 HD22 ASN A 119 28.008 19.991 -22.043 1.00 8.90 H new ATOM 1851 N CYS A 120 26.869 16.296 -18.490 1.00 7.96 N ATOM 1852 CA CYS A 120 26.400 16.065 -17.129 1.00 8.71 C ATOM 1853 C CYS A 120 26.341 14.568 -16.840 1.00 8.75 C ATOM 1854 O CYS A 120 26.381 14.142 -15.688 1.00 9.54 O ATOM 1855 CB CYS A 120 25.014 16.697 -16.901 1.00 9.25 C ATOM 1856 SG CYS A 120 24.974 18.503 -17.028 1.00 9.45 S ATOM 0 H CYS A 120 26.129 16.434 -19.178 1.00 7.96 H new ATOM 0 HA CYS A 120 27.106 16.537 -16.446 1.00 8.71 H new ATOM 0 HB2 CYS A 120 24.316 16.280 -17.627 1.00 9.25 H new ATOM 0 HB3 CYS A 120 24.656 16.408 -15.913 1.00 9.25 H new ATOM 1861 N GLY A 121 26.256 13.769 -17.901 1.00 8.15 N ATOM 1862 CA GLY A 121 26.198 12.328 -17.745 1.00 8.48 C ATOM 1863 C GLY A 121 24.784 11.828 -17.516 1.00 8.66 C ATOM 1864 O GLY A 121 24.476 10.669 -17.793 1.00 9.05 O ATOM 0 H GLY A 121 26.226 14.096 -18.867 1.00 8.15 H new ATOM 0 HA2 GLY A 121 26.609 11.852 -18.635 1.00 8.48 H new ATOM 0 HA3 GLY A 121 26.826 12.030 -16.905 1.00 8.48 H new ATOM 1868 N LYS A 122 23.922 12.717 -17.037 1.00 8.64 N ATOM 1869 CA LYS A 122 22.551 12.368 -16.694 1.00 9.14 C ATOM 1870 C LYS A 122 21.636 13.504 -17.086 1.00 9.38 C ATOM 1871 O LYS A 122 22.085 14.648 -17.177 1.00 9.60 O ATOM 1872 CB LYS A 122 22.404 12.092 -15.192 1.00 10.04 C ATOM 1873 CG LYS A 122 23.162 10.866 -14.715 1.00 10.62 C ATOM 1874 CD LYS A 122 22.578 9.574 -15.268 1.00 11.49 C ATOM 1875 CE LYS A 122 21.177 9.309 -14.742 1.00 12.13 C ATOM 1876 NZ LYS A 122 20.630 8.025 -15.254 1.00 12.70 N ATOM 0 H LYS A 122 24.154 13.697 -16.876 1.00 8.64 H new ATOM 0 HA LYS A 122 22.283 11.460 -17.235 1.00 9.14 H new ATOM 0 HB2 LYS A 122 22.754 12.962 -14.637 1.00 10.04 H new ATOM 0 HB3 LYS A 122 21.347 11.968 -14.957 1.00 10.04 H new ATOM 0 HG2 LYS A 122 24.207 10.948 -15.016 1.00 10.62 H new ATOM 0 HG3 LYS A 122 23.145 10.832 -13.626 1.00 10.62 H new ATOM 0 HD2 LYS A 122 22.553 9.625 -16.357 1.00 11.49 H new ATOM 0 HD3 LYS A 122 23.228 8.740 -15.003 1.00 11.49 H new ATOM 0 HE2 LYS A 122 21.196 9.288 -13.652 1.00 12.13 H new ATOM 0 HE3 LYS A 122 20.518 10.127 -15.034 1.00 12.13 H new ATOM 0 HZ1 LYS A 122 19.673 7.879 -14.874 1.00 12.70 H new ATOM 0 HZ2 LYS A 122 20.589 8.055 -16.293 1.00 12.70 H new ATOM 0 HZ3 LYS A 122 21.245 7.242 -14.954 1.00 12.70 H new ATOM 1890 N GLU A 123 20.368 13.175 -17.297 1.00 9.61 N ATOM 1891 CA GLU A 123 19.358 14.129 -17.747 1.00 10.15 C ATOM 1892 C GLU A 123 19.711 14.652 -19.140 1.00 10.16 C ATOM 1893 O GLU A 123 20.746 15.276 -19.336 1.00 9.77 O ATOM 1894 CB GLU A 123 19.203 15.264 -16.730 1.00 10.72 C ATOM 1895 CG GLU A 123 17.900 16.027 -16.863 1.00 11.36 C ATOM 1896 CD GLU A 123 17.632 16.934 -15.684 1.00 12.15 C ATOM 1897 OE1 GLU A 123 16.906 16.515 -14.759 1.00 12.53 O ATOM 1898 OE2 GLU A 123 18.153 18.071 -15.676 1.00 12.54 O ATOM 0 H GLU A 123 20.007 12.231 -17.160 1.00 9.61 H new ATOM 0 HA GLU A 123 18.394 13.625 -17.819 1.00 10.15 H new ATOM 0 HB2 GLU A 123 19.271 14.850 -15.724 1.00 10.72 H new ATOM 0 HB3 GLU A 123 20.034 15.959 -16.845 1.00 10.72 H new ATOM 0 HG2 GLU A 123 17.924 16.622 -17.776 1.00 11.36 H new ATOM 0 HG3 GLU A 123 17.078 15.319 -16.966 1.00 11.36 H new ATOM 1905 N GLY A 124 18.825 14.408 -20.093 1.00 10.81 N ATOM 1906 CA GLY A 124 19.157 14.547 -21.501 1.00 11.18 C ATOM 1907 C GLY A 124 19.216 15.973 -22.005 1.00 11.06 C ATOM 1908 O GLY A 124 18.499 16.337 -22.943 1.00 11.83 O ATOM 0 H GLY A 124 17.866 14.111 -19.915 1.00 10.81 H new ATOM 0 HA2 GLY A 124 20.122 14.074 -21.680 1.00 11.18 H new ATOM 0 HA3 GLY A 124 18.420 14.000 -22.089 1.00 11.18 H new ATOM 1912 N HIS A 125 20.051 16.783 -21.384 1.00 10.27 N ATOM 1913 CA HIS A 125 20.340 18.111 -21.903 1.00 10.32 C ATOM 1914 C HIS A 125 21.050 17.954 -23.235 1.00 9.72 C ATOM 1915 O HIS A 125 21.598 16.890 -23.533 1.00 9.32 O ATOM 1916 CB HIS A 125 21.266 18.929 -20.984 1.00 10.21 C ATOM 1917 CG HIS A 125 20.975 18.876 -19.513 1.00 10.68 C ATOM 1918 ND1 HIS A 125 21.904 19.319 -18.603 1.00 10.37 N ATOM 1919 CD2 HIS A 125 19.888 18.423 -18.844 1.00 11.65 C ATOM 1920 CE1 HIS A 125 21.380 19.122 -17.408 1.00 11.18 C ATOM 1921 NE2 HIS A 125 20.153 18.581 -17.504 1.00 11.94 N ATOM 0 H HIS A 125 20.542 16.548 -20.521 1.00 10.27 H new ATOM 0 HA HIS A 125 19.391 18.640 -21.986 1.00 10.32 H new ATOM 0 HB2 HIS A 125 22.289 18.587 -21.141 1.00 10.21 H new ATOM 0 HB3 HIS A 125 21.226 19.971 -21.301 1.00 10.21 H new ATOM 0 HD2 HIS A 125 18.987 18.016 -19.279 1.00 11.65 H new ATOM 0 HE1 HIS A 125 21.871 19.363 -16.477 1.00 11.18 H new ATOM 0 HE2 HIS A 125 19.536 18.335 -16.730 1.00 11.94 H new ATOM 1929 N ILE A 126 21.048 18.997 -24.032 1.00 9.89 N ATOM 1930 CA ILE A 126 21.820 18.994 -25.252 1.00 9.58 C ATOM 1931 C ILE A 126 23.117 19.742 -25.020 1.00 9.30 C ATOM 1932 O ILE A 126 23.117 20.892 -24.577 1.00 9.89 O ATOM 1933 CB ILE A 126 21.045 19.597 -26.438 1.00 10.51 C ATOM 1934 CG1 ILE A 126 20.470 20.966 -26.082 1.00 11.44 C ATOM 1935 CG2 ILE A 126 19.944 18.643 -26.860 1.00 10.87 C ATOM 1936 CD1 ILE A 126 19.762 21.644 -27.235 1.00 12.22 C ATOM 0 H ILE A 126 20.523 19.854 -23.859 1.00 9.89 H new ATOM 0 HA ILE A 126 22.032 17.958 -25.518 1.00 9.58 H new ATOM 0 HB ILE A 126 21.733 19.740 -27.271 1.00 10.51 H new ATOM 0 HG12 ILE A 126 19.771 20.853 -25.253 1.00 11.44 H new ATOM 0 HG13 ILE A 126 21.277 21.610 -25.733 1.00 11.44 H new ATOM 0 HG21 ILE A 126 19.395 19.069 -27.700 1.00 10.87 H new ATOM 0 HG22 ILE A 126 20.382 17.691 -27.159 1.00 10.87 H new ATOM 0 HG23 ILE A 126 19.262 18.482 -26.025 1.00 10.87 H new ATOM 0 HD11 ILE A 126 19.379 22.611 -26.909 1.00 12.22 H new ATOM 0 HD12 ILE A 126 20.463 21.789 -28.057 1.00 12.22 H new ATOM 0 HD13 ILE A 126 18.933 21.020 -27.570 1.00 12.22 H new ATOM 1948 N ALA A 127 24.219 19.070 -25.299 1.00 8.62 N ATOM 1949 CA ALA A 127 25.545 19.583 -24.993 1.00 8.50 C ATOM 1950 C ALA A 127 25.838 20.895 -25.707 1.00 9.47 C ATOM 1951 O ALA A 127 26.720 21.643 -25.294 1.00 9.79 O ATOM 1952 CB ALA A 127 26.591 18.544 -25.340 1.00 7.91 C ATOM 0 H ALA A 127 24.222 18.152 -25.744 1.00 8.62 H new ATOM 0 HA ALA A 127 25.579 19.791 -23.924 1.00 8.50 H new ATOM 0 HB1 ALA A 127 27.582 18.934 -25.109 1.00 7.91 H new ATOM 0 HB2 ALA A 127 26.412 17.639 -24.759 1.00 7.91 H new ATOM 0 HB3 ALA A 127 26.532 18.310 -26.403 1.00 7.91 H new ATOM 1958 N LYS A 128 25.093 21.188 -26.769 1.00 10.12 N ATOM 1959 CA LYS A 128 25.305 22.429 -27.508 1.00 11.20 C ATOM 1960 C LYS A 128 24.584 23.593 -26.837 1.00 11.91 C ATOM 1961 O LYS A 128 24.748 24.748 -27.229 1.00 12.77 O ATOM 1962 CB LYS A 128 24.850 22.295 -28.966 1.00 11.83 C ATOM 1963 CG LYS A 128 23.368 22.004 -29.141 1.00 11.76 C ATOM 1964 CD LYS A 128 22.985 21.990 -30.611 1.00 12.45 C ATOM 1965 CE LYS A 128 21.539 21.565 -30.821 1.00 12.66 C ATOM 1966 NZ LYS A 128 21.327 20.120 -30.529 1.00 13.15 N ATOM 0 H LYS A 128 24.348 20.594 -27.133 1.00 10.12 H new ATOM 0 HA LYS A 128 26.376 22.633 -27.503 1.00 11.20 H new ATOM 0 HB2 LYS A 128 25.091 23.217 -29.495 1.00 11.83 H new ATOM 0 HB3 LYS A 128 25.422 21.497 -29.440 1.00 11.83 H new ATOM 0 HG2 LYS A 128 23.127 21.041 -28.690 1.00 11.76 H new ATOM 0 HG3 LYS A 128 22.781 22.758 -28.616 1.00 11.76 H new ATOM 0 HD2 LYS A 128 23.136 22.983 -31.034 1.00 12.45 H new ATOM 0 HD3 LYS A 128 23.644 21.310 -31.151 1.00 12.45 H new ATOM 0 HE2 LYS A 128 20.890 22.162 -30.180 1.00 12.66 H new ATOM 0 HE3 LYS A 128 21.248 21.772 -31.851 1.00 12.66 H new ATOM 0 HZ1 LYS A 128 20.365 19.846 -30.814 1.00 13.15 H new ATOM 0 HZ2 LYS A 128 22.020 19.553 -31.059 1.00 13.15 H new ATOM 0 HZ3 LYS A 128 21.448 19.950 -29.510 1.00 13.15 H new ATOM 1980 N ASN A 129 23.777 23.290 -25.830 1.00 11.70 N ATOM 1981 CA ASN A 129 23.043 24.324 -25.110 1.00 12.56 C ATOM 1982 C ASN A 129 23.390 24.296 -23.623 1.00 12.29 C ATOM 1983 O ASN A 129 23.241 25.292 -22.915 1.00 13.04 O ATOM 1984 CB ASN A 129 21.539 24.129 -25.300 1.00 13.04 C ATOM 1985 CG ASN A 129 20.741 25.370 -24.967 1.00 13.96 C ATOM 1986 OD1 ASN A 129 21.211 26.491 -25.150 1.00 14.48 O ATOM 1987 ND2 ASN A 129 19.525 25.178 -24.479 1.00 14.33 N ATOM 0 H ASN A 129 23.613 22.341 -25.493 1.00 11.70 H new ATOM 0 HA ASN A 129 23.331 25.295 -25.514 1.00 12.56 H new ATOM 0 HB2 ASN A 129 21.342 23.842 -26.333 1.00 13.04 H new ATOM 0 HB3 ASN A 129 21.201 23.306 -24.671 1.00 13.04 H new ATOM 0 HD21 ASN A 129 18.939 25.978 -24.239 1.00 14.33 H new ATOM 0 HD22 ASN A 129 19.174 24.230 -24.343 1.00 14.33 H new ATOM 1994 N CYS A 130 23.859 23.148 -23.155 1.00 11.34 N ATOM 1995 CA CYS A 130 24.247 22.991 -21.762 1.00 11.22 C ATOM 1996 C CYS A 130 25.642 23.574 -21.534 1.00 11.41 C ATOM 1997 O CYS A 130 26.622 23.111 -22.121 1.00 10.94 O ATOM 1998 CB CYS A 130 24.208 21.506 -21.366 1.00 10.26 C ATOM 1999 SG CYS A 130 24.692 21.176 -19.654 1.00 10.18 S ATOM 0 H CYS A 130 23.980 22.309 -23.723 1.00 11.34 H new ATOM 0 HA CYS A 130 23.540 23.534 -21.134 1.00 11.22 H new ATOM 0 HB2 CYS A 130 23.199 21.127 -21.525 1.00 10.26 H new ATOM 0 HB3 CYS A 130 24.867 20.948 -22.031 1.00 10.26 H new ATOM 2004 N ARG A 131 25.720 24.611 -20.708 1.00 12.28 N ATOM 2005 CA ARG A 131 27.000 25.212 -20.357 1.00 12.72 C ATOM 2006 C ARG A 131 27.590 24.510 -19.144 1.00 12.49 C ATOM 2007 O ARG A 131 27.203 24.785 -18.007 1.00 12.99 O ATOM 2008 CB ARG A 131 26.852 26.710 -20.054 1.00 13.93 C ATOM 2009 CG ARG A 131 26.849 27.612 -21.280 1.00 14.54 C ATOM 2010 CD ARG A 131 25.597 27.447 -22.124 1.00 15.39 C ATOM 2011 NE ARG A 131 25.577 28.377 -23.252 1.00 15.94 N ATOM 2012 CZ ARG A 131 24.511 28.602 -24.019 1.00 16.74 C ATOM 2013 NH1 ARG A 131 23.383 27.936 -23.813 1.00 17.08 N ATOM 2014 NH2 ARG A 131 24.580 29.488 -25.002 1.00 17.31 N ATOM 0 H ARG A 131 24.912 25.053 -20.269 1.00 12.28 H new ATOM 0 HA ARG A 131 27.666 25.097 -21.212 1.00 12.72 H new ATOM 0 HB2 ARG A 131 25.924 26.865 -19.504 1.00 13.93 H new ATOM 0 HB3 ARG A 131 27.667 27.016 -19.397 1.00 13.93 H new ATOM 0 HG2 ARG A 131 26.934 28.651 -20.962 1.00 14.54 H new ATOM 0 HG3 ARG A 131 27.725 27.393 -21.890 1.00 14.54 H new ATOM 0 HD2 ARG A 131 25.541 26.424 -22.495 1.00 15.39 H new ATOM 0 HD3 ARG A 131 24.716 27.609 -21.503 1.00 15.39 H new ATOM 0 HE ARG A 131 26.434 28.886 -23.466 1.00 15.94 H new ATOM 0 HH11 ARG A 131 23.328 27.246 -23.063 1.00 17.08 H new ATOM 0 HH12 ARG A 131 22.571 28.113 -24.404 1.00 17.08 H new ATOM 0 HH21 ARG A 131 25.448 29.996 -25.170 1.00 17.31 H new ATOM 0 HH22 ARG A 131 23.765 29.662 -25.590 1.00 17.31 H new ATOM 2028 N ALA A 132 28.525 23.610 -19.389 1.00 11.89 N ATOM 2029 CA ALA A 132 29.176 22.873 -18.321 1.00 11.80 C ATOM 2030 C ALA A 132 30.622 22.579 -18.684 1.00 11.49 C ATOM 2031 O ALA A 132 30.897 21.986 -19.730 1.00 10.98 O ATOM 2032 CB ALA A 132 28.426 21.581 -18.032 1.00 11.27 C ATOM 0 H ALA A 132 28.852 23.371 -20.325 1.00 11.89 H new ATOM 0 HA ALA A 132 29.164 23.487 -17.420 1.00 11.80 H new ATOM 0 HB1 ALA A 132 28.928 21.041 -17.229 1.00 11.27 H new ATOM 0 HB2 ALA A 132 27.404 21.813 -17.731 1.00 11.27 H new ATOM 0 HB3 ALA A 132 28.408 20.962 -18.929 1.00 11.27 H new ATOM 2038 N PRO A 133 31.571 22.980 -17.818 1.00 11.98 N ATOM 2039 CA PRO A 133 33.005 22.775 -18.053 1.00 11.96 C ATOM 2040 C PRO A 133 33.433 21.324 -17.839 1.00 11.21 C ATOM 2041 O PRO A 133 34.565 21.044 -17.447 1.00 11.39 O ATOM 2042 CB PRO A 133 33.662 23.690 -17.020 1.00 12.84 C ATOM 2043 CG PRO A 133 32.678 23.767 -15.905 1.00 13.32 C ATOM 2044 CD PRO A 133 31.317 23.681 -16.542 1.00 12.82 C ATOM 0 HA PRO A 133 33.287 22.998 -19.082 1.00 11.96 H new ATOM 0 HB2 PRO A 133 34.615 23.284 -16.680 1.00 12.84 H new ATOM 0 HB3 PRO A 133 33.866 24.676 -17.437 1.00 12.84 H new ATOM 0 HG2 PRO A 133 32.828 22.953 -15.196 1.00 13.32 H new ATOM 0 HG3 PRO A 133 32.790 24.698 -15.350 1.00 13.32 H new ATOM 0 HD2 PRO A 133 30.616 23.130 -15.915 1.00 12.82 H new ATOM 0 HD3 PRO A 133 30.889 24.670 -16.707 1.00 12.82 H new ATOM 2052 N ARG A 134 32.519 20.407 -18.108 1.00 10.58 N ATOM 2053 CA ARG A 134 32.779 18.989 -17.951 1.00 10.01 C ATOM 2054 C ARG A 134 33.006 18.347 -19.315 1.00 9.69 C ATOM 2055 O ARG A 134 33.725 17.355 -19.430 1.00 10.21 O ATOM 2056 CB ARG A 134 31.595 18.325 -17.241 1.00 10.03 C ATOM 2057 CG ARG A 134 31.839 16.886 -16.798 1.00 10.19 C ATOM 2058 CD ARG A 134 32.885 16.794 -15.695 1.00 10.81 C ATOM 2059 NE ARG A 134 34.248 16.719 -16.220 1.00 11.15 N ATOM 2060 CZ ARG A 134 35.230 17.557 -15.886 1.00 11.83 C ATOM 2061 NH1 ARG A 134 34.989 18.598 -15.099 1.00 12.25 N ATOM 2062 NH2 ARG A 134 36.454 17.359 -16.349 1.00 12.30 N ATOM 0 H ARG A 134 31.580 20.625 -18.440 1.00 10.58 H new ATOM 0 HA ARG A 134 33.677 18.851 -17.348 1.00 10.01 H new ATOM 0 HB2 ARG A 134 31.334 18.920 -16.366 1.00 10.03 H new ATOM 0 HB3 ARG A 134 30.733 18.344 -17.908 1.00 10.03 H new ATOM 0 HG2 ARG A 134 30.903 16.452 -16.446 1.00 10.19 H new ATOM 0 HG3 ARG A 134 32.163 16.294 -17.654 1.00 10.19 H new ATOM 0 HD2 ARG A 134 32.798 17.663 -15.043 1.00 10.81 H new ATOM 0 HD3 ARG A 134 32.686 15.914 -15.083 1.00 10.81 H new ATOM 0 HE ARG A 134 34.462 15.976 -16.886 1.00 11.15 H new ATOM 0 HH11 ARG A 134 34.047 18.762 -14.745 1.00 12.25 H new ATOM 0 HH12 ARG A 134 35.746 19.234 -14.848 1.00 12.25 H new ATOM 0 HH21 ARG A 134 36.646 16.566 -16.961 1.00 12.30 H new ATOM 0 HH22 ARG A 134 37.206 18.000 -16.094 1.00 12.30 H new ATOM 2076 N LYS A 135 32.423 18.955 -20.348 1.00 9.06 N ATOM 2077 CA LYS A 135 32.438 18.390 -21.693 1.00 9.00 C ATOM 2078 C LYS A 135 33.828 18.477 -22.322 1.00 9.08 C ATOM 2079 O LYS A 135 34.639 17.572 -22.157 1.00 9.30 O ATOM 2080 CB LYS A 135 31.422 19.120 -22.573 1.00 8.75 C ATOM 2081 CG LYS A 135 31.173 18.460 -23.917 1.00 8.95 C ATOM 2082 CD LYS A 135 30.375 19.378 -24.822 1.00 9.28 C ATOM 2083 CE LYS A 135 29.945 18.689 -26.107 1.00 9.72 C ATOM 2084 NZ LYS A 135 31.092 18.368 -26.995 1.00 10.11 N ATOM 0 H LYS A 135 31.931 19.846 -20.275 1.00 9.06 H new ATOM 0 HA LYS A 135 32.169 17.336 -21.619 1.00 9.00 H new ATOM 0 HB2 LYS A 135 30.477 19.190 -22.035 1.00 8.75 H new ATOM 0 HB3 LYS A 135 31.770 20.139 -22.741 1.00 8.75 H new ATOM 0 HG2 LYS A 135 32.124 18.212 -24.388 1.00 8.95 H new ATOM 0 HG3 LYS A 135 30.635 17.523 -23.774 1.00 8.95 H new ATOM 0 HD2 LYS A 135 29.493 19.732 -24.289 1.00 9.28 H new ATOM 0 HD3 LYS A 135 30.974 20.255 -25.066 1.00 9.28 H new ATOM 0 HE2 LYS A 135 29.412 17.770 -25.861 1.00 9.72 H new ATOM 0 HE3 LYS A 135 29.245 19.330 -26.642 1.00 9.72 H new ATOM 0 HZ1 LYS A 135 30.744 17.900 -27.856 1.00 10.11 H new ATOM 0 HZ2 LYS A 135 31.587 19.245 -27.254 1.00 10.11 H new ATOM 0 HZ3 LYS A 135 31.749 17.734 -26.498 1.00 10.11 H new ATOM 2098 N LYS A 136 34.099 19.586 -23.016 1.00 9.17 N ATOM 2099 CA LYS A 136 35.356 19.781 -23.744 1.00 9.54 C ATOM 2100 C LYS A 136 35.606 18.641 -24.732 1.00 9.54 C ATOM 2101 O LYS A 136 36.750 18.370 -25.104 1.00 9.99 O ATOM 2102 CB LYS A 136 36.537 19.876 -22.776 1.00 10.03 C ATOM 2103 CG LYS A 136 36.458 21.022 -21.780 1.00 10.42 C ATOM 2104 CD LYS A 136 35.759 20.621 -20.481 1.00 10.60 C ATOM 2105 CE LYS A 136 36.603 19.675 -19.627 1.00 11.32 C ATOM 2106 NZ LYS A 136 36.386 18.235 -19.958 1.00 11.69 N ATOM 0 H LYS A 136 33.454 20.373 -23.089 1.00 9.17 H new ATOM 0 HA LYS A 136 35.267 20.716 -24.297 1.00 9.54 H new ATOM 0 HB2 LYS A 136 36.612 18.939 -22.224 1.00 10.03 H new ATOM 0 HB3 LYS A 136 37.455 19.979 -23.355 1.00 10.03 H new ATOM 0 HG2 LYS A 136 37.465 21.373 -21.554 1.00 10.42 H new ATOM 0 HG3 LYS A 136 35.924 21.857 -22.233 1.00 10.42 H new ATOM 0 HD2 LYS A 136 35.529 21.517 -19.905 1.00 10.60 H new ATOM 0 HD3 LYS A 136 34.809 20.142 -20.717 1.00 10.60 H new ATOM 0 HE2 LYS A 136 37.657 19.917 -19.761 1.00 11.32 H new ATOM 0 HE3 LYS A 136 36.369 19.839 -18.575 1.00 11.32 H new ATOM 0 HZ1 LYS A 136 36.892 17.641 -19.271 1.00 11.69 H new ATOM 0 HZ2 LYS A 136 35.369 18.019 -19.920 1.00 11.69 H new ATOM 0 HZ3 LYS A 136 36.745 18.041 -20.914 1.00 11.69 H new ATOM 2120 N GLY A 137 34.530 17.989 -25.157 1.00 9.28 N ATOM 2121 CA GLY A 137 34.645 16.781 -25.956 1.00 9.53 C ATOM 2122 C GLY A 137 35.159 15.620 -25.130 1.00 9.53 C ATOM 2123 O GLY A 137 34.456 14.636 -24.904 1.00 9.44 O ATOM 0 H GLY A 137 33.572 18.278 -24.961 1.00 9.28 H new ATOM 0 HA2 GLY A 137 33.672 16.527 -26.377 1.00 9.53 H new ATOM 0 HA3 GLY A 137 35.319 16.960 -26.794 1.00 9.53 H new ATOM 2127 N CYS A 138 36.389 15.756 -24.674 1.00 9.89 N ATOM 2128 CA CYS A 138 37.001 14.797 -23.784 1.00 10.22 C ATOM 2129 C CYS A 138 36.670 15.150 -22.340 1.00 9.92 C ATOM 2130 O CYS A 138 37.042 16.220 -21.856 1.00 9.94 O ATOM 2131 CB CYS A 138 38.509 14.826 -23.986 1.00 11.12 C ATOM 2132 SG CYS A 138 39.039 14.468 -25.672 1.00 12.01 S ATOM 0 H CYS A 138 36.993 16.542 -24.914 1.00 9.89 H new ATOM 0 HA CYS A 138 36.619 13.799 -24.001 1.00 10.22 H new ATOM 0 HB2 CYS A 138 38.883 15.809 -23.701 1.00 11.12 H new ATOM 0 HB3 CYS A 138 38.968 14.103 -23.312 1.00 11.12 H new ATOM 2137 N TRP A 139 35.965 14.260 -21.655 1.00 9.89 N ATOM 2138 CA TRP A 139 35.588 14.504 -20.270 1.00 9.90 C ATOM 2139 C TRP A 139 36.814 14.451 -19.369 1.00 10.86 C ATOM 2140 O TRP A 139 36.921 15.210 -18.404 1.00 11.32 O ATOM 2141 CB TRP A 139 34.543 13.490 -19.802 1.00 9.65 C ATOM 2142 CG TRP A 139 33.236 13.587 -20.532 1.00 9.03 C ATOM 2143 CD1 TRP A 139 32.430 14.686 -20.632 1.00 8.51 C ATOM 2144 CD2 TRP A 139 32.570 12.537 -21.244 1.00 9.20 C ATOM 2145 NE1 TRP A 139 31.312 14.385 -21.372 1.00 8.35 N ATOM 2146 CE2 TRP A 139 31.373 13.073 -21.758 1.00 8.78 C ATOM 2147 CE3 TRP A 139 32.872 11.196 -21.502 1.00 9.91 C ATOM 2148 CZ2 TRP A 139 30.481 12.315 -22.511 1.00 9.11 C ATOM 2149 CZ3 TRP A 139 31.984 10.446 -22.249 1.00 10.19 C ATOM 2150 CH2 TRP A 139 30.803 11.006 -22.749 1.00 9.81 C ATOM 0 H TRP A 139 35.644 13.368 -22.033 1.00 9.89 H new ATOM 0 HA TRP A 139 35.149 15.500 -20.209 1.00 9.90 H new ATOM 0 HB2 TRP A 139 34.945 12.484 -19.927 1.00 9.65 H new ATOM 0 HB3 TRP A 139 34.365 13.632 -18.736 1.00 9.65 H new ATOM 0 HD1 TRP A 139 32.641 15.650 -20.194 1.00 8.51 H new ATOM 0 HE1 TRP A 139 30.558 15.034 -21.597 1.00 8.35 H new ATOM 0 HE3 TRP A 139 33.783 10.755 -21.124 1.00 9.91 H new ATOM 0 HZ2 TRP A 139 29.567 12.744 -22.894 1.00 9.11 H new ATOM 0 HZ3 TRP A 139 32.205 9.408 -22.451 1.00 10.19 H new ATOM 0 HH2 TRP A 139 30.133 10.394 -23.334 1.00 9.81 H new ATOM 2161 N LYS A 140 37.737 13.559 -19.704 1.00 11.35 N ATOM 2162 CA LYS A 140 38.970 13.384 -18.949 1.00 12.41 C ATOM 2163 C LYS A 140 40.100 14.160 -19.612 1.00 12.91 C ATOM 2164 O LYS A 140 40.784 14.966 -18.983 1.00 13.52 O ATOM 2165 CB LYS A 140 39.314 11.903 -18.907 1.00 13.04 C ATOM 2166 CG LYS A 140 40.474 11.550 -17.994 1.00 14.05 C ATOM 2167 CD LYS A 140 40.831 10.081 -18.121 1.00 14.34 C ATOM 2168 CE LYS A 140 41.948 9.687 -17.169 1.00 15.50 C ATOM 2169 NZ LYS A 140 42.313 8.253 -17.306 1.00 16.11 N ATOM 0 H LYS A 140 37.652 12.936 -20.507 1.00 11.35 H new ATOM 0 HA LYS A 140 38.837 13.761 -17.935 1.00 12.41 H new ATOM 0 HB2 LYS A 140 38.433 11.348 -18.585 1.00 13.04 H new ATOM 0 HB3 LYS A 140 39.549 11.569 -19.918 1.00 13.04 H new ATOM 0 HG2 LYS A 140 41.340 12.162 -18.245 1.00 14.05 H new ATOM 0 HG3 LYS A 140 40.212 11.777 -16.961 1.00 14.05 H new ATOM 0 HD2 LYS A 140 39.949 9.474 -17.917 1.00 14.34 H new ATOM 0 HD3 LYS A 140 41.135 9.868 -19.146 1.00 14.34 H new ATOM 0 HE2 LYS A 140 42.825 10.305 -17.363 1.00 15.50 H new ATOM 0 HE3 LYS A 140 41.638 9.886 -16.143 1.00 15.50 H new ATOM 0 HZ1 LYS A 140 43.078 8.024 -16.640 1.00 16.11 H new ATOM 0 HZ2 LYS A 140 41.483 7.662 -17.096 1.00 16.11 H new ATOM 0 HZ3 LYS A 140 42.633 8.068 -18.278 1.00 16.11 H new ATOM 2183 N CYS A 141 40.267 13.917 -20.903 1.00 12.82 N ATOM 2184 CA CYS A 141 41.263 14.600 -21.716 1.00 13.44 C ATOM 2185 C CYS A 141 40.769 16.008 -22.083 1.00 13.01 C ATOM 2186 O CYS A 141 41.071 16.548 -23.146 1.00 13.56 O ATOM 2187 CB CYS A 141 41.560 13.741 -22.962 1.00 13.82 C ATOM 2188 SG CYS A 141 42.569 14.522 -24.240 1.00 13.97 S ATOM 0 H CYS A 141 39.711 13.236 -21.420 1.00 12.82 H new ATOM 0 HA CYS A 141 42.191 14.725 -21.159 1.00 13.44 H new ATOM 0 HB2 CYS A 141 42.061 12.829 -22.639 1.00 13.82 H new ATOM 0 HB3 CYS A 141 40.611 13.443 -23.408 1.00 13.82 H new ATOM 2193 N GLY A 142 39.966 16.584 -21.200 1.00 12.16 N ATOM 2194 CA GLY A 142 39.452 17.920 -21.420 1.00 11.86 C ATOM 2195 C GLY A 142 40.515 18.981 -21.250 1.00 11.95 C ATOM 2196 O GLY A 142 40.538 19.694 -20.247 1.00 12.26 O ATOM 0 H GLY A 142 39.660 16.147 -20.331 1.00 12.16 H new ATOM 0 HA2 GLY A 142 39.035 17.985 -22.425 1.00 11.86 H new ATOM 0 HA3 GLY A 142 38.636 18.112 -20.723 1.00 11.86 H new ATOM 2200 N LYS A 143 41.403 19.070 -22.221 1.00 11.90 N ATOM 2201 CA LYS A 143 42.449 20.078 -22.212 1.00 12.23 C ATOM 2202 C LYS A 143 41.888 21.399 -22.734 1.00 11.90 C ATOM 2203 O LYS A 143 41.643 22.329 -21.965 1.00 11.44 O ATOM 2204 CB LYS A 143 43.631 19.607 -23.066 1.00 13.11 C ATOM 2205 CG LYS A 143 44.876 20.474 -22.957 1.00 13.82 C ATOM 2206 CD LYS A 143 45.991 19.935 -23.840 1.00 14.46 C ATOM 2207 CE LYS A 143 47.261 20.759 -23.716 1.00 15.30 C ATOM 2208 NZ LYS A 143 47.873 20.650 -22.363 1.00 15.88 N ATOM 0 H LYS A 143 41.422 18.452 -23.032 1.00 11.90 H new ATOM 0 HA LYS A 143 42.805 20.231 -21.193 1.00 12.23 H new ATOM 0 HB2 LYS A 143 43.888 18.588 -22.777 1.00 13.11 H new ATOM 0 HB3 LYS A 143 43.318 19.573 -24.109 1.00 13.11 H new ATOM 0 HG2 LYS A 143 44.638 21.497 -23.248 1.00 13.82 H new ATOM 0 HG3 LYS A 143 45.211 20.507 -21.920 1.00 13.82 H new ATOM 0 HD2 LYS A 143 46.201 18.901 -23.568 1.00 14.46 H new ATOM 0 HD3 LYS A 143 45.661 19.931 -24.879 1.00 14.46 H new ATOM 0 HE2 LYS A 143 47.980 20.430 -24.466 1.00 15.30 H new ATOM 0 HE3 LYS A 143 47.036 21.804 -23.928 1.00 15.30 H new ATOM 0 HZ1 LYS A 143 48.810 21.101 -22.369 1.00 15.88 H new ATOM 0 HZ2 LYS A 143 47.264 21.126 -21.667 1.00 15.88 H new ATOM 0 HZ3 LYS A 143 47.973 19.647 -22.107 1.00 15.88 H new ATOM 2222 N GLU A 144 41.667 21.467 -24.042 1.00 12.31 N ATOM 2223 CA GLU A 144 41.064 22.645 -24.649 1.00 12.29 C ATOM 2224 C GLU A 144 39.705 22.307 -25.263 1.00 12.31 C ATOM 2225 O GLU A 144 38.787 23.129 -25.269 1.00 12.33 O ATOM 2226 CB GLU A 144 41.996 23.233 -25.712 1.00 13.02 C ATOM 2227 CG GLU A 144 41.460 24.500 -26.356 1.00 13.41 C ATOM 2228 CD GLU A 144 42.420 25.098 -27.359 1.00 13.89 C ATOM 2229 OE1 GLU A 144 42.377 24.691 -28.538 1.00 14.11 O ATOM 2230 OE2 GLU A 144 43.228 25.971 -26.972 1.00 14.20 O ATOM 0 H GLU A 144 41.896 20.722 -24.700 1.00 12.31 H new ATOM 0 HA GLU A 144 40.910 23.389 -23.867 1.00 12.29 H new ATOM 0 HB2 GLU A 144 42.963 23.448 -25.257 1.00 13.02 H new ATOM 0 HB3 GLU A 144 42.167 22.486 -26.487 1.00 13.02 H new ATOM 0 HG2 GLU A 144 40.515 24.278 -26.852 1.00 13.41 H new ATOM 0 HG3 GLU A 144 41.248 25.235 -25.580 1.00 13.41 H new ATOM 2237 N GLY A 145 39.583 21.090 -25.776 1.00 12.50 N ATOM 2238 CA GLY A 145 38.343 20.664 -26.394 1.00 12.76 C ATOM 2239 C GLY A 145 38.593 19.894 -27.670 1.00 12.89 C ATOM 2240 O GLY A 145 38.841 20.484 -28.718 1.00 13.35 O ATOM 0 H GLY A 145 40.323 20.388 -25.775 1.00 12.50 H new ATOM 0 HA2 GLY A 145 37.783 20.041 -25.696 1.00 12.76 H new ATOM 0 HA3 GLY A 145 37.725 21.536 -26.610 1.00 12.76 H new ATOM 2244 N HIS A 146 38.537 18.574 -27.583 1.00 12.67 N ATOM 2245 CA HIS A 146 38.850 17.721 -28.725 1.00 12.99 C ATOM 2246 C HIS A 146 37.785 16.648 -28.885 1.00 12.58 C ATOM 2247 O HIS A 146 36.803 16.615 -28.143 1.00 11.92 O ATOM 2248 CB HIS A 146 40.209 17.020 -28.552 1.00 13.11 C ATOM 2249 CG HIS A 146 41.133 17.644 -27.549 1.00 13.73 C ATOM 2250 ND1 HIS A 146 41.280 17.113 -26.294 1.00 13.78 N ATOM 2251 CD2 HIS A 146 41.949 18.717 -27.672 1.00 14.46 C ATOM 2252 CE1 HIS A 146 42.182 17.853 -25.685 1.00 14.54 C ATOM 2253 NE2 HIS A 146 42.619 18.848 -26.479 1.00 14.96 N ATOM 0 H HIS A 146 38.278 18.068 -26.736 1.00 12.67 H new ATOM 0 HA HIS A 146 38.886 18.364 -29.605 1.00 12.99 H new ATOM 0 HB2 HIS A 146 40.030 15.985 -28.261 1.00 13.11 H new ATOM 0 HB3 HIS A 146 40.712 16.997 -29.519 1.00 13.11 H new ATOM 0 HD2 HIS A 146 42.054 19.349 -28.541 1.00 14.46 H new ATOM 0 HE1 HIS A 146 42.528 17.683 -24.676 1.00 14.54 H new ATOM 0 HE2 HIS A 146 43.311 19.559 -26.242 1.00 14.96 H new ATOM 2261 N GLN A 147 37.983 15.784 -29.865 1.00 13.15 N ATOM 2262 CA GLN A 147 37.158 14.599 -30.027 1.00 13.06 C ATOM 2263 C GLN A 147 37.721 13.470 -29.177 1.00 12.82 C ATOM 2264 O GLN A 147 38.847 13.016 -29.396 1.00 13.08 O ATOM 2265 CB GLN A 147 37.109 14.176 -31.493 1.00 14.01 C ATOM 2266 CG GLN A 147 36.499 15.217 -32.414 1.00 14.38 C ATOM 2267 CD GLN A 147 36.426 14.742 -33.851 1.00 14.79 C ATOM 2268 OE1 GLN A 147 36.282 13.549 -34.117 1.00 14.85 O ATOM 2269 NE2 GLN A 147 36.538 15.668 -34.788 1.00 15.24 N ATOM 0 H GLN A 147 38.716 15.883 -30.568 1.00 13.15 H new ATOM 0 HA GLN A 147 36.143 14.827 -29.702 1.00 13.06 H new ATOM 0 HB2 GLN A 147 38.121 13.955 -31.831 1.00 14.01 H new ATOM 0 HB3 GLN A 147 36.536 13.252 -31.575 1.00 14.01 H new ATOM 0 HG2 GLN A 147 35.497 15.465 -32.065 1.00 14.38 H new ATOM 0 HG3 GLN A 147 37.089 16.132 -32.366 1.00 14.38 H new ATOM 0 HE21 GLN A 147 36.656 16.647 -34.526 1.00 15.24 H new ATOM 0 HE22 GLN A 147 36.506 15.404 -35.773 1.00 15.24 H new ATOM 2278 N MET A 148 36.930 13.023 -28.210 1.00 12.52 N ATOM 2279 CA MET A 148 37.364 12.016 -27.243 1.00 12.47 C ATOM 2280 C MET A 148 37.807 10.724 -27.925 1.00 13.37 C ATOM 2281 O MET A 148 38.696 10.028 -27.433 1.00 13.85 O ATOM 2282 CB MET A 148 36.233 11.718 -26.256 1.00 11.69 C ATOM 2283 CG MET A 148 36.629 10.757 -25.145 1.00 11.72 C ATOM 2284 SD MET A 148 35.260 10.373 -24.039 1.00 11.68 S ATOM 2285 CE MET A 148 36.073 9.303 -22.857 1.00 11.96 C ATOM 0 H MET A 148 35.972 13.345 -28.072 1.00 12.52 H new ATOM 0 HA MET A 148 38.223 12.422 -26.709 1.00 12.47 H new ATOM 0 HB2 MET A 148 35.895 12.654 -25.811 1.00 11.69 H new ATOM 0 HB3 MET A 148 35.387 11.300 -26.802 1.00 11.69 H new ATOM 0 HG2 MET A 148 37.005 9.834 -25.586 1.00 11.72 H new ATOM 0 HG3 MET A 148 37.446 11.191 -24.569 1.00 11.72 H new ATOM 0 HE1 MET A 148 35.354 8.980 -22.104 1.00 11.96 H new ATOM 0 HE2 MET A 148 36.475 8.431 -23.372 1.00 11.96 H new ATOM 0 HE3 MET A 148 36.885 9.846 -22.374 1.00 11.96 H new ATOM 2295 N LYS A 149 37.186 10.401 -29.052 1.00 13.75 N ATOM 2296 CA LYS A 149 37.512 9.191 -29.786 1.00 14.74 C ATOM 2297 C LYS A 149 38.840 9.320 -30.532 1.00 15.59 C ATOM 2298 O LYS A 149 39.567 8.338 -30.691 1.00 16.38 O ATOM 2299 CB LYS A 149 36.385 8.892 -30.761 1.00 15.07 C ATOM 2300 CG LYS A 149 35.054 8.644 -30.074 1.00 14.89 C ATOM 2301 CD LYS A 149 33.908 8.722 -31.058 1.00 14.96 C ATOM 2302 CE LYS A 149 32.653 8.058 -30.514 1.00 15.59 C ATOM 2303 NZ LYS A 149 31.517 8.147 -31.469 1.00 15.96 N ATOM 0 H LYS A 149 36.450 10.965 -29.477 1.00 13.75 H new ATOM 0 HA LYS A 149 37.623 8.371 -29.076 1.00 14.74 H new ATOM 0 HB2 LYS A 149 36.280 9.728 -31.453 1.00 15.07 H new ATOM 0 HB3 LYS A 149 36.649 8.017 -31.355 1.00 15.07 H new ATOM 0 HG2 LYS A 149 35.064 7.663 -29.600 1.00 14.89 H new ATOM 0 HG3 LYS A 149 34.908 9.379 -29.282 1.00 14.89 H new ATOM 0 HD2 LYS A 149 33.697 9.766 -31.288 1.00 14.96 H new ATOM 0 HD3 LYS A 149 34.198 8.242 -31.993 1.00 14.96 H new ATOM 0 HE2 LYS A 149 32.862 7.011 -30.296 1.00 15.59 H new ATOM 0 HE3 LYS A 149 32.373 8.530 -29.572 1.00 15.59 H new ATOM 0 HZ1 LYS A 149 30.682 7.682 -31.059 1.00 15.96 H new ATOM 0 HZ2 LYS A 149 31.300 9.146 -31.658 1.00 15.96 H new ATOM 0 HZ3 LYS A 149 31.774 7.675 -32.359 1.00 15.96 H new ATOM 2317 N ASP A 150 39.163 10.532 -30.975 1.00 15.52 N ATOM 2318 CA ASP A 150 40.387 10.758 -31.742 1.00 16.41 C ATOM 2319 C ASP A 150 41.591 10.881 -30.817 1.00 16.34 C ATOM 2320 O ASP A 150 42.724 10.630 -31.218 1.00 17.13 O ATOM 2321 CB ASP A 150 40.256 12.020 -32.604 1.00 16.67 C ATOM 2322 CG ASP A 150 41.543 12.380 -33.332 1.00 17.24 C ATOM 2323 OD1 ASP A 150 41.790 11.833 -34.429 1.00 17.41 O ATOM 2324 OD2 ASP A 150 42.306 13.224 -32.816 1.00 17.63 O ATOM 0 H ASP A 150 38.600 11.368 -30.818 1.00 15.52 H new ATOM 0 HA ASP A 150 40.539 9.899 -32.396 1.00 16.41 H new ATOM 0 HB2 ASP A 150 39.461 11.873 -33.335 1.00 16.67 H new ATOM 0 HB3 ASP A 150 39.957 12.856 -31.971 1.00 16.67 H new ATOM 2329 N CYS A 151 41.341 11.238 -29.569 1.00 15.51 N ATOM 2330 CA CYS A 151 42.413 11.358 -28.598 1.00 15.54 C ATOM 2331 C CYS A 151 42.781 10.005 -28.015 1.00 15.97 C ATOM 2332 O CYS A 151 41.984 9.376 -27.319 1.00 15.64 O ATOM 2333 CB CYS A 151 42.022 12.291 -27.460 1.00 14.63 C ATOM 2334 SG CYS A 151 41.960 14.040 -27.885 1.00 14.46 S ATOM 0 H CYS A 151 40.411 11.448 -29.207 1.00 15.51 H new ATOM 0 HA CYS A 151 43.273 11.770 -29.126 1.00 15.54 H new ATOM 0 HB2 CYS A 151 41.044 11.990 -27.085 1.00 14.63 H new ATOM 0 HB3 CYS A 151 42.731 12.158 -26.643 1.00 14.63 H new ATOM 2339 N THR A 152 43.986 9.560 -28.306 1.00 16.85 N ATOM 2340 CA THR A 152 44.536 8.396 -27.651 1.00 17.48 C ATOM 2341 C THR A 152 45.229 8.844 -26.371 1.00 17.79 C ATOM 2342 O THR A 152 46.106 9.707 -26.412 1.00 18.21 O ATOM 2343 CB THR A 152 45.538 7.674 -28.571 1.00 18.43 C ATOM 2344 OG1 THR A 152 44.933 7.436 -29.850 1.00 18.64 O ATOM 2345 CG2 THR A 152 45.986 6.354 -27.961 1.00 18.95 C ATOM 0 H THR A 152 44.603 9.990 -28.995 1.00 16.85 H new ATOM 0 HA THR A 152 43.733 7.697 -27.418 1.00 17.48 H new ATOM 0 HB THR A 152 46.415 8.310 -28.691 1.00 18.43 H new ATOM 0 HG1 THR A 152 45.573 6.978 -30.434 1.00 18.64 H new ATOM 0 HG21 THR A 152 46.693 5.865 -28.631 1.00 18.95 H new ATOM 0 HG22 THR A 152 46.466 6.541 -27.001 1.00 18.95 H new ATOM 0 HG23 THR A 152 45.120 5.709 -27.814 1.00 18.95 H new ATOM 2353 N GLU A 153 44.802 8.297 -25.238 1.00 17.71 N ATOM 2354 CA GLU A 153 45.344 8.698 -23.943 1.00 18.13 C ATOM 2355 C GLU A 153 46.858 8.530 -23.893 1.00 19.12 C ATOM 2356 O GLU A 153 47.400 7.528 -24.364 1.00 19.35 O ATOM 2357 CB GLU A 153 44.690 7.905 -22.813 1.00 17.70 C ATOM 2358 CG GLU A 153 43.228 8.251 -22.590 1.00 17.60 C ATOM 2359 CD GLU A 153 43.014 9.724 -22.294 1.00 17.59 C ATOM 2360 OE1 GLU A 153 43.764 10.281 -21.469 1.00 17.64 O ATOM 2361 OE2 GLU A 153 42.087 10.328 -22.878 1.00 17.65 O ATOM 0 H GLU A 153 44.083 7.575 -25.189 1.00 17.71 H new ATOM 0 HA GLU A 153 45.117 9.756 -23.809 1.00 18.13 H new ATOM 0 HB2 GLU A 153 44.773 6.841 -23.033 1.00 17.70 H new ATOM 0 HB3 GLU A 153 45.241 8.083 -21.890 1.00 17.70 H new ATOM 0 HG2 GLU A 153 42.654 7.975 -23.475 1.00 17.60 H new ATOM 0 HG3 GLU A 153 42.841 7.658 -21.762 1.00 17.60 H new ATOM 2368 N ARG A 154 47.519 9.534 -23.326 1.00 19.80 N ATOM 2369 CA ARG A 154 48.970 9.561 -23.190 1.00 20.84 C ATOM 2370 C ARG A 154 49.652 9.529 -24.558 1.00 21.28 C ATOM 2371 O ARG A 154 50.357 8.576 -24.901 1.00 21.68 O ATOM 2372 CB ARG A 154 49.470 8.409 -22.307 1.00 21.38 C ATOM 2373 CG ARG A 154 50.927 8.553 -21.888 1.00 21.89 C ATOM 2374 CD ARG A 154 51.161 9.865 -21.153 1.00 22.33 C ATOM 2375 NE ARG A 154 52.544 10.023 -20.718 1.00 22.67 N ATOM 2376 CZ ARG A 154 52.993 11.083 -20.048 1.00 23.08 C ATOM 2377 NH1 ARG A 154 52.168 12.076 -19.740 1.00 23.21 N ATOM 2378 NH2 ARG A 154 54.265 11.149 -19.686 1.00 23.48 N ATOM 0 H ARG A 154 47.057 10.360 -22.944 1.00 19.80 H new ATOM 0 HA ARG A 154 49.235 10.498 -22.700 1.00 20.84 H new ATOM 0 HB2 ARG A 154 48.848 8.350 -21.414 1.00 21.38 H new ATOM 0 HB3 ARG A 154 49.346 7.469 -22.845 1.00 21.38 H new ATOM 0 HG2 ARG A 154 51.208 7.718 -21.246 1.00 21.89 H new ATOM 0 HG3 ARG A 154 51.568 8.507 -22.769 1.00 21.89 H new ATOM 0 HD2 ARG A 154 50.891 10.696 -21.805 1.00 22.33 H new ATOM 0 HD3 ARG A 154 50.503 9.914 -20.285 1.00 22.33 H new ATOM 0 HE ARG A 154 53.206 9.279 -20.940 1.00 22.67 H new ATOM 0 HH11 ARG A 154 51.187 12.029 -20.016 1.00 23.21 H new ATOM 0 HH12 ARG A 154 52.515 12.886 -19.227 1.00 23.21 H new ATOM 0 HH21 ARG A 154 54.902 10.388 -19.920 1.00 23.48 H new ATOM 0 HH22 ARG A 154 54.608 11.961 -19.173 1.00 23.48 H new ATOM 2392 N GLN A 155 49.409 10.569 -25.340 1.00 21.32 N ATOM 2393 CA GLN A 155 50.083 10.755 -26.616 1.00 21.85 C ATOM 2394 C GLN A 155 50.499 12.209 -26.775 1.00 22.14 C ATOM 2395 O GLN A 155 49.688 13.119 -26.592 1.00 22.34 O ATOM 2396 CB GLN A 155 49.185 10.334 -27.783 1.00 21.93 C ATOM 2397 CG GLN A 155 49.084 8.829 -27.973 1.00 22.12 C ATOM 2398 CD GLN A 155 50.394 8.207 -28.418 1.00 22.30 C ATOM 2399 OE1 GLN A 155 50.664 8.089 -29.614 1.00 22.37 O ATOM 2400 NE2 GLN A 155 51.218 7.810 -27.464 1.00 22.51 N ATOM 0 H GLN A 155 48.742 11.305 -25.110 1.00 21.32 H new ATOM 0 HA GLN A 155 50.970 10.122 -26.628 1.00 21.85 H new ATOM 0 HB2 GLN A 155 48.185 10.738 -27.623 1.00 21.93 H new ATOM 0 HB3 GLN A 155 49.566 10.781 -28.701 1.00 21.93 H new ATOM 0 HG2 GLN A 155 48.767 8.369 -27.037 1.00 22.12 H new ATOM 0 HG3 GLN A 155 48.313 8.611 -28.712 1.00 22.12 H new ATOM 0 HE21 GLN A 155 50.958 7.925 -26.485 1.00 22.51 H new ATOM 0 HE22 GLN A 155 52.114 7.388 -27.707 1.00 22.51 H new ATOM 2409 N ALA A 156 51.762 12.420 -27.101 1.00 22.27 N ATOM 2410 CA ALA A 156 52.294 13.763 -27.261 1.00 22.67 C ATOM 2411 C ALA A 156 52.759 13.989 -28.692 1.00 23.02 C ATOM 2412 O ALA A 156 53.934 14.271 -28.944 1.00 23.30 O ATOM 2413 CB ALA A 156 53.437 13.994 -26.281 1.00 22.74 C ATOM 0 H ALA A 156 52.441 11.676 -27.261 1.00 22.27 H new ATOM 0 HA ALA A 156 51.501 14.480 -27.046 1.00 22.67 H new ATOM 0 HB1 ALA A 156 53.828 15.003 -26.410 1.00 22.74 H new ATOM 0 HB2 ALA A 156 53.072 13.874 -25.261 1.00 22.74 H new ATOM 0 HB3 ALA A 156 54.230 13.271 -26.470 1.00 22.74 H new ATOM 2419 N ASN A 157 51.834 13.855 -29.631 1.00 23.11 N ATOM 2420 CA ASN A 157 52.141 14.033 -31.043 1.00 23.57 C ATOM 2421 C ASN A 157 51.010 14.779 -31.741 1.00 23.76 C ATOM 2422 O ASN A 157 51.134 16.004 -31.936 1.00 23.91 O ATOM 2423 CB ASN A 157 52.364 12.679 -31.717 1.00 23.80 C ATOM 2424 CG ASN A 157 52.718 12.813 -33.185 1.00 23.98 C ATOM 2425 OD1 ASN A 157 53.346 13.788 -33.598 1.00 23.92 O ATOM 2426 ND2 ASN A 157 52.322 11.833 -33.980 1.00 24.30 N ATOM 2427 OXT ASN A 157 49.988 14.143 -32.068 1.00 23.85 O ATOM 0 H ASN A 157 50.860 13.622 -29.439 1.00 23.11 H new ATOM 0 HA ASN A 157 53.056 14.620 -31.123 1.00 23.57 H new ATOM 0 HB2 ASN A 157 53.163 12.147 -31.201 1.00 23.80 H new ATOM 0 HB3 ASN A 157 51.463 12.074 -31.618 1.00 23.80 H new ATOM 0 HD21 ASN A 157 52.535 11.867 -34.977 1.00 24.30 H new ATOM 0 HD22 ASN A 157 51.804 11.043 -33.596 1.00 24.30 H new TER 2434 ASN A 157 HETATM 2435 ZN ZN A 201 23.873 19.134 -18.954 1.00 9.38 ZN HETATM 2436 ZN ZN A 202 41.219 15.128 -26.009 1.00 13.43 ZN