USER MOD reduce.3.24.130724 H: found=0, std=0, add=1124, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1124 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 147 THR OG1 : rot 166:sc= 1.38 USER MOD Set 1.2: A 151 ASN : amide:sc= -0.285 X(o=1.1,f=1.2!) USER MOD Set 2.1: A 112 ASN : amide:sc= -1.8! C(o=0.11!,f=-15!) USER MOD Set 2.2: A 150 THR OG1 : rot -38:sc= 0.959 USER MOD Set 2.3: A 152 LYS NZ :NH3+ -177:sc= 0.956 (180deg=-0.0679) USER MOD Set 3.1: A 60 LYS NZ :NH3+ 170:sc= -1.01! (180deg=-1.73!) USER MOD Set 3.2: A 85 THR OG1 : rot 2:sc= 0.159 USER MOD Set 4.1: A 57 THR OG1 : rot -150:sc= 0.23 USER MOD Set 4.2: A 59 LYS NZ :NH3+ 164:sc= 0.162 (180deg=-0.0169) USER MOD Set 5.1: A 53 TYR OH : rot -10:sc= -1.09! USER MOD Set 5.2: A 83 TYR OH : rot 165:sc= 0.404 USER MOD Set 6.1: A 45 ASN : amide:sc= 0 X(o=-0.011,f=0.38) USER MOD Set 6.2: A 46 THR OG1 : rot -150:sc= 0 USER MOD Set 6.3: A 52 ASN : amide:sc= -0.0114 X(o=-0.011,f=0.085) USER MOD Set 7.1: A 34 SER OG : rot 105:sc= 1.22 USER MOD Set 7.2: A 36 SER OG : rot -127:sc= 1.04 USER MOD Single : A 1 MET CE :methyl -146:sc= -0.166 (180deg=-0.759) USER MOD Single : A 1 MET N :NH3+ -171:sc= 0 (180deg=-0.115) USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 4 SER OG : rot -164:sc= 0.339 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.0662 K(o=-0.066,f=-1.9!) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot -145:sc= 0.279 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 13 ASN : amide:sc=-0.00668 K(o=-0.0067,f=-1.2) USER MOD Single : A 16 SER OG : rot 76:sc= 1.09 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -165:sc= 0.513 USER MOD Single : A 23 SER OG : rot -92:sc= 1.31 USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 29 TYR OH : rot 130:sc= -0.0555 USER MOD Single : A 32 GLN : amide:sc= -0.0887 X(o=-0.089,f=-0.16) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= -0.0244 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot -49:sc= 0.153 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0203 USER MOD Single : A 58 ASN : amide:sc= 0.202 K(o=0.2,f=-7.6!) USER MOD Single : A 62 THR OG1 : rot -149:sc= -3.41! USER MOD Single : A 63 ASN : amide:sc= -1.76 K(o=-1.8,f=-0.25) USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 ASN : amide:sc= -0.906 K(o=-0.91,f=0) USER MOD Single : A 76 ASN : amide:sc= -2.47! C(o=-2.5!,f=-8.8!) USER MOD Single : A 77 ASN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 42:sc= -1.65! USER MOD Single : A 91 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0309) USER MOD Single : A 96 SER OG : rot 66:sc= 1.24 USER MOD Single : A 99 THR OG1 : rot 8:sc= 0.996 USER MOD Single : A 101 ASN : amide:sc= -1.3 K(o=-1.3,f=-0.013) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 3:sc= -0.301 USER MOD Single : A 107 LYS NZ :NH3+ -169:sc= 0.933 (180deg=0.895) USER MOD Single : A 109 TYR OH : rot 180:sc= -0.421 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 1.06 K(o=1.1,f=-0.2) USER MOD Single : A 118 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.0459 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=-0.00011) USER MOD Single : A 125 SER OG : rot 180:sc=-0.00784 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ -109:sc= -2.83! (180deg=-5.35!) USER MOD Single : A 132 SER OG : rot -28:sc= 0.274 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot 75:sc= 1.39 USER MOD Single : A 142 THR OG1 : rot 66:sc= 0.244 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 ASN : amide:sc= 0.0344 X(o=0.034,f=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 154 THR OG1 : rot -124:sc= 0.56 USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl -165:sc= 0 (180deg=-0.0883) USER MOD Single : A 158 LYS NZ :NH3+ -154:sc= 1.26 (180deg=0.532) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.462 -10.370 8.427 1.00 7.47 N ATOM 2 CA MET A 1 -17.871 -9.972 8.656 1.00 7.05 C ATOM 3 C MET A 1 -18.571 -9.692 7.336 1.00 6.18 C ATOM 4 O MET A 1 -19.695 -10.136 7.110 1.00 6.26 O ATOM 5 CB MET A 1 -17.951 -8.706 9.521 1.00 7.58 C ATOM 6 CG MET A 1 -17.326 -8.832 10.900 1.00 8.43 C ATOM 7 SD MET A 1 -17.529 -7.329 11.882 1.00 9.37 S ATOM 8 CE MET A 1 -16.706 -6.122 10.839 1.00 9.99 C ATOM 0 H1 MET A 1 -16.046 -10.703 9.320 1.00 7.47 H new ATOM 0 H2 MET A 1 -16.427 -11.134 7.723 1.00 7.47 H new ATOM 0 H3 MET A 1 -15.923 -9.552 8.077 1.00 7.47 H new ATOM 0 HA MET A 1 -18.361 -10.799 9.170 1.00 7.05 H new ATOM 0 HB2 MET A 1 -17.462 -7.889 8.990 1.00 7.58 H new ATOM 0 HB3 MET A 1 -18.999 -8.429 9.637 1.00 7.58 H new ATOM 0 HG2 MET A 1 -17.779 -9.672 11.427 1.00 8.43 H new ATOM 0 HG3 MET A 1 -16.264 -9.056 10.797 1.00 8.43 H new ATOM 0 HE1 MET A 1 -16.216 -5.375 11.464 1.00 9.99 H new ATOM 0 HE2 MET A 1 -15.961 -6.623 10.221 1.00 9.99 H new ATOM 0 HE3 MET A 1 -17.440 -5.634 10.198 1.00 9.99 H new ATOM 20 N GLU A 2 -17.897 -8.966 6.460 1.00 5.66 N ATOM 21 CA GLU A 2 -18.523 -8.451 5.255 1.00 5.12 C ATOM 22 C GLU A 2 -18.290 -9.363 4.055 1.00 4.18 C ATOM 23 O GLU A 2 -17.195 -9.901 3.863 1.00 4.52 O ATOM 24 CB GLU A 2 -17.965 -7.065 4.944 1.00 5.99 C ATOM 25 CG GLU A 2 -18.849 -6.247 4.027 1.00 6.56 C ATOM 26 CD GLU A 2 -19.988 -5.593 4.773 1.00 7.11 C ATOM 27 OE1 GLU A 2 -19.775 -4.533 5.394 1.00 7.54 O ATOM 28 OE2 GLU A 2 -21.105 -6.141 4.737 1.00 7.34 O ATOM 0 H GLU A 2 -16.913 -8.719 6.562 1.00 5.66 H new ATOM 0 HA GLU A 2 -19.597 -8.401 5.437 1.00 5.12 H new ATOM 0 HB2 GLU A 2 -17.824 -6.522 5.878 1.00 5.99 H new ATOM 0 HB3 GLU A 2 -16.982 -7.173 4.486 1.00 5.99 H new ATOM 0 HG2 GLU A 2 -18.250 -5.480 3.535 1.00 6.56 H new ATOM 0 HG3 GLU A 2 -19.251 -6.889 3.243 1.00 6.56 H new ATOM 35 N GLN A 3 -19.328 -9.526 3.250 1.00 3.35 N ATOM 36 CA GLN A 3 -19.217 -10.211 1.973 1.00 2.68 C ATOM 37 C GLN A 3 -19.264 -9.176 0.856 1.00 1.97 C ATOM 38 O GLN A 3 -20.335 -8.796 0.386 1.00 2.24 O ATOM 39 CB GLN A 3 -20.337 -11.237 1.802 1.00 2.90 C ATOM 40 CG GLN A 3 -20.275 -12.381 2.803 1.00 3.57 C ATOM 41 CD GLN A 3 -21.444 -13.337 2.664 1.00 4.03 C ATOM 42 OE1 GLN A 3 -22.542 -12.940 2.278 1.00 4.48 O ATOM 43 NE2 GLN A 3 -21.216 -14.606 2.966 1.00 4.40 N ATOM 0 H GLN A 3 -20.267 -9.189 3.462 1.00 3.35 H new ATOM 0 HA GLN A 3 -18.271 -10.751 1.935 1.00 2.68 H new ATOM 0 HB2 GLN A 3 -21.298 -10.732 1.899 1.00 2.90 H new ATOM 0 HB3 GLN A 3 -20.292 -11.646 0.793 1.00 2.90 H new ATOM 0 HG2 GLN A 3 -19.343 -12.929 2.666 1.00 3.57 H new ATOM 0 HG3 GLN A 3 -20.260 -11.975 3.814 1.00 3.57 H new ATOM 0 HE21 GLN A 3 -20.291 -14.897 3.283 1.00 4.40 H new ATOM 0 HE22 GLN A 3 -21.965 -15.293 2.882 1.00 4.40 H new ATOM 52 N SER A 4 -18.091 -8.711 0.458 1.00 1.43 N ATOM 53 CA SER A 4 -17.968 -7.592 -0.465 1.00 0.82 C ATOM 54 C SER A 4 -18.131 -8.022 -1.933 1.00 0.93 C ATOM 55 O SER A 4 -17.805 -7.256 -2.842 1.00 1.64 O ATOM 56 CB SER A 4 -16.604 -6.926 -0.252 1.00 0.60 C ATOM 57 OG SER A 4 -16.376 -6.654 1.122 1.00 1.23 O ATOM 0 H SER A 4 -17.198 -9.097 0.764 1.00 1.43 H new ATOM 0 HA SER A 4 -18.772 -6.886 -0.257 1.00 0.82 H new ATOM 0 HB2 SER A 4 -15.816 -7.575 -0.633 1.00 0.60 H new ATOM 0 HB3 SER A 4 -16.556 -5.998 -0.822 1.00 0.60 H new ATOM 0 HG SER A 4 -15.639 -6.015 1.211 1.00 1.23 H new ATOM 63 N ALA A 5 -18.646 -9.241 -2.153 1.00 1.31 N ATOM 64 CA ALA A 5 -18.897 -9.790 -3.499 1.00 1.41 C ATOM 65 C ALA A 5 -17.598 -10.100 -4.248 1.00 1.33 C ATOM 66 O ALA A 5 -17.285 -11.261 -4.516 1.00 1.96 O ATOM 67 CB ALA A 5 -19.787 -8.862 -4.322 1.00 1.72 C ATOM 0 H ALA A 5 -18.902 -9.879 -1.400 1.00 1.31 H new ATOM 0 HA ALA A 5 -19.425 -10.733 -3.359 1.00 1.41 H new ATOM 0 HB1 ALA A 5 -19.952 -9.296 -5.308 1.00 1.72 H new ATOM 0 HB2 ALA A 5 -20.744 -8.734 -3.817 1.00 1.72 H new ATOM 0 HB3 ALA A 5 -19.301 -7.892 -4.429 1.00 1.72 H new ATOM 73 N SER A 6 -16.838 -9.064 -4.575 1.00 1.05 N ATOM 74 CA SER A 6 -15.582 -9.224 -5.297 1.00 0.98 C ATOM 75 C SER A 6 -14.471 -9.697 -4.358 1.00 0.84 C ATOM 76 O SER A 6 -13.299 -9.757 -4.744 1.00 0.79 O ATOM 77 CB SER A 6 -15.187 -7.898 -5.952 1.00 1.17 C ATOM 78 OG SER A 6 -16.241 -7.386 -6.752 1.00 1.25 O ATOM 0 H SER A 6 -17.071 -8.097 -4.350 1.00 1.05 H new ATOM 0 HA SER A 6 -15.721 -9.980 -6.070 1.00 0.98 H new ATOM 0 HB2 SER A 6 -14.926 -7.172 -5.182 1.00 1.17 H new ATOM 0 HB3 SER A 6 -14.298 -8.043 -6.566 1.00 1.17 H new ATOM 0 HG SER A 6 -15.962 -6.538 -7.157 1.00 1.25 H new ATOM 84 N ASP A 7 -14.857 -10.064 -3.139 1.00 0.83 N ATOM 85 CA ASP A 7 -13.911 -10.464 -2.104 1.00 0.77 C ATOM 86 C ASP A 7 -13.225 -11.778 -2.463 1.00 0.72 C ATOM 87 O ASP A 7 -12.102 -12.040 -2.037 1.00 0.82 O ATOM 88 CB ASP A 7 -14.617 -10.569 -0.745 1.00 0.85 C ATOM 89 CG ASP A 7 -15.666 -11.665 -0.685 1.00 0.92 C ATOM 90 OD1 ASP A 7 -16.615 -11.633 -1.495 1.00 1.18 O ATOM 91 OD2 ASP A 7 -15.529 -12.586 0.149 1.00 1.36 O ATOM 0 H ASP A 7 -15.832 -10.092 -2.842 1.00 0.83 H new ATOM 0 HA ASP A 7 -13.140 -9.697 -2.034 1.00 0.77 H new ATOM 0 HB2 ASP A 7 -13.871 -10.750 0.029 1.00 0.85 H new ATOM 0 HB3 ASP A 7 -15.089 -9.614 -0.516 1.00 0.85 H new ATOM 96 N SER A 8 -13.893 -12.592 -3.261 1.00 0.69 N ATOM 97 CA SER A 8 -13.301 -13.834 -3.732 1.00 0.75 C ATOM 98 C SER A 8 -12.736 -13.662 -5.140 1.00 0.78 C ATOM 99 O SER A 8 -11.929 -14.468 -5.601 1.00 1.03 O ATOM 100 CB SER A 8 -14.340 -14.955 -3.722 1.00 0.89 C ATOM 101 OG SER A 8 -14.910 -15.112 -2.436 1.00 1.49 O ATOM 0 H SER A 8 -14.841 -12.418 -3.596 1.00 0.69 H new ATOM 0 HA SER A 8 -12.486 -14.099 -3.059 1.00 0.75 H new ATOM 0 HB2 SER A 8 -15.124 -14.734 -4.446 1.00 0.89 H new ATOM 0 HB3 SER A 8 -13.873 -15.890 -4.033 1.00 0.89 H new ATOM 0 HG SER A 8 -15.572 -15.834 -2.458 1.00 1.49 H new ATOM 107 N ASN A 9 -13.158 -12.604 -5.823 1.00 0.73 N ATOM 108 CA ASN A 9 -12.782 -12.411 -7.218 1.00 0.82 C ATOM 109 C ASN A 9 -11.468 -11.651 -7.357 1.00 0.77 C ATOM 110 O ASN A 9 -10.484 -12.190 -7.854 1.00 0.86 O ATOM 111 CB ASN A 9 -13.886 -11.660 -7.974 1.00 0.94 C ATOM 112 CG ASN A 9 -15.155 -12.476 -8.156 1.00 1.48 C ATOM 113 OD1 ASN A 9 -15.494 -13.328 -7.331 1.00 2.27 O ATOM 114 ND2 ASN A 9 -15.872 -12.215 -9.239 1.00 2.04 N ATOM 0 H ASN A 9 -13.755 -11.873 -5.438 1.00 0.73 H new ATOM 0 HA ASN A 9 -12.648 -13.403 -7.650 1.00 0.82 H new ATOM 0 HB2 ASN A 9 -14.126 -10.744 -7.435 1.00 0.94 H new ATOM 0 HB3 ASN A 9 -13.509 -11.365 -8.953 1.00 0.94 H new ATOM 0 HD21 ASN A 9 -16.737 -12.726 -9.413 1.00 2.04 H new ATOM 0 HD22 ASN A 9 -15.559 -11.503 -9.899 1.00 2.04 H new ATOM 121 N LYS A 10 -11.441 -10.411 -6.882 1.00 0.72 N ATOM 122 CA LYS A 10 -10.293 -9.546 -7.120 1.00 0.75 C ATOM 123 C LYS A 10 -9.238 -9.714 -6.036 1.00 0.70 C ATOM 124 O LYS A 10 -8.036 -9.654 -6.308 1.00 0.76 O ATOM 125 CB LYS A 10 -10.729 -8.082 -7.208 1.00 0.83 C ATOM 126 CG LYS A 10 -9.671 -7.174 -7.817 1.00 0.99 C ATOM 127 CD LYS A 10 -10.181 -5.754 -7.993 1.00 1.03 C ATOM 128 CE LYS A 10 -9.271 -4.942 -8.904 1.00 1.11 C ATOM 129 NZ LYS A 10 -7.932 -4.702 -8.301 1.00 1.56 N ATOM 0 H LYS A 10 -12.191 -9.987 -6.337 1.00 0.72 H new ATOM 0 HA LYS A 10 -9.851 -9.840 -8.072 1.00 0.75 H new ATOM 0 HB2 LYS A 10 -11.640 -8.017 -7.803 1.00 0.83 H new ATOM 0 HB3 LYS A 10 -10.975 -7.723 -6.209 1.00 0.83 H new ATOM 0 HG2 LYS A 10 -8.787 -7.167 -7.179 1.00 0.99 H new ATOM 0 HG3 LYS A 10 -9.363 -7.572 -8.784 1.00 0.99 H new ATOM 0 HD2 LYS A 10 -11.188 -5.777 -8.410 1.00 1.03 H new ATOM 0 HD3 LYS A 10 -10.250 -5.268 -7.020 1.00 1.03 H new ATOM 0 HE2 LYS A 10 -9.151 -5.465 -9.853 1.00 1.11 H new ATOM 0 HE3 LYS A 10 -9.743 -3.985 -9.125 1.00 1.11 H new ATOM 0 HZ1 LYS A 10 -7.350 -4.146 -8.959 1.00 1.56 H new ATOM 0 HZ2 LYS A 10 -8.042 -4.179 -7.409 1.00 1.56 H new ATOM 0 HZ3 LYS A 10 -7.467 -5.613 -8.113 1.00 1.56 H new ATOM 143 N SER A 11 -9.694 -9.930 -4.806 1.00 0.65 N ATOM 144 CA SER A 11 -8.797 -10.040 -3.664 1.00 0.64 C ATOM 145 C SER A 11 -7.792 -11.173 -3.865 1.00 0.66 C ATOM 146 O SER A 11 -6.599 -10.998 -3.626 1.00 0.67 O ATOM 147 CB SER A 11 -9.597 -10.259 -2.377 1.00 0.67 C ATOM 148 OG SER A 11 -8.751 -10.255 -1.238 1.00 1.52 O ATOM 0 H SER A 11 -10.682 -10.032 -4.576 1.00 0.65 H new ATOM 0 HA SER A 11 -8.242 -9.106 -3.577 1.00 0.64 H new ATOM 0 HB2 SER A 11 -10.350 -9.477 -2.276 1.00 0.67 H new ATOM 0 HB3 SER A 11 -10.129 -11.208 -2.434 1.00 0.67 H new ATOM 0 HG SER A 11 -9.090 -10.893 -0.576 1.00 1.52 H new ATOM 154 N GLN A 12 -8.274 -12.321 -4.332 1.00 0.72 N ATOM 155 CA GLN A 12 -7.418 -13.490 -4.511 1.00 0.81 C ATOM 156 C GLN A 12 -6.429 -13.279 -5.658 1.00 0.79 C ATOM 157 O GLN A 12 -5.310 -13.793 -5.623 1.00 0.85 O ATOM 158 CB GLN A 12 -8.258 -14.745 -4.757 1.00 0.95 C ATOM 159 CG GLN A 12 -9.175 -15.099 -3.595 1.00 1.19 C ATOM 160 CD GLN A 12 -9.873 -16.432 -3.782 1.00 1.74 C ATOM 161 OE1 GLN A 12 -10.140 -16.858 -4.908 1.00 2.34 O ATOM 162 NE2 GLN A 12 -10.184 -17.094 -2.678 1.00 2.40 N ATOM 0 H GLN A 12 -9.249 -12.467 -4.593 1.00 0.72 H new ATOM 0 HA GLN A 12 -6.848 -13.628 -3.592 1.00 0.81 H new ATOM 0 HB2 GLN A 12 -8.860 -14.599 -5.654 1.00 0.95 H new ATOM 0 HB3 GLN A 12 -7.592 -15.585 -4.953 1.00 0.95 H new ATOM 0 HG2 GLN A 12 -8.593 -15.125 -2.674 1.00 1.19 H new ATOM 0 HG3 GLN A 12 -9.924 -14.315 -3.477 1.00 1.19 H new ATOM 0 HE21 GLN A 12 -9.945 -16.705 -1.766 1.00 2.40 H new ATOM 0 HE22 GLN A 12 -10.663 -17.992 -2.740 1.00 2.40 H new ATOM 171 N ASN A 13 -6.835 -12.515 -6.663 1.00 0.77 N ATOM 172 CA ASN A 13 -5.951 -12.208 -7.782 1.00 0.81 C ATOM 173 C ASN A 13 -4.815 -11.310 -7.325 1.00 0.73 C ATOM 174 O ASN A 13 -3.647 -11.591 -7.593 1.00 0.76 O ATOM 175 CB ASN A 13 -6.711 -11.543 -8.931 1.00 0.95 C ATOM 176 CG ASN A 13 -7.674 -12.487 -9.619 1.00 1.41 C ATOM 177 OD1 ASN A 13 -7.472 -13.701 -9.632 1.00 2.14 O ATOM 178 ND2 ASN A 13 -8.718 -11.938 -10.218 1.00 1.63 N ATOM 0 H ASN A 13 -7.764 -12.098 -6.728 1.00 0.77 H new ATOM 0 HA ASN A 13 -5.542 -13.150 -8.148 1.00 0.81 H new ATOM 0 HB2 ASN A 13 -7.262 -10.684 -8.548 1.00 0.95 H new ATOM 0 HB3 ASN A 13 -5.997 -11.163 -9.662 1.00 0.95 H new ATOM 0 HD21 ASN A 13 -9.389 -12.525 -10.713 1.00 1.63 H new ATOM 0 HD22 ASN A 13 -8.852 -10.927 -10.185 1.00 1.63 H new ATOM 185 N ALA A 14 -5.160 -10.236 -6.618 1.00 0.69 N ATOM 186 CA ALA A 14 -4.163 -9.325 -6.062 1.00 0.66 C ATOM 187 C ALA A 14 -3.165 -10.072 -5.179 1.00 0.59 C ATOM 188 O ALA A 14 -1.960 -9.820 -5.238 1.00 0.61 O ATOM 189 CB ALA A 14 -4.841 -8.218 -5.270 1.00 0.68 C ATOM 0 H ALA A 14 -6.125 -9.975 -6.416 1.00 0.69 H new ATOM 0 HA ALA A 14 -3.614 -8.880 -6.892 1.00 0.66 H new ATOM 0 HB1 ALA A 14 -4.085 -7.547 -4.862 1.00 0.68 H new ATOM 0 HB2 ALA A 14 -5.508 -7.658 -5.925 1.00 0.68 H new ATOM 0 HB3 ALA A 14 -5.417 -8.655 -4.454 1.00 0.68 H new ATOM 195 N ILE A 15 -3.679 -10.996 -4.371 1.00 0.59 N ATOM 196 CA ILE A 15 -2.841 -11.838 -3.521 1.00 0.60 C ATOM 197 C ILE A 15 -1.817 -12.602 -4.360 1.00 0.59 C ATOM 198 O ILE A 15 -0.626 -12.610 -4.052 1.00 0.59 O ATOM 199 CB ILE A 15 -3.697 -12.842 -2.714 1.00 0.72 C ATOM 200 CG1 ILE A 15 -4.553 -12.099 -1.686 1.00 0.87 C ATOM 201 CG2 ILE A 15 -2.818 -13.886 -2.032 1.00 0.77 C ATOM 202 CD1 ILE A 15 -5.502 -12.994 -0.919 1.00 1.80 C ATOM 0 H ILE A 15 -4.678 -11.181 -4.287 1.00 0.59 H new ATOM 0 HA ILE A 15 -2.318 -11.183 -2.824 1.00 0.60 H new ATOM 0 HB ILE A 15 -4.358 -13.364 -3.406 1.00 0.72 H new ATOM 0 HG12 ILE A 15 -3.896 -11.591 -0.979 1.00 0.87 H new ATOM 0 HG13 ILE A 15 -5.129 -11.327 -2.197 1.00 0.87 H new ATOM 0 HG21 ILE A 15 -3.445 -14.579 -1.471 1.00 0.77 H new ATOM 0 HG22 ILE A 15 -2.254 -14.435 -2.786 1.00 0.77 H new ATOM 0 HG23 ILE A 15 -2.126 -13.390 -1.351 1.00 0.77 H new ATOM 0 HD11 ILE A 15 -6.074 -12.395 -0.210 1.00 1.80 H new ATOM 0 HD12 ILE A 15 -6.184 -13.482 -1.615 1.00 1.80 H new ATOM 0 HD13 ILE A 15 -4.932 -13.750 -0.379 1.00 1.80 H new ATOM 214 N SER A 16 -2.293 -13.211 -5.436 1.00 0.64 N ATOM 215 CA SER A 16 -1.440 -14.009 -6.306 1.00 0.70 C ATOM 216 C SER A 16 -0.342 -13.149 -6.935 1.00 0.69 C ATOM 217 O SER A 16 0.786 -13.611 -7.128 1.00 0.79 O ATOM 218 CB SER A 16 -2.286 -14.672 -7.392 1.00 0.81 C ATOM 219 OG SER A 16 -3.377 -15.382 -6.823 1.00 1.28 O ATOM 0 H SER A 16 -3.269 -13.168 -5.729 1.00 0.64 H new ATOM 0 HA SER A 16 -0.958 -14.781 -5.707 1.00 0.70 H new ATOM 0 HB2 SER A 16 -2.660 -13.914 -8.081 1.00 0.81 H new ATOM 0 HB3 SER A 16 -1.667 -15.354 -7.975 1.00 0.81 H new ATOM 0 HG SER A 16 -4.067 -14.747 -6.536 1.00 1.28 H new ATOM 225 N GLU A 17 -0.679 -11.896 -7.234 1.00 0.68 N ATOM 226 CA GLU A 17 0.276 -10.951 -7.806 1.00 0.75 C ATOM 227 C GLU A 17 1.404 -10.652 -6.821 1.00 0.69 C ATOM 228 O GLU A 17 2.575 -10.939 -7.085 1.00 0.75 O ATOM 229 CB GLU A 17 -0.418 -9.635 -8.177 1.00 0.88 C ATOM 230 CG GLU A 17 -1.558 -9.775 -9.172 1.00 1.30 C ATOM 231 CD GLU A 17 -1.102 -10.273 -10.527 1.00 1.49 C ATOM 232 OE1 GLU A 17 -0.426 -9.510 -11.249 1.00 1.70 O ATOM 233 OE2 GLU A 17 -1.439 -11.418 -10.884 1.00 2.07 O ATOM 0 H GLU A 17 -1.612 -11.511 -7.088 1.00 0.68 H new ATOM 0 HA GLU A 17 0.691 -11.410 -8.703 1.00 0.75 H new ATOM 0 HB2 GLU A 17 -0.803 -9.174 -7.267 1.00 0.88 H new ATOM 0 HB3 GLU A 17 0.325 -8.953 -8.590 1.00 0.88 H new ATOM 0 HG2 GLU A 17 -2.302 -10.463 -8.770 1.00 1.30 H new ATOM 0 HG3 GLU A 17 -2.049 -8.809 -9.292 1.00 1.30 H new ATOM 240 N VAL A 18 1.036 -10.091 -5.674 1.00 0.64 N ATOM 241 CA VAL A 18 2.014 -9.587 -4.717 1.00 0.69 C ATOM 242 C VAL A 18 2.822 -10.705 -4.069 1.00 0.67 C ATOM 243 O VAL A 18 4.003 -10.523 -3.783 1.00 0.76 O ATOM 244 CB VAL A 18 1.350 -8.728 -3.619 1.00 0.75 C ATOM 245 CG1 VAL A 18 0.647 -7.530 -4.236 1.00 1.59 C ATOM 246 CG2 VAL A 18 0.376 -9.553 -2.788 1.00 1.43 C ATOM 0 H VAL A 18 0.065 -9.974 -5.384 1.00 0.64 H new ATOM 0 HA VAL A 18 2.697 -8.961 -5.291 1.00 0.69 H new ATOM 0 HB VAL A 18 2.133 -8.367 -2.953 1.00 0.75 H new ATOM 0 HG11 VAL A 18 0.184 -6.935 -3.449 1.00 1.59 H new ATOM 0 HG12 VAL A 18 1.373 -6.920 -4.774 1.00 1.59 H new ATOM 0 HG13 VAL A 18 -0.121 -7.875 -4.929 1.00 1.59 H new ATOM 0 HG21 VAL A 18 -0.076 -8.921 -2.023 1.00 1.43 H new ATOM 0 HG22 VAL A 18 -0.404 -9.955 -3.434 1.00 1.43 H new ATOM 0 HG23 VAL A 18 0.910 -10.375 -2.311 1.00 1.43 H new ATOM 256 N MET A 19 2.195 -11.863 -3.862 1.00 0.65 N ATOM 257 CA MET A 19 2.867 -12.993 -3.225 1.00 0.75 C ATOM 258 C MET A 19 4.084 -13.408 -4.046 1.00 0.74 C ATOM 259 O MET A 19 5.124 -13.778 -3.497 1.00 0.78 O ATOM 260 CB MET A 19 1.893 -14.169 -3.060 1.00 0.89 C ATOM 261 CG MET A 19 2.387 -15.279 -2.135 1.00 1.25 C ATOM 262 SD MET A 19 3.638 -16.342 -2.886 1.00 2.00 S ATOM 263 CE MET A 19 4.026 -17.429 -1.517 1.00 2.13 C ATOM 0 H MET A 19 1.226 -12.042 -4.126 1.00 0.65 H new ATOM 0 HA MET A 19 3.206 -12.691 -2.234 1.00 0.75 H new ATOM 0 HB2 MET A 19 0.946 -13.789 -2.676 1.00 0.89 H new ATOM 0 HB3 MET A 19 1.690 -14.596 -4.042 1.00 0.89 H new ATOM 0 HG2 MET A 19 2.799 -14.831 -1.231 1.00 1.25 H new ATOM 0 HG3 MET A 19 1.538 -15.891 -1.830 1.00 1.25 H new ATOM 0 HE1 MET A 19 4.787 -18.146 -1.826 1.00 2.13 H new ATOM 0 HE2 MET A 19 4.401 -16.840 -0.680 1.00 2.13 H new ATOM 0 HE3 MET A 19 3.127 -17.964 -1.211 1.00 2.13 H new ATOM 273 N SER A 20 3.958 -13.310 -5.364 1.00 0.75 N ATOM 274 CA SER A 20 5.046 -13.665 -6.258 1.00 0.82 C ATOM 275 C SER A 20 6.202 -12.683 -6.090 1.00 0.82 C ATOM 276 O SER A 20 7.367 -13.074 -6.095 1.00 0.90 O ATOM 277 CB SER A 20 4.559 -13.671 -7.713 1.00 0.91 C ATOM 278 OG SER A 20 5.526 -14.240 -8.580 1.00 1.63 O ATOM 0 H SER A 20 3.112 -12.987 -5.834 1.00 0.75 H new ATOM 0 HA SER A 20 5.396 -14.666 -6.006 1.00 0.82 H new ATOM 0 HB2 SER A 20 3.628 -14.234 -7.784 1.00 0.91 H new ATOM 0 HB3 SER A 20 4.340 -12.651 -8.029 1.00 0.91 H new ATOM 0 HG SER A 20 5.187 -14.231 -9.499 1.00 1.63 H new ATOM 284 N ALA A 21 5.868 -11.412 -5.910 1.00 0.78 N ATOM 285 CA ALA A 21 6.872 -10.366 -5.809 1.00 0.85 C ATOM 286 C ALA A 21 7.537 -10.355 -4.434 1.00 0.82 C ATOM 287 O ALA A 21 8.756 -10.216 -4.333 1.00 0.89 O ATOM 288 CB ALA A 21 6.252 -9.011 -6.115 1.00 0.93 C ATOM 0 H ALA A 21 4.906 -11.082 -5.831 1.00 0.78 H new ATOM 0 HA ALA A 21 7.648 -10.575 -6.546 1.00 0.85 H new ATOM 0 HB1 ALA A 21 7.014 -8.236 -6.036 1.00 0.93 H new ATOM 0 HB2 ALA A 21 5.844 -9.017 -7.126 1.00 0.93 H new ATOM 0 HB3 ALA A 21 5.452 -8.808 -5.403 1.00 0.93 H new ATOM 294 N THR A 22 6.736 -10.522 -3.384 1.00 0.78 N ATOM 295 CA THR A 22 7.242 -10.461 -2.017 1.00 0.83 C ATOM 296 C THR A 22 8.258 -11.565 -1.740 1.00 0.87 C ATOM 297 O THR A 22 9.170 -11.392 -0.934 1.00 0.94 O ATOM 298 CB THR A 22 6.096 -10.537 -0.982 1.00 0.89 C ATOM 299 OG1 THR A 22 5.210 -11.619 -1.293 1.00 1.42 O ATOM 300 CG2 THR A 22 5.311 -9.237 -0.939 1.00 1.93 C ATOM 0 H THR A 22 5.734 -10.701 -3.455 1.00 0.78 H new ATOM 0 HA THR A 22 7.741 -9.497 -1.915 1.00 0.83 H new ATOM 0 HB THR A 22 6.545 -10.708 -0.004 1.00 0.89 H new ATOM 0 HG1 THR A 22 4.379 -11.518 -0.783 1.00 1.42 H new ATOM 0 HG21 THR A 22 4.511 -9.319 -0.203 1.00 1.93 H new ATOM 0 HG22 THR A 22 5.976 -8.419 -0.663 1.00 1.93 H new ATOM 0 HG23 THR A 22 4.881 -9.039 -1.921 1.00 1.93 H new ATOM 308 N SER A 23 8.106 -12.690 -2.420 1.00 0.89 N ATOM 309 CA SER A 23 9.017 -13.807 -2.252 1.00 0.99 C ATOM 310 C SER A 23 10.210 -13.693 -3.204 1.00 1.01 C ATOM 311 O SER A 23 11.347 -13.968 -2.824 1.00 1.11 O ATOM 312 CB SER A 23 8.265 -15.120 -2.479 1.00 1.07 C ATOM 313 OG SER A 23 7.485 -15.056 -3.662 1.00 1.55 O ATOM 0 H SER A 23 7.358 -12.852 -3.094 1.00 0.89 H new ATOM 0 HA SER A 23 9.407 -13.791 -1.234 1.00 0.99 H new ATOM 0 HB2 SER A 23 8.976 -15.943 -2.551 1.00 1.07 H new ATOM 0 HB3 SER A 23 7.621 -15.328 -1.624 1.00 1.07 H new ATOM 0 HG SER A 23 6.582 -14.746 -3.442 1.00 1.55 H new ATOM 319 N ALA A 24 9.951 -13.261 -4.438 1.00 0.96 N ATOM 320 CA ALA A 24 10.994 -13.177 -5.456 1.00 1.03 C ATOM 321 C ALA A 24 12.055 -12.139 -5.102 1.00 1.01 C ATOM 322 O ALA A 24 13.244 -12.362 -5.332 1.00 1.10 O ATOM 323 CB ALA A 24 10.389 -12.868 -6.815 1.00 1.05 C ATOM 0 H ALA A 24 9.028 -12.964 -4.755 1.00 0.96 H new ATOM 0 HA ALA A 24 11.485 -14.149 -5.497 1.00 1.03 H new ATOM 0 HB1 ALA A 24 11.181 -12.809 -7.561 1.00 1.05 H new ATOM 0 HB2 ALA A 24 9.690 -13.658 -7.090 1.00 1.05 H new ATOM 0 HB3 ALA A 24 9.861 -11.915 -6.770 1.00 1.05 H new ATOM 329 N ILE A 25 11.628 -11.013 -4.538 1.00 0.93 N ATOM 330 CA ILE A 25 12.552 -9.937 -4.192 1.00 0.93 C ATOM 331 C ILE A 25 13.582 -10.405 -3.164 1.00 0.97 C ATOM 332 O ILE A 25 14.728 -9.952 -3.170 1.00 1.02 O ATOM 333 CB ILE A 25 11.811 -8.682 -3.667 1.00 0.89 C ATOM 334 CG1 ILE A 25 12.807 -7.538 -3.427 1.00 1.23 C ATOM 335 CG2 ILE A 25 11.041 -8.996 -2.389 1.00 1.11 C ATOM 336 CD1 ILE A 25 12.160 -6.243 -2.977 1.00 1.56 C ATOM 0 H ILE A 25 10.652 -10.822 -4.311 1.00 0.93 H new ATOM 0 HA ILE A 25 13.071 -9.661 -5.110 1.00 0.93 H new ATOM 0 HB ILE A 25 11.092 -8.369 -4.424 1.00 0.89 H new ATOM 0 HG12 ILE A 25 13.531 -7.852 -2.675 1.00 1.23 H new ATOM 0 HG13 ILE A 25 13.363 -7.354 -4.347 1.00 1.23 H new ATOM 0 HG21 ILE A 25 10.530 -8.098 -2.042 1.00 1.11 H new ATOM 0 HG22 ILE A 25 10.307 -9.777 -2.589 1.00 1.11 H new ATOM 0 HG23 ILE A 25 11.735 -9.338 -1.621 1.00 1.11 H new ATOM 0 HD11 ILE A 25 12.929 -5.485 -2.829 1.00 1.56 H new ATOM 0 HD12 ILE A 25 11.457 -5.904 -3.738 1.00 1.56 H new ATOM 0 HD13 ILE A 25 11.628 -6.408 -2.040 1.00 1.56 H new ATOM 348 N ASN A 26 13.173 -11.333 -2.304 1.00 0.98 N ATOM 349 CA ASN A 26 14.071 -11.906 -1.308 1.00 1.08 C ATOM 350 C ASN A 26 15.224 -12.619 -2.000 1.00 1.12 C ATOM 351 O ASN A 26 16.394 -12.390 -1.684 1.00 1.20 O ATOM 352 CB ASN A 26 13.315 -12.894 -0.418 1.00 1.15 C ATOM 353 CG ASN A 26 14.208 -13.545 0.624 1.00 1.48 C ATOM 354 OD1 ASN A 26 15.143 -12.932 1.140 1.00 1.96 O ATOM 355 ND2 ASN A 26 13.933 -14.804 0.927 1.00 2.02 N ATOM 0 H ASN A 26 12.223 -11.705 -2.277 1.00 0.98 H new ATOM 0 HA ASN A 26 14.464 -11.101 -0.688 1.00 1.08 H new ATOM 0 HB2 ASN A 26 12.498 -12.374 0.083 1.00 1.15 H new ATOM 0 HB3 ASN A 26 12.866 -13.668 -1.041 1.00 1.15 H new ATOM 0 HD21 ASN A 26 14.505 -15.301 1.610 1.00 2.02 H new ATOM 0 HD22 ASN A 26 13.149 -15.277 0.477 1.00 2.02 H new ATOM 362 N GLY A 27 14.878 -13.451 -2.979 1.00 1.12 N ATOM 363 CA GLY A 27 15.872 -14.216 -3.710 1.00 1.20 C ATOM 364 C GLY A 27 16.755 -13.343 -4.582 1.00 1.23 C ATOM 365 O GLY A 27 17.845 -13.756 -4.985 1.00 1.36 O ATOM 0 H GLY A 27 13.917 -13.609 -3.281 1.00 1.12 H new ATOM 0 HA2 GLY A 27 16.495 -14.765 -3.003 1.00 1.20 H new ATOM 0 HA3 GLY A 27 15.370 -14.956 -4.333 1.00 1.20 H new ATOM 369 N LEU A 28 16.283 -12.143 -4.887 1.00 1.16 N ATOM 370 CA LEU A 28 17.061 -11.199 -5.673 1.00 1.22 C ATOM 371 C LEU A 28 18.138 -10.549 -4.815 1.00 1.28 C ATOM 372 O LEU A 28 19.295 -10.441 -5.223 1.00 1.42 O ATOM 373 CB LEU A 28 16.156 -10.117 -6.271 1.00 1.18 C ATOM 374 CG LEU A 28 15.074 -10.623 -7.227 1.00 1.39 C ATOM 375 CD1 LEU A 28 14.219 -9.467 -7.722 1.00 1.69 C ATOM 376 CD2 LEU A 28 15.701 -11.359 -8.401 1.00 1.81 C ATOM 0 H LEU A 28 15.365 -11.801 -4.602 1.00 1.16 H new ATOM 0 HA LEU A 28 17.537 -11.749 -6.485 1.00 1.22 H new ATOM 0 HB2 LEU A 28 15.674 -9.579 -5.455 1.00 1.18 H new ATOM 0 HB3 LEU A 28 16.780 -9.398 -6.802 1.00 1.18 H new ATOM 0 HG LEU A 28 14.435 -11.320 -6.685 1.00 1.39 H new ATOM 0 HD11 LEU A 28 13.454 -9.845 -8.401 1.00 1.69 H new ATOM 0 HD12 LEU A 28 13.741 -8.978 -6.873 1.00 1.69 H new ATOM 0 HD13 LEU A 28 14.848 -8.748 -8.247 1.00 1.69 H new ATOM 0 HD21 LEU A 28 14.916 -11.712 -9.070 1.00 1.81 H new ATOM 0 HD22 LEU A 28 16.363 -10.683 -8.942 1.00 1.81 H new ATOM 0 HD23 LEU A 28 16.274 -12.210 -8.033 1.00 1.81 H new ATOM 388 N TYR A 29 17.754 -10.124 -3.621 1.00 1.22 N ATOM 389 CA TYR A 29 18.668 -9.416 -2.736 1.00 1.31 C ATOM 390 C TYR A 29 19.574 -10.396 -1.998 1.00 1.58 C ATOM 391 O TYR A 29 20.785 -10.395 -2.212 1.00 2.30 O ATOM 392 CB TYR A 29 17.894 -8.528 -1.752 1.00 1.13 C ATOM 393 CG TYR A 29 17.290 -7.290 -2.392 1.00 0.94 C ATOM 394 CD1 TYR A 29 16.646 -7.365 -3.617 1.00 0.91 C ATOM 395 CD2 TYR A 29 17.355 -6.051 -1.763 1.00 0.90 C ATOM 396 CE1 TYR A 29 16.084 -6.244 -4.199 1.00 0.87 C ATOM 397 CE2 TYR A 29 16.798 -4.927 -2.338 1.00 0.84 C ATOM 398 CZ TYR A 29 16.209 -5.013 -3.569 1.00 0.85 C ATOM 399 OH TYR A 29 15.599 -3.910 -4.125 1.00 0.96 O ATOM 0 H TYR A 29 16.816 -10.257 -3.242 1.00 1.22 H new ATOM 0 HA TYR A 29 19.300 -8.769 -3.344 1.00 1.31 H new ATOM 0 HB2 TYR A 29 17.097 -9.115 -1.295 1.00 1.13 H new ATOM 0 HB3 TYR A 29 18.564 -8.221 -0.949 1.00 1.13 H new ATOM 0 HD1 TYR A 29 16.582 -8.316 -4.126 1.00 0.91 H new ATOM 0 HD2 TYR A 29 17.851 -5.967 -0.807 1.00 0.90 H new ATOM 0 HE1 TYR A 29 15.552 -6.325 -5.136 1.00 0.87 H new ATOM 0 HE2 TYR A 29 16.827 -3.981 -1.817 1.00 0.84 H new ATOM 0 HH TYR A 29 15.077 -3.444 -3.439 1.00 0.96 H new ATOM 409 N ILE A 30 18.977 -11.242 -1.156 1.00 1.25 N ATOM 410 CA ILE A 30 19.717 -12.255 -0.393 1.00 1.45 C ATOM 411 C ILE A 30 20.692 -11.628 0.608 1.00 1.45 C ATOM 412 O ILE A 30 21.626 -10.914 0.240 1.00 1.99 O ATOM 413 CB ILE A 30 20.476 -13.229 -1.327 1.00 1.67 C ATOM 414 CG1 ILE A 30 19.486 -14.049 -2.162 1.00 1.88 C ATOM 415 CG2 ILE A 30 21.395 -14.148 -0.526 1.00 1.89 C ATOM 416 CD1 ILE A 30 18.604 -14.973 -1.343 1.00 2.50 C ATOM 0 H ILE A 30 17.972 -11.246 -0.983 1.00 1.25 H new ATOM 0 HA ILE A 30 18.971 -12.818 0.169 1.00 1.45 H new ATOM 0 HB ILE A 30 21.095 -12.640 -2.003 1.00 1.67 H new ATOM 0 HG12 ILE A 30 18.852 -13.367 -2.729 1.00 1.88 H new ATOM 0 HG13 ILE A 30 20.043 -14.643 -2.887 1.00 1.88 H new ATOM 0 HG21 ILE A 30 21.917 -14.823 -1.205 1.00 1.89 H new ATOM 0 HG22 ILE A 30 22.123 -13.548 0.020 1.00 1.89 H new ATOM 0 HG23 ILE A 30 20.802 -14.730 0.179 1.00 1.89 H new ATOM 0 HD11 ILE A 30 17.932 -15.517 -2.007 1.00 2.50 H new ATOM 0 HD12 ILE A 30 19.227 -15.681 -0.797 1.00 2.50 H new ATOM 0 HD13 ILE A 30 18.018 -14.385 -0.636 1.00 2.50 H new ATOM 428 N GLY A 31 20.462 -11.896 1.887 1.00 1.43 N ATOM 429 CA GLY A 31 21.361 -11.411 2.917 1.00 1.69 C ATOM 430 C GLY A 31 20.806 -10.207 3.647 1.00 1.52 C ATOM 431 O GLY A 31 21.145 -9.963 4.807 1.00 1.93 O ATOM 0 H GLY A 31 19.670 -12.440 2.230 1.00 1.43 H new ATOM 0 HA2 GLY A 31 21.553 -12.210 3.633 1.00 1.69 H new ATOM 0 HA3 GLY A 31 22.318 -11.150 2.466 1.00 1.69 H new ATOM 435 N GLN A 32 19.949 -9.454 2.973 1.00 1.16 N ATOM 436 CA GLN A 32 19.357 -8.263 3.563 1.00 1.10 C ATOM 437 C GLN A 32 18.404 -8.644 4.685 1.00 1.14 C ATOM 438 O GLN A 32 17.454 -9.399 4.477 1.00 1.93 O ATOM 439 CB GLN A 32 18.616 -7.441 2.508 1.00 1.09 C ATOM 440 CG GLN A 32 19.489 -7.021 1.341 1.00 1.38 C ATOM 441 CD GLN A 32 20.660 -6.153 1.757 1.00 2.15 C ATOM 442 OE1 GLN A 32 21.724 -6.660 2.111 1.00 2.74 O ATOM 443 NE2 GLN A 32 20.489 -4.843 1.686 1.00 2.84 N ATOM 0 H GLN A 32 19.648 -9.647 2.018 1.00 1.16 H new ATOM 0 HA GLN A 32 20.163 -7.655 3.972 1.00 1.10 H new ATOM 0 HB2 GLN A 32 17.775 -8.023 2.131 1.00 1.09 H new ATOM 0 HB3 GLN A 32 18.201 -6.550 2.979 1.00 1.09 H new ATOM 0 HG2 GLN A 32 19.865 -7.911 0.837 1.00 1.38 H new ATOM 0 HG3 GLN A 32 18.881 -6.478 0.617 1.00 1.38 H new ATOM 0 HE21 GLN A 32 19.591 -4.461 1.388 1.00 2.84 H new ATOM 0 HE22 GLN A 32 21.255 -4.215 1.929 1.00 2.84 H new ATOM 452 N THR A 33 18.676 -8.128 5.870 1.00 1.15 N ATOM 453 CA THR A 33 17.838 -8.374 7.026 1.00 1.20 C ATOM 454 C THR A 33 16.432 -7.825 6.798 1.00 1.09 C ATOM 455 O THR A 33 15.435 -8.484 7.100 1.00 1.21 O ATOM 456 CB THR A 33 18.446 -7.713 8.276 1.00 1.54 C ATOM 457 OG1 THR A 33 19.814 -8.115 8.424 1.00 1.91 O ATOM 458 CG2 THR A 33 17.667 -8.087 9.528 1.00 1.83 C ATOM 0 H THR A 33 19.481 -7.529 6.056 1.00 1.15 H new ATOM 0 HA THR A 33 17.779 -9.452 7.178 1.00 1.20 H new ATOM 0 HB THR A 33 18.393 -6.632 8.147 1.00 1.54 H new ATOM 0 HG1 THR A 33 20.196 -7.690 9.220 1.00 1.91 H new ATOM 0 HG21 THR A 33 18.119 -7.606 10.395 1.00 1.83 H new ATOM 0 HG22 THR A 33 16.634 -7.755 9.426 1.00 1.83 H new ATOM 0 HG23 THR A 33 17.689 -9.169 9.661 1.00 1.83 H new ATOM 466 N SER A 34 16.361 -6.628 6.236 1.00 1.12 N ATOM 467 CA SER A 34 15.092 -5.955 6.047 1.00 1.35 C ATOM 468 C SER A 34 15.119 -5.035 4.830 1.00 1.13 C ATOM 469 O SER A 34 14.362 -4.067 4.762 1.00 1.18 O ATOM 470 CB SER A 34 14.768 -5.161 7.307 1.00 1.82 C ATOM 471 OG SER A 34 15.935 -4.551 7.841 1.00 2.42 O ATOM 0 H SER A 34 17.171 -6.105 5.903 1.00 1.12 H new ATOM 0 HA SER A 34 14.320 -6.703 5.866 1.00 1.35 H new ATOM 0 HB2 SER A 34 14.026 -4.396 7.078 1.00 1.82 H new ATOM 0 HB3 SER A 34 14.325 -5.821 8.053 1.00 1.82 H new ATOM 0 HG SER A 34 15.923 -3.591 7.642 1.00 2.42 H new ATOM 477 N TYR A 35 15.989 -5.353 3.861 1.00 0.96 N ATOM 478 CA TYR A 35 16.137 -4.545 2.643 1.00 0.78 C ATOM 479 C TYR A 35 16.537 -3.108 2.986 1.00 0.74 C ATOM 480 O TYR A 35 16.428 -2.207 2.154 1.00 0.68 O ATOM 481 CB TYR A 35 14.832 -4.531 1.832 1.00 0.90 C ATOM 482 CG TYR A 35 14.269 -5.903 1.524 1.00 0.97 C ATOM 483 CD1 TYR A 35 14.703 -6.625 0.419 1.00 1.27 C ATOM 484 CD2 TYR A 35 13.296 -6.469 2.338 1.00 0.97 C ATOM 485 CE1 TYR A 35 14.182 -7.875 0.136 1.00 1.37 C ATOM 486 CE2 TYR A 35 12.772 -7.715 2.063 1.00 1.12 C ATOM 487 CZ TYR A 35 13.216 -8.414 0.961 1.00 1.23 C ATOM 488 OH TYR A 35 12.693 -9.655 0.687 1.00 1.41 O ATOM 0 H TYR A 35 16.603 -6.167 3.898 1.00 0.96 H new ATOM 0 HA TYR A 35 16.924 -5.000 2.042 1.00 0.78 H new ATOM 0 HB2 TYR A 35 14.084 -3.960 2.382 1.00 0.90 H new ATOM 0 HB3 TYR A 35 15.008 -4.005 0.893 1.00 0.90 H new ATOM 0 HD1 TYR A 35 15.458 -6.204 -0.228 1.00 1.27 H new ATOM 0 HD2 TYR A 35 12.944 -5.924 3.201 1.00 0.97 H new ATOM 0 HE1 TYR A 35 14.529 -8.426 -0.726 1.00 1.37 H new ATOM 0 HE2 TYR A 35 12.018 -8.141 2.708 1.00 1.12 H new ATOM 0 HH TYR A 35 12.026 -9.886 1.366 1.00 1.41 H new ATOM 498 N SER A 36 17.052 -2.911 4.197 1.00 0.89 N ATOM 499 CA SER A 36 17.310 -1.576 4.722 1.00 1.03 C ATOM 500 C SER A 36 18.559 -0.947 4.110 1.00 1.25 C ATOM 501 O SER A 36 18.997 0.123 4.530 1.00 2.03 O ATOM 502 CB SER A 36 17.431 -1.629 6.244 1.00 1.37 C ATOM 503 OG SER A 36 16.233 -2.118 6.825 1.00 2.08 O ATOM 0 H SER A 36 17.300 -3.666 4.836 1.00 0.89 H new ATOM 0 HA SER A 36 16.465 -0.945 4.446 1.00 1.03 H new ATOM 0 HB2 SER A 36 18.266 -2.271 6.525 1.00 1.37 H new ATOM 0 HB3 SER A 36 17.649 -0.634 6.631 1.00 1.37 H new ATOM 0 HG SER A 36 15.922 -1.490 7.510 1.00 2.08 H new ATOM 509 N GLY A 37 19.119 -1.607 3.109 1.00 1.42 N ATOM 510 CA GLY A 37 20.212 -1.021 2.367 1.00 1.83 C ATOM 511 C GLY A 37 19.725 0.111 1.490 1.00 1.52 C ATOM 512 O GLY A 37 20.498 0.973 1.083 1.00 1.88 O ATOM 0 H GLY A 37 18.836 -2.536 2.798 1.00 1.42 H new ATOM 0 HA2 GLY A 37 20.969 -0.651 3.059 1.00 1.83 H new ATOM 0 HA3 GLY A 37 20.689 -1.784 1.751 1.00 1.83 H new ATOM 516 N LEU A 38 18.428 0.107 1.215 1.00 0.95 N ATOM 517 CA LEU A 38 17.811 1.141 0.397 1.00 0.77 C ATOM 518 C LEU A 38 17.118 2.183 1.267 1.00 0.68 C ATOM 519 O LEU A 38 16.528 3.130 0.751 1.00 0.66 O ATOM 520 CB LEU A 38 16.779 0.522 -0.552 1.00 0.68 C ATOM 521 CG LEU A 38 17.304 -0.571 -1.481 1.00 0.87 C ATOM 522 CD1 LEU A 38 16.173 -1.146 -2.316 1.00 1.11 C ATOM 523 CD2 LEU A 38 18.399 -0.026 -2.380 1.00 1.19 C ATOM 0 H LEU A 38 17.779 -0.606 1.549 1.00 0.95 H new ATOM 0 HA LEU A 38 18.601 1.624 -0.179 1.00 0.77 H new ATOM 0 HB2 LEU A 38 15.967 0.107 0.045 1.00 0.68 H new ATOM 0 HB3 LEU A 38 16.351 1.317 -1.162 1.00 0.68 H new ATOM 0 HG LEU A 38 17.725 -1.369 -0.869 1.00 0.87 H new ATOM 0 HD11 LEU A 38 16.564 -1.923 -2.972 1.00 1.11 H new ATOM 0 HD12 LEU A 38 15.416 -1.573 -1.658 1.00 1.11 H new ATOM 0 HD13 LEU A 38 15.726 -0.354 -2.917 1.00 1.11 H new ATOM 0 HD21 LEU A 38 18.761 -0.819 -3.035 1.00 1.19 H new ATOM 0 HD22 LEU A 38 18.002 0.790 -2.984 1.00 1.19 H new ATOM 0 HD23 LEU A 38 19.222 0.343 -1.768 1.00 1.19 H new ATOM 535 N ASP A 39 17.196 1.998 2.588 1.00 0.76 N ATOM 536 CA ASP A 39 16.447 2.829 3.539 1.00 0.85 C ATOM 537 C ASP A 39 16.774 4.300 3.354 1.00 0.82 C ATOM 538 O ASP A 39 15.961 5.071 2.853 1.00 0.90 O ATOM 539 CB ASP A 39 16.765 2.421 4.979 1.00 1.08 C ATOM 540 CG ASP A 39 15.800 3.020 5.985 1.00 1.59 C ATOM 541 OD1 ASP A 39 16.061 4.140 6.478 1.00 1.84 O ATOM 542 OD2 ASP A 39 14.785 2.368 6.297 1.00 2.42 O ATOM 0 H ASP A 39 17.772 1.278 3.025 1.00 0.76 H new ATOM 0 HA ASP A 39 15.386 2.674 3.344 1.00 0.85 H new ATOM 0 HB2 ASP A 39 16.738 1.334 5.059 1.00 1.08 H new ATOM 0 HB3 ASP A 39 17.780 2.733 5.225 1.00 1.08 H new ATOM 547 N SER A 40 17.984 4.675 3.743 1.00 0.82 N ATOM 548 CA SER A 40 18.431 6.049 3.617 1.00 0.94 C ATOM 549 C SER A 40 18.552 6.440 2.149 1.00 0.89 C ATOM 550 O SER A 40 18.364 7.601 1.795 1.00 1.00 O ATOM 551 CB SER A 40 19.771 6.220 4.326 1.00 1.13 C ATOM 552 OG SER A 40 19.701 5.713 5.647 1.00 1.71 O ATOM 0 H SER A 40 18.674 4.043 4.149 1.00 0.82 H new ATOM 0 HA SER A 40 17.695 6.704 4.083 1.00 0.94 H new ATOM 0 HB2 SER A 40 20.552 5.700 3.771 1.00 1.13 H new ATOM 0 HB3 SER A 40 20.045 7.275 4.349 1.00 1.13 H new ATOM 0 HG SER A 40 20.569 5.828 6.088 1.00 1.71 H new ATOM 558 N THR A 41 18.843 5.456 1.303 1.00 0.81 N ATOM 559 CA THR A 41 18.992 5.681 -0.128 1.00 0.85 C ATOM 560 C THR A 41 17.740 6.326 -0.714 1.00 0.79 C ATOM 561 O THR A 41 17.806 7.403 -1.306 1.00 0.95 O ATOM 562 CB THR A 41 19.265 4.356 -0.855 1.00 0.92 C ATOM 563 OG1 THR A 41 20.317 3.651 -0.184 1.00 1.25 O ATOM 564 CG2 THR A 41 19.653 4.594 -2.305 1.00 1.38 C ATOM 0 H THR A 41 18.981 4.487 1.589 1.00 0.81 H new ATOM 0 HA THR A 41 19.837 6.355 -0.270 1.00 0.85 H new ATOM 0 HB THR A 41 18.351 3.762 -0.841 1.00 0.92 H new ATOM 0 HG1 THR A 41 20.490 2.805 -0.647 1.00 1.25 H new ATOM 0 HG21 THR A 41 19.840 3.638 -2.793 1.00 1.38 H new ATOM 0 HG22 THR A 41 18.842 5.111 -2.818 1.00 1.38 H new ATOM 0 HG23 THR A 41 20.555 5.204 -2.345 1.00 1.38 H new ATOM 572 N ILE A 42 16.598 5.674 -0.522 1.00 0.67 N ATOM 573 CA ILE A 42 15.332 6.182 -1.032 1.00 0.67 C ATOM 574 C ILE A 42 14.870 7.374 -0.200 1.00 0.64 C ATOM 575 O ILE A 42 14.244 8.303 -0.709 1.00 0.68 O ATOM 576 CB ILE A 42 14.243 5.088 -1.018 1.00 0.73 C ATOM 577 CG1 ILE A 42 14.711 3.855 -1.801 1.00 0.82 C ATOM 578 CG2 ILE A 42 12.935 5.618 -1.591 1.00 0.78 C ATOM 579 CD1 ILE A 42 15.116 4.149 -3.234 1.00 0.87 C ATOM 0 H ILE A 42 16.525 4.791 -0.016 1.00 0.67 H new ATOM 0 HA ILE A 42 15.491 6.497 -2.063 1.00 0.67 H new ATOM 0 HB ILE A 42 14.067 4.796 0.017 1.00 0.73 H new ATOM 0 HG12 ILE A 42 15.557 3.407 -1.280 1.00 0.82 H new ATOM 0 HG13 ILE A 42 13.911 3.115 -1.805 1.00 0.82 H new ATOM 0 HG21 ILE A 42 12.183 4.829 -1.571 1.00 0.78 H new ATOM 0 HG22 ILE A 42 12.592 6.462 -0.993 1.00 0.78 H new ATOM 0 HG23 ILE A 42 13.093 5.942 -2.620 1.00 0.78 H new ATOM 0 HD11 ILE A 42 15.434 3.226 -3.719 1.00 0.87 H new ATOM 0 HD12 ILE A 42 14.267 4.568 -3.773 1.00 0.87 H new ATOM 0 HD13 ILE A 42 15.939 4.864 -3.240 1.00 0.87 H new ATOM 591 N LEU A 43 15.216 7.343 1.079 1.00 0.64 N ATOM 592 CA LEU A 43 14.841 8.395 2.010 1.00 0.70 C ATOM 593 C LEU A 43 15.393 9.746 1.554 1.00 0.75 C ATOM 594 O LEU A 43 14.632 10.662 1.246 1.00 0.75 O ATOM 595 CB LEU A 43 15.361 8.055 3.406 1.00 0.85 C ATOM 596 CG LEU A 43 14.753 8.873 4.546 1.00 1.07 C ATOM 597 CD1 LEU A 43 13.272 8.563 4.694 1.00 1.20 C ATOM 598 CD2 LEU A 43 15.489 8.597 5.846 1.00 1.43 C ATOM 0 H LEU A 43 15.762 6.591 1.498 1.00 0.64 H new ATOM 0 HA LEU A 43 13.754 8.466 2.038 1.00 0.70 H new ATOM 0 HB2 LEU A 43 15.174 6.999 3.598 1.00 0.85 H new ATOM 0 HB3 LEU A 43 16.442 8.194 3.417 1.00 0.85 H new ATOM 0 HG LEU A 43 14.859 9.931 4.307 1.00 1.07 H new ATOM 0 HD11 LEU A 43 12.856 9.154 5.510 1.00 1.20 H new ATOM 0 HD12 LEU A 43 12.754 8.809 3.767 1.00 1.20 H new ATOM 0 HD13 LEU A 43 13.142 7.503 4.911 1.00 1.20 H new ATOM 0 HD21 LEU A 43 15.045 9.187 6.648 1.00 1.43 H new ATOM 0 HD22 LEU A 43 15.413 7.537 6.089 1.00 1.43 H new ATOM 0 HD23 LEU A 43 16.539 8.869 5.735 1.00 1.43 H new ATOM 610 N LEU A 44 16.716 9.858 1.469 1.00 0.85 N ATOM 611 CA LEU A 44 17.348 11.125 1.109 1.00 0.98 C ATOM 612 C LEU A 44 17.223 11.399 -0.386 1.00 0.92 C ATOM 613 O LEU A 44 17.528 12.500 -0.850 1.00 1.03 O ATOM 614 CB LEU A 44 18.823 11.158 1.556 1.00 1.19 C ATOM 615 CG LEU A 44 19.744 10.067 0.984 1.00 1.33 C ATOM 616 CD1 LEU A 44 20.213 10.412 -0.420 1.00 1.54 C ATOM 617 CD2 LEU A 44 20.937 9.856 1.904 1.00 1.66 C ATOM 0 H LEU A 44 17.368 9.093 1.643 1.00 0.85 H new ATOM 0 HA LEU A 44 16.821 11.919 1.638 1.00 0.98 H new ATOM 0 HB2 LEU A 44 19.238 12.129 1.287 1.00 1.19 H new ATOM 0 HB3 LEU A 44 18.850 11.090 2.644 1.00 1.19 H new ATOM 0 HG LEU A 44 19.171 9.142 0.923 1.00 1.33 H new ATOM 0 HD11 LEU A 44 20.862 9.619 -0.792 1.00 1.54 H new ATOM 0 HD12 LEU A 44 19.350 10.513 -1.077 1.00 1.54 H new ATOM 0 HD13 LEU A 44 20.765 11.352 -0.399 1.00 1.54 H new ATOM 0 HD21 LEU A 44 21.583 9.082 1.490 1.00 1.66 H new ATOM 0 HD22 LEU A 44 21.497 10.787 1.993 1.00 1.66 H new ATOM 0 HD23 LEU A 44 20.587 9.548 2.889 1.00 1.66 H new ATOM 629 N ASN A 45 16.778 10.391 -1.132 1.00 0.84 N ATOM 630 CA ASN A 45 16.595 10.509 -2.578 1.00 0.91 C ATOM 631 C ASN A 45 15.678 11.676 -2.915 1.00 0.88 C ATOM 632 O ASN A 45 15.932 12.432 -3.852 1.00 1.02 O ATOM 633 CB ASN A 45 15.998 9.221 -3.147 1.00 1.01 C ATOM 634 CG ASN A 45 15.771 9.291 -4.646 1.00 1.17 C ATOM 635 OD1 ASN A 45 14.715 9.727 -5.109 1.00 1.88 O ATOM 636 ND2 ASN A 45 16.755 8.855 -5.414 1.00 1.32 N ATOM 0 H ASN A 45 16.535 9.475 -0.755 1.00 0.84 H new ATOM 0 HA ASN A 45 17.574 10.685 -3.024 1.00 0.91 H new ATOM 0 HB2 ASN A 45 16.664 8.387 -2.923 1.00 1.01 H new ATOM 0 HB3 ASN A 45 15.050 9.014 -2.650 1.00 1.01 H new ATOM 0 HD21 ASN A 45 16.656 8.872 -6.429 1.00 1.32 H new ATOM 0 HD22 ASN A 45 17.614 8.502 -4.991 1.00 1.32 H new ATOM 643 N THR A 46 14.607 11.817 -2.154 1.00 0.79 N ATOM 644 CA THR A 46 13.663 12.887 -2.390 1.00 0.85 C ATOM 645 C THR A 46 13.525 13.772 -1.155 1.00 0.79 C ATOM 646 O THR A 46 12.778 13.449 -0.241 1.00 0.68 O ATOM 647 CB THR A 46 12.282 12.322 -2.772 1.00 0.93 C ATOM 648 OG1 THR A 46 12.425 11.326 -3.795 1.00 1.15 O ATOM 649 CG2 THR A 46 11.358 13.425 -3.265 1.00 1.12 C ATOM 0 H THR A 46 14.373 11.206 -1.372 1.00 0.79 H new ATOM 0 HA THR A 46 14.044 13.487 -3.216 1.00 0.85 H new ATOM 0 HB THR A 46 11.843 11.873 -1.881 1.00 0.93 H new ATOM 0 HG1 THR A 46 11.621 11.314 -4.355 1.00 1.15 H new ATOM 0 HG21 THR A 46 10.390 12.998 -3.528 1.00 1.12 H new ATOM 0 HG22 THR A 46 11.226 14.168 -2.478 1.00 1.12 H new ATOM 0 HG23 THR A 46 11.795 13.901 -4.143 1.00 1.12 H new ATOM 657 N SER A 47 14.277 14.870 -1.136 1.00 0.97 N ATOM 658 CA SER A 47 14.155 15.903 -0.105 1.00 1.13 C ATOM 659 C SER A 47 14.327 15.338 1.315 1.00 1.06 C ATOM 660 O SER A 47 13.820 15.919 2.277 1.00 1.32 O ATOM 661 CB SER A 47 12.789 16.584 -0.239 1.00 1.29 C ATOM 662 OG SER A 47 12.776 17.848 0.407 1.00 1.87 O ATOM 0 H SER A 47 14.991 15.071 -1.836 1.00 0.97 H new ATOM 0 HA SER A 47 14.956 16.626 -0.257 1.00 1.13 H new ATOM 0 HB2 SER A 47 12.545 16.710 -1.294 1.00 1.29 H new ATOM 0 HB3 SER A 47 12.018 15.945 0.192 1.00 1.29 H new ATOM 0 HG SER A 47 13.135 17.755 1.314 1.00 1.87 H new ATOM 668 N ALA A 48 15.038 14.211 1.432 1.00 0.92 N ATOM 669 CA ALA A 48 15.258 13.520 2.718 1.00 0.97 C ATOM 670 C ALA A 48 13.976 12.856 3.235 1.00 0.88 C ATOM 671 O ALA A 48 14.029 11.871 3.972 1.00 1.00 O ATOM 672 CB ALA A 48 15.842 14.461 3.769 1.00 1.22 C ATOM 0 H ALA A 48 15.480 13.747 0.638 1.00 0.92 H new ATOM 0 HA ALA A 48 15.987 12.732 2.531 1.00 0.97 H new ATOM 0 HB1 ALA A 48 15.990 13.917 4.702 1.00 1.22 H new ATOM 0 HB2 ALA A 48 16.799 14.849 3.419 1.00 1.22 H new ATOM 0 HB3 ALA A 48 15.155 15.290 3.937 1.00 1.22 H new ATOM 678 N ILE A 49 12.834 13.408 2.857 1.00 0.78 N ATOM 679 CA ILE A 49 11.543 12.807 3.139 1.00 0.75 C ATOM 680 C ILE A 49 10.830 12.567 1.818 1.00 0.62 C ATOM 681 O ILE A 49 10.294 13.506 1.231 1.00 0.65 O ATOM 682 CB ILE A 49 10.660 13.717 4.016 1.00 0.86 C ATOM 683 CG1 ILE A 49 11.458 14.265 5.203 1.00 1.17 C ATOM 684 CG2 ILE A 49 9.436 12.950 4.503 1.00 0.95 C ATOM 685 CD1 ILE A 49 10.690 15.255 6.050 1.00 1.93 C ATOM 0 H ILE A 49 12.778 14.288 2.345 1.00 0.78 H new ATOM 0 HA ILE A 49 11.711 11.877 3.682 1.00 0.75 H new ATOM 0 HB ILE A 49 10.326 14.561 3.413 1.00 0.86 H new ATOM 0 HG12 ILE A 49 11.775 13.432 5.831 1.00 1.17 H new ATOM 0 HG13 ILE A 49 12.363 14.745 4.830 1.00 1.17 H new ATOM 0 HG21 ILE A 49 8.820 13.603 5.121 1.00 0.95 H new ATOM 0 HG22 ILE A 49 8.856 12.608 3.646 1.00 0.95 H new ATOM 0 HG23 ILE A 49 9.756 12.089 5.091 1.00 0.95 H new ATOM 0 HD11 ILE A 49 11.321 15.598 6.870 1.00 1.93 H new ATOM 0 HD12 ILE A 49 10.396 16.107 5.437 1.00 1.93 H new ATOM 0 HD13 ILE A 49 9.799 14.774 6.454 1.00 1.93 H new ATOM 697 N PRO A 50 10.847 11.320 1.317 1.00 0.57 N ATOM 698 CA PRO A 50 10.322 10.994 -0.011 1.00 0.52 C ATOM 699 C PRO A 50 8.894 11.490 -0.216 1.00 0.53 C ATOM 700 O PRO A 50 7.934 10.897 0.268 1.00 0.53 O ATOM 701 CB PRO A 50 10.401 9.464 -0.074 1.00 0.54 C ATOM 702 CG PRO A 50 11.449 9.103 0.921 1.00 0.66 C ATOM 703 CD PRO A 50 11.373 10.136 2.011 1.00 0.68 C ATOM 0 HA PRO A 50 10.891 11.481 -0.802 1.00 0.52 H new ATOM 0 HB2 PRO A 50 9.443 9.007 0.175 1.00 0.54 H new ATOM 0 HB3 PRO A 50 10.668 9.121 -1.074 1.00 0.54 H new ATOM 0 HG2 PRO A 50 11.277 8.103 1.321 1.00 0.66 H new ATOM 0 HG3 PRO A 50 12.437 9.097 0.460 1.00 0.66 H new ATOM 0 HD2 PRO A 50 10.716 9.819 2.821 1.00 0.68 H new ATOM 0 HD3 PRO A 50 12.351 10.329 2.451 1.00 0.68 H new ATOM 711 N ASP A 51 8.775 12.593 -0.946 1.00 0.59 N ATOM 712 CA ASP A 51 7.490 13.242 -1.214 1.00 0.63 C ATOM 713 C ASP A 51 6.582 12.328 -2.040 1.00 0.52 C ATOM 714 O ASP A 51 5.383 12.569 -2.176 1.00 0.54 O ATOM 715 CB ASP A 51 7.740 14.564 -1.950 1.00 0.84 C ATOM 716 CG ASP A 51 6.512 15.452 -2.028 1.00 1.30 C ATOM 717 OD1 ASP A 51 6.117 16.019 -0.987 1.00 1.86 O ATOM 718 OD2 ASP A 51 5.915 15.554 -3.123 1.00 2.04 O ATOM 0 H ASP A 51 9.570 13.068 -1.373 1.00 0.59 H new ATOM 0 HA ASP A 51 6.985 13.443 -0.269 1.00 0.63 H new ATOM 0 HB2 ASP A 51 8.540 15.106 -1.446 1.00 0.84 H new ATOM 0 HB3 ASP A 51 8.088 14.349 -2.960 1.00 0.84 H new ATOM 723 N ASN A 52 7.175 11.256 -2.550 1.00 0.47 N ATOM 724 CA ASN A 52 6.489 10.285 -3.397 1.00 0.49 C ATOM 725 C ASN A 52 5.369 9.588 -2.631 1.00 0.43 C ATOM 726 O ASN A 52 4.478 8.981 -3.224 1.00 0.56 O ATOM 727 CB ASN A 52 7.495 9.236 -3.888 1.00 0.59 C ATOM 728 CG ASN A 52 8.646 9.833 -4.674 1.00 1.32 C ATOM 729 OD1 ASN A 52 8.482 10.813 -5.397 1.00 2.22 O ATOM 730 ND2 ASN A 52 9.827 9.250 -4.519 1.00 1.84 N ATOM 0 H ASN A 52 8.157 11.033 -2.386 1.00 0.47 H new ATOM 0 HA ASN A 52 6.054 10.814 -4.245 1.00 0.49 H new ATOM 0 HB2 ASN A 52 7.892 8.694 -3.030 1.00 0.59 H new ATOM 0 HB3 ASN A 52 6.976 8.509 -4.512 1.00 0.59 H new ATOM 0 HD21 ASN A 52 10.644 9.614 -5.010 1.00 1.84 H new ATOM 0 HD22 ASN A 52 9.919 8.438 -3.909 1.00 1.84 H new ATOM 737 N TYR A 53 5.435 9.670 -1.309 1.00 0.39 N ATOM 738 CA TYR A 53 4.455 9.048 -0.427 1.00 0.52 C ATOM 739 C TYR A 53 3.041 9.520 -0.750 1.00 0.56 C ATOM 740 O TYR A 53 2.083 8.761 -0.641 1.00 0.83 O ATOM 741 CB TYR A 53 4.805 9.365 1.020 1.00 0.66 C ATOM 742 CG TYR A 53 6.131 8.783 1.454 1.00 0.63 C ATOM 743 CD1 TYR A 53 6.734 7.764 0.731 1.00 0.67 C ATOM 744 CD2 TYR A 53 6.787 9.261 2.584 1.00 0.67 C ATOM 745 CE1 TYR A 53 7.952 7.245 1.117 1.00 0.73 C ATOM 746 CE2 TYR A 53 8.001 8.743 2.977 1.00 0.67 C ATOM 747 CZ TYR A 53 8.552 7.690 2.263 1.00 0.70 C ATOM 748 OH TYR A 53 9.799 7.227 2.613 1.00 0.79 O ATOM 0 H TYR A 53 6.173 10.172 -0.815 1.00 0.39 H new ATOM 0 HA TYR A 53 4.483 7.969 -0.580 1.00 0.52 H new ATOM 0 HB2 TYR A 53 4.830 10.447 1.152 1.00 0.66 H new ATOM 0 HB3 TYR A 53 4.018 8.982 1.670 1.00 0.66 H new ATOM 0 HD1 TYR A 53 6.242 7.371 -0.147 1.00 0.67 H new ATOM 0 HD2 TYR A 53 6.336 10.053 3.164 1.00 0.67 H new ATOM 0 HE1 TYR A 53 8.432 6.488 0.515 1.00 0.73 H new ATOM 0 HE2 TYR A 53 8.518 9.153 3.832 1.00 0.67 H new ATOM 0 HH TYR A 53 10.043 6.475 2.034 1.00 0.79 H new ATOM 758 N LYS A 54 2.919 10.753 -1.189 1.00 0.46 N ATOM 759 CA LYS A 54 1.626 11.305 -1.537 1.00 0.49 C ATOM 760 C LYS A 54 1.603 11.705 -3.009 1.00 0.52 C ATOM 761 O LYS A 54 2.642 12.004 -3.594 1.00 0.72 O ATOM 762 CB LYS A 54 1.338 12.536 -0.678 1.00 0.61 C ATOM 763 CG LYS A 54 2.514 13.498 -0.603 1.00 0.85 C ATOM 764 CD LYS A 54 2.095 14.882 -0.142 1.00 1.15 C ATOM 765 CE LYS A 54 3.309 15.761 0.112 1.00 1.15 C ATOM 766 NZ LYS A 54 2.960 17.204 0.162 1.00 1.75 N ATOM 0 H LYS A 54 3.701 11.395 -1.314 1.00 0.46 H new ATOM 0 HA LYS A 54 0.864 10.546 -1.357 1.00 0.49 H new ATOM 0 HB2 LYS A 54 0.472 13.060 -1.083 1.00 0.61 H new ATOM 0 HB3 LYS A 54 1.074 12.215 0.330 1.00 0.61 H new ATOM 0 HG2 LYS A 54 3.263 13.100 0.082 1.00 0.85 H new ATOM 0 HG3 LYS A 54 2.985 13.571 -1.583 1.00 0.85 H new ATOM 0 HD2 LYS A 54 1.459 15.344 -0.897 1.00 1.15 H new ATOM 0 HD3 LYS A 54 1.502 14.802 0.769 1.00 1.15 H new ATOM 0 HE2 LYS A 54 3.775 15.469 1.053 1.00 1.15 H new ATOM 0 HE3 LYS A 54 4.046 15.595 -0.674 1.00 1.15 H new ATOM 0 HZ1 LYS A 54 3.819 17.763 0.337 1.00 1.75 H new ATOM 0 HZ2 LYS A 54 2.539 17.491 -0.745 1.00 1.75 H new ATOM 0 HZ3 LYS A 54 2.277 17.370 0.929 1.00 1.75 H new ATOM 780 N ASP A 55 0.423 11.709 -3.607 1.00 0.48 N ATOM 781 CA ASP A 55 0.263 12.249 -4.949 1.00 0.51 C ATOM 782 C ASP A 55 -0.669 13.460 -4.910 1.00 0.60 C ATOM 783 O ASP A 55 -1.653 13.464 -4.167 1.00 0.72 O ATOM 784 CB ASP A 55 -0.281 11.193 -5.911 1.00 0.49 C ATOM 785 CG ASP A 55 -0.382 11.717 -7.325 1.00 0.90 C ATOM 786 OD1 ASP A 55 0.642 11.763 -8.036 1.00 1.35 O ATOM 787 OD2 ASP A 55 -1.486 12.095 -7.731 1.00 1.29 O ATOM 0 H ASP A 55 -0.434 11.347 -3.188 1.00 0.48 H new ATOM 0 HA ASP A 55 1.243 12.558 -5.313 1.00 0.51 H new ATOM 0 HB2 ASP A 55 0.368 10.318 -5.894 1.00 0.49 H new ATOM 0 HB3 ASP A 55 -1.265 10.867 -5.574 1.00 0.49 H new ATOM 792 N THR A 56 -0.361 14.480 -5.701 1.00 0.67 N ATOM 793 CA THR A 56 -1.123 15.723 -5.677 1.00 0.78 C ATOM 794 C THR A 56 -2.238 15.711 -6.715 1.00 0.75 C ATOM 795 O THR A 56 -3.195 16.478 -6.618 1.00 0.78 O ATOM 796 CB THR A 56 -0.204 16.934 -5.907 1.00 0.98 C ATOM 797 OG1 THR A 56 0.750 16.636 -6.938 1.00 1.50 O ATOM 798 CG2 THR A 56 0.521 17.306 -4.625 1.00 1.52 C ATOM 0 H THR A 56 0.411 14.471 -6.367 1.00 0.67 H new ATOM 0 HA THR A 56 -1.576 15.808 -4.689 1.00 0.78 H new ATOM 0 HB THR A 56 -0.817 17.780 -6.218 1.00 0.98 H new ATOM 0 HG1 THR A 56 1.331 17.412 -7.080 1.00 1.50 H new ATOM 0 HG21 THR A 56 1.166 18.165 -4.808 1.00 1.52 H new ATOM 0 HG22 THR A 56 -0.208 17.557 -3.855 1.00 1.52 H new ATOM 0 HG23 THR A 56 1.126 16.463 -4.291 1.00 1.52 H new ATOM 806 N THR A 57 -2.115 14.839 -7.705 1.00 0.76 N ATOM 807 CA THR A 57 -3.200 14.598 -8.643 1.00 0.79 C ATOM 808 C THR A 57 -4.217 13.681 -7.969 1.00 0.74 C ATOM 809 O THR A 57 -5.326 13.463 -8.462 1.00 1.04 O ATOM 810 CB THR A 57 -2.689 13.942 -9.943 1.00 0.89 C ATOM 811 OG1 THR A 57 -1.487 14.591 -10.384 1.00 1.00 O ATOM 812 CG2 THR A 57 -3.733 14.023 -11.045 1.00 1.05 C ATOM 0 H THR A 57 -1.275 14.287 -7.879 1.00 0.76 H new ATOM 0 HA THR A 57 -3.655 15.551 -8.913 1.00 0.79 H new ATOM 0 HB THR A 57 -2.485 12.893 -9.729 1.00 0.89 H new ATOM 0 HG1 THR A 57 -1.427 14.540 -11.361 1.00 1.00 H new ATOM 0 HG21 THR A 57 -3.345 13.553 -11.949 1.00 1.05 H new ATOM 0 HG22 THR A 57 -4.639 13.506 -10.727 1.00 1.05 H new ATOM 0 HG23 THR A 57 -3.965 15.068 -11.250 1.00 1.05 H new ATOM 820 N ASN A 58 -3.791 13.158 -6.819 1.00 0.65 N ATOM 821 CA ASN A 58 -4.596 12.298 -5.965 1.00 0.70 C ATOM 822 C ASN A 58 -4.742 10.912 -6.565 1.00 0.59 C ATOM 823 O ASN A 58 -5.811 10.295 -6.512 1.00 0.66 O ATOM 824 CB ASN A 58 -5.957 12.924 -5.665 1.00 0.95 C ATOM 825 CG ASN A 58 -5.811 14.212 -4.881 1.00 1.91 C ATOM 826 OD1 ASN A 58 -5.633 14.192 -3.663 1.00 2.73 O ATOM 827 ND2 ASN A 58 -5.895 15.341 -5.569 1.00 2.46 N ATOM 0 H ASN A 58 -2.855 13.327 -6.451 1.00 0.65 H new ATOM 0 HA ASN A 58 -4.072 12.192 -5.015 1.00 0.70 H new ATOM 0 HB2 ASN A 58 -6.482 13.122 -6.599 1.00 0.95 H new ATOM 0 HB3 ASN A 58 -6.567 12.219 -5.100 1.00 0.95 H new ATOM 0 HD21 ASN A 58 -5.812 16.238 -5.090 1.00 2.46 H new ATOM 0 HD22 ASN A 58 -6.043 15.314 -6.578 1.00 2.46 H new ATOM 834 N LYS A 59 -3.649 10.412 -7.129 1.00 0.52 N ATOM 835 CA LYS A 59 -3.596 9.035 -7.564 1.00 0.51 C ATOM 836 C LYS A 59 -2.229 8.430 -7.199 1.00 0.45 C ATOM 837 O LYS A 59 -1.256 8.506 -7.939 1.00 0.48 O ATOM 838 CB LYS A 59 -3.957 8.902 -9.075 1.00 0.58 C ATOM 839 CG LYS A 59 -2.832 9.102 -10.071 1.00 0.83 C ATOM 840 CD LYS A 59 -2.293 10.511 -10.040 1.00 0.64 C ATOM 841 CE LYS A 59 -1.100 10.643 -10.950 1.00 1.53 C ATOM 842 NZ LYS A 59 -0.288 11.844 -10.625 1.00 2.11 N ATOM 0 H LYS A 59 -2.794 10.943 -7.292 1.00 0.52 H new ATOM 0 HA LYS A 59 -4.354 8.455 -7.037 1.00 0.51 H new ATOM 0 HB2 LYS A 59 -4.380 7.910 -9.236 1.00 0.58 H new ATOM 0 HB3 LYS A 59 -4.742 9.624 -9.301 1.00 0.58 H new ATOM 0 HG2 LYS A 59 -2.026 8.401 -9.853 1.00 0.83 H new ATOM 0 HG3 LYS A 59 -3.191 8.873 -11.074 1.00 0.83 H new ATOM 0 HD2 LYS A 59 -3.071 11.210 -10.347 1.00 0.64 H new ATOM 0 HD3 LYS A 59 -2.011 10.776 -9.021 1.00 0.64 H new ATOM 0 HE2 LYS A 59 -0.479 9.751 -10.867 1.00 1.53 H new ATOM 0 HE3 LYS A 59 -1.437 10.701 -11.985 1.00 1.53 H new ATOM 0 HZ1 LYS A 59 0.647 11.762 -11.072 1.00 2.11 H new ATOM 0 HZ2 LYS A 59 -0.769 12.695 -10.981 1.00 2.11 H new ATOM 0 HZ3 LYS A 59 -0.173 11.917 -9.594 1.00 2.11 H new ATOM 856 N LYS A 60 -2.147 7.907 -5.989 1.00 0.41 N ATOM 857 CA LYS A 60 -0.966 7.177 -5.542 1.00 0.38 C ATOM 858 C LYS A 60 -1.386 6.059 -4.600 1.00 0.38 C ATOM 859 O LYS A 60 -2.134 6.287 -3.646 1.00 0.41 O ATOM 860 CB LYS A 60 0.037 8.128 -4.846 1.00 0.41 C ATOM 861 CG LYS A 60 1.390 7.501 -4.472 1.00 0.45 C ATOM 862 CD LYS A 60 1.273 6.549 -3.291 1.00 1.22 C ATOM 863 CE LYS A 60 2.584 5.846 -2.995 1.00 2.18 C ATOM 864 NZ LYS A 60 3.499 6.673 -2.169 1.00 3.14 N ATOM 0 H LYS A 60 -2.888 7.973 -5.291 1.00 0.41 H new ATOM 0 HA LYS A 60 -0.468 6.745 -6.410 1.00 0.38 H new ATOM 0 HB2 LYS A 60 0.219 8.979 -5.502 1.00 0.41 H new ATOM 0 HB3 LYS A 60 -0.427 8.517 -3.940 1.00 0.41 H new ATOM 0 HG2 LYS A 60 1.790 6.964 -5.332 1.00 0.45 H new ATOM 0 HG3 LYS A 60 2.101 8.291 -4.231 1.00 0.45 H new ATOM 0 HD2 LYS A 60 0.952 7.103 -2.409 1.00 1.22 H new ATOM 0 HD3 LYS A 60 0.503 5.807 -3.499 1.00 1.22 H new ATOM 0 HE2 LYS A 60 2.381 4.908 -2.478 1.00 2.18 H new ATOM 0 HE3 LYS A 60 3.077 5.592 -3.934 1.00 2.18 H new ATOM 0 HZ1 LYS A 60 4.302 6.092 -1.853 1.00 3.14 H new ATOM 0 HZ2 LYS A 60 3.851 7.472 -2.734 1.00 3.14 H new ATOM 0 HZ3 LYS A 60 2.986 7.035 -1.340 1.00 3.14 H new ATOM 878 N ILE A 61 -0.913 4.855 -4.881 1.00 0.37 N ATOM 879 CA ILE A 61 -1.091 3.729 -3.983 1.00 0.38 C ATOM 880 C ILE A 61 0.240 2.999 -3.809 1.00 0.38 C ATOM 881 O ILE A 61 0.923 2.696 -4.789 1.00 0.45 O ATOM 882 CB ILE A 61 -2.177 2.741 -4.483 1.00 0.45 C ATOM 883 CG1 ILE A 61 -1.863 2.226 -5.896 1.00 0.49 C ATOM 884 CG2 ILE A 61 -3.546 3.398 -4.451 1.00 0.47 C ATOM 885 CD1 ILE A 61 -2.980 1.406 -6.511 1.00 0.55 C ATOM 0 H ILE A 61 -0.398 4.633 -5.733 1.00 0.37 H new ATOM 0 HA ILE A 61 -1.431 4.122 -3.025 1.00 0.38 H new ATOM 0 HB ILE A 61 -2.181 1.883 -3.810 1.00 0.45 H new ATOM 0 HG12 ILE A 61 -1.650 3.077 -6.544 1.00 0.49 H new ATOM 0 HG13 ILE A 61 -0.958 1.620 -5.859 1.00 0.49 H new ATOM 0 HG21 ILE A 61 -4.297 2.692 -4.805 1.00 0.47 H new ATOM 0 HG22 ILE A 61 -3.782 3.697 -3.430 1.00 0.47 H new ATOM 0 HG23 ILE A 61 -3.543 4.277 -5.095 1.00 0.47 H new ATOM 0 HD11 ILE A 61 -2.684 1.078 -7.508 1.00 0.55 H new ATOM 0 HD12 ILE A 61 -3.178 0.535 -5.886 1.00 0.55 H new ATOM 0 HD13 ILE A 61 -3.882 2.015 -6.582 1.00 0.55 H new ATOM 897 N THR A 62 0.642 2.762 -2.570 1.00 0.39 N ATOM 898 CA THR A 62 1.884 2.047 -2.311 1.00 0.45 C ATOM 899 C THR A 62 1.639 0.547 -2.317 1.00 0.50 C ATOM 900 O THR A 62 0.892 0.047 -1.481 1.00 0.62 O ATOM 901 CB THR A 62 2.514 2.457 -0.969 1.00 0.56 C ATOM 902 OG1 THR A 62 2.848 3.843 -1.000 1.00 0.84 O ATOM 903 CG2 THR A 62 3.759 1.643 -0.676 1.00 0.84 C ATOM 0 H THR A 62 0.133 3.051 -1.735 1.00 0.39 H new ATOM 0 HA THR A 62 2.580 2.311 -3.107 1.00 0.45 H new ATOM 0 HB THR A 62 1.787 2.267 -0.180 1.00 0.56 H new ATOM 0 HG1 THR A 62 3.636 4.002 -0.439 1.00 0.84 H new ATOM 0 HG21 THR A 62 4.182 1.956 0.279 1.00 0.84 H new ATOM 0 HG22 THR A 62 3.500 0.585 -0.629 1.00 0.84 H new ATOM 0 HG23 THR A 62 4.492 1.802 -1.467 1.00 0.84 H new ATOM 911 N ASN A 63 2.259 -0.138 -3.284 1.00 0.52 N ATOM 912 CA ASN A 63 2.145 -1.593 -3.451 1.00 0.61 C ATOM 913 C ASN A 63 2.523 -2.020 -4.869 1.00 0.76 C ATOM 914 O ASN A 63 3.418 -2.844 -5.050 1.00 1.31 O ATOM 915 CB ASN A 63 0.730 -2.108 -3.157 1.00 1.03 C ATOM 916 CG ASN A 63 0.564 -3.581 -3.480 1.00 1.80 C ATOM 917 OD1 ASN A 63 0.161 -3.948 -4.584 1.00 2.50 O ATOM 918 ND2 ASN A 63 0.876 -4.435 -2.521 1.00 2.26 N ATOM 0 H ASN A 63 2.860 0.305 -3.979 1.00 0.52 H new ATOM 0 HA ASN A 63 2.837 -2.028 -2.730 1.00 0.61 H new ATOM 0 HB2 ASN A 63 0.499 -1.943 -2.105 1.00 1.03 H new ATOM 0 HB3 ASN A 63 0.010 -1.530 -3.736 1.00 1.03 H new ATOM 0 HD21 ASN A 63 0.786 -5.438 -2.682 1.00 2.26 H new ATOM 0 HD22 ASN A 63 1.207 -4.091 -1.619 1.00 2.26 H new ATOM 925 N PRO A 64 1.863 -1.452 -5.902 1.00 0.64 N ATOM 926 CA PRO A 64 1.922 -1.973 -7.255 1.00 0.97 C ATOM 927 C PRO A 64 3.074 -1.387 -8.067 1.00 1.15 C ATOM 928 O PRO A 64 3.706 -0.409 -7.667 1.00 1.75 O ATOM 929 CB PRO A 64 0.559 -1.551 -7.841 1.00 0.91 C ATOM 930 CG PRO A 64 -0.037 -0.570 -6.867 1.00 0.85 C ATOM 931 CD PRO A 64 1.036 -0.244 -5.873 1.00 0.60 C ATOM 0 HA PRO A 64 2.101 -3.048 -7.277 1.00 0.97 H new ATOM 0 HB2 PRO A 64 0.683 -1.096 -8.824 1.00 0.91 H new ATOM 0 HB3 PRO A 64 -0.093 -2.415 -7.970 1.00 0.91 H new ATOM 0 HG2 PRO A 64 -0.374 0.330 -7.382 1.00 0.85 H new ATOM 0 HG3 PRO A 64 -0.908 -0.998 -6.370 1.00 0.85 H new ATOM 0 HD2 PRO A 64 1.601 0.643 -6.160 1.00 0.60 H new ATOM 0 HD3 PRO A 64 0.627 -0.054 -4.880 1.00 0.60 H new ATOM 939 N PHE A 65 3.327 -1.992 -9.217 1.00 1.16 N ATOM 940 CA PHE A 65 4.404 -1.571 -10.099 1.00 1.47 C ATOM 941 C PHE A 65 3.919 -1.585 -11.546 1.00 1.30 C ATOM 942 O PHE A 65 4.663 -1.913 -12.471 1.00 1.80 O ATOM 943 CB PHE A 65 5.626 -2.487 -9.920 1.00 2.09 C ATOM 944 CG PHE A 65 5.311 -3.961 -9.944 1.00 2.12 C ATOM 945 CD1 PHE A 65 5.317 -4.663 -11.140 1.00 2.65 C ATOM 946 CD2 PHE A 65 5.006 -4.642 -8.776 1.00 2.10 C ATOM 947 CE1 PHE A 65 5.025 -6.013 -11.171 1.00 3.23 C ATOM 948 CE2 PHE A 65 4.714 -5.993 -8.800 1.00 2.47 C ATOM 949 CZ PHE A 65 4.731 -6.681 -9.976 1.00 3.09 C ATOM 0 H PHE A 65 2.792 -2.788 -9.565 1.00 1.16 H new ATOM 0 HA PHE A 65 4.704 -0.555 -9.843 1.00 1.47 H new ATOM 0 HB2 PHE A 65 6.346 -2.269 -10.709 1.00 2.09 H new ATOM 0 HB3 PHE A 65 6.109 -2.247 -8.973 1.00 2.09 H new ATOM 0 HD1 PHE A 65 5.553 -4.148 -12.059 1.00 2.65 H new ATOM 0 HD2 PHE A 65 4.996 -4.111 -7.836 1.00 2.10 H new ATOM 0 HE1 PHE A 65 5.024 -6.549 -12.109 1.00 3.23 H new ATOM 0 HE2 PHE A 65 4.471 -6.506 -7.881 1.00 2.47 H new ATOM 0 HZ PHE A 65 4.518 -7.740 -9.986 1.00 3.09 H new ATOM 959 N GLY A 66 2.664 -1.190 -11.735 1.00 0.85 N ATOM 960 CA GLY A 66 2.053 -1.277 -13.043 1.00 0.86 C ATOM 961 C GLY A 66 2.214 -0.006 -13.847 1.00 0.86 C ATOM 962 O GLY A 66 1.955 0.015 -15.048 1.00 1.21 O ATOM 0 H GLY A 66 2.062 -0.812 -11.004 1.00 0.85 H new ATOM 0 HA2 GLY A 66 2.496 -2.108 -13.592 1.00 0.86 H new ATOM 0 HA3 GLY A 66 0.992 -1.499 -12.930 1.00 0.86 H new ATOM 966 N GLY A 67 2.638 1.056 -13.180 1.00 0.70 N ATOM 967 CA GLY A 67 2.758 2.347 -13.825 1.00 0.70 C ATOM 968 C GLY A 67 4.013 3.069 -13.394 1.00 0.65 C ATOM 969 O GLY A 67 5.118 2.618 -13.683 1.00 0.67 O ATOM 0 H GLY A 67 2.903 1.046 -12.195 1.00 0.70 H new ATOM 0 HA2 GLY A 67 2.767 2.214 -14.907 1.00 0.70 H new ATOM 0 HA3 GLY A 67 1.887 2.956 -13.586 1.00 0.70 H new ATOM 973 N GLU A 68 3.846 4.173 -12.683 1.00 0.63 N ATOM 974 CA GLU A 68 4.976 4.919 -12.153 1.00 0.64 C ATOM 975 C GLU A 68 5.363 4.356 -10.795 1.00 0.58 C ATOM 976 O GLU A 68 4.712 4.640 -9.793 1.00 0.59 O ATOM 977 CB GLU A 68 4.601 6.392 -12.016 1.00 0.73 C ATOM 978 CG GLU A 68 5.723 7.283 -11.509 1.00 1.36 C ATOM 979 CD GLU A 68 6.109 8.353 -12.504 1.00 1.84 C ATOM 980 OE1 GLU A 68 5.311 9.292 -12.718 1.00 2.78 O ATOM 981 OE2 GLU A 68 7.217 8.266 -13.080 1.00 1.99 O ATOM 0 H GLU A 68 2.935 4.573 -12.459 1.00 0.63 H new ATOM 0 HA GLU A 68 5.822 4.829 -12.834 1.00 0.64 H new ATOM 0 HB2 GLU A 68 4.271 6.762 -12.987 1.00 0.73 H new ATOM 0 HB3 GLU A 68 3.752 6.476 -11.337 1.00 0.73 H new ATOM 0 HG2 GLU A 68 5.415 7.754 -10.576 1.00 1.36 H new ATOM 0 HG3 GLU A 68 6.595 6.670 -11.283 1.00 1.36 H new ATOM 988 N LEU A 69 6.408 3.548 -10.771 1.00 0.57 N ATOM 989 CA LEU A 69 6.841 2.900 -9.536 1.00 0.57 C ATOM 990 C LEU A 69 8.138 3.496 -8.992 1.00 0.55 C ATOM 991 O LEU A 69 9.074 3.783 -9.739 1.00 0.60 O ATOM 992 CB LEU A 69 7.011 1.383 -9.739 1.00 0.69 C ATOM 993 CG LEU A 69 8.044 0.959 -10.793 1.00 0.83 C ATOM 994 CD1 LEU A 69 8.767 -0.299 -10.342 1.00 1.15 C ATOM 995 CD2 LEU A 69 7.378 0.712 -12.140 1.00 1.17 C ATOM 0 H LEU A 69 6.975 3.322 -11.589 1.00 0.57 H new ATOM 0 HA LEU A 69 6.057 3.079 -8.801 1.00 0.57 H new ATOM 0 HB2 LEU A 69 7.291 0.937 -8.784 1.00 0.69 H new ATOM 0 HB3 LEU A 69 6.044 0.962 -10.016 1.00 0.69 H new ATOM 0 HG LEU A 69 8.764 1.770 -10.905 1.00 0.83 H new ATOM 0 HD11 LEU A 69 9.497 -0.590 -11.098 1.00 1.15 H new ATOM 0 HD12 LEU A 69 9.278 -0.107 -9.399 1.00 1.15 H new ATOM 0 HD13 LEU A 69 8.045 -1.104 -10.206 1.00 1.15 H new ATOM 0 HD21 LEU A 69 8.131 0.413 -12.869 1.00 1.17 H new ATOM 0 HD22 LEU A 69 6.636 -0.080 -12.039 1.00 1.17 H new ATOM 0 HD23 LEU A 69 6.889 1.626 -12.477 1.00 1.17 H new ATOM 1007 N ASN A 70 8.166 3.689 -7.677 1.00 0.52 N ATOM 1008 CA ASN A 70 9.369 4.112 -6.969 1.00 0.53 C ATOM 1009 C ASN A 70 9.654 3.126 -5.838 1.00 0.49 C ATOM 1010 O ASN A 70 8.799 2.903 -4.980 1.00 0.51 O ATOM 1011 CB ASN A 70 9.189 5.528 -6.407 1.00 0.59 C ATOM 1012 CG ASN A 70 10.487 6.124 -5.880 1.00 0.65 C ATOM 1013 OD1 ASN A 70 11.287 6.648 -6.653 1.00 0.92 O ATOM 1014 ND2 ASN A 70 10.692 6.097 -4.564 1.00 0.73 N ATOM 0 H ASN A 70 7.355 3.557 -7.072 1.00 0.52 H new ATOM 0 HA ASN A 70 10.211 4.126 -7.661 1.00 0.53 H new ATOM 0 HB2 ASN A 70 8.788 6.175 -7.187 1.00 0.59 H new ATOM 0 HB3 ASN A 70 8.453 5.504 -5.603 1.00 0.59 H new ATOM 0 HD21 ASN A 70 11.533 6.519 -4.170 1.00 0.73 H new ATOM 0 HD22 ASN A 70 10.008 5.654 -3.950 1.00 0.73 H new ATOM 1021 N VAL A 71 10.845 2.544 -5.837 1.00 0.51 N ATOM 1022 CA VAL A 71 11.165 1.462 -4.910 1.00 0.52 C ATOM 1023 C VAL A 71 11.532 1.990 -3.528 1.00 0.49 C ATOM 1024 O VAL A 71 11.976 3.126 -3.390 1.00 0.58 O ATOM 1025 CB VAL A 71 12.324 0.584 -5.437 1.00 0.68 C ATOM 1026 CG1 VAL A 71 11.948 -0.073 -6.757 1.00 0.97 C ATOM 1027 CG2 VAL A 71 13.604 1.396 -5.589 1.00 1.02 C ATOM 0 H VAL A 71 11.606 2.801 -6.466 1.00 0.51 H new ATOM 0 HA VAL A 71 10.264 0.854 -4.829 1.00 0.52 H new ATOM 0 HB VAL A 71 12.507 -0.200 -4.703 1.00 0.68 H new ATOM 0 HG11 VAL A 71 12.779 -0.685 -7.108 1.00 0.97 H new ATOM 0 HG12 VAL A 71 11.069 -0.701 -6.613 1.00 0.97 H new ATOM 0 HG13 VAL A 71 11.727 0.697 -7.496 1.00 0.97 H new ATOM 0 HG21 VAL A 71 14.401 0.752 -5.961 1.00 1.02 H new ATOM 0 HG22 VAL A 71 13.437 2.211 -6.294 1.00 1.02 H new ATOM 0 HG23 VAL A 71 13.891 1.807 -4.621 1.00 1.02 H new ATOM 1037 N GLY A 72 11.317 1.159 -2.513 1.00 0.44 N ATOM 1038 CA GLY A 72 11.739 1.497 -1.163 1.00 0.46 C ATOM 1039 C GLY A 72 11.580 0.332 -0.196 1.00 0.44 C ATOM 1040 O GLY A 72 10.785 -0.570 -0.445 1.00 0.48 O ATOM 0 H GLY A 72 10.856 0.253 -2.601 1.00 0.44 H new ATOM 0 HA2 GLY A 72 12.782 1.812 -1.180 1.00 0.46 H new ATOM 0 HA3 GLY A 72 11.156 2.345 -0.805 1.00 0.46 H new ATOM 1044 N PRO A 73 12.356 0.310 0.900 1.00 0.53 N ATOM 1045 CA PRO A 73 12.235 -0.696 1.955 1.00 0.54 C ATOM 1046 C PRO A 73 11.405 -0.206 3.144 1.00 0.49 C ATOM 1047 O PRO A 73 11.215 0.998 3.325 1.00 0.59 O ATOM 1048 CB PRO A 73 13.688 -0.871 2.366 1.00 0.72 C ATOM 1049 CG PRO A 73 14.282 0.494 2.223 1.00 1.00 C ATOM 1050 CD PRO A 73 13.458 1.237 1.190 1.00 0.76 C ATOM 0 HA PRO A 73 11.730 -1.604 1.624 1.00 0.54 H new ATOM 0 HB2 PRO A 73 13.770 -1.235 3.390 1.00 0.72 H new ATOM 0 HB3 PRO A 73 14.197 -1.594 1.729 1.00 0.72 H new ATOM 0 HG2 PRO A 73 14.269 1.021 3.177 1.00 1.00 H new ATOM 0 HG3 PRO A 73 15.324 0.429 1.909 1.00 1.00 H new ATOM 0 HD2 PRO A 73 13.092 2.188 1.577 1.00 0.76 H new ATOM 0 HD3 PRO A 73 14.041 1.460 0.296 1.00 0.76 H new ATOM 1058 N ALA A 74 10.928 -1.130 3.974 1.00 0.51 N ATOM 1059 CA ALA A 74 10.068 -0.754 5.089 1.00 0.61 C ATOM 1060 C ALA A 74 10.460 -1.447 6.393 1.00 0.84 C ATOM 1061 O ALA A 74 10.107 -2.602 6.620 1.00 1.58 O ATOM 1062 CB ALA A 74 8.623 -1.054 4.751 1.00 0.86 C ATOM 0 H ALA A 74 11.119 -2.129 3.897 1.00 0.51 H new ATOM 0 HA ALA A 74 10.195 0.317 5.248 1.00 0.61 H new ATOM 0 HB1 ALA A 74 7.987 -0.770 5.589 1.00 0.86 H new ATOM 0 HB2 ALA A 74 8.331 -0.488 3.866 1.00 0.86 H new ATOM 0 HB3 ALA A 74 8.509 -2.120 4.554 1.00 0.86 H new ATOM 1068 N ASN A 75 11.184 -0.700 7.229 1.00 0.62 N ATOM 1069 CA ASN A 75 11.577 -1.108 8.583 1.00 0.74 C ATOM 1070 C ASN A 75 12.280 -2.462 8.630 1.00 0.76 C ATOM 1071 O ASN A 75 13.508 -2.536 8.636 1.00 0.85 O ATOM 1072 CB ASN A 75 10.368 -1.129 9.522 1.00 0.99 C ATOM 1073 CG ASN A 75 10.767 -1.354 10.970 1.00 1.38 C ATOM 1074 OD1 ASN A 75 10.070 -2.037 11.717 1.00 2.09 O ATOM 1075 ND2 ASN A 75 11.885 -0.766 11.380 1.00 1.58 N ATOM 0 H ASN A 75 11.523 0.229 6.979 1.00 0.62 H new ATOM 0 HA ASN A 75 12.295 -0.359 8.918 1.00 0.74 H new ATOM 0 HB2 ASN A 75 9.829 -0.185 9.438 1.00 0.99 H new ATOM 0 HB3 ASN A 75 9.682 -1.916 9.210 1.00 0.99 H new ATOM 0 HD21 ASN A 75 12.193 -0.873 12.346 1.00 1.58 H new ATOM 0 HD22 ASN A 75 12.436 -0.207 10.728 1.00 1.58 H new ATOM 1082 N ASN A 76 11.491 -3.524 8.646 1.00 0.75 N ATOM 1083 CA ASN A 76 12.006 -4.864 8.887 1.00 0.82 C ATOM 1084 C ASN A 76 11.172 -5.901 8.139 1.00 0.77 C ATOM 1085 O ASN A 76 9.999 -5.671 7.860 1.00 0.81 O ATOM 1086 CB ASN A 76 12.014 -5.170 10.387 1.00 1.02 C ATOM 1087 CG ASN A 76 12.716 -6.474 10.712 1.00 1.32 C ATOM 1088 OD1 ASN A 76 12.101 -7.539 10.708 1.00 2.08 O ATOM 1089 ND2 ASN A 76 14.009 -6.401 10.982 1.00 1.38 N ATOM 0 H ASN A 76 10.483 -3.484 8.494 1.00 0.75 H new ATOM 0 HA ASN A 76 13.030 -4.911 8.516 1.00 0.82 H new ATOM 0 HB2 ASN A 76 12.506 -4.355 10.918 1.00 1.02 H new ATOM 0 HB3 ASN A 76 10.987 -5.214 10.751 1.00 1.02 H new ATOM 0 HD21 ASN A 76 14.534 -7.249 11.197 1.00 1.38 H new ATOM 0 HD22 ASN A 76 14.481 -5.497 10.975 1.00 1.38 H new ATOM 1096 N ASN A 77 11.777 -7.050 7.853 1.00 0.80 N ATOM 1097 CA ASN A 77 11.163 -8.068 7.003 1.00 0.86 C ATOM 1098 C ASN A 77 9.996 -8.779 7.697 1.00 0.95 C ATOM 1099 O ASN A 77 9.125 -9.335 7.034 1.00 1.05 O ATOM 1100 CB ASN A 77 12.221 -9.089 6.580 1.00 0.95 C ATOM 1101 CG ASN A 77 11.738 -10.036 5.495 1.00 1.40 C ATOM 1102 OD1 ASN A 77 10.933 -9.670 4.641 1.00 2.28 O ATOM 1103 ND2 ASN A 77 12.243 -11.259 5.517 1.00 1.72 N ATOM 0 H ASN A 77 12.702 -7.302 8.201 1.00 0.80 H new ATOM 0 HA ASN A 77 10.757 -7.565 6.125 1.00 0.86 H new ATOM 0 HB2 ASN A 77 13.105 -8.560 6.225 1.00 0.95 H new ATOM 0 HB3 ASN A 77 12.525 -9.669 7.451 1.00 0.95 H new ATOM 0 HD21 ASN A 77 11.967 -11.938 4.808 1.00 1.72 H new ATOM 0 HD22 ASN A 77 12.909 -11.523 6.243 1.00 1.72 H new ATOM 1110 N THR A 78 9.975 -8.780 9.026 1.00 1.02 N ATOM 1111 CA THR A 78 8.867 -9.403 9.739 1.00 1.22 C ATOM 1112 C THR A 78 7.737 -8.397 9.957 1.00 1.16 C ATOM 1113 O THR A 78 6.556 -8.753 9.943 1.00 1.41 O ATOM 1114 CB THR A 78 9.310 -10.015 11.091 1.00 1.44 C ATOM 1115 OG1 THR A 78 8.237 -10.776 11.662 1.00 1.95 O ATOM 1116 CG2 THR A 78 9.744 -8.942 12.083 1.00 1.88 C ATOM 0 H THR A 78 10.695 -8.367 9.619 1.00 1.02 H new ATOM 0 HA THR A 78 8.504 -10.220 9.116 1.00 1.22 H new ATOM 0 HB THR A 78 10.164 -10.662 10.891 1.00 1.44 H new ATOM 0 HG1 THR A 78 8.527 -11.160 12.516 1.00 1.95 H new ATOM 0 HG21 THR A 78 10.047 -9.412 13.018 1.00 1.88 H new ATOM 0 HG22 THR A 78 10.583 -8.382 11.670 1.00 1.88 H new ATOM 0 HG23 THR A 78 8.913 -8.263 12.271 1.00 1.88 H new ATOM 1124 N ALA A 79 8.105 -7.133 10.130 1.00 0.91 N ATOM 1125 CA ALA A 79 7.129 -6.078 10.338 1.00 0.86 C ATOM 1126 C ALA A 79 6.458 -5.719 9.024 1.00 0.73 C ATOM 1127 O ALA A 79 5.234 -5.662 8.933 1.00 0.77 O ATOM 1128 CB ALA A 79 7.793 -4.855 10.953 1.00 0.88 C ATOM 0 H ALA A 79 9.075 -6.817 10.130 1.00 0.91 H new ATOM 0 HA ALA A 79 6.367 -6.437 11.029 1.00 0.86 H new ATOM 0 HB1 ALA A 79 7.048 -4.073 11.103 1.00 0.88 H new ATOM 0 HB2 ALA A 79 8.234 -5.124 11.913 1.00 0.88 H new ATOM 0 HB3 ALA A 79 8.573 -4.490 10.285 1.00 0.88 H new ATOM 1134 N PHE A 80 7.276 -5.502 8.004 1.00 0.65 N ATOM 1135 CA PHE A 80 6.797 -5.169 6.673 1.00 0.60 C ATOM 1136 C PHE A 80 7.666 -5.884 5.647 1.00 0.72 C ATOM 1137 O PHE A 80 7.896 -7.083 5.761 1.00 1.37 O ATOM 1138 CB PHE A 80 6.843 -3.653 6.448 1.00 0.58 C ATOM 1139 CG PHE A 80 6.097 -2.870 7.488 1.00 0.58 C ATOM 1140 CD1 PHE A 80 4.713 -2.851 7.496 1.00 0.56 C ATOM 1141 CD2 PHE A 80 6.781 -2.167 8.466 1.00 0.72 C ATOM 1142 CE1 PHE A 80 4.023 -2.148 8.459 1.00 0.65 C ATOM 1143 CE2 PHE A 80 6.095 -1.461 9.436 1.00 0.82 C ATOM 1144 CZ PHE A 80 4.714 -1.452 9.432 1.00 0.77 C ATOM 0 H PHE A 80 8.292 -5.552 8.078 1.00 0.65 H new ATOM 0 HA PHE A 80 5.761 -5.492 6.567 1.00 0.60 H new ATOM 0 HB2 PHE A 80 7.883 -3.327 6.436 1.00 0.58 H new ATOM 0 HB3 PHE A 80 6.427 -3.427 5.466 1.00 0.58 H new ATOM 0 HD1 PHE A 80 4.168 -3.394 6.738 1.00 0.56 H new ATOM 0 HD2 PHE A 80 7.861 -2.171 8.471 1.00 0.72 H new ATOM 0 HE1 PHE A 80 2.943 -2.141 8.453 1.00 0.65 H new ATOM 0 HE2 PHE A 80 6.638 -0.918 10.195 1.00 0.82 H new ATOM 0 HZ PHE A 80 4.175 -0.901 10.189 1.00 0.77 H new ATOM 1154 N GLY A 81 8.132 -5.158 4.647 1.00 0.52 N ATOM 1155 CA GLY A 81 9.091 -5.714 3.716 1.00 0.57 C ATOM 1156 C GLY A 81 9.654 -4.645 2.816 1.00 0.50 C ATOM 1157 O GLY A 81 10.759 -4.145 3.030 1.00 0.54 O ATOM 0 H GLY A 81 7.864 -4.192 4.461 1.00 0.52 H new ATOM 0 HA2 GLY A 81 9.900 -6.194 4.266 1.00 0.57 H new ATOM 0 HA3 GLY A 81 8.613 -6.486 3.114 1.00 0.57 H new ATOM 1161 N TYR A 82 8.870 -4.272 1.825 1.00 0.45 N ATOM 1162 CA TYR A 82 9.252 -3.236 0.886 1.00 0.44 C ATOM 1163 C TYR A 82 8.008 -2.481 0.458 1.00 0.41 C ATOM 1164 O TYR A 82 6.893 -2.986 0.602 1.00 0.46 O ATOM 1165 CB TYR A 82 9.959 -3.843 -0.332 1.00 0.54 C ATOM 1166 CG TYR A 82 9.092 -4.785 -1.144 1.00 0.84 C ATOM 1167 CD1 TYR A 82 8.929 -6.114 -0.773 1.00 1.33 C ATOM 1168 CD2 TYR A 82 8.438 -4.339 -2.283 1.00 1.01 C ATOM 1169 CE1 TYR A 82 8.136 -6.967 -1.514 1.00 1.92 C ATOM 1170 CE2 TYR A 82 7.642 -5.187 -3.029 1.00 1.53 C ATOM 1171 CZ TYR A 82 7.495 -6.497 -2.641 1.00 1.98 C ATOM 1172 OH TYR A 82 6.704 -7.342 -3.382 1.00 2.58 O ATOM 0 H TYR A 82 7.951 -4.678 1.648 1.00 0.45 H new ATOM 0 HA TYR A 82 9.949 -2.550 1.366 1.00 0.44 H new ATOM 0 HB2 TYR A 82 10.304 -3.036 -0.978 1.00 0.54 H new ATOM 0 HB3 TYR A 82 10.844 -4.381 0.006 1.00 0.54 H new ATOM 0 HD1 TYR A 82 9.430 -6.485 0.109 1.00 1.33 H new ATOM 0 HD2 TYR A 82 8.553 -3.311 -2.592 1.00 1.01 H new ATOM 0 HE1 TYR A 82 8.018 -7.997 -1.213 1.00 1.92 H new ATOM 0 HE2 TYR A 82 7.138 -4.822 -3.912 1.00 1.53 H new ATOM 0 HH TYR A 82 6.325 -6.853 -4.142 1.00 2.58 H new ATOM 1182 N TYR A 83 8.188 -1.281 -0.052 1.00 0.36 N ATOM 1183 CA TYR A 83 7.067 -0.489 -0.506 1.00 0.38 C ATOM 1184 C TYR A 83 7.361 0.114 -1.868 1.00 0.38 C ATOM 1185 O TYR A 83 8.447 0.640 -2.112 1.00 0.43 O ATOM 1186 CB TYR A 83 6.720 0.609 0.515 1.00 0.39 C ATOM 1187 CG TYR A 83 7.695 1.764 0.580 1.00 0.39 C ATOM 1188 CD1 TYR A 83 8.835 1.696 1.375 1.00 0.50 C ATOM 1189 CD2 TYR A 83 7.486 2.917 -0.159 1.00 0.41 C ATOM 1190 CE1 TYR A 83 9.731 2.747 1.431 1.00 0.58 C ATOM 1191 CE2 TYR A 83 8.377 3.971 -0.108 1.00 0.49 C ATOM 1192 CZ TYR A 83 9.480 3.893 0.712 1.00 0.56 C ATOM 1193 OH TYR A 83 10.380 4.937 0.739 1.00 0.68 O ATOM 0 H TYR A 83 9.098 -0.834 -0.162 1.00 0.36 H new ATOM 0 HA TYR A 83 6.201 -1.144 -0.600 1.00 0.38 H new ATOM 0 HB2 TYR A 83 5.731 1.003 0.278 1.00 0.39 H new ATOM 0 HB3 TYR A 83 6.654 0.155 1.504 1.00 0.39 H new ATOM 0 HD1 TYR A 83 9.023 0.807 1.958 1.00 0.50 H new ATOM 0 HD2 TYR A 83 6.610 2.993 -0.786 1.00 0.41 H new ATOM 0 HE1 TYR A 83 10.623 2.669 2.035 1.00 0.58 H new ATOM 0 HE2 TYR A 83 8.209 4.853 -0.709 1.00 0.49 H new ATOM 0 HH TYR A 83 10.182 5.559 0.008 1.00 0.68 H new ATOM 1203 N LEU A 84 6.405 -0.005 -2.768 1.00 0.40 N ATOM 1204 CA LEU A 84 6.511 0.613 -4.075 1.00 0.42 C ATOM 1205 C LEU A 84 5.562 1.795 -4.170 1.00 0.43 C ATOM 1206 O LEU A 84 4.352 1.646 -4.010 1.00 0.50 O ATOM 1207 CB LEU A 84 6.195 -0.391 -5.189 1.00 0.51 C ATOM 1208 CG LEU A 84 7.392 -1.151 -5.777 1.00 0.66 C ATOM 1209 CD1 LEU A 84 8.328 -0.196 -6.493 1.00 1.42 C ATOM 1210 CD2 LEU A 84 8.140 -1.914 -4.696 1.00 1.21 C ATOM 0 H LEU A 84 5.542 -0.527 -2.617 1.00 0.40 H new ATOM 0 HA LEU A 84 7.537 0.957 -4.202 1.00 0.42 H new ATOM 0 HB2 LEU A 84 5.483 -1.120 -4.801 1.00 0.51 H new ATOM 0 HB3 LEU A 84 5.696 0.142 -5.999 1.00 0.51 H new ATOM 0 HG LEU A 84 7.010 -1.873 -6.499 1.00 0.66 H new ATOM 0 HD11 LEU A 84 9.171 -0.752 -6.904 1.00 1.42 H new ATOM 0 HD12 LEU A 84 7.792 0.301 -7.302 1.00 1.42 H new ATOM 0 HD13 LEU A 84 8.695 0.551 -5.789 1.00 1.42 H new ATOM 0 HD21 LEU A 84 8.983 -2.443 -5.141 1.00 1.21 H new ATOM 0 HD22 LEU A 84 8.506 -1.215 -3.944 1.00 1.21 H new ATOM 0 HD23 LEU A 84 7.468 -2.632 -4.226 1.00 1.21 H new ATOM 1222 N THR A 85 6.112 2.965 -4.431 1.00 0.43 N ATOM 1223 CA THR A 85 5.313 4.148 -4.621 1.00 0.47 C ATOM 1224 C THR A 85 4.850 4.214 -6.062 1.00 0.45 C ATOM 1225 O THR A 85 5.629 4.511 -6.964 1.00 0.50 O ATOM 1226 CB THR A 85 6.101 5.425 -4.258 1.00 0.58 C ATOM 1227 OG1 THR A 85 6.170 5.568 -2.834 1.00 0.75 O ATOM 1228 CG2 THR A 85 5.467 6.663 -4.871 1.00 0.98 C ATOM 0 H THR A 85 7.117 3.116 -4.516 1.00 0.43 H new ATOM 0 HA THR A 85 4.450 4.092 -3.957 1.00 0.47 H new ATOM 0 HB THR A 85 7.107 5.325 -4.665 1.00 0.58 H new ATOM 0 HG1 THR A 85 5.726 4.806 -2.407 1.00 0.75 H new ATOM 0 HG21 THR A 85 6.047 7.543 -4.595 1.00 0.98 H new ATOM 0 HG22 THR A 85 5.451 6.564 -5.956 1.00 0.98 H new ATOM 0 HG23 THR A 85 4.447 6.770 -4.502 1.00 0.98 H new ATOM 1236 N LEU A 86 3.594 3.886 -6.271 1.00 0.43 N ATOM 1237 CA LEU A 86 3.024 3.907 -7.593 1.00 0.43 C ATOM 1238 C LEU A 86 1.952 4.966 -7.676 1.00 0.45 C ATOM 1239 O LEU A 86 1.091 5.045 -6.799 1.00 0.50 O ATOM 1240 CB LEU A 86 2.406 2.560 -7.932 1.00 0.46 C ATOM 1241 CG LEU A 86 2.044 2.376 -9.399 1.00 0.63 C ATOM 1242 CD1 LEU A 86 3.231 1.836 -10.171 1.00 1.23 C ATOM 1243 CD2 LEU A 86 0.847 1.461 -9.542 1.00 1.35 C ATOM 0 H LEU A 86 2.948 3.601 -5.535 1.00 0.43 H new ATOM 0 HA LEU A 86 3.822 4.127 -8.302 1.00 0.43 H new ATOM 0 HB2 LEU A 86 3.102 1.773 -7.643 1.00 0.46 H new ATOM 0 HB3 LEU A 86 1.507 2.427 -7.331 1.00 0.46 H new ATOM 0 HG LEU A 86 1.778 3.348 -9.815 1.00 0.63 H new ATOM 0 HD11 LEU A 86 2.957 1.710 -11.218 1.00 1.23 H new ATOM 0 HD12 LEU A 86 4.063 2.536 -10.096 1.00 1.23 H new ATOM 0 HD13 LEU A 86 3.528 0.873 -9.755 1.00 1.23 H new ATOM 0 HD21 LEU A 86 0.604 1.342 -10.598 1.00 1.35 H new ATOM 0 HD22 LEU A 86 1.080 0.487 -9.111 1.00 1.35 H new ATOM 0 HD23 LEU A 86 -0.006 1.894 -9.020 1.00 1.35 H new ATOM 1255 N THR A 87 1.993 5.778 -8.710 1.00 0.48 N ATOM 1256 CA THR A 87 0.913 6.704 -8.932 1.00 0.55 C ATOM 1257 C THR A 87 -0.135 6.059 -9.829 1.00 0.55 C ATOM 1258 O THR A 87 0.174 5.595 -10.932 1.00 0.56 O ATOM 1259 CB THR A 87 1.411 8.026 -9.551 1.00 0.61 C ATOM 1260 OG1 THR A 87 2.195 7.767 -10.722 1.00 1.21 O ATOM 1261 CG2 THR A 87 2.239 8.813 -8.548 1.00 1.26 C ATOM 0 H THR A 87 2.747 5.814 -9.395 1.00 0.48 H new ATOM 0 HA THR A 87 0.469 6.946 -7.966 1.00 0.55 H new ATOM 0 HB THR A 87 0.538 8.617 -9.828 1.00 0.61 H new ATOM 0 HG1 THR A 87 1.767 7.063 -11.253 1.00 1.21 H new ATOM 0 HG21 THR A 87 2.580 9.741 -9.006 1.00 1.26 H new ATOM 0 HG22 THR A 87 1.630 9.042 -7.674 1.00 1.26 H new ATOM 0 HG23 THR A 87 3.102 8.221 -8.244 1.00 1.26 H new ATOM 1269 N ARG A 88 -1.364 6.038 -9.324 1.00 0.60 N ATOM 1270 CA ARG A 88 -2.530 5.500 -10.019 1.00 0.67 C ATOM 1271 C ARG A 88 -3.630 5.241 -8.996 1.00 0.71 C ATOM 1272 O ARG A 88 -3.381 4.620 -7.961 1.00 1.02 O ATOM 1273 CB ARG A 88 -2.221 4.193 -10.771 1.00 0.71 C ATOM 1274 CG ARG A 88 -3.283 3.840 -11.801 1.00 0.93 C ATOM 1275 CD ARG A 88 -2.788 2.803 -12.792 1.00 1.05 C ATOM 1276 NE ARG A 88 -2.470 1.530 -12.153 1.00 0.86 N ATOM 1277 CZ ARG A 88 -1.264 0.970 -12.173 1.00 0.99 C ATOM 1278 NH1 ARG A 88 -0.240 1.608 -12.744 1.00 1.06 N ATOM 1279 NH2 ARG A 88 -1.085 -0.220 -11.614 1.00 1.34 N ATOM 0 H ARG A 88 -1.583 6.403 -8.397 1.00 0.60 H new ATOM 0 HA ARG A 88 -2.843 6.234 -10.762 1.00 0.67 H new ATOM 0 HB2 ARG A 88 -1.255 4.285 -11.268 1.00 0.71 H new ATOM 0 HB3 ARG A 88 -2.133 3.378 -10.053 1.00 0.71 H new ATOM 0 HG2 ARG A 88 -4.170 3.462 -11.293 1.00 0.93 H new ATOM 0 HG3 ARG A 88 -3.582 4.741 -12.337 1.00 0.93 H new ATOM 0 HD2 ARG A 88 -3.548 2.643 -13.556 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -1.901 3.183 -13.299 1.00 1.05 H new ATOM 0 HE ARG A 88 -3.218 1.040 -11.662 1.00 0.86 H new ATOM 0 HH11 ARG A 88 -0.382 2.526 -13.165 1.00 1.06 H new ATOM 0 HH12 ARG A 88 0.685 1.178 -12.759 1.00 1.06 H new ATOM 0 HH21 ARG A 88 -1.870 -0.699 -11.173 1.00 1.34 H new ATOM 0 HH22 ARG A 88 -0.163 -0.655 -11.626 1.00 1.34 H new ATOM 1293 N LEU A 89 -4.833 5.735 -9.262 1.00 0.56 N ATOM 1294 CA LEU A 89 -5.945 5.553 -8.342 1.00 0.55 C ATOM 1295 C LEU A 89 -7.271 5.762 -9.063 1.00 0.55 C ATOM 1296 O LEU A 89 -7.416 6.667 -9.886 1.00 0.77 O ATOM 1297 CB LEU A 89 -5.810 6.520 -7.148 1.00 0.62 C ATOM 1298 CG LEU A 89 -6.703 6.239 -5.925 1.00 0.82 C ATOM 1299 CD1 LEU A 89 -8.143 6.664 -6.173 1.00 1.71 C ATOM 1300 CD2 LEU A 89 -6.643 4.765 -5.542 1.00 1.06 C ATOM 0 H LEU A 89 -5.061 6.263 -10.104 1.00 0.56 H new ATOM 0 HA LEU A 89 -5.924 4.532 -7.961 1.00 0.55 H new ATOM 0 HB2 LEU A 89 -4.771 6.512 -6.819 1.00 0.62 H new ATOM 0 HB3 LEU A 89 -6.025 7.529 -7.501 1.00 0.62 H new ATOM 0 HG LEU A 89 -6.319 6.833 -5.096 1.00 0.82 H new ATOM 0 HD11 LEU A 89 -8.743 6.450 -5.288 1.00 1.71 H new ATOM 0 HD12 LEU A 89 -8.176 7.733 -6.384 1.00 1.71 H new ATOM 0 HD13 LEU A 89 -8.543 6.114 -7.024 1.00 1.71 H new ATOM 0 HD21 LEU A 89 -7.281 4.588 -4.676 1.00 1.06 H new ATOM 0 HD22 LEU A 89 -6.989 4.157 -6.378 1.00 1.06 H new ATOM 0 HD23 LEU A 89 -5.616 4.494 -5.298 1.00 1.06 H new ATOM 1312 N ASP A 90 -8.233 4.922 -8.730 1.00 0.47 N ATOM 1313 CA ASP A 90 -9.571 4.999 -9.296 1.00 0.52 C ATOM 1314 C ASP A 90 -10.579 4.942 -8.164 1.00 0.53 C ATOM 1315 O ASP A 90 -10.270 4.433 -7.085 1.00 0.51 O ATOM 1316 CB ASP A 90 -9.843 3.831 -10.256 1.00 0.68 C ATOM 1317 CG ASP A 90 -8.919 3.797 -11.458 1.00 1.40 C ATOM 1318 OD1 ASP A 90 -9.214 4.485 -12.459 1.00 1.74 O ATOM 1319 OD2 ASP A 90 -7.882 3.106 -11.399 1.00 2.21 O ATOM 0 H ASP A 90 -8.110 4.165 -8.058 1.00 0.47 H new ATOM 0 HA ASP A 90 -9.657 5.931 -9.855 1.00 0.52 H new ATOM 0 HB2 ASP A 90 -9.746 2.893 -9.709 1.00 0.68 H new ATOM 0 HB3 ASP A 90 -10.874 3.892 -10.604 1.00 0.68 H new ATOM 1324 N LYS A 91 -11.781 5.437 -8.393 1.00 0.63 N ATOM 1325 CA LYS A 91 -12.830 5.313 -7.397 1.00 0.75 C ATOM 1326 C LYS A 91 -13.252 3.850 -7.342 1.00 0.79 C ATOM 1327 O LYS A 91 -13.573 3.313 -6.280 1.00 0.85 O ATOM 1328 CB LYS A 91 -14.017 6.232 -7.726 1.00 0.89 C ATOM 1329 CG LYS A 91 -14.968 6.464 -6.555 1.00 1.15 C ATOM 1330 CD LYS A 91 -15.924 5.298 -6.344 1.00 1.38 C ATOM 1331 CE LYS A 91 -16.657 5.398 -5.014 1.00 1.71 C ATOM 1332 NZ LYS A 91 -17.419 6.668 -4.882 1.00 2.24 N ATOM 0 H LYS A 91 -12.054 5.922 -9.248 1.00 0.63 H new ATOM 0 HA LYS A 91 -12.461 5.626 -6.420 1.00 0.75 H new ATOM 0 HB2 LYS A 91 -13.634 7.194 -8.066 1.00 0.89 H new ATOM 0 HB3 LYS A 91 -14.577 5.801 -8.556 1.00 0.89 H new ATOM 0 HG2 LYS A 91 -14.388 6.624 -5.646 1.00 1.15 H new ATOM 0 HG3 LYS A 91 -15.542 7.374 -6.731 1.00 1.15 H new ATOM 0 HD2 LYS A 91 -16.649 5.272 -7.157 1.00 1.38 H new ATOM 0 HD3 LYS A 91 -15.368 4.361 -6.382 1.00 1.38 H new ATOM 0 HE2 LYS A 91 -17.341 4.555 -4.915 1.00 1.71 H new ATOM 0 HE3 LYS A 91 -15.937 5.323 -4.199 1.00 1.71 H new ATOM 0 HZ1 LYS A 91 -17.994 6.639 -4.016 1.00 2.24 H new ATOM 0 HZ2 LYS A 91 -16.756 7.467 -4.831 1.00 2.24 H new ATOM 0 HZ3 LYS A 91 -18.041 6.787 -5.707 1.00 2.24 H new ATOM 1346 N ALA A 92 -13.204 3.204 -8.501 1.00 0.81 N ATOM 1347 CA ALA A 92 -13.423 1.770 -8.592 1.00 0.94 C ATOM 1348 C ALA A 92 -12.333 1.020 -7.833 1.00 0.81 C ATOM 1349 O ALA A 92 -12.582 -0.034 -7.252 1.00 0.81 O ATOM 1350 CB ALA A 92 -13.456 1.327 -10.047 1.00 1.13 C ATOM 0 H ALA A 92 -13.014 3.656 -9.395 1.00 0.81 H new ATOM 0 HA ALA A 92 -14.387 1.537 -8.139 1.00 0.94 H new ATOM 0 HB1 ALA A 92 -13.621 0.251 -10.096 1.00 1.13 H new ATOM 0 HB2 ALA A 92 -14.265 1.842 -10.566 1.00 1.13 H new ATOM 0 HB3 ALA A 92 -12.506 1.571 -10.523 1.00 1.13 H new ATOM 1356 N ALA A 93 -11.126 1.586 -7.828 1.00 0.73 N ATOM 1357 CA ALA A 93 -10.005 1.005 -7.096 1.00 0.67 C ATOM 1358 C ALA A 93 -10.250 1.089 -5.595 1.00 0.57 C ATOM 1359 O ALA A 93 -9.890 0.181 -4.849 1.00 0.57 O ATOM 1360 CB ALA A 93 -8.698 1.696 -7.465 1.00 0.69 C ATOM 0 H ALA A 93 -10.901 2.448 -8.324 1.00 0.73 H new ATOM 0 HA ALA A 93 -9.923 -0.045 -7.376 1.00 0.67 H new ATOM 0 HB1 ALA A 93 -7.878 1.245 -6.906 1.00 0.69 H new ATOM 0 HB2 ALA A 93 -8.515 1.582 -8.533 1.00 0.69 H new ATOM 0 HB3 ALA A 93 -8.765 2.756 -7.219 1.00 0.69 H new ATOM 1366 N CYS A 94 -10.865 2.185 -5.159 1.00 0.55 N ATOM 1367 CA CYS A 94 -11.294 2.325 -3.772 1.00 0.58 C ATOM 1368 C CYS A 94 -12.224 1.175 -3.389 1.00 0.60 C ATOM 1369 O CYS A 94 -12.017 0.502 -2.379 1.00 0.63 O ATOM 1370 CB CYS A 94 -11.997 3.673 -3.571 1.00 0.67 C ATOM 1371 SG CYS A 94 -12.833 3.855 -1.962 1.00 1.02 S ATOM 0 H CYS A 94 -11.077 2.990 -5.748 1.00 0.55 H new ATOM 0 HA CYS A 94 -10.417 2.291 -3.126 1.00 0.58 H new ATOM 0 HB2 CYS A 94 -11.262 4.471 -3.677 1.00 0.67 H new ATOM 0 HB3 CYS A 94 -12.731 3.808 -4.365 1.00 0.67 H new ATOM 1376 N VAL A 95 -13.226 0.933 -4.228 1.00 0.64 N ATOM 1377 CA VAL A 95 -14.171 -0.155 -3.999 1.00 0.71 C ATOM 1378 C VAL A 95 -13.464 -1.500 -4.067 1.00 0.65 C ATOM 1379 O VAL A 95 -13.773 -2.417 -3.310 1.00 0.67 O ATOM 1380 CB VAL A 95 -15.331 -0.120 -5.020 1.00 0.83 C ATOM 1381 CG1 VAL A 95 -16.342 -1.226 -4.745 1.00 0.96 C ATOM 1382 CG2 VAL A 95 -16.015 1.238 -5.007 1.00 1.04 C ATOM 0 H VAL A 95 -13.405 1.476 -5.073 1.00 0.64 H new ATOM 0 HA VAL A 95 -14.590 -0.021 -3.002 1.00 0.71 H new ATOM 0 HB VAL A 95 -14.908 -0.288 -6.010 1.00 0.83 H new ATOM 0 HG11 VAL A 95 -17.146 -1.175 -5.480 1.00 0.96 H new ATOM 0 HG12 VAL A 95 -15.848 -2.195 -4.814 1.00 0.96 H new ATOM 0 HG13 VAL A 95 -16.756 -1.100 -3.745 1.00 0.96 H new ATOM 0 HG21 VAL A 95 -16.829 1.243 -5.732 1.00 1.04 H new ATOM 0 HG22 VAL A 95 -16.415 1.435 -4.012 1.00 1.04 H new ATOM 0 HG23 VAL A 95 -15.293 2.012 -5.267 1.00 1.04 H new ATOM 1392 N SER A 96 -12.499 -1.587 -4.961 1.00 0.62 N ATOM 1393 CA SER A 96 -11.678 -2.774 -5.106 1.00 0.61 C ATOM 1394 C SER A 96 -10.978 -3.129 -3.793 1.00 0.55 C ATOM 1395 O SER A 96 -10.894 -4.300 -3.420 1.00 0.58 O ATOM 1396 CB SER A 96 -10.641 -2.522 -6.189 1.00 0.68 C ATOM 1397 OG SER A 96 -11.246 -2.353 -7.461 1.00 1.00 O ATOM 0 H SER A 96 -12.261 -0.836 -5.609 1.00 0.62 H new ATOM 0 HA SER A 96 -12.318 -3.613 -5.380 1.00 0.61 H new ATOM 0 HB2 SER A 96 -10.062 -1.633 -5.940 1.00 0.68 H new ATOM 0 HB3 SER A 96 -9.942 -3.357 -6.226 1.00 0.68 H new ATOM 0 HG SER A 96 -11.787 -1.536 -7.460 1.00 1.00 H new ATOM 1403 N LEU A 97 -10.485 -2.116 -3.092 1.00 0.56 N ATOM 1404 CA LEU A 97 -9.784 -2.332 -1.833 1.00 0.61 C ATOM 1405 C LEU A 97 -10.761 -2.756 -0.748 1.00 0.63 C ATOM 1406 O LEU A 97 -10.428 -3.570 0.108 1.00 0.70 O ATOM 1407 CB LEU A 97 -9.031 -1.069 -1.419 1.00 0.69 C ATOM 1408 CG LEU A 97 -7.981 -0.605 -2.435 1.00 0.78 C ATOM 1409 CD1 LEU A 97 -7.365 0.717 -2.015 1.00 0.86 C ATOM 1410 CD2 LEU A 97 -6.903 -1.664 -2.606 1.00 0.89 C ATOM 0 H LEU A 97 -10.557 -1.138 -3.373 1.00 0.56 H new ATOM 0 HA LEU A 97 -9.058 -3.133 -1.972 1.00 0.61 H new ATOM 0 HB2 LEU A 97 -9.750 -0.265 -1.263 1.00 0.69 H new ATOM 0 HB3 LEU A 97 -8.541 -1.248 -0.462 1.00 0.69 H new ATOM 0 HG LEU A 97 -8.479 -0.457 -3.393 1.00 0.78 H new ATOM 0 HD11 LEU A 97 -6.624 1.024 -2.753 1.00 0.86 H new ATOM 0 HD12 LEU A 97 -8.144 1.476 -1.947 1.00 0.86 H new ATOM 0 HD13 LEU A 97 -6.884 0.602 -1.044 1.00 0.86 H new ATOM 0 HD21 LEU A 97 -6.166 -1.319 -3.331 1.00 0.89 H new ATOM 0 HD22 LEU A 97 -6.414 -1.844 -1.648 1.00 0.89 H new ATOM 0 HD23 LEU A 97 -7.355 -2.590 -2.962 1.00 0.89 H new ATOM 1422 N ALA A 98 -11.976 -2.225 -0.813 1.00 0.64 N ATOM 1423 CA ALA A 98 -13.029 -2.607 0.118 1.00 0.75 C ATOM 1424 C ALA A 98 -13.497 -4.035 -0.154 1.00 0.71 C ATOM 1425 O ALA A 98 -14.133 -4.672 0.690 1.00 0.85 O ATOM 1426 CB ALA A 98 -14.193 -1.635 0.025 1.00 0.92 C ATOM 0 H ALA A 98 -12.256 -1.527 -1.502 1.00 0.64 H new ATOM 0 HA ALA A 98 -12.626 -2.569 1.130 1.00 0.75 H new ATOM 0 HB1 ALA A 98 -14.973 -1.933 0.726 1.00 0.92 H new ATOM 0 HB2 ALA A 98 -13.849 -0.630 0.270 1.00 0.92 H new ATOM 0 HB3 ALA A 98 -14.594 -1.644 -0.988 1.00 0.92 H new ATOM 1432 N THR A 99 -13.190 -4.528 -1.345 1.00 0.66 N ATOM 1433 CA THR A 99 -13.498 -5.898 -1.704 1.00 0.71 C ATOM 1434 C THR A 99 -12.244 -6.764 -1.627 1.00 0.66 C ATOM 1435 O THR A 99 -12.267 -7.946 -1.964 1.00 0.77 O ATOM 1436 CB THR A 99 -14.109 -5.991 -3.120 1.00 0.81 C ATOM 1437 OG1 THR A 99 -13.188 -5.495 -4.101 1.00 0.82 O ATOM 1438 CG2 THR A 99 -15.404 -5.198 -3.205 1.00 0.92 C ATOM 0 H THR A 99 -12.726 -3.994 -2.080 1.00 0.66 H new ATOM 0 HA THR A 99 -14.236 -6.265 -0.990 1.00 0.71 H new ATOM 0 HB THR A 99 -14.320 -7.042 -3.320 1.00 0.81 H new ATOM 0 HG1 THR A 99 -12.323 -5.315 -3.676 1.00 0.82 H new ATOM 0 HG21 THR A 99 -15.815 -5.279 -4.211 1.00 0.92 H new ATOM 0 HG22 THR A 99 -16.122 -5.595 -2.487 1.00 0.92 H new ATOM 0 HG23 THR A 99 -15.205 -4.151 -2.978 1.00 0.92 H new ATOM 1446 N LEU A 100 -11.146 -6.163 -1.185 1.00 0.59 N ATOM 1447 CA LEU A 100 -9.880 -6.868 -1.071 1.00 0.61 C ATOM 1448 C LEU A 100 -9.576 -7.121 0.400 1.00 0.66 C ATOM 1449 O LEU A 100 -9.505 -6.190 1.202 1.00 0.93 O ATOM 1450 CB LEU A 100 -8.756 -6.040 -1.720 1.00 0.60 C ATOM 1451 CG LEU A 100 -7.585 -6.834 -2.319 1.00 0.69 C ATOM 1452 CD1 LEU A 100 -6.627 -5.895 -3.033 1.00 1.08 C ATOM 1453 CD2 LEU A 100 -6.838 -7.621 -1.250 1.00 0.73 C ATOM 0 H LEU A 100 -11.109 -5.185 -0.899 1.00 0.59 H new ATOM 0 HA LEU A 100 -9.945 -7.824 -1.591 1.00 0.61 H new ATOM 0 HB2 LEU A 100 -9.194 -5.428 -2.509 1.00 0.60 H new ATOM 0 HB3 LEU A 100 -8.358 -5.356 -0.970 1.00 0.60 H new ATOM 0 HG LEU A 100 -7.998 -7.545 -3.035 1.00 0.69 H new ATOM 0 HD11 LEU A 100 -5.801 -6.469 -3.454 1.00 1.08 H new ATOM 0 HD12 LEU A 100 -7.154 -5.377 -3.834 1.00 1.08 H new ATOM 0 HD13 LEU A 100 -6.237 -5.164 -2.324 1.00 1.08 H new ATOM 0 HD21 LEU A 100 -6.017 -8.170 -1.710 1.00 0.73 H new ATOM 0 HD22 LEU A 100 -6.441 -6.934 -0.503 1.00 0.73 H new ATOM 0 HD23 LEU A 100 -7.521 -8.323 -0.771 1.00 0.73 H new ATOM 1465 N ASN A 101 -9.402 -8.380 0.761 1.00 0.60 N ATOM 1466 CA ASN A 101 -9.096 -8.726 2.136 1.00 0.66 C ATOM 1467 C ASN A 101 -7.625 -8.461 2.430 1.00 0.70 C ATOM 1468 O ASN A 101 -6.785 -9.356 2.352 1.00 0.79 O ATOM 1469 CB ASN A 101 -9.438 -10.188 2.427 1.00 0.80 C ATOM 1470 CG ASN A 101 -9.261 -10.542 3.888 1.00 0.93 C ATOM 1471 OD1 ASN A 101 -8.828 -11.642 4.223 1.00 1.29 O ATOM 1472 ND2 ASN A 101 -9.621 -9.623 4.772 1.00 1.12 N ATOM 0 H ASN A 101 -9.467 -9.175 0.125 1.00 0.60 H new ATOM 0 HA ASN A 101 -9.707 -8.100 2.786 1.00 0.66 H new ATOM 0 HB2 ASN A 101 -10.469 -10.383 2.131 1.00 0.80 H new ATOM 0 HB3 ASN A 101 -8.804 -10.834 1.820 1.00 0.80 H new ATOM 0 HD21 ASN A 101 -9.543 -9.817 5.770 1.00 1.12 H new ATOM 0 HD22 ASN A 101 -9.976 -8.721 4.454 1.00 1.12 H new ATOM 1479 N LEU A 102 -7.318 -7.210 2.733 1.00 0.76 N ATOM 1480 CA LEU A 102 -5.966 -6.814 3.087 1.00 0.88 C ATOM 1481 C LEU A 102 -5.690 -7.149 4.541 1.00 0.99 C ATOM 1482 O LEU A 102 -5.618 -6.272 5.394 1.00 1.50 O ATOM 1483 CB LEU A 102 -5.757 -5.318 2.825 1.00 1.07 C ATOM 1484 CG LEU A 102 -5.776 -4.909 1.350 1.00 1.01 C ATOM 1485 CD1 LEU A 102 -5.729 -3.398 1.211 1.00 1.55 C ATOM 1486 CD2 LEU A 102 -4.607 -5.539 0.610 1.00 1.47 C ATOM 0 H LEU A 102 -7.994 -6.446 2.740 1.00 0.76 H new ATOM 0 HA LEU A 102 -5.264 -7.367 2.464 1.00 0.88 H new ATOM 0 HB2 LEU A 102 -6.533 -4.761 3.351 1.00 1.07 H new ATOM 0 HB3 LEU A 102 -4.802 -5.019 3.257 1.00 1.07 H new ATOM 0 HG LEU A 102 -6.706 -5.268 0.909 1.00 1.01 H new ATOM 0 HD11 LEU A 102 -5.743 -3.129 0.155 1.00 1.55 H new ATOM 0 HD12 LEU A 102 -6.594 -2.960 1.709 1.00 1.55 H new ATOM 0 HD13 LEU A 102 -4.816 -3.019 1.670 1.00 1.55 H new ATOM 0 HD21 LEU A 102 -4.635 -5.238 -0.437 1.00 1.47 H new ATOM 0 HD22 LEU A 102 -3.671 -5.206 1.058 1.00 1.47 H new ATOM 0 HD23 LEU A 102 -4.676 -6.625 0.678 1.00 1.47 H new ATOM 1498 N GLY A 103 -5.583 -8.438 4.810 1.00 0.92 N ATOM 1499 CA GLY A 103 -5.263 -8.904 6.141 1.00 1.04 C ATOM 1500 C GLY A 103 -4.271 -10.049 6.113 1.00 1.12 C ATOM 1501 O GLY A 103 -3.099 -9.868 6.438 1.00 1.70 O ATOM 0 H GLY A 103 -5.714 -9.179 4.121 1.00 0.92 H new ATOM 0 HA2 GLY A 103 -4.852 -8.081 6.725 1.00 1.04 H new ATOM 0 HA3 GLY A 103 -6.176 -9.226 6.643 1.00 1.04 H new ATOM 1505 N THR A 104 -4.742 -11.218 5.701 1.00 1.03 N ATOM 1506 CA THR A 104 -3.913 -12.418 5.655 1.00 1.28 C ATOM 1507 C THR A 104 -2.697 -12.225 4.749 1.00 1.06 C ATOM 1508 O THR A 104 -1.553 -12.438 5.166 1.00 1.25 O ATOM 1509 CB THR A 104 -4.735 -13.620 5.159 1.00 1.73 C ATOM 1510 OG1 THR A 104 -5.930 -13.743 5.943 1.00 2.31 O ATOM 1511 CG2 THR A 104 -3.929 -14.908 5.247 1.00 2.21 C ATOM 0 H THR A 104 -5.703 -11.363 5.391 1.00 1.03 H new ATOM 0 HA THR A 104 -3.561 -12.610 6.669 1.00 1.28 H new ATOM 0 HB THR A 104 -4.995 -13.450 4.114 1.00 1.73 H new ATOM 0 HG1 THR A 104 -6.453 -14.508 5.624 1.00 2.31 H new ATOM 0 HG21 THR A 104 -4.534 -15.741 4.890 1.00 2.21 H new ATOM 0 HG22 THR A 104 -3.034 -14.820 4.631 1.00 2.21 H new ATOM 0 HG23 THR A 104 -3.641 -15.087 6.283 1.00 2.21 H new ATOM 1519 N SER A 105 -2.941 -11.809 3.515 1.00 0.97 N ATOM 1520 CA SER A 105 -1.867 -11.622 2.554 1.00 1.06 C ATOM 1521 C SER A 105 -1.504 -10.142 2.428 1.00 1.02 C ATOM 1522 O SER A 105 -1.044 -9.689 1.386 1.00 1.48 O ATOM 1523 CB SER A 105 -2.275 -12.196 1.195 1.00 1.35 C ATOM 1524 OG SER A 105 -1.162 -12.312 0.326 1.00 2.06 O ATOM 0 H SER A 105 -3.872 -11.595 3.157 1.00 0.97 H new ATOM 0 HA SER A 105 -0.985 -12.155 2.909 1.00 1.06 H new ATOM 0 HB2 SER A 105 -2.733 -13.175 1.335 1.00 1.35 H new ATOM 0 HB3 SER A 105 -3.029 -11.554 0.739 1.00 1.35 H new ATOM 0 HG SER A 105 -0.348 -12.041 0.799 1.00 2.06 H new ATOM 1530 N ALA A 106 -1.697 -9.391 3.497 1.00 0.76 N ATOM 1531 CA ALA A 106 -1.303 -7.996 3.516 1.00 0.73 C ATOM 1532 C ALA A 106 -0.520 -7.692 4.776 1.00 0.59 C ATOM 1533 O ALA A 106 -0.515 -8.482 5.718 1.00 0.67 O ATOM 1534 CB ALA A 106 -2.515 -7.090 3.412 1.00 0.90 C ATOM 0 H ALA A 106 -2.124 -9.724 4.362 1.00 0.76 H new ATOM 0 HA ALA A 106 -0.666 -7.807 2.652 1.00 0.73 H new ATOM 0 HB1 ALA A 106 -2.193 -6.049 3.428 1.00 0.90 H new ATOM 0 HB2 ALA A 106 -3.042 -7.292 2.479 1.00 0.90 H new ATOM 0 HB3 ALA A 106 -3.182 -7.277 4.253 1.00 0.90 H new ATOM 1540 N LYS A 107 0.158 -6.561 4.781 1.00 0.51 N ATOM 1541 CA LYS A 107 0.913 -6.146 5.945 1.00 0.47 C ATOM 1542 C LYS A 107 0.129 -5.083 6.702 1.00 0.51 C ATOM 1543 O LYS A 107 0.153 -5.019 7.934 1.00 0.70 O ATOM 1544 CB LYS A 107 2.268 -5.587 5.527 1.00 0.58 C ATOM 1545 CG LYS A 107 3.433 -6.126 6.336 1.00 0.99 C ATOM 1546 CD LYS A 107 3.824 -7.522 5.885 1.00 0.67 C ATOM 1547 CE LYS A 107 4.906 -8.117 6.771 1.00 1.07 C ATOM 1548 NZ LYS A 107 4.399 -8.448 8.130 1.00 1.69 N ATOM 0 H LYS A 107 0.201 -5.915 3.993 1.00 0.51 H new ATOM 0 HA LYS A 107 1.077 -7.010 6.589 1.00 0.47 H new ATOM 0 HB2 LYS A 107 2.434 -5.814 4.474 1.00 0.58 H new ATOM 0 HB3 LYS A 107 2.246 -4.501 5.619 1.00 0.58 H new ATOM 0 HG2 LYS A 107 4.288 -5.457 6.235 1.00 0.99 H new ATOM 0 HG3 LYS A 107 3.166 -6.145 7.393 1.00 0.99 H new ATOM 0 HD2 LYS A 107 2.946 -8.168 5.899 1.00 0.67 H new ATOM 0 HD3 LYS A 107 4.177 -7.486 4.854 1.00 0.67 H new ATOM 0 HE2 LYS A 107 5.302 -9.018 6.303 1.00 1.07 H new ATOM 0 HE3 LYS A 107 5.733 -7.412 6.855 1.00 1.07 H new ATOM 0 HZ1 LYS A 107 5.200 -8.673 8.754 1.00 1.69 H new ATOM 0 HZ2 LYS A 107 3.879 -7.633 8.514 1.00 1.69 H new ATOM 0 HZ3 LYS A 107 3.763 -9.269 8.073 1.00 1.69 H new ATOM 1562 N GLY A 108 -0.563 -4.252 5.936 1.00 0.50 N ATOM 1563 CA GLY A 108 -1.374 -3.194 6.496 1.00 0.61 C ATOM 1564 C GLY A 108 -1.791 -2.215 5.429 1.00 0.58 C ATOM 1565 O GLY A 108 -1.207 -2.191 4.352 1.00 0.81 O ATOM 0 H GLY A 108 -0.575 -4.296 4.917 1.00 0.50 H new ATOM 0 HA2 GLY A 108 -2.258 -3.620 6.970 1.00 0.61 H new ATOM 0 HA3 GLY A 108 -0.815 -2.674 7.274 1.00 0.61 H new ATOM 1569 N TYR A 109 -2.790 -1.407 5.713 1.00 0.52 N ATOM 1570 CA TYR A 109 -3.278 -0.445 4.740 1.00 0.49 C ATOM 1571 C TYR A 109 -3.673 0.858 5.437 1.00 0.47 C ATOM 1572 O TYR A 109 -4.424 0.845 6.406 1.00 0.51 O ATOM 1573 CB TYR A 109 -4.448 -1.070 3.959 1.00 0.58 C ATOM 1574 CG TYR A 109 -5.186 -0.123 3.034 1.00 0.57 C ATOM 1575 CD1 TYR A 109 -4.519 0.933 2.433 1.00 0.98 C ATOM 1576 CD2 TYR A 109 -6.533 -0.293 2.750 1.00 1.25 C ATOM 1577 CE1 TYR A 109 -5.170 1.791 1.572 1.00 1.13 C ATOM 1578 CE2 TYR A 109 -7.194 0.563 1.893 1.00 1.39 C ATOM 1579 CZ TYR A 109 -6.571 1.616 1.371 1.00 0.99 C ATOM 1580 OH TYR A 109 -7.154 2.444 0.433 1.00 1.28 O ATOM 0 H TYR A 109 -3.281 -1.395 6.607 1.00 0.52 H new ATOM 0 HA TYR A 109 -2.492 -0.196 4.028 1.00 0.49 H new ATOM 0 HB2 TYR A 109 -4.066 -1.904 3.370 1.00 0.58 H new ATOM 0 HB3 TYR A 109 -5.160 -1.484 4.673 1.00 0.58 H new ATOM 0 HD1 TYR A 109 -3.471 1.087 2.643 1.00 0.98 H new ATOM 0 HD2 TYR A 109 -7.073 -1.109 3.207 1.00 1.25 H new ATOM 0 HE1 TYR A 109 -4.632 2.577 1.062 1.00 1.13 H new ATOM 0 HE2 TYR A 109 -8.228 0.376 1.643 1.00 1.39 H new ATOM 0 HH TYR A 109 -8.111 2.244 0.370 1.00 1.28 H new ATOM 1590 N GLY A 110 -3.146 1.976 4.952 1.00 0.45 N ATOM 1591 CA GLY A 110 -3.439 3.258 5.560 1.00 0.48 C ATOM 1592 C GLY A 110 -3.909 4.287 4.548 1.00 0.52 C ATOM 1593 O GLY A 110 -3.754 4.096 3.344 1.00 0.85 O ATOM 0 H GLY A 110 -2.520 2.016 4.147 1.00 0.45 H new ATOM 0 HA2 GLY A 110 -4.206 3.128 6.324 1.00 0.48 H new ATOM 0 HA3 GLY A 110 -2.547 3.630 6.064 1.00 0.48 H new ATOM 1597 N VAL A 111 -4.497 5.374 5.033 1.00 0.44 N ATOM 1598 CA VAL A 111 -4.944 6.459 4.162 1.00 0.50 C ATOM 1599 C VAL A 111 -4.384 7.793 4.646 1.00 0.50 C ATOM 1600 O VAL A 111 -4.494 8.125 5.829 1.00 0.52 O ATOM 1601 CB VAL A 111 -6.492 6.538 4.082 1.00 0.64 C ATOM 1602 CG1 VAL A 111 -7.108 6.667 5.467 1.00 1.25 C ATOM 1603 CG2 VAL A 111 -6.934 7.694 3.194 1.00 1.53 C ATOM 0 H VAL A 111 -4.676 5.529 6.025 1.00 0.44 H new ATOM 0 HA VAL A 111 -4.567 6.247 3.161 1.00 0.50 H new ATOM 0 HB VAL A 111 -6.847 5.608 3.637 1.00 0.64 H new ATOM 0 HG11 VAL A 111 -8.193 6.720 5.379 1.00 1.25 H new ATOM 0 HG12 VAL A 111 -6.835 5.800 6.069 1.00 1.25 H new ATOM 0 HG13 VAL A 111 -6.738 7.573 5.947 1.00 1.25 H new ATOM 0 HG21 VAL A 111 -8.023 7.727 3.155 1.00 1.53 H new ATOM 0 HG22 VAL A 111 -6.557 8.632 3.603 1.00 1.53 H new ATOM 0 HG23 VAL A 111 -6.539 7.552 2.188 1.00 1.53 H new ATOM 1613 N ASN A 112 -3.768 8.536 3.724 1.00 0.53 N ATOM 1614 CA ASN A 112 -3.155 9.833 4.033 1.00 0.60 C ATOM 1615 C ASN A 112 -1.889 9.671 4.868 1.00 0.56 C ATOM 1616 O ASN A 112 -1.384 10.638 5.435 1.00 0.69 O ATOM 1617 CB ASN A 112 -4.142 10.773 4.745 1.00 0.69 C ATOM 1618 CG ASN A 112 -4.815 11.736 3.792 1.00 0.79 C ATOM 1619 OD1 ASN A 112 -4.224 12.143 2.798 1.00 1.07 O ATOM 1620 ND2 ASN A 112 -6.045 12.123 4.094 1.00 1.16 N ATOM 0 H ASN A 112 -3.679 8.259 2.746 1.00 0.53 H new ATOM 0 HA ASN A 112 -2.881 10.285 3.079 1.00 0.60 H new ATOM 0 HB2 ASN A 112 -4.902 10.179 5.253 1.00 0.69 H new ATOM 0 HB3 ASN A 112 -3.612 11.337 5.513 1.00 0.69 H new ATOM 0 HD21 ASN A 112 -6.535 12.783 3.490 1.00 1.16 H new ATOM 0 HD22 ASN A 112 -6.503 11.761 4.931 1.00 1.16 H new ATOM 1627 N ILE A 113 -1.370 8.450 4.927 1.00 0.54 N ATOM 1628 CA ILE A 113 -0.113 8.193 5.613 1.00 0.54 C ATOM 1629 C ILE A 113 1.061 8.556 4.713 1.00 0.60 C ATOM 1630 O ILE A 113 1.167 8.076 3.583 1.00 0.73 O ATOM 1631 CB ILE A 113 0.021 6.713 6.076 1.00 0.58 C ATOM 1632 CG1 ILE A 113 -0.726 6.474 7.394 1.00 0.77 C ATOM 1633 CG2 ILE A 113 1.485 6.319 6.237 1.00 0.76 C ATOM 1634 CD1 ILE A 113 -2.230 6.550 7.284 1.00 0.83 C ATOM 0 H ILE A 113 -1.800 7.625 4.509 1.00 0.54 H new ATOM 0 HA ILE A 113 -0.105 8.818 6.506 1.00 0.54 H new ATOM 0 HB ILE A 113 -0.428 6.091 5.302 1.00 0.58 H new ATOM 0 HG12 ILE A 113 -0.452 5.492 7.780 1.00 0.77 H new ATOM 0 HG13 ILE A 113 -0.390 7.209 8.126 1.00 0.77 H new ATOM 0 HG21 ILE A 113 1.549 5.280 6.561 1.00 0.76 H new ATOM 0 HG22 ILE A 113 2.000 6.434 5.283 1.00 0.76 H new ATOM 0 HG23 ILE A 113 1.955 6.961 6.982 1.00 0.76 H new ATOM 0 HD11 ILE A 113 -2.676 6.369 8.262 1.00 0.83 H new ATOM 0 HD12 ILE A 113 -2.519 7.540 6.931 1.00 0.83 H new ATOM 0 HD13 ILE A 113 -2.582 5.796 6.580 1.00 0.83 H new ATOM 1646 N SER A 114 1.919 9.429 5.210 1.00 0.60 N ATOM 1647 CA SER A 114 3.130 9.790 4.505 1.00 0.70 C ATOM 1648 C SER A 114 4.332 9.279 5.291 1.00 0.67 C ATOM 1649 O SER A 114 4.672 9.823 6.343 1.00 0.77 O ATOM 1650 CB SER A 114 3.205 11.311 4.325 1.00 0.83 C ATOM 1651 OG SER A 114 4.294 11.686 3.497 1.00 1.58 O ATOM 0 H SER A 114 1.796 9.902 6.105 1.00 0.60 H new ATOM 0 HA SER A 114 3.129 9.335 3.515 1.00 0.70 H new ATOM 0 HB2 SER A 114 2.274 11.673 3.888 1.00 0.83 H new ATOM 0 HB3 SER A 114 3.307 11.789 5.299 1.00 0.83 H new ATOM 0 HG SER A 114 4.312 12.661 3.402 1.00 1.58 H new ATOM 1657 N GLY A 115 4.964 8.225 4.793 1.00 0.70 N ATOM 1658 CA GLY A 115 6.055 7.619 5.523 1.00 0.70 C ATOM 1659 C GLY A 115 5.912 6.123 5.633 1.00 0.70 C ATOM 1660 O GLY A 115 5.844 5.588 6.734 1.00 0.75 O ATOM 0 H GLY A 115 4.741 7.782 3.902 1.00 0.70 H new ATOM 0 HA2 GLY A 115 6.996 7.856 5.027 1.00 0.70 H new ATOM 0 HA3 GLY A 115 6.104 8.051 6.523 1.00 0.70 H new ATOM 1664 N GLU A 116 5.862 5.449 4.490 1.00 0.73 N ATOM 1665 CA GLU A 116 5.774 3.998 4.440 1.00 0.77 C ATOM 1666 C GLU A 116 6.884 3.338 5.256 1.00 0.75 C ATOM 1667 O GLU A 116 6.717 2.238 5.776 1.00 0.84 O ATOM 1668 CB GLU A 116 5.847 3.524 2.989 1.00 0.82 C ATOM 1669 CG GLU A 116 4.613 3.845 2.164 1.00 0.97 C ATOM 1670 CD GLU A 116 4.656 5.222 1.537 1.00 1.60 C ATOM 1671 OE1 GLU A 116 4.631 6.219 2.297 1.00 2.30 O ATOM 1672 OE2 GLU A 116 4.735 5.315 0.294 1.00 2.05 O ATOM 0 H GLU A 116 5.881 5.895 3.573 1.00 0.73 H new ATOM 0 HA GLU A 116 4.819 3.706 4.876 1.00 0.77 H new ATOM 0 HB2 GLU A 116 6.716 3.979 2.514 1.00 0.82 H new ATOM 0 HB3 GLU A 116 6.006 2.446 2.979 1.00 0.82 H new ATOM 0 HG2 GLU A 116 4.505 3.098 1.378 1.00 0.97 H new ATOM 0 HG3 GLU A 116 3.730 3.769 2.799 1.00 0.97 H new ATOM 1679 N ASN A 117 8.010 4.027 5.380 1.00 0.67 N ATOM 1680 CA ASN A 117 9.144 3.522 6.149 1.00 0.67 C ATOM 1681 C ASN A 117 8.755 3.295 7.616 1.00 0.69 C ATOM 1682 O ASN A 117 9.381 2.502 8.319 1.00 0.75 O ATOM 1683 CB ASN A 117 10.319 4.497 6.045 1.00 0.71 C ATOM 1684 CG ASN A 117 11.617 3.913 6.562 1.00 1.03 C ATOM 1685 OD1 ASN A 117 11.963 4.061 7.734 1.00 1.95 O ATOM 1686 ND2 ASN A 117 12.342 3.231 5.686 1.00 0.96 N ATOM 0 H ASN A 117 8.165 4.942 4.956 1.00 0.67 H new ATOM 0 HA ASN A 117 9.446 2.561 5.733 1.00 0.67 H new ATOM 0 HB2 ASN A 117 10.449 4.792 5.004 1.00 0.71 H new ATOM 0 HB3 ASN A 117 10.085 5.402 6.606 1.00 0.71 H new ATOM 0 HD21 ASN A 117 13.223 2.805 5.975 1.00 0.96 H new ATOM 0 HD22 ASN A 117 12.019 3.132 4.724 1.00 0.96 H new ATOM 1693 N ASN A 118 7.708 3.990 8.058 1.00 0.70 N ATOM 1694 CA ASN A 118 7.169 3.825 9.406 1.00 0.80 C ATOM 1695 C ASN A 118 5.694 4.233 9.427 1.00 0.82 C ATOM 1696 O ASN A 118 5.348 5.354 9.804 1.00 1.00 O ATOM 1697 CB ASN A 118 7.964 4.656 10.421 1.00 0.90 C ATOM 1698 CG ASN A 118 7.451 4.497 11.843 1.00 1.75 C ATOM 1699 OD1 ASN A 118 6.930 3.447 12.224 1.00 2.60 O ATOM 1700 ND2 ASN A 118 7.591 5.544 12.639 1.00 2.33 N ATOM 0 H ASN A 118 7.212 4.680 7.494 1.00 0.70 H new ATOM 0 HA ASN A 118 7.256 2.776 9.688 1.00 0.80 H new ATOM 0 HB2 ASN A 118 9.013 4.361 10.383 1.00 0.90 H new ATOM 0 HB3 ASN A 118 7.918 5.708 10.138 1.00 0.90 H new ATOM 0 HD21 ASN A 118 7.263 5.499 13.604 1.00 2.33 H new ATOM 0 HD22 ASN A 118 8.027 6.397 12.288 1.00 2.33 H new ATOM 1707 N ILE A 119 4.834 3.329 8.974 1.00 0.78 N ATOM 1708 CA ILE A 119 3.403 3.606 8.858 1.00 0.87 C ATOM 1709 C ILE A 119 2.698 3.502 10.218 1.00 0.71 C ATOM 1710 O ILE A 119 3.165 2.804 11.125 1.00 0.73 O ATOM 1711 CB ILE A 119 2.741 2.648 7.830 1.00 1.22 C ATOM 1712 CG1 ILE A 119 1.247 2.948 7.654 1.00 1.45 C ATOM 1713 CG2 ILE A 119 2.940 1.203 8.251 1.00 1.38 C ATOM 1714 CD1 ILE A 119 0.591 2.139 6.554 1.00 2.02 C ATOM 0 H ILE A 119 5.103 2.391 8.678 1.00 0.78 H new ATOM 0 HA ILE A 119 3.294 4.631 8.502 1.00 0.87 H new ATOM 0 HB ILE A 119 3.227 2.811 6.868 1.00 1.22 H new ATOM 0 HG12 ILE A 119 0.732 2.751 8.594 1.00 1.45 H new ATOM 0 HG13 ILE A 119 1.121 4.009 7.438 1.00 1.45 H new ATOM 0 HG21 ILE A 119 2.471 0.543 7.521 1.00 1.38 H new ATOM 0 HG22 ILE A 119 4.006 0.984 8.306 1.00 1.38 H new ATOM 0 HG23 ILE A 119 2.486 1.043 9.229 1.00 1.38 H new ATOM 0 HD11 ILE A 119 -0.464 2.404 6.487 1.00 2.02 H new ATOM 0 HD12 ILE A 119 1.080 2.354 5.604 1.00 2.02 H new ATOM 0 HD13 ILE A 119 0.685 1.076 6.778 1.00 2.02 H new ATOM 1726 N THR A 120 1.586 4.220 10.343 1.00 0.70 N ATOM 1727 CA THR A 120 0.797 4.278 11.569 1.00 0.64 C ATOM 1728 C THR A 120 0.195 2.910 11.934 1.00 0.56 C ATOM 1729 O THR A 120 0.115 2.015 11.090 1.00 0.54 O ATOM 1730 CB THR A 120 -0.343 5.299 11.381 1.00 0.79 C ATOM 1731 OG1 THR A 120 0.118 6.376 10.552 1.00 1.59 O ATOM 1732 CG2 THR A 120 -0.820 5.860 12.711 1.00 1.33 C ATOM 0 H THR A 120 1.203 4.785 9.586 1.00 0.70 H new ATOM 0 HA THR A 120 1.459 4.577 12.382 1.00 0.64 H new ATOM 0 HB THR A 120 -1.181 4.786 10.910 1.00 0.79 H new ATOM 0 HG1 THR A 120 -0.605 7.026 10.429 1.00 1.59 H new ATOM 0 HG21 THR A 120 -1.623 6.576 12.537 1.00 1.33 H new ATOM 0 HG22 THR A 120 -1.187 5.047 13.338 1.00 1.33 H new ATOM 0 HG23 THR A 120 0.008 6.360 13.213 1.00 1.33 H new ATOM 1740 N SER A 121 -0.214 2.764 13.196 1.00 0.57 N ATOM 1741 CA SER A 121 -0.856 1.542 13.675 1.00 0.55 C ATOM 1742 C SER A 121 -2.127 1.241 12.876 1.00 0.52 C ATOM 1743 O SER A 121 -2.761 2.149 12.335 1.00 0.57 O ATOM 1744 CB SER A 121 -1.195 1.691 15.160 1.00 0.65 C ATOM 1745 OG SER A 121 -0.074 2.157 15.895 1.00 1.27 O ATOM 0 H SER A 121 -0.110 3.486 13.909 1.00 0.57 H new ATOM 0 HA SER A 121 -0.165 0.710 13.539 1.00 0.55 H new ATOM 0 HB2 SER A 121 -2.026 2.386 15.279 1.00 0.65 H new ATOM 0 HB3 SER A 121 -1.523 0.731 15.560 1.00 0.65 H new ATOM 0 HG SER A 121 -0.317 2.246 16.840 1.00 1.27 H new ATOM 1751 N PHE A 122 -2.508 -0.027 12.826 1.00 0.49 N ATOM 1752 CA PHE A 122 -3.615 -0.461 11.982 1.00 0.50 C ATOM 1753 C PHE A 122 -4.859 -0.772 12.812 1.00 0.53 C ATOM 1754 O PHE A 122 -4.817 -1.594 13.730 1.00 0.68 O ATOM 1755 CB PHE A 122 -3.212 -1.698 11.174 1.00 0.52 C ATOM 1756 CG PHE A 122 -1.919 -1.539 10.425 1.00 0.52 C ATOM 1757 CD1 PHE A 122 -1.865 -0.770 9.271 1.00 0.53 C ATOM 1758 CD2 PHE A 122 -0.762 -2.156 10.866 1.00 0.61 C ATOM 1759 CE1 PHE A 122 -0.680 -0.622 8.574 1.00 0.59 C ATOM 1760 CE2 PHE A 122 0.425 -2.012 10.172 1.00 0.66 C ATOM 1761 CZ PHE A 122 0.478 -1.243 9.050 1.00 0.63 C ATOM 0 H PHE A 122 -2.067 -0.776 13.360 1.00 0.49 H new ATOM 0 HA PHE A 122 -3.853 0.356 11.301 1.00 0.50 H new ATOM 0 HB2 PHE A 122 -3.128 -2.550 11.849 1.00 0.52 H new ATOM 0 HB3 PHE A 122 -4.006 -1.931 10.464 1.00 0.52 H new ATOM 0 HD1 PHE A 122 -2.759 -0.281 8.913 1.00 0.53 H new ATOM 0 HD2 PHE A 122 -0.786 -2.757 11.763 1.00 0.61 H new ATOM 0 HE1 PHE A 122 -0.650 -0.032 7.670 1.00 0.59 H new ATOM 0 HE2 PHE A 122 1.316 -2.513 10.522 1.00 0.66 H new ATOM 0 HZ PHE A 122 1.414 -1.113 8.528 1.00 0.63 H new ATOM 1771 N GLY A 123 -5.960 -0.112 12.478 1.00 0.53 N ATOM 1772 CA GLY A 123 -7.222 -0.366 13.145 1.00 0.60 C ATOM 1773 C GLY A 123 -8.207 -1.084 12.242 1.00 0.67 C ATOM 1774 O GLY A 123 -7.903 -2.154 11.713 1.00 1.24 O ATOM 0 H GLY A 123 -6.001 0.601 11.750 1.00 0.53 H new ATOM 0 HA2 GLY A 123 -7.046 -0.965 14.038 1.00 0.60 H new ATOM 0 HA3 GLY A 123 -7.654 0.579 13.475 1.00 0.60 H new ATOM 1778 N ASN A 124 -9.379 -0.495 12.042 1.00 0.58 N ATOM 1779 CA ASN A 124 -10.410 -1.112 11.207 1.00 0.60 C ATOM 1780 C ASN A 124 -11.195 -0.057 10.430 1.00 0.61 C ATOM 1781 O ASN A 124 -12.265 -0.334 9.890 1.00 0.99 O ATOM 1782 CB ASN A 124 -11.365 -1.945 12.067 1.00 0.81 C ATOM 1783 CG ASN A 124 -12.091 -1.118 13.113 1.00 1.83 C ATOM 1784 OD1 ASN A 124 -13.176 -0.588 12.866 1.00 2.63 O ATOM 1785 ND2 ASN A 124 -11.504 -1.005 14.293 1.00 2.45 N ATOM 0 H ASN A 124 -9.642 0.405 12.443 1.00 0.58 H new ATOM 0 HA ASN A 124 -9.912 -1.765 10.490 1.00 0.60 H new ATOM 0 HB2 ASN A 124 -12.098 -2.430 11.422 1.00 0.81 H new ATOM 0 HB3 ASN A 124 -10.803 -2.737 12.563 1.00 0.81 H new ATOM 0 HD21 ASN A 124 -11.950 -0.465 15.035 1.00 2.45 H new ATOM 0 HD22 ASN A 124 -10.606 -1.458 14.461 1.00 2.45 H new ATOM 1792 N SER A 125 -10.651 1.146 10.362 1.00 0.51 N ATOM 1793 CA SER A 125 -11.304 2.242 9.664 1.00 0.55 C ATOM 1794 C SER A 125 -10.256 3.080 8.936 1.00 0.49 C ATOM 1795 O SER A 125 -9.054 2.841 9.086 1.00 0.64 O ATOM 1796 CB SER A 125 -12.077 3.101 10.667 1.00 0.73 C ATOM 1797 OG SER A 125 -12.938 4.018 10.014 1.00 1.33 O ATOM 0 H SER A 125 -9.755 1.390 10.783 1.00 0.51 H new ATOM 0 HA SER A 125 -12.006 1.845 8.931 1.00 0.55 H new ATOM 0 HB2 SER A 125 -12.661 2.457 11.324 1.00 0.73 H new ATOM 0 HB3 SER A 125 -11.375 3.646 11.297 1.00 0.73 H new ATOM 0 HG SER A 125 -13.418 4.550 10.683 1.00 1.33 H new ATOM 1803 N ALA A 126 -10.698 4.060 8.159 1.00 0.61 N ATOM 1804 CA ALA A 126 -9.779 4.875 7.385 1.00 0.57 C ATOM 1805 C ALA A 126 -10.165 6.347 7.399 1.00 0.73 C ATOM 1806 O ALA A 126 -11.143 6.748 6.775 1.00 1.25 O ATOM 1807 CB ALA A 126 -9.710 4.378 5.954 1.00 0.62 C ATOM 0 H ALA A 126 -11.682 4.307 8.050 1.00 0.61 H new ATOM 0 HA ALA A 126 -8.799 4.784 7.853 1.00 0.57 H new ATOM 0 HB1 ALA A 126 -9.017 4.999 5.386 1.00 0.62 H new ATOM 0 HB2 ALA A 126 -9.363 3.345 5.944 1.00 0.62 H new ATOM 0 HB3 ALA A 126 -10.700 4.433 5.502 1.00 0.62 H new ATOM 1813 N ASP A 127 -9.381 7.132 8.124 1.00 0.96 N ATOM 1814 CA ASP A 127 -9.497 8.590 8.124 1.00 1.08 C ATOM 1815 C ASP A 127 -8.318 9.165 8.901 1.00 0.90 C ATOM 1816 O ASP A 127 -8.363 9.261 10.130 1.00 1.34 O ATOM 1817 CB ASP A 127 -10.827 9.049 8.734 1.00 1.42 C ATOM 1818 CG ASP A 127 -11.026 10.555 8.661 1.00 1.53 C ATOM 1819 OD1 ASP A 127 -10.566 11.268 9.581 1.00 1.40 O ATOM 1820 OD2 ASP A 127 -11.629 11.035 7.677 1.00 2.08 O ATOM 0 H ASP A 127 -8.643 6.778 8.732 1.00 0.96 H new ATOM 0 HA ASP A 127 -9.480 8.953 7.096 1.00 1.08 H new ATOM 0 HB2 ASP A 127 -11.648 8.554 8.216 1.00 1.42 H new ATOM 0 HB3 ASP A 127 -10.871 8.732 9.776 1.00 1.42 H new ATOM 1825 N GLN A 128 -7.239 9.475 8.171 1.00 0.95 N ATOM 1826 CA GLN A 128 -5.963 9.864 8.777 1.00 0.92 C ATOM 1827 C GLN A 128 -5.441 8.745 9.672 1.00 0.83 C ATOM 1828 O GLN A 128 -4.694 8.979 10.621 1.00 1.02 O ATOM 1829 CB GLN A 128 -6.100 11.168 9.568 1.00 1.02 C ATOM 1830 CG GLN A 128 -6.231 12.390 8.681 1.00 1.17 C ATOM 1831 CD GLN A 128 -6.564 13.643 9.458 1.00 1.60 C ATOM 1832 OE1 GLN A 128 -7.734 13.965 9.660 1.00 1.72 O ATOM 1833 NE2 GLN A 128 -5.543 14.360 9.897 1.00 2.54 N ATOM 0 H GLN A 128 -7.227 9.463 7.151 1.00 0.95 H new ATOM 0 HA GLN A 128 -5.245 10.036 7.975 1.00 0.92 H new ATOM 0 HB2 GLN A 128 -6.973 11.102 10.217 1.00 1.02 H new ATOM 0 HB3 GLN A 128 -5.230 11.287 10.214 1.00 1.02 H new ATOM 0 HG2 GLN A 128 -5.298 12.541 8.138 1.00 1.17 H new ATOM 0 HG3 GLN A 128 -7.007 12.212 7.937 1.00 1.17 H new ATOM 0 HE21 GLN A 128 -4.588 14.057 9.707 1.00 2.54 H new ATOM 0 HE22 GLN A 128 -5.711 15.216 10.425 1.00 2.54 H new ATOM 1842 N ALA A 129 -5.821 7.523 9.327 1.00 0.65 N ATOM 1843 CA ALA A 129 -5.486 6.351 10.114 1.00 0.63 C ATOM 1844 C ALA A 129 -5.355 5.132 9.211 1.00 0.52 C ATOM 1845 O ALA A 129 -5.617 5.211 8.008 1.00 0.47 O ATOM 1846 CB ALA A 129 -6.547 6.112 11.180 1.00 0.69 C ATOM 0 H ALA A 129 -6.371 7.319 8.492 1.00 0.65 H new ATOM 0 HA ALA A 129 -4.530 6.521 10.609 1.00 0.63 H new ATOM 0 HB1 ALA A 129 -6.284 5.230 11.764 1.00 0.69 H new ATOM 0 HB2 ALA A 129 -6.603 6.979 11.838 1.00 0.69 H new ATOM 0 HB3 ALA A 129 -7.514 5.956 10.702 1.00 0.69 H new ATOM 1852 N ALA A 130 -4.955 4.013 9.790 1.00 0.54 N ATOM 1853 CA ALA A 130 -4.766 2.787 9.032 1.00 0.50 C ATOM 1854 C ALA A 130 -5.736 1.708 9.501 1.00 0.47 C ATOM 1855 O ALA A 130 -6.317 1.812 10.581 1.00 0.53 O ATOM 1856 CB ALA A 130 -3.327 2.313 9.157 1.00 0.58 C ATOM 0 H ALA A 130 -4.754 3.928 10.786 1.00 0.54 H new ATOM 0 HA ALA A 130 -4.974 2.990 7.981 1.00 0.50 H new ATOM 0 HB1 ALA A 130 -3.196 1.394 8.586 1.00 0.58 H new ATOM 0 HB2 ALA A 130 -2.656 3.080 8.770 1.00 0.58 H new ATOM 0 HB3 ALA A 130 -3.096 2.125 10.205 1.00 0.58 H new ATOM 1862 N LYS A 131 -5.916 0.678 8.689 1.00 0.43 N ATOM 1863 CA LYS A 131 -6.810 -0.421 9.035 1.00 0.44 C ATOM 1864 C LYS A 131 -6.124 -1.756 8.739 1.00 0.45 C ATOM 1865 O LYS A 131 -5.351 -1.869 7.785 1.00 0.49 O ATOM 1866 CB LYS A 131 -8.171 -0.298 8.304 1.00 0.49 C ATOM 1867 CG LYS A 131 -8.216 -0.804 6.858 1.00 0.58 C ATOM 1868 CD LYS A 131 -7.263 -0.050 5.943 1.00 0.62 C ATOM 1869 CE LYS A 131 -7.613 1.426 5.830 1.00 0.89 C ATOM 1870 NZ LYS A 131 -8.451 1.703 4.636 1.00 1.43 N ATOM 0 H LYS A 131 -5.455 0.578 7.784 1.00 0.43 H new ATOM 0 HA LYS A 131 -7.027 -0.374 10.102 1.00 0.44 H new ATOM 0 HB2 LYS A 131 -8.919 -0.843 8.880 1.00 0.49 H new ATOM 0 HB3 LYS A 131 -8.468 0.751 8.308 1.00 0.49 H new ATOM 0 HG2 LYS A 131 -7.967 -1.865 6.841 1.00 0.58 H new ATOM 0 HG3 LYS A 131 -9.232 -0.709 6.475 1.00 0.58 H new ATOM 0 HD2 LYS A 131 -6.245 -0.151 6.320 1.00 0.62 H new ATOM 0 HD3 LYS A 131 -7.282 -0.502 4.951 1.00 0.62 H new ATOM 0 HE2 LYS A 131 -8.143 1.744 6.728 1.00 0.89 H new ATOM 0 HE3 LYS A 131 -6.697 2.014 5.776 1.00 0.89 H new ATOM 0 HZ1 LYS A 131 -7.889 2.220 3.930 1.00 1.43 H new ATOM 0 HZ2 LYS A 131 -8.780 0.805 4.227 1.00 1.43 H new ATOM 0 HZ3 LYS A 131 -9.272 2.278 4.914 1.00 1.43 H new ATOM 1884 N SER A 132 -6.382 -2.748 9.580 1.00 0.49 N ATOM 1885 CA SER A 132 -5.725 -4.042 9.459 1.00 0.59 C ATOM 1886 C SER A 132 -6.527 -4.976 8.558 1.00 0.68 C ATOM 1887 O SER A 132 -6.090 -6.087 8.254 1.00 0.97 O ATOM 1888 CB SER A 132 -5.530 -4.666 10.843 1.00 0.69 C ATOM 1889 OG SER A 132 -4.734 -5.836 10.770 1.00 1.43 O ATOM 0 H SER A 132 -7.042 -2.681 10.354 1.00 0.49 H new ATOM 0 HA SER A 132 -4.747 -3.891 9.002 1.00 0.59 H new ATOM 0 HB2 SER A 132 -5.058 -3.943 11.508 1.00 0.69 H new ATOM 0 HB3 SER A 132 -6.501 -4.910 11.275 1.00 0.69 H new ATOM 0 HG SER A 132 -4.843 -6.251 9.889 1.00 1.43 H new ATOM 1895 N THR A 133 -7.706 -4.524 8.158 1.00 0.72 N ATOM 1896 CA THR A 133 -8.520 -5.229 7.184 1.00 0.93 C ATOM 1897 C THR A 133 -9.371 -4.244 6.401 1.00 0.69 C ATOM 1898 O THR A 133 -9.946 -3.320 6.971 1.00 1.11 O ATOM 1899 CB THR A 133 -9.444 -6.279 7.830 1.00 1.84 C ATOM 1900 OG1 THR A 133 -9.915 -5.808 9.098 1.00 2.38 O ATOM 1901 CG2 THR A 133 -8.739 -7.616 8.000 1.00 2.26 C ATOM 0 H THR A 133 -8.124 -3.659 8.500 1.00 0.72 H new ATOM 0 HA THR A 133 -7.829 -5.751 6.522 1.00 0.93 H new ATOM 0 HB THR A 133 -10.292 -6.431 7.163 1.00 1.84 H new ATOM 0 HG1 THR A 133 -10.503 -6.482 9.499 1.00 2.38 H new ATOM 0 HG21 THR A 133 -9.422 -8.332 8.459 1.00 2.26 H new ATOM 0 HG22 THR A 133 -8.425 -7.988 7.025 1.00 2.26 H new ATOM 0 HG23 THR A 133 -7.865 -7.488 8.639 1.00 2.26 H new ATOM 1909 N ALA A 134 -9.450 -4.451 5.099 1.00 0.82 N ATOM 1910 CA ALA A 134 -10.196 -3.554 4.228 1.00 1.50 C ATOM 1911 C ALA A 134 -11.388 -4.277 3.623 1.00 1.30 C ATOM 1912 O ALA A 134 -11.972 -3.838 2.641 1.00 1.86 O ATOM 1913 CB ALA A 134 -9.291 -3.005 3.137 1.00 2.33 C ATOM 0 H ALA A 134 -9.006 -5.234 4.618 1.00 0.82 H new ATOM 0 HA ALA A 134 -10.566 -2.717 4.821 1.00 1.50 H new ATOM 0 HB1 ALA A 134 -9.862 -2.336 2.493 1.00 2.33 H new ATOM 0 HB2 ALA A 134 -8.466 -2.456 3.591 1.00 2.33 H new ATOM 0 HB3 ALA A 134 -8.895 -3.829 2.544 1.00 2.33 H new ATOM 1919 N ILE A 135 -11.766 -5.376 4.251 1.00 0.99 N ATOM 1920 CA ILE A 135 -12.823 -6.234 3.729 1.00 0.96 C ATOM 1921 C ILE A 135 -14.207 -5.764 4.203 1.00 1.21 C ATOM 1922 O ILE A 135 -14.844 -6.374 5.070 1.00 2.09 O ATOM 1923 CB ILE A 135 -12.568 -7.722 4.095 1.00 1.26 C ATOM 1924 CG1 ILE A 135 -13.655 -8.626 3.508 1.00 1.57 C ATOM 1925 CG2 ILE A 135 -12.457 -7.920 5.603 1.00 1.67 C ATOM 1926 CD1 ILE A 135 -13.710 -8.601 1.997 1.00 1.72 C ATOM 0 H ILE A 135 -11.357 -5.699 5.127 1.00 0.99 H new ATOM 0 HA ILE A 135 -12.809 -6.157 2.642 1.00 0.96 H new ATOM 0 HB ILE A 135 -11.612 -8.005 3.654 1.00 1.26 H new ATOM 0 HG12 ILE A 135 -13.483 -9.650 3.840 1.00 1.57 H new ATOM 0 HG13 ILE A 135 -14.623 -8.320 3.904 1.00 1.57 H new ATOM 0 HG21 ILE A 135 -12.279 -8.973 5.820 1.00 1.67 H new ATOM 0 HG22 ILE A 135 -11.629 -7.325 5.988 1.00 1.67 H new ATOM 0 HG23 ILE A 135 -13.384 -7.603 6.081 1.00 1.67 H new ATOM 0 HD11 ILE A 135 -14.503 -9.264 1.651 1.00 1.72 H new ATOM 0 HD12 ILE A 135 -13.912 -7.585 1.657 1.00 1.72 H new ATOM 0 HD13 ILE A 135 -12.755 -8.935 1.593 1.00 1.72 H new ATOM 1938 N THR A 136 -14.636 -4.637 3.647 1.00 1.18 N ATOM 1939 CA THR A 136 -15.961 -4.084 3.889 1.00 1.62 C ATOM 1940 C THR A 136 -16.119 -2.749 3.161 1.00 1.09 C ATOM 1941 O THR A 136 -15.247 -1.882 3.234 1.00 1.00 O ATOM 1942 CB THR A 136 -16.272 -3.894 5.401 1.00 2.43 C ATOM 1943 OG1 THR A 136 -17.498 -3.164 5.568 1.00 3.11 O ATOM 1944 CG2 THR A 136 -15.148 -3.168 6.125 1.00 3.17 C ATOM 0 H THR A 136 -14.068 -4.078 3.010 1.00 1.18 H new ATOM 0 HA THR A 136 -16.676 -4.809 3.500 1.00 1.62 H new ATOM 0 HB THR A 136 -16.370 -4.888 5.838 1.00 2.43 H new ATOM 0 HG1 THR A 136 -18.258 -3.751 5.371 1.00 3.11 H new ATOM 0 HG21 THR A 136 -15.406 -3.056 7.178 1.00 3.17 H new ATOM 0 HG22 THR A 136 -14.227 -3.744 6.036 1.00 3.17 H new ATOM 0 HG23 THR A 136 -15.005 -2.183 5.680 1.00 3.17 H new ATOM 1952 N PRO A 137 -17.229 -2.577 2.422 1.00 1.02 N ATOM 1953 CA PRO A 137 -17.544 -1.312 1.754 1.00 1.06 C ATOM 1954 C PRO A 137 -17.695 -0.165 2.749 1.00 0.97 C ATOM 1955 O PRO A 137 -17.542 1.001 2.394 1.00 1.12 O ATOM 1956 CB PRO A 137 -18.879 -1.591 1.053 1.00 1.46 C ATOM 1957 CG PRO A 137 -18.955 -3.075 0.944 1.00 1.55 C ATOM 1958 CD PRO A 137 -18.245 -3.606 2.154 1.00 1.31 C ATOM 0 HA PRO A 137 -16.752 -1.004 1.071 1.00 1.06 H new ATOM 0 HB2 PRO A 137 -19.716 -1.194 1.627 1.00 1.46 H new ATOM 0 HB3 PRO A 137 -18.915 -1.121 0.070 1.00 1.46 H new ATOM 0 HG2 PRO A 137 -19.991 -3.413 0.918 1.00 1.55 H new ATOM 0 HG3 PRO A 137 -18.482 -3.425 0.027 1.00 1.55 H new ATOM 0 HD2 PRO A 137 -18.924 -3.731 2.997 1.00 1.31 H new ATOM 0 HD3 PRO A 137 -17.793 -4.579 1.962 1.00 1.31 H new ATOM 1966 N ALA A 138 -17.986 -0.505 4.001 1.00 1.04 N ATOM 1967 CA ALA A 138 -18.136 0.493 5.051 1.00 1.16 C ATOM 1968 C ALA A 138 -16.787 1.103 5.409 1.00 0.92 C ATOM 1969 O ALA A 138 -16.710 2.247 5.857 1.00 0.97 O ATOM 1970 CB ALA A 138 -18.787 -0.123 6.281 1.00 1.54 C ATOM 0 H ALA A 138 -18.123 -1.467 4.312 1.00 1.04 H new ATOM 0 HA ALA A 138 -18.783 1.288 4.679 1.00 1.16 H new ATOM 0 HB1 ALA A 138 -18.892 0.636 7.056 1.00 1.54 H new ATOM 0 HB2 ALA A 138 -19.771 -0.510 6.017 1.00 1.54 H new ATOM 0 HB3 ALA A 138 -18.165 -0.937 6.653 1.00 1.54 H new ATOM 1976 N GLU A 139 -15.730 0.332 5.204 1.00 0.82 N ATOM 1977 CA GLU A 139 -14.375 0.790 5.457 1.00 0.81 C ATOM 1978 C GLU A 139 -14.017 1.907 4.485 1.00 0.71 C ATOM 1979 O GLU A 139 -13.825 3.059 4.886 1.00 0.80 O ATOM 1980 CB GLU A 139 -13.413 -0.394 5.306 1.00 0.97 C ATOM 1981 CG GLU A 139 -12.029 -0.165 5.877 1.00 1.27 C ATOM 1982 CD GLU A 139 -11.130 0.635 4.972 1.00 1.55 C ATOM 1983 OE1 GLU A 139 -11.128 1.878 5.072 1.00 1.90 O ATOM 1984 OE2 GLU A 139 -10.456 0.034 4.119 1.00 2.13 O ATOM 0 H GLU A 139 -15.788 -0.626 4.859 1.00 0.82 H new ATOM 0 HA GLU A 139 -14.297 1.184 6.470 1.00 0.81 H new ATOM 0 HB2 GLU A 139 -13.852 -1.265 5.793 1.00 0.97 H new ATOM 0 HB3 GLU A 139 -13.319 -0.634 4.247 1.00 0.97 H new ATOM 0 HG2 GLU A 139 -12.120 0.350 6.833 1.00 1.27 H new ATOM 0 HG3 GLU A 139 -11.563 -1.130 6.078 1.00 1.27 H new ATOM 1991 N ALA A 140 -13.987 1.567 3.202 1.00 0.71 N ATOM 1992 CA ALA A 140 -13.612 2.518 2.162 1.00 0.90 C ATOM 1993 C ALA A 140 -14.551 3.717 2.138 1.00 0.85 C ATOM 1994 O ALA A 140 -14.145 4.833 1.809 1.00 1.08 O ATOM 1995 CB ALA A 140 -13.591 1.833 0.805 1.00 1.09 C ATOM 0 H ALA A 140 -14.219 0.636 2.856 1.00 0.71 H new ATOM 0 HA ALA A 140 -12.611 2.885 2.389 1.00 0.90 H new ATOM 0 HB1 ALA A 140 -13.310 2.554 0.038 1.00 1.09 H new ATOM 0 HB2 ALA A 140 -12.867 1.018 0.820 1.00 1.09 H new ATOM 0 HB3 ALA A 140 -14.581 1.435 0.583 1.00 1.09 H new ATOM 2001 N ALA A 141 -15.803 3.485 2.515 1.00 0.71 N ATOM 2002 CA ALA A 141 -16.813 4.536 2.529 1.00 0.82 C ATOM 2003 C ALA A 141 -16.487 5.619 3.550 1.00 0.79 C ATOM 2004 O ALA A 141 -17.010 6.727 3.467 1.00 0.92 O ATOM 2005 CB ALA A 141 -18.182 3.949 2.813 1.00 0.95 C ATOM 0 H ALA A 141 -16.144 2.572 2.817 1.00 0.71 H new ATOM 0 HA ALA A 141 -16.818 4.999 1.542 1.00 0.82 H new ATOM 0 HB1 ALA A 141 -18.925 4.746 2.820 1.00 0.95 H new ATOM 0 HB2 ALA A 141 -18.435 3.224 2.039 1.00 0.95 H new ATOM 0 HB3 ALA A 141 -18.171 3.454 3.784 1.00 0.95 H new ATOM 2011 N THR A 142 -15.636 5.304 4.519 1.00 0.72 N ATOM 2012 CA THR A 142 -15.236 6.291 5.504 1.00 0.83 C ATOM 2013 C THR A 142 -14.177 7.235 4.929 1.00 0.97 C ATOM 2014 O THR A 142 -14.221 8.443 5.157 1.00 1.17 O ATOM 2015 CB THR A 142 -14.709 5.619 6.789 1.00 0.84 C ATOM 2016 OG1 THR A 142 -15.725 4.762 7.333 1.00 0.81 O ATOM 2017 CG2 THR A 142 -14.307 6.655 7.833 1.00 1.00 C ATOM 0 H THR A 142 -15.216 4.383 4.640 1.00 0.72 H new ATOM 0 HA THR A 142 -16.120 6.874 5.763 1.00 0.83 H new ATOM 0 HB THR A 142 -13.825 5.036 6.530 1.00 0.84 H new ATOM 0 HG1 THR A 142 -15.896 4.023 6.713 1.00 0.81 H new ATOM 0 HG21 THR A 142 -13.940 6.149 8.726 1.00 1.00 H new ATOM 0 HG22 THR A 142 -13.521 7.293 7.429 1.00 1.00 H new ATOM 0 HG23 THR A 142 -15.172 7.265 8.092 1.00 1.00 H new ATOM 2025 N ALA A 143 -13.252 6.682 4.155 1.00 0.97 N ATOM 2026 CA ALA A 143 -12.153 7.463 3.612 1.00 1.19 C ATOM 2027 C ALA A 143 -12.536 8.130 2.296 1.00 1.05 C ATOM 2028 O ALA A 143 -12.468 9.353 2.174 1.00 1.28 O ATOM 2029 CB ALA A 143 -10.927 6.589 3.430 1.00 1.42 C ATOM 0 H ALA A 143 -13.243 5.697 3.891 1.00 0.97 H new ATOM 0 HA ALA A 143 -11.920 8.254 4.325 1.00 1.19 H new ATOM 0 HB1 ALA A 143 -10.111 7.187 3.023 1.00 1.42 H new ATOM 0 HB2 ALA A 143 -10.628 6.176 4.394 1.00 1.42 H new ATOM 0 HB3 ALA A 143 -11.159 5.775 2.743 1.00 1.42 H new ATOM 2035 N CYS A 144 -12.973 7.328 1.329 1.00 0.87 N ATOM 2036 CA CYS A 144 -13.262 7.822 -0.019 1.00 0.96 C ATOM 2037 C CYS A 144 -14.448 8.786 -0.033 1.00 0.91 C ATOM 2038 O CYS A 144 -14.744 9.409 -1.056 1.00 1.26 O ATOM 2039 CB CYS A 144 -13.508 6.650 -0.973 1.00 1.28 C ATOM 2040 SG CYS A 144 -12.056 5.565 -1.192 1.00 1.45 S ATOM 0 H CYS A 144 -13.136 6.329 1.452 1.00 0.87 H new ATOM 0 HA CYS A 144 -12.389 8.379 -0.359 1.00 0.96 H new ATOM 0 HB2 CYS A 144 -14.341 6.056 -0.597 1.00 1.28 H new ATOM 0 HB3 CYS A 144 -13.808 7.041 -1.945 1.00 1.28 H new ATOM 2045 N LYS A 145 -15.130 8.904 1.103 1.00 1.09 N ATOM 2046 CA LYS A 145 -16.177 9.898 1.270 1.00 1.29 C ATOM 2047 C LYS A 145 -15.588 11.303 1.178 1.00 1.29 C ATOM 2048 O LYS A 145 -16.074 12.139 0.416 1.00 2.01 O ATOM 2049 CB LYS A 145 -16.883 9.699 2.618 1.00 1.65 C ATOM 2050 CG LYS A 145 -17.699 10.896 3.095 1.00 2.35 C ATOM 2051 CD LYS A 145 -18.779 11.298 2.100 1.00 3.18 C ATOM 2052 CE LYS A 145 -19.541 12.517 2.592 1.00 4.04 C ATOM 2053 NZ LYS A 145 -20.529 13.005 1.595 1.00 4.87 N ATOM 0 H LYS A 145 -14.972 8.319 1.923 1.00 1.09 H new ATOM 0 HA LYS A 145 -16.910 9.777 0.472 1.00 1.29 H new ATOM 0 HB2 LYS A 145 -17.542 8.834 2.543 1.00 1.65 H new ATOM 0 HB3 LYS A 145 -16.133 9.464 3.374 1.00 1.65 H new ATOM 0 HG2 LYS A 145 -18.162 10.658 4.053 1.00 2.35 H new ATOM 0 HG3 LYS A 145 -17.033 11.742 3.265 1.00 2.35 H new ATOM 0 HD2 LYS A 145 -18.326 11.513 1.132 1.00 3.18 H new ATOM 0 HD3 LYS A 145 -19.470 10.468 1.951 1.00 3.18 H new ATOM 0 HE2 LYS A 145 -20.056 12.270 3.520 1.00 4.04 H new ATOM 0 HE3 LYS A 145 -18.835 13.315 2.822 1.00 4.04 H new ATOM 0 HZ1 LYS A 145 -21.024 13.837 1.975 1.00 4.87 H new ATOM 0 HZ2 LYS A 145 -20.036 13.266 0.717 1.00 4.87 H new ATOM 0 HZ3 LYS A 145 -21.219 12.254 1.394 1.00 4.87 H new ATOM 2067 N ASN A 146 -14.530 11.556 1.938 1.00 1.10 N ATOM 2068 CA ASN A 146 -13.931 12.879 1.959 1.00 1.21 C ATOM 2069 C ASN A 146 -12.416 12.798 2.083 1.00 1.25 C ATOM 2070 O ASN A 146 -11.846 13.025 3.150 1.00 1.88 O ATOM 2071 CB ASN A 146 -14.518 13.727 3.091 1.00 1.56 C ATOM 2072 CG ASN A 146 -14.171 15.198 2.946 1.00 2.22 C ATOM 2073 OD1 ASN A 146 -14.881 15.947 2.278 1.00 2.76 O ATOM 2074 ND2 ASN A 146 -13.086 15.626 3.573 1.00 2.97 N ATOM 0 H ASN A 146 -14.075 10.870 2.540 1.00 1.10 H new ATOM 0 HA ASN A 146 -14.166 13.362 1.010 1.00 1.21 H new ATOM 0 HB2 ASN A 146 -15.602 13.611 3.105 1.00 1.56 H new ATOM 0 HB3 ASN A 146 -14.146 13.360 4.048 1.00 1.56 H new ATOM 0 HD21 ASN A 146 -12.815 16.607 3.511 1.00 2.97 H new ATOM 0 HD22 ASN A 146 -12.522 14.974 4.118 1.00 2.97 H new ATOM 2081 N THR A 147 -11.780 12.409 0.993 1.00 1.03 N ATOM 2082 CA THR A 147 -10.338 12.506 0.859 1.00 1.07 C ATOM 2083 C THR A 147 -10.019 13.618 -0.128 1.00 1.14 C ATOM 2084 O THR A 147 -9.349 14.596 0.212 1.00 2.01 O ATOM 2085 CB THR A 147 -9.733 11.177 0.367 1.00 1.20 C ATOM 2086 OG1 THR A 147 -10.583 10.616 -0.647 1.00 1.79 O ATOM 2087 CG2 THR A 147 -9.560 10.192 1.515 1.00 1.52 C ATOM 0 H THR A 147 -12.248 12.017 0.176 1.00 1.03 H new ATOM 0 HA THR A 147 -9.903 12.726 1.834 1.00 1.07 H new ATOM 0 HB THR A 147 -8.746 11.375 -0.050 1.00 1.20 H new ATOM 0 HG1 THR A 147 -10.103 9.903 -1.118 1.00 1.79 H new ATOM 0 HG21 THR A 147 -9.131 9.264 1.137 1.00 1.52 H new ATOM 0 HG22 THR A 147 -8.894 10.620 2.265 1.00 1.52 H new ATOM 0 HG23 THR A 147 -10.530 9.986 1.967 1.00 1.52 H new ATOM 2095 N ASP A 148 -10.528 13.442 -1.349 1.00 0.94 N ATOM 2096 CA ASP A 148 -10.512 14.468 -2.396 1.00 1.01 C ATOM 2097 C ASP A 148 -9.120 15.021 -2.652 1.00 0.89 C ATOM 2098 O ASP A 148 -8.365 14.453 -3.429 1.00 0.88 O ATOM 2099 CB ASP A 148 -11.485 15.602 -2.068 1.00 1.33 C ATOM 2100 CG ASP A 148 -12.929 15.146 -2.098 1.00 1.89 C ATOM 2101 OD1 ASP A 148 -13.490 14.999 -3.203 1.00 2.20 O ATOM 2102 OD2 ASP A 148 -13.508 14.928 -1.015 1.00 2.54 O ATOM 0 H ASP A 148 -10.969 12.571 -1.643 1.00 0.94 H new ATOM 0 HA ASP A 148 -10.837 13.978 -3.314 1.00 1.01 H new ATOM 0 HB2 ASP A 148 -11.253 16.003 -1.081 1.00 1.33 H new ATOM 0 HB3 ASP A 148 -11.348 16.414 -2.782 1.00 1.33 H new ATOM 2107 N SER A 149 -8.777 16.108 -1.971 1.00 0.95 N ATOM 2108 CA SER A 149 -7.502 16.783 -2.180 1.00 1.01 C ATOM 2109 C SER A 149 -6.368 16.074 -1.440 1.00 0.85 C ATOM 2110 O SER A 149 -5.204 16.469 -1.528 1.00 1.07 O ATOM 2111 CB SER A 149 -7.614 18.232 -1.715 1.00 1.27 C ATOM 2112 OG SER A 149 -8.711 18.878 -2.342 1.00 1.53 O ATOM 0 H SER A 149 -9.369 16.543 -1.264 1.00 0.95 H new ATOM 0 HA SER A 149 -7.267 16.757 -3.244 1.00 1.01 H new ATOM 0 HB2 SER A 149 -7.738 18.263 -0.633 1.00 1.27 H new ATOM 0 HB3 SER A 149 -6.692 18.765 -1.946 1.00 1.27 H new ATOM 0 HG SER A 149 -8.767 19.805 -2.029 1.00 1.53 H new ATOM 2118 N THR A 150 -6.710 15.027 -0.710 1.00 0.63 N ATOM 2119 CA THR A 150 -5.722 14.257 0.023 1.00 0.67 C ATOM 2120 C THR A 150 -5.829 12.775 -0.319 1.00 0.56 C ATOM 2121 O THR A 150 -5.439 11.917 0.469 1.00 0.64 O ATOM 2122 CB THR A 150 -5.888 14.445 1.547 1.00 0.92 C ATOM 2123 OG1 THR A 150 -7.234 14.147 1.946 1.00 1.15 O ATOM 2124 CG2 THR A 150 -5.535 15.865 1.969 1.00 1.26 C ATOM 0 H THR A 150 -7.668 14.690 -0.609 1.00 0.63 H new ATOM 0 HA THR A 150 -4.739 14.623 -0.272 1.00 0.67 H new ATOM 0 HB THR A 150 -5.203 13.755 2.041 1.00 0.92 H new ATOM 0 HG1 THR A 150 -7.857 14.470 1.262 1.00 1.15 H new ATOM 0 HG21 THR A 150 -5.662 15.966 3.047 1.00 1.26 H new ATOM 0 HG22 THR A 150 -4.499 16.076 1.704 1.00 1.26 H new ATOM 0 HG23 THR A 150 -6.191 16.570 1.459 1.00 1.26 H new ATOM 2132 N ASN A 151 -6.307 12.467 -1.515 1.00 0.49 N ATOM 2133 CA ASN A 151 -6.608 11.082 -1.859 1.00 0.47 C ATOM 2134 C ASN A 151 -5.361 10.329 -2.309 1.00 0.44 C ATOM 2135 O ASN A 151 -5.081 10.217 -3.502 1.00 0.59 O ATOM 2136 CB ASN A 151 -7.691 10.995 -2.938 1.00 0.57 C ATOM 2137 CG ASN A 151 -8.242 9.585 -3.084 1.00 0.69 C ATOM 2138 OD1 ASN A 151 -9.164 9.195 -2.374 1.00 1.21 O ATOM 2139 ND2 ASN A 151 -7.694 8.812 -4.007 1.00 0.79 N ATOM 0 H ASN A 151 -6.493 13.144 -2.255 1.00 0.49 H new ATOM 0 HA ASN A 151 -6.984 10.608 -0.952 1.00 0.47 H new ATOM 0 HB2 ASN A 151 -8.504 11.678 -2.691 1.00 0.57 H new ATOM 0 HB3 ASN A 151 -7.279 11.323 -3.892 1.00 0.57 H new ATOM 0 HD21 ASN A 151 -8.037 7.861 -4.145 1.00 0.79 H new ATOM 0 HD22 ASN A 151 -6.929 9.167 -4.581 1.00 0.79 H new ATOM 2146 N LYS A 152 -4.595 9.843 -1.343 1.00 0.41 N ATOM 2147 CA LYS A 152 -3.478 8.950 -1.621 1.00 0.41 C ATOM 2148 C LYS A 152 -3.345 7.928 -0.505 1.00 0.39 C ATOM 2149 O LYS A 152 -3.340 8.274 0.678 1.00 0.48 O ATOM 2150 CB LYS A 152 -2.163 9.723 -1.844 1.00 0.48 C ATOM 2151 CG LYS A 152 -2.035 11.034 -1.075 1.00 0.67 C ATOM 2152 CD LYS A 152 -1.840 10.823 0.417 1.00 0.85 C ATOM 2153 CE LYS A 152 -1.543 12.136 1.123 1.00 0.82 C ATOM 2154 NZ LYS A 152 -2.618 13.139 0.910 1.00 1.35 N ATOM 0 H LYS A 152 -4.727 10.053 -0.354 1.00 0.41 H new ATOM 0 HA LYS A 152 -3.685 8.423 -2.552 1.00 0.41 H new ATOM 0 HB2 LYS A 152 -1.330 9.077 -1.567 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -2.062 9.935 -2.908 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -1.193 11.601 -1.471 1.00 0.67 H new ATOM 0 HG3 LYS A 152 -2.929 11.635 -1.239 1.00 0.67 H new ATOM 0 HD2 LYS A 152 -2.736 10.372 0.843 1.00 0.85 H new ATOM 0 HD3 LYS A 152 -1.021 10.124 0.584 1.00 0.85 H new ATOM 0 HE2 LYS A 152 -1.424 11.954 2.191 1.00 0.82 H new ATOM 0 HE3 LYS A 152 -0.597 12.537 0.760 1.00 0.82 H new ATOM 0 HZ1 LYS A 152 -2.352 14.035 1.366 1.00 1.35 H new ATOM 0 HZ2 LYS A 152 -2.750 13.295 -0.110 1.00 1.35 H new ATOM 0 HZ3 LYS A 152 -3.506 12.790 1.325 1.00 1.35 H new ATOM 2168 N VAL A 153 -3.276 6.666 -0.883 1.00 0.36 N ATOM 2169 CA VAL A 153 -3.239 5.601 0.084 1.00 0.37 C ATOM 2170 C VAL A 153 -2.010 4.717 -0.096 1.00 0.35 C ATOM 2171 O VAL A 153 -1.953 3.857 -0.976 1.00 0.43 O ATOM 2172 CB VAL A 153 -4.521 4.748 0.004 1.00 0.43 C ATOM 2173 CG1 VAL A 153 -5.675 5.450 0.697 1.00 1.18 C ATOM 2174 CG2 VAL A 153 -4.889 4.440 -1.441 1.00 1.32 C ATOM 0 H VAL A 153 -3.245 6.359 -1.855 1.00 0.36 H new ATOM 0 HA VAL A 153 -3.179 6.061 1.070 1.00 0.37 H new ATOM 0 HB VAL A 153 -4.324 3.805 0.515 1.00 0.43 H new ATOM 0 HG11 VAL A 153 -6.570 4.832 0.629 1.00 1.18 H new ATOM 0 HG12 VAL A 153 -5.425 5.613 1.745 1.00 1.18 H new ATOM 0 HG13 VAL A 153 -5.860 6.410 0.214 1.00 1.18 H new ATOM 0 HG21 VAL A 153 -5.797 3.837 -1.465 1.00 1.32 H new ATOM 0 HG22 VAL A 153 -5.058 5.372 -1.980 1.00 1.32 H new ATOM 0 HG23 VAL A 153 -4.076 3.890 -1.914 1.00 1.32 H new ATOM 2184 N THR A 154 -1.013 4.964 0.725 1.00 0.35 N ATOM 2185 CA THR A 154 0.124 4.077 0.830 1.00 0.38 C ATOM 2186 C THR A 154 -0.219 2.850 1.692 1.00 0.37 C ATOM 2187 O THR A 154 -0.783 2.991 2.781 1.00 0.47 O ATOM 2188 CB THR A 154 1.296 4.848 1.458 1.00 0.52 C ATOM 2189 OG1 THR A 154 0.974 5.240 2.800 1.00 0.94 O ATOM 2190 CG2 THR A 154 1.588 6.096 0.648 1.00 0.96 C ATOM 0 H THR A 154 -0.967 5.780 1.335 1.00 0.35 H new ATOM 0 HA THR A 154 0.398 3.725 -0.165 1.00 0.38 H new ATOM 0 HB THR A 154 2.169 4.195 1.466 1.00 0.52 H new ATOM 0 HG1 THR A 154 1.075 6.211 2.890 1.00 0.94 H new ATOM 0 HG21 THR A 154 2.420 6.637 1.100 1.00 0.96 H new ATOM 0 HG22 THR A 154 1.849 5.815 -0.372 1.00 0.96 H new ATOM 0 HG23 THR A 154 0.705 6.735 0.633 1.00 0.96 H new ATOM 2198 N TYR A 155 0.074 1.639 1.204 1.00 0.35 N ATOM 2199 CA TYR A 155 -0.158 0.452 2.025 1.00 0.38 C ATOM 2200 C TYR A 155 0.889 -0.634 1.803 1.00 0.38 C ATOM 2201 O TYR A 155 1.769 -0.515 0.953 1.00 0.61 O ATOM 2202 CB TYR A 155 -1.573 -0.106 1.818 1.00 0.41 C ATOM 2203 CG TYR A 155 -1.857 -0.728 0.465 1.00 0.43 C ATOM 2204 CD1 TYR A 155 -2.156 0.072 -0.634 1.00 0.50 C ATOM 2205 CD2 TYR A 155 -1.788 -2.103 0.275 1.00 0.53 C ATOM 2206 CE1 TYR A 155 -2.387 -0.479 -1.879 1.00 0.61 C ATOM 2207 CE2 TYR A 155 -2.013 -2.663 -0.972 1.00 0.63 C ATOM 2208 CZ TYR A 155 -2.442 -1.895 -1.993 1.00 0.65 C ATOM 2209 OH TYR A 155 -2.531 -2.399 -3.286 1.00 0.79 O ATOM 0 H TYR A 155 0.459 1.460 0.277 1.00 0.35 H new ATOM 0 HA TYR A 155 -0.064 0.777 3.061 1.00 0.38 H new ATOM 0 HB2 TYR A 155 -1.761 -0.856 2.586 1.00 0.41 H new ATOM 0 HB3 TYR A 155 -2.287 0.702 1.980 1.00 0.41 H new ATOM 0 HD1 TYR A 155 -2.208 1.144 -0.511 1.00 0.50 H new ATOM 0 HD2 TYR A 155 -1.555 -2.745 1.112 1.00 0.53 H new ATOM 0 HE1 TYR A 155 -2.523 0.151 -2.746 1.00 0.61 H new ATOM 0 HE2 TYR A 155 -1.844 -3.718 -1.126 1.00 0.63 H new ATOM 0 HH TYR A 155 -2.562 -3.378 -3.254 1.00 0.79 H new ATOM 2219 N PHE A 156 0.801 -1.674 2.618 1.00 0.41 N ATOM 2220 CA PHE A 156 1.724 -2.795 2.568 1.00 0.44 C ATOM 2221 C PHE A 156 0.985 -4.108 2.364 1.00 0.46 C ATOM 2222 O PHE A 156 -0.147 -4.276 2.817 1.00 0.46 O ATOM 2223 CB PHE A 156 2.545 -2.846 3.848 1.00 0.44 C ATOM 2224 CG PHE A 156 3.525 -1.729 3.941 1.00 0.45 C ATOM 2225 CD1 PHE A 156 4.790 -1.843 3.390 1.00 0.55 C ATOM 2226 CD2 PHE A 156 3.180 -0.569 4.602 1.00 0.53 C ATOM 2227 CE1 PHE A 156 5.693 -0.809 3.501 1.00 0.62 C ATOM 2228 CE2 PHE A 156 4.077 0.465 4.714 1.00 0.61 C ATOM 2229 CZ PHE A 156 5.349 0.342 4.066 1.00 0.62 C ATOM 0 H PHE A 156 0.083 -1.763 3.337 1.00 0.41 H new ATOM 0 HA PHE A 156 2.391 -2.651 1.718 1.00 0.44 H new ATOM 0 HB2 PHE A 156 1.875 -2.810 4.707 1.00 0.44 H new ATOM 0 HB3 PHE A 156 3.076 -3.796 3.898 1.00 0.44 H new ATOM 0 HD1 PHE A 156 5.070 -2.747 2.870 1.00 0.55 H new ATOM 0 HD2 PHE A 156 2.196 -0.473 5.036 1.00 0.53 H new ATOM 0 HE1 PHE A 156 6.696 -0.937 3.123 1.00 0.62 H new ATOM 0 HE2 PHE A 156 3.829 1.352 5.278 1.00 0.61 H new ATOM 0 HZ PHE A 156 6.026 1.183 4.037 1.00 0.62 H new ATOM 2239 N MET A 157 1.639 -5.057 1.725 1.00 0.59 N ATOM 2240 CA MET A 157 0.993 -6.308 1.375 1.00 0.68 C ATOM 2241 C MET A 157 2.035 -7.419 1.315 1.00 0.82 C ATOM 2242 O MET A 157 3.116 -7.231 0.762 1.00 1.12 O ATOM 2243 CB MET A 157 0.257 -6.146 0.043 1.00 0.83 C ATOM 2244 CG MET A 157 -0.802 -7.202 -0.216 1.00 1.47 C ATOM 2245 SD MET A 157 -1.758 -6.872 -1.707 1.00 2.50 S ATOM 2246 CE MET A 157 -2.882 -8.265 -1.693 1.00 3.27 C ATOM 0 H MET A 157 2.615 -4.987 1.438 1.00 0.59 H new ATOM 0 HA MET A 157 0.258 -6.579 2.133 1.00 0.68 H new ATOM 0 HB2 MET A 157 -0.213 -5.163 0.018 1.00 0.83 H new ATOM 0 HB3 MET A 157 0.986 -6.172 -0.767 1.00 0.83 H new ATOM 0 HG2 MET A 157 -0.324 -8.177 -0.304 1.00 1.47 H new ATOM 0 HG3 MET A 157 -1.476 -7.253 0.639 1.00 1.47 H new ATOM 0 HE1 MET A 157 -3.356 -8.360 -2.670 1.00 3.27 H new ATOM 0 HE2 MET A 157 -2.329 -9.177 -1.467 1.00 3.27 H new ATOM 0 HE3 MET A 157 -3.647 -8.108 -0.933 1.00 3.27 H new ATOM 2256 N LYS A 158 1.717 -8.553 1.924 1.00 0.75 N ATOM 2257 CA LYS A 158 2.668 -9.650 2.055 1.00 0.96 C ATOM 2258 C LYS A 158 2.162 -10.889 1.320 1.00 1.43 C ATOM 2259 O LYS A 158 2.747 -11.239 0.273 1.00 1.89 O ATOM 2260 CB LYS A 158 2.893 -9.943 3.547 1.00 0.95 C ATOM 2261 CG LYS A 158 3.984 -10.966 3.855 1.00 1.11 C ATOM 2262 CD LYS A 158 3.475 -12.398 3.747 1.00 1.49 C ATOM 2263 CE LYS A 158 2.268 -12.628 4.643 1.00 1.88 C ATOM 2264 NZ LYS A 158 1.123 -13.186 3.875 1.00 2.24 N ATOM 2265 OXT LYS A 158 1.181 -11.501 1.798 1.00 2.11 O ATOM 0 H LYS A 158 0.803 -8.738 2.337 1.00 0.75 H new ATOM 0 HA LYS A 158 3.618 -9.367 1.602 1.00 0.96 H new ATOM 0 HB2 LYS A 158 3.142 -9.009 4.050 1.00 0.95 H new ATOM 0 HB3 LYS A 158 1.955 -10.296 3.976 1.00 0.95 H new ATOM 0 HG2 LYS A 158 4.817 -10.825 3.166 1.00 1.11 H new ATOM 0 HG3 LYS A 158 4.369 -10.793 4.860 1.00 1.11 H new ATOM 0 HD2 LYS A 158 3.208 -12.614 2.712 1.00 1.49 H new ATOM 0 HD3 LYS A 158 4.271 -13.090 4.022 1.00 1.49 H new ATOM 0 HE2 LYS A 158 2.536 -13.311 5.449 1.00 1.88 H new ATOM 0 HE3 LYS A 158 1.973 -11.687 5.108 1.00 1.88 H new ATOM 0 HZ1 LYS A 158 0.232 -12.932 4.347 1.00 2.24 H new ATOM 0 HZ2 LYS A 158 1.128 -12.795 2.911 1.00 2.24 H new ATOM 0 HZ3 LYS A 158 1.207 -14.222 3.829 1.00 2.24 H new TER 2279 LYS A 158