USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 646 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: B 221 TYR OH : rot 81:sc= -0.0359 USER MOD Set 1.2: B 245 THR OG1 : rot 85:sc= 1.56 USER MOD Set 2.1: A 21 TYR OH : rot -121:sc= -0.197 USER MOD Set 2.2: A 45 THR OG1 : rot 94:sc= 2.18 USER MOD Set 3.1: A 11 THR OG1 : rot 141:sc= -1.7! USER MOD Set 3.2: A 18 SER OG : rot 38:sc= 0.833 USER MOD Set 4.1: A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.2: B 207 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 7 THR OG1 : rot -170:sc= 0 USER MOD Set 5.2: B 213 ASN : amide:sc= 0 X(o=0,f=0.06) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -1.3 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= -8.04! C(o=-8!,f=-25!) USER MOD Single : A 14 SER OG : rot 36:sc= -0.397 USER MOD Single : A 15 ASN : amide:sc= -0.201 X(o=-0.2,f=-0.61) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.435 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.134 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= -0.398 X(o=-0.4,f=-0.18) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.59! USER MOD Single : B 206 TYR OH : rot 180:sc= 0 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 211 THR OG1 : rot 180:sc= -0.211 USER MOD Single : B 212 ASN : amide:sc= -10.2! C(o=-10!,f=-27!) USER MOD Single : B 214 SER OG : rot 180:sc=-0.00626 USER MOD Single : B 215 ASN : amide:sc= -0.6 X(o=-0.6,f=-0.44) USER MOD Single : B 218 SER OG : rot 180:sc= 0 USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -1.11 USER MOD Single : B 227 MET CE :methyl -134:sc= -1.61 (180deg=-4.45!) USER MOD Single : B 228 THR OG1 : rot 180:sc= -0.0467 USER MOD Single : B 240 LYS NZ :NH3+ -168:sc= 0.0465 (180deg=0.0265) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.676 F(o=-1.2!,f=-0.68) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.122 -20.086 -6.347 1.00 0.00 N ATOM 26 CA LYS A 3 -0.144 -19.786 -5.313 1.00 0.00 C ATOM 27 C LYS A 3 -0.685 -18.673 -4.414 1.00 0.00 C ATOM 28 O LYS A 3 -1.690 -18.041 -4.737 1.00 0.00 O ATOM 29 CB LYS A 3 1.215 -19.465 -5.939 1.00 0.00 C ATOM 30 CG LYS A 3 1.784 -20.684 -6.668 1.00 0.00 C ATOM 31 CD LYS A 3 1.330 -21.983 -6.001 1.00 0.00 C ATOM 32 CE LYS A 3 2.066 -23.188 -6.589 1.00 0.00 C ATOM 33 NZ LYS A 3 1.209 -24.395 -6.538 1.00 0.00 N ATOM 0 HA LYS A 3 0.020 -20.657 -4.679 1.00 0.00 H new ATOM 0 HB2 LYS A 3 1.111 -18.635 -6.638 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.910 -19.143 -5.163 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.461 -20.673 -7.709 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.873 -20.634 -6.672 1.00 0.00 H new ATOM 0 HD2 LYS A 3 1.514 -21.928 -4.928 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.255 -22.108 -6.134 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.350 -22.980 -7.621 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.987 -23.365 -6.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.724 -25.204 -6.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 0.959 -24.602 -5.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.342 -24.228 -7.087 1.00 0.00 H new ATOM 47 N ALA A 4 0.005 -18.467 -3.301 1.00 0.00 N ATOM 48 CA ALA A 4 -0.394 -17.442 -2.352 1.00 0.00 C ATOM 49 C ALA A 4 0.561 -16.251 -2.464 1.00 0.00 C ATOM 50 O ALA A 4 1.614 -16.233 -1.829 1.00 0.00 O ATOM 51 CB ALA A 4 -0.423 -18.034 -0.943 1.00 0.00 C ATOM 0 H ALA A 4 0.838 -18.993 -3.036 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.399 -17.083 -2.575 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.722 -17.265 -0.231 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.136 -18.857 -0.909 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.569 -18.403 -0.683 1.00 0.00 H new ATOM 57 N THR A 5 0.158 -15.286 -3.277 1.00 0.00 N ATOM 58 CA THR A 5 0.964 -14.093 -3.481 1.00 0.00 C ATOM 59 C THR A 5 0.079 -12.845 -3.480 1.00 0.00 C ATOM 60 O THR A 5 -1.140 -12.944 -3.600 1.00 0.00 O ATOM 61 CB THR A 5 1.757 -14.275 -4.777 1.00 0.00 C ATOM 62 OG1 THR A 5 0.760 -14.289 -5.795 1.00 0.00 O ATOM 63 CG2 THR A 5 2.410 -15.655 -4.875 1.00 0.00 C ATOM 0 H THR A 5 -0.716 -15.305 -3.803 1.00 0.00 H new ATOM 0 HA THR A 5 1.673 -13.950 -2.666 1.00 0.00 H new ATOM 0 HB THR A 5 2.525 -13.505 -4.844 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.187 -14.401 -6.670 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.960 -15.732 -5.813 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.096 -15.793 -4.040 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.639 -16.425 -4.842 1.00 0.00 H new ATOM 71 N TYR A 6 0.730 -11.699 -3.342 1.00 0.00 N ATOM 72 CA TYR A 6 0.017 -10.433 -3.324 1.00 0.00 C ATOM 73 C TYR A 6 0.757 -9.376 -4.147 1.00 0.00 C ATOM 74 O TYR A 6 1.986 -9.326 -4.141 1.00 0.00 O ATOM 75 CB TYR A 6 -0.016 -9.989 -1.859 1.00 0.00 C ATOM 76 CG TYR A 6 -1.357 -10.234 -1.166 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.656 -11.484 -0.663 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.268 -9.205 -1.043 1.00 0.00 C ATOM 79 CE1 TYR A 6 -2.918 -11.715 -0.009 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.531 -9.436 -0.389 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.793 -10.679 0.095 1.00 0.00 C ATOM 82 OH TYR A 6 -4.986 -10.897 0.712 1.00 0.00 O ATOM 0 H TYR A 6 1.742 -11.621 -3.242 1.00 0.00 H new ATOM 0 HA TYR A 6 -0.980 -10.547 -3.750 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.766 -10.516 -1.312 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.220 -8.926 -1.807 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -0.943 -12.289 -0.760 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -2.034 -8.227 -1.437 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -3.164 -12.688 0.390 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.253 -8.640 -0.286 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.509 -10.068 0.714 1.00 0.00 H new ATOM 92 N THR A 7 -0.024 -8.556 -4.837 1.00 0.00 N ATOM 93 CA THR A 7 0.540 -7.504 -5.664 1.00 0.00 C ATOM 94 C THR A 7 0.157 -6.129 -5.112 1.00 0.00 C ATOM 95 O THR A 7 -1.002 -5.726 -5.192 1.00 0.00 O ATOM 96 CB THR A 7 0.075 -7.733 -7.104 1.00 0.00 C ATOM 97 OG1 THR A 7 0.248 -9.133 -7.306 1.00 0.00 O ATOM 98 CG2 THR A 7 1.010 -7.090 -8.129 1.00 0.00 C ATOM 0 H THR A 7 -1.043 -8.600 -4.839 1.00 0.00 H new ATOM 0 HA THR A 7 1.630 -7.532 -5.652 1.00 0.00 H new ATOM 0 HB THR A 7 -0.931 -7.333 -7.229 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.123 -9.345 -8.255 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.635 -7.282 -9.134 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.054 -6.015 -7.957 1.00 0.00 H new ATOM 0 HG23 THR A 7 2.009 -7.515 -8.027 1.00 0.00 H new ATOM 106 N VAL A 8 1.153 -5.447 -4.567 1.00 0.00 N ATOM 107 CA VAL A 8 0.936 -4.126 -4.003 1.00 0.00 C ATOM 108 C VAL A 8 1.512 -3.070 -4.949 1.00 0.00 C ATOM 109 O VAL A 8 2.710 -3.072 -5.228 1.00 0.00 O ATOM 110 CB VAL A 8 1.528 -4.054 -2.594 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.653 -2.603 -2.125 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.699 -4.880 -1.608 1.00 0.00 C ATOM 0 H VAL A 8 2.113 -5.785 -4.504 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.131 -3.925 -3.903 1.00 0.00 H new ATOM 0 HB VAL A 8 2.530 -4.482 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.076 -2.580 -1.121 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.305 -2.055 -2.806 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.667 -2.138 -2.114 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.141 -4.812 -0.614 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.321 -4.496 -1.579 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.685 -5.922 -1.928 1.00 0.00 H new ATOM 122 N THR A 9 0.633 -2.196 -5.415 1.00 0.00 N ATOM 123 CA THR A 9 1.040 -1.138 -6.324 1.00 0.00 C ATOM 124 C THR A 9 0.818 0.233 -5.680 1.00 0.00 C ATOM 125 O THR A 9 -0.293 0.553 -5.262 1.00 0.00 O ATOM 126 CB THR A 9 0.277 -1.323 -7.637 1.00 0.00 C ATOM 127 OG1 THR A 9 0.597 -2.652 -8.041 1.00 0.00 O ATOM 128 CG2 THR A 9 0.830 -0.448 -8.763 1.00 0.00 C ATOM 0 H THR A 9 -0.360 -2.198 -5.180 1.00 0.00 H new ATOM 0 HA THR A 9 2.107 -1.192 -6.541 1.00 0.00 H new ATOM 0 HB THR A 9 -0.776 -1.091 -7.480 1.00 0.00 H new ATOM 0 HG1 THR A 9 0.142 -2.856 -8.885 1.00 0.00 H new ATOM 0 HG21 THR A 9 0.253 -0.618 -9.672 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.757 0.601 -8.477 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.874 -0.703 -8.943 1.00 0.00 H new ATOM 136 N VAL A 10 1.895 1.003 -5.620 1.00 0.00 N ATOM 137 CA VAL A 10 1.831 2.331 -5.034 1.00 0.00 C ATOM 138 C VAL A 10 2.168 3.372 -6.103 1.00 0.00 C ATOM 139 O VAL A 10 3.203 3.279 -6.762 1.00 0.00 O ATOM 140 CB VAL A 10 2.751 2.409 -3.814 1.00 0.00 C ATOM 141 CG1 VAL A 10 3.143 3.857 -3.514 1.00 0.00 C ATOM 142 CG2 VAL A 10 2.100 1.753 -2.594 1.00 0.00 C ATOM 0 H VAL A 10 2.815 0.733 -5.967 1.00 0.00 H new ATOM 0 HA VAL A 10 0.823 2.544 -4.679 1.00 0.00 H new ATOM 0 HB VAL A 10 3.662 1.857 -4.046 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.797 3.884 -2.642 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.666 4.278 -4.373 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.246 4.443 -3.313 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.774 1.822 -1.741 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.166 2.265 -2.361 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.895 0.705 -2.811 1.00 0.00 H new ATOM 152 N THR A 11 1.275 4.341 -6.243 1.00 0.00 N ATOM 153 CA THR A 11 1.464 5.399 -7.222 1.00 0.00 C ATOM 154 C THR A 11 1.225 6.767 -6.581 1.00 0.00 C ATOM 155 O THR A 11 0.305 6.929 -5.780 1.00 0.00 O ATOM 156 CB THR A 11 0.542 5.115 -8.409 1.00 0.00 C ATOM 157 OG1 THR A 11 1.013 3.872 -8.926 1.00 0.00 O ATOM 158 CG2 THR A 11 0.750 6.100 -9.561 1.00 0.00 C ATOM 0 H THR A 11 0.418 4.416 -5.695 1.00 0.00 H new ATOM 0 HA THR A 11 2.491 5.421 -7.587 1.00 0.00 H new ATOM 0 HB THR A 11 -0.496 5.156 -8.079 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.250 3.322 -9.201 1.00 0.00 H new ATOM 0 HG21 THR A 11 0.071 5.854 -10.377 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.548 7.113 -9.214 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.780 6.036 -9.913 1.00 0.00 H new ATOM 166 N ASN A 12 2.070 7.716 -6.956 1.00 0.00 N ATOM 167 CA ASN A 12 1.961 9.066 -6.428 1.00 0.00 C ATOM 168 C ASN A 12 1.267 9.958 -7.459 1.00 0.00 C ATOM 169 O ASN A 12 1.897 10.424 -8.407 1.00 0.00 O ATOM 170 CB ASN A 12 3.343 9.658 -6.144 1.00 0.00 C ATOM 171 CG ASN A 12 4.289 9.434 -7.326 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.890 9.035 -8.408 1.00 0.00 O ATOM 173 ND2 ASN A 12 5.562 9.712 -7.060 1.00 0.00 N ATOM 0 H ASN A 12 2.833 7.577 -7.619 1.00 0.00 H new ATOM 0 HA ASN A 12 1.390 9.021 -5.501 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.251 10.726 -5.944 1.00 0.00 H new ATOM 0 HB3 ASN A 12 3.761 9.201 -5.247 1.00 0.00 H new ATOM 0 HD21 ASN A 12 6.272 9.595 -7.783 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.829 10.042 -6.133 1.00 0.00 H new ATOM 180 N ASN A 13 -0.022 10.170 -7.239 1.00 0.00 N ATOM 181 CA ASN A 13 -0.809 10.998 -8.136 1.00 0.00 C ATOM 182 C ASN A 13 -0.189 12.394 -8.210 1.00 0.00 C ATOM 183 O ASN A 13 -0.506 13.173 -9.107 1.00 0.00 O ATOM 184 CB ASN A 13 -2.246 11.144 -7.633 1.00 0.00 C ATOM 185 CG ASN A 13 -3.225 10.402 -8.546 1.00 0.00 C ATOM 186 OD1 ASN A 13 -3.625 10.884 -9.593 1.00 0.00 O ATOM 187 ND2 ASN A 13 -3.587 9.206 -8.092 1.00 0.00 N ATOM 0 H ASN A 13 -0.541 9.782 -6.452 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.817 10.520 -9.116 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.321 10.753 -6.618 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.514 12.200 -7.588 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.237 8.632 -8.629 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.214 8.862 -7.207 1.00 0.00 H new ATOM 194 N SER A 14 0.685 12.670 -7.252 1.00 0.00 N ATOM 195 CA SER A 14 1.352 13.960 -7.196 1.00 0.00 C ATOM 196 C SER A 14 2.463 14.020 -8.247 1.00 0.00 C ATOM 197 O SER A 14 2.721 15.076 -8.822 1.00 0.00 O ATOM 198 CB SER A 14 1.924 14.224 -5.803 1.00 0.00 C ATOM 199 OG SER A 14 1.774 15.587 -5.413 1.00 0.00 O ATOM 0 H SER A 14 0.946 12.022 -6.509 1.00 0.00 H new ATOM 0 HA SER A 14 0.616 14.735 -7.409 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.423 13.582 -5.078 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.981 13.957 -5.789 1.00 0.00 H new ATOM 0 HG SER A 14 0.924 15.934 -5.756 1.00 0.00 H new ATOM 205 N ASN A 15 3.090 12.873 -8.463 1.00 0.00 N ATOM 206 CA ASN A 15 4.168 12.783 -9.434 1.00 0.00 C ATOM 207 C ASN A 15 3.703 11.947 -10.629 1.00 0.00 C ATOM 208 O ASN A 15 4.426 11.811 -11.615 1.00 0.00 O ATOM 209 CB ASN A 15 5.397 12.100 -8.830 1.00 0.00 C ATOM 210 CG ASN A 15 6.658 12.935 -9.063 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.655 14.151 -8.961 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.731 12.218 -9.381 1.00 0.00 N ATOM 0 H ASN A 15 2.873 11.999 -7.983 1.00 0.00 H new ATOM 0 HA ASN A 15 4.432 13.795 -9.741 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.247 11.952 -7.761 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.523 11.112 -9.273 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.622 12.683 -9.557 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.664 11.203 -9.449 1.00 0.00 H new ATOM 219 N GLY A 16 2.499 11.410 -10.502 1.00 0.00 N ATOM 220 CA GLY A 16 1.929 10.592 -11.558 1.00 0.00 C ATOM 221 C GLY A 16 2.765 9.331 -11.788 1.00 0.00 C ATOM 222 O GLY A 16 2.563 8.617 -12.769 1.00 0.00 O ATOM 0 H GLY A 16 1.902 11.526 -9.683 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.908 10.313 -11.296 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.874 11.170 -12.481 1.00 0.00 H new ATOM 226 N VAL A 17 3.687 9.096 -10.866 1.00 0.00 N ATOM 227 CA VAL A 17 4.554 7.934 -10.955 1.00 0.00 C ATOM 228 C VAL A 17 3.888 6.749 -10.251 1.00 0.00 C ATOM 229 O VAL A 17 3.203 6.927 -9.245 1.00 0.00 O ATOM 230 CB VAL A 17 5.936 8.266 -10.387 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.824 7.022 -10.341 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.601 9.388 -11.186 1.00 0.00 C ATOM 0 H VAL A 17 3.852 9.691 -10.054 1.00 0.00 H new ATOM 0 HA VAL A 17 4.705 7.651 -11.997 1.00 0.00 H new ATOM 0 HB VAL A 17 5.803 8.618 -9.364 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.800 7.286 -9.933 1.00 0.00 H new ATOM 0 HG12 VAL A 17 6.359 6.266 -9.708 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.947 6.625 -11.349 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.581 9.605 -10.762 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.715 9.077 -12.224 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.981 10.283 -11.142 1.00 0.00 H new ATOM 242 N SER A 18 4.113 5.569 -10.807 1.00 0.00 N ATOM 243 CA SER A 18 3.543 4.355 -10.246 1.00 0.00 C ATOM 244 C SER A 18 4.659 3.386 -9.853 1.00 0.00 C ATOM 245 O SER A 18 5.782 3.494 -10.345 1.00 0.00 O ATOM 246 CB SER A 18 2.583 3.689 -11.233 1.00 0.00 C ATOM 247 OG SER A 18 1.991 2.513 -10.690 1.00 0.00 O ATOM 0 H SER A 18 4.683 5.426 -11.641 1.00 0.00 H new ATOM 0 HA SER A 18 2.975 4.624 -9.356 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.800 4.395 -11.509 1.00 0.00 H new ATOM 0 HB3 SER A 18 3.121 3.436 -12.147 1.00 0.00 H new ATOM 0 HG SER A 18 1.801 2.652 -9.739 1.00 0.00 H new ATOM 253 N VAL A 19 4.312 2.459 -8.973 1.00 0.00 N ATOM 254 CA VAL A 19 5.272 1.470 -8.509 1.00 0.00 C ATOM 255 C VAL A 19 4.525 0.209 -8.071 1.00 0.00 C ATOM 256 O VAL A 19 3.638 0.271 -7.221 1.00 0.00 O ATOM 257 CB VAL A 19 6.142 2.065 -7.401 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.750 0.964 -6.530 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.231 2.968 -7.983 1.00 0.00 C ATOM 0 H VAL A 19 3.380 2.371 -8.569 1.00 0.00 H new ATOM 0 HA VAL A 19 5.948 1.185 -9.315 1.00 0.00 H new ATOM 0 HB VAL A 19 5.502 2.679 -6.767 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.364 1.414 -5.750 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.952 0.380 -6.072 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.368 0.312 -7.147 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.835 3.378 -7.173 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.866 2.387 -8.652 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.769 3.783 -8.539 1.00 0.00 H new ATOM 269 N ASP A 20 4.913 -0.907 -8.670 1.00 0.00 N ATOM 270 CA ASP A 20 4.291 -2.182 -8.353 1.00 0.00 C ATOM 271 C ASP A 20 5.333 -3.111 -7.727 1.00 0.00 C ATOM 272 O ASP A 20 6.482 -3.147 -8.167 1.00 0.00 O ATOM 273 CB ASP A 20 3.750 -2.860 -9.613 1.00 0.00 C ATOM 274 CG ASP A 20 3.721 -1.976 -10.862 1.00 0.00 C ATOM 275 OD1 ASP A 20 4.746 -1.972 -11.576 1.00 0.00 O ATOM 276 OD2 ASP A 20 2.675 -1.325 -11.072 1.00 0.00 O ATOM 0 H ASP A 20 5.650 -0.955 -9.373 1.00 0.00 H new ATOM 0 HA ASP A 20 3.468 -1.993 -7.664 1.00 0.00 H new ATOM 0 HB2 ASP A 20 4.358 -3.740 -9.823 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.738 -3.212 -9.412 1.00 0.00 H new ATOM 281 N TYR A 21 4.896 -3.839 -6.711 1.00 0.00 N ATOM 282 CA TYR A 21 5.777 -4.766 -6.021 1.00 0.00 C ATOM 283 C TYR A 21 5.045 -6.066 -5.676 1.00 0.00 C ATOM 284 O TYR A 21 3.983 -6.038 -5.058 1.00 0.00 O ATOM 285 CB TYR A 21 6.189 -4.068 -4.723 1.00 0.00 C ATOM 286 CG TYR A 21 7.515 -3.310 -4.818 1.00 0.00 C ATOM 287 CD1 TYR A 21 8.710 -3.995 -4.726 1.00 0.00 C ATOM 288 CD2 TYR A 21 7.517 -1.941 -4.997 1.00 0.00 C ATOM 289 CE1 TYR A 21 9.957 -3.281 -4.817 1.00 0.00 C ATOM 290 CE2 TYR A 21 8.764 -1.229 -5.087 1.00 0.00 C ATOM 291 CZ TYR A 21 9.924 -1.933 -4.992 1.00 0.00 C ATOM 292 OH TYR A 21 11.101 -1.260 -5.077 1.00 0.00 O ATOM 0 H TYR A 21 3.943 -3.806 -6.348 1.00 0.00 H new ATOM 0 HA TYR A 21 6.631 -5.023 -6.648 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.403 -3.370 -4.432 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.264 -4.812 -3.930 1.00 0.00 H new ATOM 0 HD1 TYR A 21 8.710 -5.066 -4.586 1.00 0.00 H new ATOM 0 HD2 TYR A 21 6.582 -1.405 -5.069 1.00 0.00 H new ATOM 0 HE1 TYR A 21 10.899 -3.805 -4.748 1.00 0.00 H new ATOM 0 HE2 TYR A 21 8.779 -0.158 -5.227 1.00 0.00 H new ATOM 0 HH TYR A 21 11.145 -0.586 -4.367 1.00 0.00 H new ATOM 302 N GLU A 22 5.644 -7.171 -6.092 1.00 0.00 N ATOM 303 CA GLU A 22 5.062 -8.478 -5.836 1.00 0.00 C ATOM 304 C GLU A 22 5.621 -9.062 -4.537 1.00 0.00 C ATOM 305 O GLU A 22 6.807 -9.377 -4.454 1.00 0.00 O ATOM 306 CB GLU A 22 5.305 -9.426 -7.012 1.00 0.00 C ATOM 307 CG GLU A 22 4.824 -10.841 -6.684 1.00 0.00 C ATOM 308 CD GLU A 22 5.363 -11.853 -7.698 1.00 0.00 C ATOM 309 OE1 GLU A 22 5.271 -11.547 -8.907 1.00 0.00 O ATOM 310 OE2 GLU A 22 5.853 -12.908 -7.242 1.00 0.00 O ATOM 0 H GLU A 22 6.526 -7.189 -6.604 1.00 0.00 H new ATOM 0 HA GLU A 22 3.984 -8.359 -5.724 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.784 -9.057 -7.895 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.368 -9.446 -7.254 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.151 -11.117 -5.681 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.734 -10.867 -6.683 1.00 0.00 H new ATOM 317 N THR A 23 4.740 -9.189 -3.556 1.00 0.00 N ATOM 318 CA THR A 23 5.130 -9.730 -2.265 1.00 0.00 C ATOM 319 C THR A 23 4.062 -10.694 -1.745 1.00 0.00 C ATOM 320 O THR A 23 2.914 -10.301 -1.540 1.00 0.00 O ATOM 321 CB THR A 23 5.399 -8.555 -1.322 1.00 0.00 C ATOM 322 OG1 THR A 23 6.065 -9.147 -0.210 1.00 0.00 O ATOM 323 CG2 THR A 23 4.115 -7.978 -0.724 1.00 0.00 C ATOM 0 H THR A 23 3.757 -8.927 -3.629 1.00 0.00 H new ATOM 0 HA THR A 23 6.044 -10.319 -2.343 1.00 0.00 H new ATOM 0 HB THR A 23 5.931 -7.772 -1.862 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.278 -8.455 0.450 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.363 -7.147 -0.063 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.468 -7.623 -1.526 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.598 -8.752 -0.156 1.00 0.00 H new ATOM 331 N GLU A 24 4.477 -11.936 -1.546 1.00 0.00 N ATOM 332 CA GLU A 24 3.570 -12.958 -1.055 1.00 0.00 C ATOM 333 C GLU A 24 3.552 -12.961 0.475 1.00 0.00 C ATOM 334 O GLU A 24 4.404 -13.582 1.110 1.00 0.00 O ATOM 335 CB GLU A 24 3.950 -14.337 -1.600 1.00 0.00 C ATOM 336 CG GLU A 24 5.438 -14.619 -1.388 1.00 0.00 C ATOM 337 CD GLU A 24 6.224 -14.424 -2.687 1.00 0.00 C ATOM 338 OE1 GLU A 24 5.770 -14.977 -3.712 1.00 0.00 O ATOM 339 OE2 GLU A 24 7.260 -13.729 -2.624 1.00 0.00 O ATOM 0 H GLU A 24 5.430 -12.258 -1.716 1.00 0.00 H new ATOM 0 HA GLU A 24 2.566 -12.726 -1.411 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.356 -15.104 -1.103 1.00 0.00 H new ATOM 0 HB3 GLU A 24 3.714 -14.390 -2.663 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.831 -13.956 -0.618 1.00 0.00 H new ATOM 0 HG3 GLU A 24 5.571 -15.639 -1.028 1.00 0.00 H new ATOM 346 N THR A 25 2.571 -12.259 1.025 1.00 0.00 N ATOM 347 CA THR A 25 2.431 -12.172 2.469 1.00 0.00 C ATOM 348 C THR A 25 0.976 -12.407 2.878 1.00 0.00 C ATOM 349 O THR A 25 0.096 -11.619 2.537 1.00 0.00 O ATOM 350 CB THR A 25 2.977 -10.814 2.915 1.00 0.00 C ATOM 351 OG1 THR A 25 2.484 -9.903 1.937 1.00 0.00 O ATOM 352 CG2 THR A 25 4.497 -10.720 2.780 1.00 0.00 C ATOM 0 H THR A 25 1.866 -11.745 0.496 1.00 0.00 H new ATOM 0 HA THR A 25 3.006 -12.950 2.971 1.00 0.00 H new ATOM 0 HB THR A 25 2.694 -10.633 3.952 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.790 -8.997 2.151 1.00 0.00 H new ATOM 0 HG21 THR A 25 4.831 -9.736 3.110 1.00 0.00 H new ATOM 0 HG22 THR A 25 4.965 -11.488 3.396 1.00 0.00 H new ATOM 0 HG23 THR A 25 4.780 -10.869 1.738 1.00 0.00 H new ATOM 360 N PRO A 26 0.761 -13.525 3.623 1.00 0.00 N ATOM 361 CA PRO A 26 -0.572 -13.874 4.082 1.00 0.00 C ATOM 362 C PRO A 26 -1.004 -12.976 5.243 1.00 0.00 C ATOM 363 O PRO A 26 -1.593 -11.917 5.028 1.00 0.00 O ATOM 364 CB PRO A 26 -0.483 -15.342 4.469 1.00 0.00 C ATOM 365 CG PRO A 26 0.997 -15.635 4.651 1.00 0.00 C ATOM 366 CD PRO A 26 1.780 -14.482 4.046 1.00 0.00 C ATOM 0 HA PRO A 26 -1.333 -13.722 3.317 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -1.036 -15.538 5.388 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.915 -15.977 3.695 1.00 0.00 H new ATOM 0 HG2 PRO A 26 1.237 -15.745 5.709 1.00 0.00 H new ATOM 0 HG3 PRO A 26 1.263 -16.573 4.164 1.00 0.00 H new ATOM 0 HD2 PRO A 26 2.461 -14.040 4.774 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.386 -14.814 3.203 1.00 0.00 H new ATOM 374 N MET A 27 -0.695 -13.430 6.448 1.00 0.00 N ATOM 375 CA MET A 27 -1.044 -12.681 7.644 1.00 0.00 C ATOM 376 C MET A 27 -0.122 -11.473 7.823 1.00 0.00 C ATOM 377 O MET A 27 -0.519 -10.466 8.405 1.00 0.00 O ATOM 378 CB MET A 27 -0.936 -13.592 8.868 1.00 0.00 C ATOM 379 CG MET A 27 -1.946 -14.740 8.788 1.00 0.00 C ATOM 380 SD MET A 27 -3.149 -14.585 10.097 1.00 0.00 S ATOM 381 CE MET A 27 -4.655 -14.777 9.159 1.00 0.00 C ATOM 0 H MET A 27 -0.206 -14.308 6.623 1.00 0.00 H new ATOM 0 HA MET A 27 -2.067 -12.321 7.538 1.00 0.00 H new ATOM 0 HB2 MET A 27 0.074 -13.996 8.937 1.00 0.00 H new ATOM 0 HB3 MET A 27 -1.110 -13.012 9.774 1.00 0.00 H new ATOM 0 HG2 MET A 27 -2.446 -14.729 7.820 1.00 0.00 H new ATOM 0 HG3 MET A 27 -1.429 -15.696 8.869 1.00 0.00 H new ATOM 0 HE1 MET A 27 -5.512 -14.706 9.829 1.00 0.00 H new ATOM 0 HE2 MET A 27 -4.717 -13.992 8.406 1.00 0.00 H new ATOM 0 HE3 MET A 27 -4.657 -15.751 8.669 1.00 0.00 H new ATOM 391 N THR A 28 1.092 -11.615 7.311 1.00 0.00 N ATOM 392 CA THR A 28 2.074 -10.549 7.408 1.00 0.00 C ATOM 393 C THR A 28 1.493 -9.239 6.872 1.00 0.00 C ATOM 394 O THR A 28 1.861 -8.159 7.331 1.00 0.00 O ATOM 395 CB THR A 28 3.337 -11.001 6.672 1.00 0.00 C ATOM 396 OG1 THR A 28 3.232 -12.422 6.642 1.00 0.00 O ATOM 397 CG2 THR A 28 4.611 -10.738 7.477 1.00 0.00 C ATOM 0 H THR A 28 1.418 -12.452 6.828 1.00 0.00 H new ATOM 0 HA THR A 28 2.340 -10.349 8.446 1.00 0.00 H new ATOM 0 HB THR A 28 3.401 -10.486 5.713 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.010 -12.798 6.180 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.477 -11.077 6.909 1.00 0.00 H new ATOM 0 HG22 THR A 28 4.703 -9.670 7.675 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.562 -11.279 8.422 1.00 0.00 H new ATOM 405 N LEU A 29 0.596 -9.379 5.907 1.00 0.00 N ATOM 406 CA LEU A 29 -0.039 -8.220 5.301 1.00 0.00 C ATOM 407 C LEU A 29 -0.630 -7.336 6.402 1.00 0.00 C ATOM 408 O LEU A 29 -0.727 -6.121 6.242 1.00 0.00 O ATOM 409 CB LEU A 29 -1.059 -8.656 4.249 1.00 0.00 C ATOM 410 CG LEU A 29 -0.514 -8.872 2.836 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.521 -9.633 1.970 1.00 0.00 C ATOM 412 CD2 LEU A 29 -0.101 -7.543 2.199 1.00 0.00 C ATOM 0 H LEU A 29 0.294 -10.277 5.530 1.00 0.00 H new ATOM 0 HA LEU A 29 0.696 -7.618 4.767 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.523 -9.584 4.584 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.847 -7.904 4.202 1.00 0.00 H new ATOM 0 HG LEU A 29 0.382 -9.489 2.906 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.109 -9.773 0.971 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.725 -10.605 2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.448 -9.063 1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.283 -7.724 1.195 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.966 -6.882 2.143 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.675 -7.075 2.805 1.00 0.00 H new ATOM 424 N LEU A 30 -1.012 -7.982 7.494 1.00 0.00 N ATOM 425 CA LEU A 30 -1.591 -7.270 8.621 1.00 0.00 C ATOM 426 C LEU A 30 -0.469 -6.682 9.478 1.00 0.00 C ATOM 427 O LEU A 30 -0.647 -5.642 10.113 1.00 0.00 O ATOM 428 CB LEU A 30 -2.545 -8.180 9.397 1.00 0.00 C ATOM 429 CG LEU A 30 -3.529 -8.994 8.554 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.464 -9.816 9.444 1.00 0.00 C ATOM 431 CD2 LEU A 30 -4.302 -8.091 7.591 1.00 0.00 C ATOM 0 H LEU A 30 -0.932 -8.991 7.622 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.198 -6.434 8.272 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.951 -8.871 9.995 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.116 -7.566 10.094 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.959 -9.699 7.948 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.153 -10.385 8.820 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.876 -10.502 10.054 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -5.030 -9.147 10.093 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.994 -8.694 7.004 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.860 -7.347 8.159 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.603 -7.588 6.923 1.00 0.00 H new ATOM 443 N VAL A 31 0.663 -7.371 9.471 1.00 0.00 N ATOM 444 CA VAL A 31 1.814 -6.930 10.240 1.00 0.00 C ATOM 445 C VAL A 31 2.181 -5.503 9.827 1.00 0.00 C ATOM 446 O VAL A 31 2.228 -5.190 8.637 1.00 0.00 O ATOM 447 CB VAL A 31 2.968 -7.918 10.067 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.221 -7.430 10.797 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.568 -9.316 10.542 1.00 0.00 C ATOM 0 H VAL A 31 0.807 -8.232 8.944 1.00 0.00 H new ATOM 0 HA VAL A 31 1.578 -6.910 11.304 1.00 0.00 H new ATOM 0 HB VAL A 31 3.201 -7.978 9.004 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.027 -8.151 10.658 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.524 -6.464 10.393 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.006 -7.327 11.861 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.406 -10.000 10.408 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.296 -9.278 11.597 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.716 -9.668 9.960 1.00 0.00 H new ATOM 459 N PRO A 32 2.439 -4.654 10.857 1.00 0.00 N ATOM 460 CA PRO A 32 2.801 -3.268 10.613 1.00 0.00 C ATOM 461 C PRO A 32 4.244 -3.158 10.115 1.00 0.00 C ATOM 462 O PRO A 32 4.531 -2.392 9.197 1.00 0.00 O ATOM 463 CB PRO A 32 2.575 -2.563 11.939 1.00 0.00 C ATOM 464 CG PRO A 32 2.542 -3.658 12.994 1.00 0.00 C ATOM 465 CD PRO A 32 2.393 -4.990 12.277 1.00 0.00 C ATOM 0 HA PRO A 32 2.202 -2.809 9.826 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.373 -1.849 12.142 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.640 -2.002 11.929 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.456 -3.644 13.588 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.712 -3.500 13.683 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.195 -5.677 12.547 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.454 -5.477 12.538 1.00 0.00 H new ATOM 473 N GLU A 33 5.114 -3.934 10.744 1.00 0.00 N ATOM 474 CA GLU A 33 6.519 -3.934 10.378 1.00 0.00 C ATOM 475 C GLU A 33 6.684 -4.318 8.905 1.00 0.00 C ATOM 476 O GLU A 33 7.551 -3.785 8.214 1.00 0.00 O ATOM 477 CB GLU A 33 7.323 -4.872 11.280 1.00 0.00 C ATOM 478 CG GLU A 33 6.849 -4.773 12.733 1.00 0.00 C ATOM 479 CD GLU A 33 7.948 -5.218 13.699 1.00 0.00 C ATOM 480 OE1 GLU A 33 9.088 -4.735 13.524 1.00 0.00 O ATOM 481 OE2 GLU A 33 7.624 -6.031 14.591 1.00 0.00 O ATOM 0 H GLU A 33 4.872 -4.568 11.506 1.00 0.00 H new ATOM 0 HA GLU A 33 6.909 -2.926 10.518 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.219 -5.899 10.929 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.382 -4.621 11.221 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.558 -3.746 12.955 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.963 -5.393 12.874 1.00 0.00 H new ATOM 488 N VAL A 34 5.839 -5.240 8.469 1.00 0.00 N ATOM 489 CA VAL A 34 5.879 -5.701 7.092 1.00 0.00 C ATOM 490 C VAL A 34 5.130 -4.705 6.203 1.00 0.00 C ATOM 491 O VAL A 34 5.618 -4.330 5.138 1.00 0.00 O ATOM 492 CB VAL A 34 5.321 -7.122 6.999 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.018 -7.499 5.548 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.279 -8.130 7.638 1.00 0.00 C ATOM 0 H VAL A 34 5.122 -5.681 9.045 1.00 0.00 H new ATOM 0 HA VAL A 34 6.908 -5.746 6.735 1.00 0.00 H new ATOM 0 HB VAL A 34 4.384 -7.150 7.555 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.623 -8.514 5.511 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.282 -6.807 5.139 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.934 -7.444 4.959 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.859 -9.132 7.558 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.239 -8.097 7.122 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.423 -7.879 8.689 1.00 0.00 H new ATOM 504 N ALA A 35 3.958 -4.307 6.674 1.00 0.00 N ATOM 505 CA ALA A 35 3.136 -3.363 5.935 1.00 0.00 C ATOM 506 C ALA A 35 3.880 -2.030 5.818 1.00 0.00 C ATOM 507 O ALA A 35 3.970 -1.459 4.732 1.00 0.00 O ATOM 508 CB ALA A 35 1.780 -3.215 6.627 1.00 0.00 C ATOM 0 H ALA A 35 3.557 -4.621 7.558 1.00 0.00 H new ATOM 0 HA ALA A 35 2.948 -3.726 4.925 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.164 -2.507 6.073 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.280 -4.183 6.659 1.00 0.00 H new ATOM 0 HB3 ALA A 35 1.928 -2.849 7.643 1.00 0.00 H new ATOM 514 N ALA A 36 4.393 -1.574 6.950 1.00 0.00 N ATOM 515 CA ALA A 36 5.125 -0.319 6.989 1.00 0.00 C ATOM 516 C ALA A 36 6.285 -0.381 5.993 1.00 0.00 C ATOM 517 O ALA A 36 6.473 0.537 5.197 1.00 0.00 O ATOM 518 CB ALA A 36 5.597 -0.047 8.419 1.00 0.00 C ATOM 0 H ALA A 36 4.317 -2.051 7.848 1.00 0.00 H new ATOM 0 HA ALA A 36 4.482 0.511 6.696 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.146 0.894 8.448 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.734 0.016 9.081 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.248 -0.857 8.748 1.00 0.00 H new ATOM 524 N GLU A 37 7.034 -1.471 6.072 1.00 0.00 N ATOM 525 CA GLU A 37 8.170 -1.664 5.189 1.00 0.00 C ATOM 526 C GLU A 37 7.704 -1.741 3.733 1.00 0.00 C ATOM 527 O GLU A 37 8.397 -1.272 2.831 1.00 0.00 O ATOM 528 CB GLU A 37 8.962 -2.914 5.577 1.00 0.00 C ATOM 529 CG GLU A 37 10.077 -3.194 4.569 1.00 0.00 C ATOM 530 CD GLU A 37 11.208 -4.001 5.210 1.00 0.00 C ATOM 531 OE1 GLU A 37 11.617 -3.615 6.326 1.00 0.00 O ATOM 532 OE2 GLU A 37 11.637 -4.984 4.571 1.00 0.00 O ATOM 0 H GLU A 37 6.876 -2.230 6.735 1.00 0.00 H new ATOM 0 HA GLU A 37 8.835 -0.806 5.293 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.390 -2.783 6.571 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.291 -3.772 5.630 1.00 0.00 H new ATOM 0 HG2 GLU A 37 9.673 -3.741 3.717 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.470 -2.252 4.185 1.00 0.00 H new ATOM 539 N VAL A 38 6.534 -2.334 3.550 1.00 0.00 N ATOM 540 CA VAL A 38 5.968 -2.477 2.220 1.00 0.00 C ATOM 541 C VAL A 38 5.568 -1.099 1.689 1.00 0.00 C ATOM 542 O VAL A 38 5.860 -0.762 0.543 1.00 0.00 O ATOM 543 CB VAL A 38 4.801 -3.467 2.252 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.665 -3.005 1.337 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.268 -4.875 1.879 1.00 0.00 C ATOM 0 H VAL A 38 5.962 -2.721 4.301 1.00 0.00 H new ATOM 0 HA VAL A 38 6.707 -2.888 1.533 1.00 0.00 H new ATOM 0 HB VAL A 38 4.417 -3.500 3.271 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.849 -3.726 1.378 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.305 -2.030 1.667 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.031 -2.929 0.313 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.420 -5.559 1.909 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.690 -4.864 0.874 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.027 -5.206 2.588 1.00 0.00 H new ATOM 555 N ILE A 39 4.905 -0.339 2.549 1.00 0.00 N ATOM 556 CA ILE A 39 4.462 0.995 2.182 1.00 0.00 C ATOM 557 C ILE A 39 5.682 1.903 2.005 1.00 0.00 C ATOM 558 O ILE A 39 5.763 2.657 1.037 1.00 0.00 O ATOM 559 CB ILE A 39 3.445 1.521 3.197 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.187 0.653 3.214 1.00 0.00 C ATOM 561 CG2 ILE A 39 3.123 2.994 2.937 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.550 0.583 1.824 1.00 0.00 C ATOM 0 H ILE A 39 4.664 -0.622 3.499 1.00 0.00 H new ATOM 0 HA ILE A 39 3.940 0.973 1.226 1.00 0.00 H new ATOM 0 HB ILE A 39 3.890 1.459 4.190 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.439 -0.352 3.554 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.470 1.060 3.927 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.398 3.343 3.672 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.035 3.586 3.018 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.706 3.104 1.936 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.657 -0.041 1.864 1.00 0.00 H new ATOM 0 HD12 ILE A 39 1.277 1.587 1.498 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.261 0.153 1.119 1.00 0.00 H new ATOM 574 N LYS A 40 6.599 1.799 2.955 1.00 0.00 N ATOM 575 CA LYS A 40 7.810 2.600 2.916 1.00 0.00 C ATOM 576 C LYS A 40 8.677 2.149 1.740 1.00 0.00 C ATOM 577 O LYS A 40 9.203 2.978 0.997 1.00 0.00 O ATOM 578 CB LYS A 40 8.529 2.550 4.266 1.00 0.00 C ATOM 579 CG LYS A 40 10.047 2.603 4.081 1.00 0.00 C ATOM 580 CD LYS A 40 10.656 1.201 4.145 1.00 0.00 C ATOM 581 CE LYS A 40 12.120 1.220 3.700 1.00 0.00 C ATOM 582 NZ LYS A 40 12.962 1.893 4.713 1.00 0.00 N ATOM 0 H LYS A 40 6.528 1.172 3.756 1.00 0.00 H new ATOM 0 HA LYS A 40 7.568 3.649 2.749 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.205 3.386 4.886 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.255 1.637 4.794 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.284 3.063 3.122 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.490 3.231 4.854 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.586 0.816 5.162 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.087 0.524 3.508 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.472 0.200 3.546 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.209 1.736 2.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.952 1.897 4.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.636 2.872 4.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.891 1.384 5.617 1.00 0.00 H new ATOM 596 N ASP A 41 8.803 0.837 1.607 1.00 0.00 N ATOM 597 CA ASP A 41 9.598 0.266 0.534 1.00 0.00 C ATOM 598 C ASP A 41 9.032 0.721 -0.812 1.00 0.00 C ATOM 599 O ASP A 41 9.783 1.101 -1.709 1.00 0.00 O ATOM 600 CB ASP A 41 9.558 -1.263 0.572 1.00 0.00 C ATOM 601 CG ASP A 41 10.186 -1.957 -0.639 1.00 0.00 C ATOM 602 OD1 ASP A 41 11.324 -1.574 -0.984 1.00 0.00 O ATOM 603 OD2 ASP A 41 9.514 -2.855 -1.191 1.00 0.00 O ATOM 0 H ASP A 41 8.367 0.153 2.225 1.00 0.00 H new ATOM 0 HA ASP A 41 10.627 0.603 0.661 1.00 0.00 H new ATOM 0 HB2 ASP A 41 10.070 -1.603 1.472 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.519 -1.582 0.657 1.00 0.00 H new ATOM 608 N LEU A 42 7.712 0.666 -0.912 1.00 0.00 N ATOM 609 CA LEU A 42 7.036 1.068 -2.134 1.00 0.00 C ATOM 610 C LEU A 42 7.228 2.571 -2.347 1.00 0.00 C ATOM 611 O LEU A 42 7.643 3.001 -3.422 1.00 0.00 O ATOM 612 CB LEU A 42 5.570 0.634 -2.103 1.00 0.00 C ATOM 613 CG LEU A 42 5.270 -0.757 -2.665 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.689 -1.672 -1.585 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.360 -0.668 -3.891 1.00 0.00 C ATOM 0 H LEU A 42 7.092 0.349 -0.166 1.00 0.00 H new ATOM 0 HA LEU A 42 7.475 0.565 -2.995 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.223 0.669 -1.070 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.984 1.364 -2.661 1.00 0.00 H new ATOM 0 HG LEU A 42 6.209 -1.203 -2.993 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.485 -2.654 -2.011 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.405 -1.772 -0.769 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.763 -1.242 -1.204 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.162 -1.670 -4.271 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.419 -0.194 -3.612 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.849 -0.077 -4.665 1.00 0.00 H new ATOM 627 N VAL A 43 6.918 3.329 -1.306 1.00 0.00 N ATOM 628 CA VAL A 43 7.051 4.774 -1.364 1.00 0.00 C ATOM 629 C VAL A 43 8.503 5.136 -1.677 1.00 0.00 C ATOM 630 O VAL A 43 8.766 6.005 -2.509 1.00 0.00 O ATOM 631 CB VAL A 43 6.545 5.401 -0.063 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.402 6.604 0.335 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.071 5.792 -0.179 1.00 0.00 C ATOM 0 H VAL A 43 6.574 2.969 -0.416 1.00 0.00 H new ATOM 0 HA VAL A 43 6.434 5.181 -2.165 1.00 0.00 H new ATOM 0 HB VAL A 43 6.631 4.653 0.725 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.021 7.031 1.263 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.434 6.284 0.480 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.363 7.356 -0.453 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.737 6.235 0.759 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.949 6.515 -0.985 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.475 4.905 -0.394 1.00 0.00 H new ATOM 643 N ASN A 44 9.410 4.452 -0.995 1.00 0.00 N ATOM 644 CA ASN A 44 10.831 4.690 -1.190 1.00 0.00 C ATOM 645 C ASN A 44 11.176 4.503 -2.669 1.00 0.00 C ATOM 646 O ASN A 44 12.014 5.222 -3.210 1.00 0.00 O ATOM 647 CB ASN A 44 11.671 3.703 -0.378 1.00 0.00 C ATOM 648 CG ASN A 44 12.207 4.356 0.897 1.00 0.00 C ATOM 649 OD1 ASN A 44 13.402 4.455 1.120 1.00 0.00 O ATOM 650 ND2 ASN A 44 11.257 4.797 1.718 1.00 0.00 N ATOM 0 H ASN A 44 9.189 3.733 -0.306 1.00 0.00 H new ATOM 0 HA ASN A 44 11.052 5.705 -0.861 1.00 0.00 H new ATOM 0 HB2 ASN A 44 11.067 2.834 -0.119 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.503 3.344 -0.984 1.00 0.00 H new ATOM 0 HD21 ASN A 44 11.511 5.250 2.596 1.00 0.00 H new ATOM 0 HD22 ASN A 44 10.274 4.682 1.470 1.00 0.00 H new ATOM 657 N THR A 45 10.514 3.531 -3.280 1.00 0.00 N ATOM 658 CA THR A 45 10.741 3.240 -4.685 1.00 0.00 C ATOM 659 C THR A 45 10.099 4.316 -5.564 1.00 0.00 C ATOM 660 O THR A 45 10.698 4.765 -6.540 1.00 0.00 O ATOM 661 CB THR A 45 10.215 1.832 -4.967 1.00 0.00 C ATOM 662 OG1 THR A 45 10.865 1.017 -3.996 1.00 0.00 O ATOM 663 CG2 THR A 45 10.706 1.279 -6.307 1.00 0.00 C ATOM 0 H THR A 45 9.821 2.935 -2.828 1.00 0.00 H new ATOM 0 HA THR A 45 11.804 3.260 -4.926 1.00 0.00 H new ATOM 0 HB THR A 45 9.125 1.844 -4.958 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.285 0.917 -3.212 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.303 0.277 -6.457 1.00 0.00 H new ATOM 0 HG22 THR A 45 10.370 1.930 -7.114 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.795 1.235 -6.306 1.00 0.00 H new ATOM 925 N LYS B 203 -2.091 18.043 -7.384 1.00 0.00 N ATOM 926 CA LYS B 203 -2.561 17.631 -6.072 1.00 0.00 C ATOM 927 C LYS B 203 -1.662 16.514 -5.539 1.00 0.00 C ATOM 928 O LYS B 203 -1.036 15.793 -6.315 1.00 0.00 O ATOM 929 CB LYS B 203 -4.042 17.254 -6.129 1.00 0.00 C ATOM 930 CG LYS B 203 -4.763 17.662 -4.842 1.00 0.00 C ATOM 931 CD LYS B 203 -6.270 17.778 -5.069 1.00 0.00 C ATOM 932 CE LYS B 203 -6.703 19.244 -5.133 1.00 0.00 C ATOM 933 NZ LYS B 203 -8.114 19.350 -5.569 1.00 0.00 N ATOM 0 HA LYS B 203 -2.493 18.458 -5.366 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -4.512 17.741 -6.983 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.142 16.179 -6.280 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -4.565 16.927 -4.062 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -4.371 18.616 -4.488 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -6.542 17.274 -5.997 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -6.803 17.272 -4.264 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -6.583 19.708 -4.154 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -6.061 19.789 -5.825 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -8.391 20.352 -5.607 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -8.219 18.926 -6.513 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -8.725 18.847 -4.894 1.00 0.00 H new ATOM 947 N ALA B 204 -1.627 16.405 -4.219 1.00 0.00 N ATOM 948 CA ALA B 204 -0.815 15.388 -3.574 1.00 0.00 C ATOM 949 C ALA B 204 -1.714 14.237 -3.117 1.00 0.00 C ATOM 950 O ALA B 204 -2.475 14.381 -2.162 1.00 0.00 O ATOM 951 CB ALA B 204 -0.037 16.014 -2.415 1.00 0.00 C ATOM 0 H ALA B 204 -2.148 17.004 -3.579 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.086 14.980 -4.274 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.572 15.250 -1.931 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.608 16.806 -2.796 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -0.736 16.432 -1.691 1.00 0.00 H new ATOM 957 N THR B 205 -1.597 13.122 -3.822 1.00 0.00 N ATOM 958 CA THR B 205 -2.389 11.946 -3.501 1.00 0.00 C ATOM 959 C THR B 205 -1.610 10.672 -3.830 1.00 0.00 C ATOM 960 O THR B 205 -0.655 10.706 -4.604 1.00 0.00 O ATOM 961 CB THR B 205 -3.719 12.056 -4.249 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.342 12.383 -5.584 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.552 13.255 -3.793 1.00 0.00 C ATOM 0 H THR B 205 -0.966 13.007 -4.615 1.00 0.00 H new ATOM 0 HA THR B 205 -2.602 11.891 -2.434 1.00 0.00 H new ATOM 0 HB THR B 205 -4.292 11.140 -4.103 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.145 12.471 -6.138 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.485 13.285 -4.356 1.00 0.00 H new ATOM 0 HG22 THR B 205 -4.773 13.161 -2.730 1.00 0.00 H new ATOM 0 HG23 THR B 205 -3.993 14.174 -3.968 1.00 0.00 H new ATOM 971 N TYR B 206 -2.048 9.577 -3.225 1.00 0.00 N ATOM 972 CA TYR B 206 -1.404 8.293 -3.443 1.00 0.00 C ATOM 973 C TYR B 206 -2.441 7.188 -3.654 1.00 0.00 C ATOM 974 O TYR B 206 -3.524 7.229 -3.073 1.00 0.00 O ATOM 975 CB TYR B 206 -0.612 7.997 -2.168 1.00 0.00 C ATOM 976 CG TYR B 206 0.905 8.127 -2.332 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.515 9.351 -2.145 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.660 7.023 -2.668 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.941 9.474 -2.299 1.00 0.00 C ATOM 980 CE2 TYR B 206 3.086 7.146 -2.823 1.00 0.00 C ATOM 981 CZ TYR B 206 3.656 8.366 -2.630 1.00 0.00 C ATOM 982 OH TYR B 206 5.003 8.483 -2.776 1.00 0.00 O ATOM 0 H TYR B 206 -2.841 9.553 -2.584 1.00 0.00 H new ATOM 0 HA TYR B 206 -0.771 8.327 -4.330 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -0.942 8.676 -1.382 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.846 6.986 -1.834 1.00 0.00 H new ATOM 0 HD1 TYR B 206 0.923 10.216 -1.883 1.00 0.00 H new ATOM 0 HD2 TYR B 206 1.181 6.066 -2.815 1.00 0.00 H new ATOM 0 HE1 TYR B 206 3.432 10.425 -2.155 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.689 6.290 -3.086 1.00 0.00 H new ATOM 0 HH TYR B 206 5.383 7.611 -3.012 1.00 0.00 H new ATOM 992 N THR B 207 -2.072 6.226 -4.487 1.00 0.00 N ATOM 993 CA THR B 207 -2.957 5.111 -4.782 1.00 0.00 C ATOM 994 C THR B 207 -2.250 3.782 -4.508 1.00 0.00 C ATOM 995 O THR B 207 -1.351 3.389 -5.249 1.00 0.00 O ATOM 996 CB THR B 207 -3.436 5.257 -6.227 1.00 0.00 C ATOM 997 OG1 THR B 207 -4.120 6.508 -6.241 1.00 0.00 O ATOM 998 CG2 THR B 207 -4.517 4.239 -6.591 1.00 0.00 C ATOM 0 H THR B 207 -1.173 6.195 -4.967 1.00 0.00 H new ATOM 0 HA THR B 207 -3.832 5.118 -4.132 1.00 0.00 H new ATOM 0 HB THR B 207 -2.589 5.144 -6.903 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.463 6.683 -7.142 1.00 0.00 H new ATOM 0 HG21 THR B 207 -4.822 4.386 -7.627 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.123 3.230 -6.469 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.379 4.374 -5.937 1.00 0.00 H new ATOM 1006 N VAL B 208 -2.683 3.128 -3.440 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.103 1.851 -3.059 1.00 0.00 C ATOM 1008 C VAL B 208 -3.061 0.723 -3.449 1.00 0.00 C ATOM 1009 O VAL B 208 -4.163 0.626 -2.911 1.00 0.00 O ATOM 1010 CB VAL B 208 -1.761 1.856 -1.567 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.524 0.434 -1.054 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.552 2.750 -1.285 1.00 0.00 C ATOM 0 H VAL B 208 -3.428 3.458 -2.827 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.168 1.682 -3.593 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.615 2.268 -1.029 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.283 0.466 0.008 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.424 -0.162 -1.204 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.696 -0.017 -1.601 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.330 2.736 -0.218 1.00 0.00 H new ATOM 0 HG22 VAL B 208 0.311 2.381 -1.840 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -0.774 3.771 -1.596 1.00 0.00 H new ATOM 1022 N THR B 209 -2.607 -0.100 -4.382 1.00 0.00 N ATOM 1023 CA THR B 209 -3.410 -1.217 -4.851 1.00 0.00 C ATOM 1024 C THR B 209 -3.005 -2.504 -4.130 1.00 0.00 C ATOM 1025 O THR B 209 -1.843 -2.675 -3.762 1.00 0.00 O ATOM 1026 CB THR B 209 -3.262 -1.300 -6.371 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.097 0.056 -6.779 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.553 -1.743 -7.062 1.00 0.00 C ATOM 0 H THR B 209 -1.693 -0.016 -4.826 1.00 0.00 H new ATOM 0 HA THR B 209 -4.465 -1.070 -4.620 1.00 0.00 H new ATOM 0 HB THR B 209 -2.460 -1.996 -6.620 1.00 0.00 H new ATOM 0 HG1 THR B 209 -2.992 0.094 -7.753 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.393 -1.785 -8.139 1.00 0.00 H new ATOM 0 HG22 THR B 209 -4.840 -2.730 -6.699 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.347 -1.030 -6.841 1.00 0.00 H new ATOM 1036 N VAL B 210 -3.987 -3.375 -3.947 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.748 -4.641 -3.276 1.00 0.00 C ATOM 1038 C VAL B 210 -4.528 -5.747 -3.991 1.00 0.00 C ATOM 1039 O VAL B 210 -5.758 -5.743 -3.990 1.00 0.00 O ATOM 1040 CB VAL B 210 -4.102 -4.522 -1.792 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.479 -5.885 -1.208 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.955 -3.886 -1.005 1.00 0.00 C ATOM 0 H VAL B 210 -4.949 -3.229 -4.252 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.692 -4.906 -3.324 1.00 0.00 H new ATOM 0 HB VAL B 210 -4.970 -3.869 -1.705 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.726 -5.773 -0.152 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.341 -6.284 -1.742 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.638 -6.571 -1.313 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -3.232 -3.813 0.047 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -2.061 -4.502 -1.103 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.753 -2.889 -1.397 1.00 0.00 H new ATOM 1052 N THR B 211 -3.780 -6.668 -4.582 1.00 0.00 N ATOM 1053 CA THR B 211 -4.387 -7.777 -5.298 1.00 0.00 C ATOM 1054 C THR B 211 -3.781 -9.104 -4.838 1.00 0.00 C ATOM 1055 O THR B 211 -2.563 -9.276 -4.864 1.00 0.00 O ATOM 1056 CB THR B 211 -4.219 -7.520 -6.797 1.00 0.00 C ATOM 1057 OG1 THR B 211 -4.800 -6.233 -6.996 1.00 0.00 O ATOM 1058 CG2 THR B 211 -5.080 -8.453 -7.651 1.00 0.00 C ATOM 0 H THR B 211 -2.760 -6.669 -4.579 1.00 0.00 H new ATOM 0 HA THR B 211 -5.453 -7.851 -5.083 1.00 0.00 H new ATOM 0 HB THR B 211 -3.171 -7.641 -7.071 1.00 0.00 H new ATOM 0 HG1 THR B 211 -4.733 -5.986 -7.942 1.00 0.00 H new ATOM 0 HG21 THR B 211 -4.923 -8.229 -8.706 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.800 -9.488 -7.455 1.00 0.00 H new ATOM 0 HG23 THR B 211 -6.131 -8.308 -7.402 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.657 -10.007 -4.427 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.224 -11.314 -3.961 1.00 0.00 C ATOM 1068 C ASN B 212 -4.329 -12.320 -5.109 1.00 0.00 C ATOM 1069 O ASN B 212 -5.408 -12.844 -5.383 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.106 -11.810 -2.814 1.00 0.00 C ATOM 1071 CG ASN B 212 -6.586 -11.769 -3.203 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -6.953 -11.424 -4.313 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -7.412 -12.138 -2.228 1.00 0.00 N ATOM 0 H ASN B 212 -5.666 -9.860 -4.407 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.196 -11.224 -3.611 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -4.824 -12.829 -2.548 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -4.941 -11.193 -1.931 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -8.419 -12.143 -2.388 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.038 -12.416 -1.321 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.194 -12.560 -5.749 1.00 0.00 N ATOM 1081 CA ASN B 213 -3.146 -13.494 -6.861 1.00 0.00 C ATOM 1082 C ASN B 213 -3.633 -14.866 -6.390 1.00 0.00 C ATOM 1083 O ASN B 213 -3.969 -15.724 -7.206 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.717 -13.654 -7.384 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.512 -12.854 -8.672 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.788 -13.313 -9.768 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -1.013 -11.637 -8.480 1.00 0.00 N ATOM 0 H ASN B 213 -2.301 -12.124 -5.519 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.780 -13.104 -7.657 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -1.009 -13.318 -6.626 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.510 -14.708 -7.569 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.839 -11.025 -9.278 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.804 -11.315 -7.535 1.00 0.00 H new ATOM 1094 N SER B 214 -3.655 -15.032 -5.076 1.00 0.00 N ATOM 1095 CA SER B 214 -4.095 -16.286 -4.486 1.00 0.00 C ATOM 1096 C SER B 214 -5.611 -16.427 -4.629 1.00 0.00 C ATOM 1097 O SER B 214 -6.119 -17.527 -4.840 1.00 0.00 O ATOM 1098 CB SER B 214 -3.689 -16.374 -3.014 1.00 0.00 C ATOM 1099 OG SER B 214 -4.738 -15.957 -2.145 1.00 0.00 O ATOM 0 H SER B 214 -3.375 -14.319 -4.402 1.00 0.00 H new ATOM 0 HA SER B 214 -3.609 -17.104 -5.018 1.00 0.00 H new ATOM 0 HB2 SER B 214 -3.408 -17.400 -2.776 1.00 0.00 H new ATOM 0 HB3 SER B 214 -2.809 -15.754 -2.843 1.00 0.00 H new ATOM 0 HG SER B 214 -4.440 -16.030 -1.214 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.292 -15.296 -4.507 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.741 -15.280 -4.620 1.00 0.00 C ATOM 1107 C ASN B 215 -8.140 -14.546 -5.902 1.00 0.00 C ATOM 1108 O ASN B 215 -9.322 -14.471 -6.236 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.377 -14.548 -3.438 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.543 -15.351 -2.857 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -9.474 -16.557 -2.685 1.00 0.00 O ATOM 1112 ND2 ASN B 215 -10.614 -14.618 -2.568 1.00 0.00 N ATOM 0 H ASN B 215 -5.867 -14.385 -4.331 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.090 -16.313 -4.634 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.627 -14.378 -2.665 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.730 -13.568 -3.760 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -11.445 -15.062 -2.177 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.604 -13.612 -2.737 1.00 0.00 H new ATOM 1119 N GLY B 216 -7.133 -14.023 -6.584 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.364 -13.297 -7.822 1.00 0.00 C ATOM 1121 C GLY B 216 -8.225 -12.056 -7.577 1.00 0.00 C ATOM 1122 O GLY B 216 -8.750 -11.464 -8.519 1.00 0.00 O ATOM 0 H GLY B 216 -6.154 -14.087 -6.303 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.410 -13.002 -8.258 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.856 -13.949 -8.544 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.343 -11.698 -6.307 1.00 0.00 N ATOM 1127 CA VAL B 217 -9.130 -10.538 -5.926 1.00 0.00 C ATOM 1128 C VAL B 217 -8.233 -9.299 -5.917 1.00 0.00 C ATOM 1129 O VAL B 217 -7.139 -9.324 -5.356 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.816 -10.790 -4.581 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.480 -9.515 -4.058 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.830 -11.930 -4.688 1.00 0.00 C ATOM 0 H VAL B 217 -7.906 -12.191 -5.528 1.00 0.00 H new ATOM 0 HA VAL B 217 -9.923 -10.359 -6.652 1.00 0.00 H new ATOM 0 HB VAL B 217 -9.050 -11.088 -3.865 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.960 -9.721 -3.101 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.725 -8.740 -3.926 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.228 -9.175 -4.774 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.303 -12.088 -3.719 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.591 -11.672 -5.425 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.320 -12.843 -4.996 1.00 0.00 H new ATOM 1142 N SER B 218 -8.730 -8.243 -6.544 1.00 0.00 N ATOM 1143 CA SER B 218 -7.987 -6.997 -6.615 1.00 0.00 C ATOM 1144 C SER B 218 -8.745 -5.893 -5.875 1.00 0.00 C ATOM 1145 O SER B 218 -9.975 -5.896 -5.838 1.00 0.00 O ATOM 1146 CB SER B 218 -7.738 -6.586 -8.068 1.00 0.00 C ATOM 1147 OG SER B 218 -8.644 -7.221 -8.966 1.00 0.00 O ATOM 0 H SER B 218 -9.638 -8.225 -7.007 1.00 0.00 H new ATOM 0 HA SER B 218 -7.019 -7.149 -6.137 1.00 0.00 H new ATOM 0 HB2 SER B 218 -7.835 -5.504 -8.160 1.00 0.00 H new ATOM 0 HB3 SER B 218 -6.715 -6.839 -8.346 1.00 0.00 H new ATOM 0 HG SER B 218 -8.453 -6.931 -9.883 1.00 0.00 H new ATOM 1153 N VAL B 219 -7.981 -4.975 -5.302 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.565 -3.867 -4.565 1.00 0.00 C ATOM 1155 C VAL B 219 -7.610 -2.672 -4.607 1.00 0.00 C ATOM 1156 O VAL B 219 -6.442 -2.794 -4.239 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.907 -4.310 -3.141 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -9.110 -3.101 -2.225 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -10.138 -5.219 -3.131 1.00 0.00 C ATOM 0 H VAL B 219 -6.961 -4.976 -5.333 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.500 -3.551 -5.027 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.064 -4.884 -2.756 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.352 -3.443 -1.219 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -8.196 -2.508 -2.197 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -9.927 -2.489 -2.606 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.360 -5.520 -2.107 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.991 -4.681 -3.544 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.941 -6.105 -3.735 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.142 -1.546 -5.057 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.351 -0.331 -5.152 1.00 0.00 C ATOM 1171 C ASP B 220 -7.888 0.700 -4.156 1.00 0.00 C ATOM 1172 O ASP B 220 -9.092 0.762 -3.909 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.439 0.276 -6.554 1.00 0.00 C ATOM 1174 CG ASP B 220 -7.992 -0.660 -7.630 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -7.580 -1.841 -7.622 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -8.813 -0.174 -8.437 1.00 0.00 O ATOM 0 H ASP B 220 -9.111 -1.449 -5.360 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.314 -0.586 -4.934 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.067 1.166 -6.510 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.444 0.603 -6.855 1.00 0.00 H new ATOM 1181 N TYR B 221 -6.969 1.483 -3.611 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.335 2.508 -2.648 1.00 0.00 C ATOM 1183 C TYR B 221 -6.531 3.790 -2.880 1.00 0.00 C ATOM 1184 O TYR B 221 -5.304 3.754 -2.948 1.00 0.00 O ATOM 1185 CB TYR B 221 -6.981 1.940 -1.273 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.148 1.249 -0.566 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -8.684 0.090 -1.091 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.664 1.783 0.597 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -9.783 -0.560 -0.424 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -9.763 1.133 1.262 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.269 -0.007 0.718 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.307 -0.621 1.348 1.00 0.00 O ATOM 0 H TYR B 221 -5.972 1.428 -3.818 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.392 2.759 -2.737 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.164 1.227 -1.385 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.614 2.749 -0.641 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -8.280 -0.329 -2.001 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -8.243 2.689 1.008 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -10.211 -1.467 -0.823 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -10.177 1.541 2.172 1.00 0.00 H new ATOM 0 HH TYR B 221 -10.968 -1.367 1.885 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.258 4.892 -2.995 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.628 6.183 -3.218 1.00 0.00 C ATOM 1204 C GLU B 222 -6.602 6.992 -1.919 1.00 0.00 C ATOM 1205 O GLU B 222 -7.650 7.370 -1.398 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.339 6.956 -4.331 1.00 0.00 C ATOM 1207 CG GLU B 222 -6.656 8.300 -4.587 1.00 0.00 C ATOM 1208 CD GLU B 222 -6.947 8.801 -6.003 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -6.857 7.968 -6.930 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -7.253 10.007 -6.126 1.00 0.00 O ATOM 0 H GLU B 222 -8.276 4.918 -2.938 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.600 6.013 -3.539 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.340 6.364 -5.246 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.381 7.120 -4.056 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.004 9.033 -3.859 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -5.580 8.198 -4.447 1.00 0.00 H new ATOM 1217 N THR B 223 -5.393 7.233 -1.434 1.00 0.00 N ATOM 1218 CA THR B 223 -5.217 7.990 -0.206 1.00 0.00 C ATOM 1219 C THR B 223 -4.060 8.981 -0.352 1.00 0.00 C ATOM 1220 O THR B 223 -3.104 8.721 -1.081 1.00 0.00 O ATOM 1221 CB THR B 223 -5.024 6.996 0.940 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.205 7.779 2.116 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.582 6.495 1.045 1.00 0.00 C ATOM 0 H THR B 223 -4.526 6.918 -1.869 1.00 0.00 H new ATOM 0 HA THR B 223 -6.097 8.595 0.015 1.00 0.00 H new ATOM 0 HB THR B 223 -5.694 6.148 0.799 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.098 7.211 2.907 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.500 5.792 1.874 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.302 5.996 0.117 1.00 0.00 H new ATOM 0 HG23 THR B 223 -2.915 7.340 1.218 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.185 10.095 0.355 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.162 11.126 0.313 1.00 0.00 C ATOM 1233 C GLU B 224 -2.353 11.123 1.611 1.00 0.00 C ATOM 1234 O GLU B 224 -2.746 11.752 2.593 1.00 0.00 O ATOM 1235 CB GLU B 224 -3.780 12.502 0.054 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.242 12.539 0.501 1.00 0.00 C ATOM 1237 CD GLU B 224 -5.360 12.343 2.013 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -4.815 13.201 2.741 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -5.991 11.339 2.409 1.00 0.00 O ATOM 0 H GLU B 224 -4.979 10.306 0.960 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.486 10.907 -0.514 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.213 13.265 0.587 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -3.714 12.740 -1.008 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -5.688 13.493 0.219 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -5.803 11.760 -0.015 1.00 0.00 H new ATOM 1246 N THR B 225 -1.238 10.410 1.575 1.00 0.00 N ATOM 1247 CA THR B 225 -0.370 10.317 2.736 1.00 0.00 C ATOM 1248 C THR B 225 1.088 10.540 2.332 1.00 0.00 C ATOM 1249 O THR B 225 1.682 9.704 1.651 1.00 0.00 O ATOM 1250 CB THR B 225 -0.616 8.962 3.404 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.523 8.027 2.333 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.053 8.810 3.908 1.00 0.00 C ATOM 0 H THR B 225 -0.915 9.890 0.759 1.00 0.00 H new ATOM 0 HA THR B 225 -0.596 11.099 3.462 1.00 0.00 H new ATOM 0 HB THR B 225 0.076 8.836 4.237 1.00 0.00 H new ATOM 0 HG1 THR B 225 -0.668 7.121 2.676 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.174 7.832 4.373 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.266 9.589 4.640 1.00 0.00 H new ATOM 0 HG23 THR B 225 -2.744 8.901 3.070 1.00 0.00 H new ATOM 1260 N PRO B 226 1.639 11.700 2.780 1.00 0.00 N ATOM 1261 CA PRO B 226 3.017 12.043 2.472 1.00 0.00 C ATOM 1262 C PRO B 226 3.990 11.214 3.315 1.00 0.00 C ATOM 1263 O PRO B 226 4.461 10.166 2.876 1.00 0.00 O ATOM 1264 CB PRO B 226 3.121 13.535 2.740 1.00 0.00 C ATOM 1265 CG PRO B 226 1.936 13.882 3.626 1.00 0.00 C ATOM 1266 CD PRO B 226 0.966 12.712 3.589 1.00 0.00 C ATOM 0 HA PRO B 226 3.286 11.818 1.440 1.00 0.00 H new ATOM 0 HB2 PRO B 226 4.062 13.779 3.233 1.00 0.00 H new ATOM 0 HB3 PRO B 226 3.092 14.102 1.810 1.00 0.00 H new ATOM 0 HG2 PRO B 226 2.266 14.072 4.647 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.450 14.792 3.274 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.754 12.341 4.592 1.00 0.00 H new ATOM 0 HD3 PRO B 226 0.012 13.002 3.148 1.00 0.00 H new ATOM 1274 N MET B 227 4.261 11.717 4.511 1.00 0.00 N ATOM 1275 CA MET B 227 5.169 11.038 5.419 1.00 0.00 C ATOM 1276 C MET B 227 4.504 9.808 6.042 1.00 0.00 C ATOM 1277 O MET B 227 5.179 8.835 6.374 1.00 0.00 O ATOM 1278 CB MET B 227 5.599 12.001 6.527 1.00 0.00 C ATOM 1279 CG MET B 227 6.013 13.355 5.946 1.00 0.00 C ATOM 1280 SD MET B 227 5.502 14.670 7.040 1.00 0.00 S ATOM 1281 CE MET B 227 3.772 14.270 7.219 1.00 0.00 C ATOM 0 H MET B 227 3.868 12.586 4.872 1.00 0.00 H new ATOM 0 HA MET B 227 6.040 10.710 4.852 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.779 12.139 7.232 1.00 0.00 H new ATOM 0 HB3 MET B 227 6.431 11.571 7.085 1.00 0.00 H new ATOM 0 HG2 MET B 227 7.094 13.385 5.807 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.561 13.492 4.963 1.00 0.00 H new ATOM 0 HE1 MET B 227 3.175 15.175 7.103 1.00 0.00 H new ATOM 0 HE2 MET B 227 3.485 13.546 6.456 1.00 0.00 H new ATOM 0 HE3 MET B 227 3.597 13.845 8.207 1.00 0.00 H new ATOM 1291 N THR B 228 3.189 9.893 6.179 1.00 0.00 N ATOM 1292 CA THR B 228 2.425 8.799 6.755 1.00 0.00 C ATOM 1293 C THR B 228 2.761 7.484 6.049 1.00 0.00 C ATOM 1294 O THR B 228 2.797 6.428 6.679 1.00 0.00 O ATOM 1295 CB THR B 228 0.942 9.167 6.681 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.934 10.448 6.055 1.00 0.00 O ATOM 1297 CG2 THR B 228 0.332 9.423 8.061 1.00 0.00 C ATOM 0 H THR B 228 2.633 10.702 5.901 1.00 0.00 H new ATOM 0 HA THR B 228 2.684 8.644 7.802 1.00 0.00 H new ATOM 0 HB THR B 228 0.393 8.366 6.185 1.00 0.00 H new ATOM 0 HG1 THR B 228 0.010 10.762 5.965 1.00 0.00 H new ATOM 0 HG21 THR B 228 -0.722 9.680 7.951 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.425 8.525 8.672 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.858 10.246 8.544 1.00 0.00 H new ATOM 1305 N LEU B 229 2.997 7.591 4.750 1.00 0.00 N ATOM 1306 CA LEU B 229 3.328 6.423 3.950 1.00 0.00 C ATOM 1307 C LEU B 229 4.483 5.669 4.612 1.00 0.00 C ATOM 1308 O LEU B 229 4.555 4.443 4.533 1.00 0.00 O ATOM 1309 CB LEU B 229 3.608 6.828 2.502 1.00 0.00 C ATOM 1310 CG LEU B 229 2.384 6.951 1.592 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.728 7.713 0.310 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.779 5.577 1.297 1.00 0.00 C ATOM 0 H LEU B 229 2.966 8.468 4.231 1.00 0.00 H new ATOM 0 HA LEU B 229 2.482 5.737 3.907 1.00 0.00 H new ATOM 0 HB2 LEU B 229 4.130 7.785 2.508 1.00 0.00 H new ATOM 0 HB3 LEU B 229 4.288 6.097 2.066 1.00 0.00 H new ATOM 0 HG LEU B 229 1.625 7.531 2.118 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.841 7.786 -0.319 1.00 0.00 H new ATOM 0 HD12 LEU B 229 3.076 8.714 0.564 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.512 7.182 -0.229 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.911 5.693 0.648 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.521 4.952 0.801 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.473 5.106 2.231 1.00 0.00 H new ATOM 1324 N LEU B 230 5.358 6.432 5.252 1.00 0.00 N ATOM 1325 CA LEU B 230 6.506 5.851 5.927 1.00 0.00 C ATOM 1326 C LEU B 230 6.079 5.348 7.307 1.00 0.00 C ATOM 1327 O LEU B 230 6.722 4.469 7.878 1.00 0.00 O ATOM 1328 CB LEU B 230 7.665 6.849 5.967 1.00 0.00 C ATOM 1329 CG LEU B 230 7.953 7.594 4.663 1.00 0.00 C ATOM 1330 CD1 LEU B 230 9.179 8.498 4.808 1.00 0.00 C ATOM 1331 CD2 LEU B 230 8.094 6.620 3.492 1.00 0.00 C ATOM 0 H LEU B 230 5.294 7.448 5.317 1.00 0.00 H new ATOM 0 HA LEU B 230 6.878 4.988 5.374 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.458 7.584 6.745 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.568 6.316 6.265 1.00 0.00 H new ATOM 0 HG LEU B 230 7.101 8.238 4.443 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.362 9.016 3.867 1.00 0.00 H new ATOM 0 HD12 LEU B 230 9.001 9.229 5.596 1.00 0.00 H new ATOM 0 HD13 LEU B 230 10.049 7.893 5.064 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.298 7.177 2.578 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.916 5.931 3.689 1.00 0.00 H new ATOM 0 HD23 LEU B 230 7.169 6.056 3.374 1.00 0.00 H new ATOM 1343 N VAL B 231 4.996 5.927 7.804 1.00 0.00 N ATOM 1344 CA VAL B 231 4.476 5.550 9.107 1.00 0.00 C ATOM 1345 C VAL B 231 3.949 4.114 9.044 1.00 0.00 C ATOM 1346 O VAL B 231 3.250 3.746 8.101 1.00 0.00 O ATOM 1347 CB VAL B 231 3.416 6.555 9.559 1.00 0.00 C ATOM 1348 CG1 VAL B 231 2.779 6.123 10.882 1.00 0.00 C ATOM 1349 CG2 VAL B 231 4.007 7.963 9.670 1.00 0.00 C ATOM 0 H VAL B 231 4.464 6.655 7.327 1.00 0.00 H new ATOM 0 HA VAL B 231 5.268 5.575 9.856 1.00 0.00 H new ATOM 0 HB VAL B 231 2.633 6.578 8.801 1.00 0.00 H new ATOM 0 HG11 VAL B 231 2.029 6.855 11.181 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.306 5.149 10.757 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.548 6.057 11.652 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.232 8.658 9.993 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.819 7.961 10.397 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.391 8.274 8.699 1.00 0.00 H new ATOM 1359 N PRO B 232 4.314 3.321 10.086 1.00 0.00 N ATOM 1360 CA PRO B 232 3.886 1.935 10.159 1.00 0.00 C ATOM 1361 C PRO B 232 2.412 1.836 10.555 1.00 0.00 C ATOM 1362 O PRO B 232 1.663 1.043 9.985 1.00 0.00 O ATOM 1363 CB PRO B 232 4.818 1.288 11.170 1.00 0.00 C ATOM 1364 CG PRO B 232 5.426 2.430 11.968 1.00 0.00 C ATOM 1365 CD PRO B 232 5.141 3.723 11.222 1.00 0.00 C ATOM 0 HA PRO B 232 3.947 1.425 9.198 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.274 0.604 11.821 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.592 0.705 10.670 1.00 0.00 H new ATOM 0 HG2 PRO B 232 4.999 2.465 12.970 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.500 2.285 12.084 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.620 4.440 11.857 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.063 4.201 10.891 1.00 0.00 H new ATOM 1373 N GLU B 233 2.038 2.652 11.529 1.00 0.00 N ATOM 1374 CA GLU B 233 0.666 2.666 12.009 1.00 0.00 C ATOM 1375 C GLU B 233 -0.290 3.024 10.870 1.00 0.00 C ATOM 1376 O GLU B 233 -1.410 2.517 10.811 1.00 0.00 O ATOM 1377 CB GLU B 233 0.506 3.633 13.184 1.00 0.00 C ATOM 1378 CG GLU B 233 1.707 3.552 14.128 1.00 0.00 C ATOM 1379 CD GLU B 233 1.341 4.056 15.526 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.166 3.866 15.907 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.244 4.620 16.181 1.00 0.00 O ATOM 0 H GLU B 233 2.661 3.309 11.999 1.00 0.00 H new ATOM 0 HA GLU B 233 0.416 1.667 12.367 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.401 4.651 12.810 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.407 3.399 13.731 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.057 2.522 14.189 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.529 4.145 13.728 1.00 0.00 H new ATOM 1388 N VAL B 234 0.186 3.895 9.992 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.613 4.328 8.858 1.00 0.00 C ATOM 1390 C VAL B 234 -0.502 3.292 7.738 1.00 0.00 C ATOM 1391 O VAL B 234 -1.508 2.904 7.144 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.185 5.730 8.420 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -0.944 6.168 7.166 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.372 6.739 9.555 1.00 0.00 C ATOM 0 H VAL B 234 1.115 4.313 10.043 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.665 4.397 9.136 1.00 0.00 H new ATOM 0 HB VAL B 234 0.876 5.695 8.174 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.621 7.168 6.876 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.738 5.470 6.354 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -2.014 6.178 7.373 1.00 0.00 H new ATOM 0 HG21 VAL B 234 -0.061 7.728 9.218 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.422 6.769 9.846 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.233 6.440 10.411 1.00 0.00 H new ATOM 1404 N ALA B 235 0.728 2.873 7.482 1.00 0.00 N ATOM 1405 CA ALA B 235 0.984 1.890 6.443 1.00 0.00 C ATOM 1406 C ALA B 235 0.332 0.561 6.833 1.00 0.00 C ATOM 1407 O ALA B 235 -0.342 -0.066 6.018 1.00 0.00 O ATOM 1408 CB ALA B 235 2.492 1.757 6.225 1.00 0.00 C ATOM 0 H ALA B 235 1.559 3.197 7.977 1.00 0.00 H new ATOM 0 HA ALA B 235 0.545 2.208 5.497 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.683 1.019 5.446 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.902 2.720 5.922 1.00 0.00 H new ATOM 0 HB3 ALA B 235 2.967 1.436 7.152 1.00 0.00 H new ATOM 1414 N ALA B 236 0.556 0.172 8.080 1.00 0.00 N ATOM 1415 CA ALA B 236 -0.001 -1.070 8.588 1.00 0.00 C ATOM 1416 C ALA B 236 -1.514 -1.077 8.359 1.00 0.00 C ATOM 1417 O ALA B 236 -2.069 -2.067 7.885 1.00 0.00 O ATOM 1418 CB ALA B 236 0.366 -1.228 10.065 1.00 0.00 C ATOM 0 H ALA B 236 1.116 0.695 8.753 1.00 0.00 H new ATOM 0 HA ALA B 236 0.417 -1.924 8.055 1.00 0.00 H new ATOM 0 HB1 ALA B 236 -0.052 -2.160 10.446 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.451 -1.247 10.170 1.00 0.00 H new ATOM 0 HB3 ALA B 236 -0.039 -0.390 10.632 1.00 0.00 H new ATOM 1424 N GLU B 237 -2.138 0.039 8.706 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.576 0.174 8.545 1.00 0.00 C ATOM 1426 C GLU B 237 -3.941 0.220 7.060 1.00 0.00 C ATOM 1427 O GLU B 237 -4.984 -0.292 6.658 1.00 0.00 O ATOM 1428 CB GLU B 237 -4.095 1.414 9.276 1.00 0.00 C ATOM 1429 CG GLU B 237 -5.602 1.579 9.070 1.00 0.00 C ATOM 1430 CD GLU B 237 -6.343 1.564 10.410 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -5.809 2.176 11.361 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -7.425 0.941 10.452 1.00 0.00 O ATOM 0 H GLU B 237 -1.674 0.858 9.098 1.00 0.00 H new ATOM 0 HA GLU B 237 -4.056 -0.697 8.990 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.876 1.331 10.341 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -3.575 2.300 8.912 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -5.801 2.516 8.550 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -5.976 0.776 8.434 1.00 0.00 H new ATOM 1439 N VAL B 238 -3.061 0.837 6.286 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.278 0.956 4.854 1.00 0.00 C ATOM 1441 C VAL B 238 -3.175 -0.429 4.210 1.00 0.00 C ATOM 1442 O VAL B 238 -3.944 -0.757 3.308 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.296 1.967 4.258 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -1.900 1.572 2.834 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -2.877 3.382 4.293 1.00 0.00 C ATOM 0 H VAL B 238 -2.196 1.260 6.623 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.279 1.336 4.650 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.395 1.960 4.871 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.202 2.307 2.433 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.426 0.591 2.847 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.790 1.537 2.205 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.159 4.081 3.864 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.801 3.410 3.715 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -3.085 3.664 5.325 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.217 -1.204 4.699 1.00 0.00 N ATOM 1456 CA ILE B 239 -2.004 -2.545 4.182 1.00 0.00 C ATOM 1457 C ILE B 239 -3.105 -3.470 4.705 1.00 0.00 C ATOM 1458 O ILE B 239 -3.671 -4.257 3.948 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.589 -3.026 4.511 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.462 -2.152 3.824 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.420 -4.506 4.164 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.256 -2.137 2.308 1.00 0.00 C ATOM 0 H ILE B 239 -1.580 -0.929 5.447 1.00 0.00 H new ATOM 0 HA ILE B 239 -2.074 -2.550 3.094 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.436 -2.927 5.586 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.405 -1.135 4.212 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.459 -2.526 4.056 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.594 -4.823 4.407 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.133 -5.098 4.738 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.601 -4.653 3.099 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.016 -1.509 1.844 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.338 -3.152 1.920 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.733 -1.739 2.079 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.376 -3.343 5.996 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.400 -4.158 6.628 1.00 0.00 C ATOM 1476 C LYS B 240 -5.774 -3.748 6.094 1.00 0.00 C ATOM 1477 O LYS B 240 -6.626 -4.599 5.844 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.283 -4.076 8.152 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.660 -4.172 8.813 1.00 0.00 C ATOM 1480 CD LYS B 240 -6.215 -2.780 9.126 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.692 -2.855 9.518 1.00 0.00 C ATOM 1482 NZ LYS B 240 -7.895 -2.311 10.879 1.00 0.00 N ATOM 0 H LYS B 240 -2.905 -2.689 6.621 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.261 -5.209 6.376 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.644 -4.881 8.515 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.805 -3.138 8.434 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.348 -4.702 8.154 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.587 -4.754 9.732 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.642 -2.330 9.937 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -6.098 -2.134 8.256 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -8.293 -2.294 8.802 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -8.033 -3.890 9.479 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -8.851 -2.551 11.210 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.192 -2.722 11.526 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -7.785 -1.277 10.860 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.947 -2.444 5.935 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.202 -1.912 5.434 1.00 0.00 C ATOM 1498 C ASP B 241 -7.464 -2.465 4.032 1.00 0.00 C ATOM 1499 O ASP B 241 -8.577 -2.890 3.726 1.00 0.00 O ATOM 1500 CB ASP B 241 -7.154 -0.385 5.339 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.320 0.253 4.582 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -9.472 -0.124 4.892 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -8.036 1.102 3.712 1.00 0.00 O ATOM 0 H ASP B 241 -5.239 -1.741 6.144 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.992 -2.206 6.125 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -7.127 0.026 6.348 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.223 -0.095 4.852 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.419 -2.440 3.216 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.522 -2.935 1.854 1.00 0.00 C ATOM 1510 C LEU B 242 -6.807 -4.437 1.881 1.00 0.00 C ATOM 1511 O LEU B 242 -7.710 -4.915 1.196 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.274 -2.559 1.053 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.369 -1.274 0.227 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -4.117 -0.413 0.410 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -5.639 -1.588 -1.246 1.00 0.00 C ATOM 0 H LEU B 242 -5.498 -2.085 3.472 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.358 -2.462 1.339 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.438 -2.461 1.745 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -5.036 -3.383 0.380 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.216 -0.693 0.592 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -4.209 0.494 -0.187 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.009 -0.146 1.461 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.240 -0.973 0.086 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -5.702 -0.658 -1.811 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.828 -2.199 -1.642 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -6.580 -2.131 -1.336 1.00 0.00 H new ATOM 1527 N VAL B 243 -6.019 -5.142 2.680 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.175 -6.581 2.805 1.00 0.00 C ATOM 1529 C VAL B 243 -7.558 -6.892 3.382 1.00 0.00 C ATOM 1530 O VAL B 243 -8.252 -7.782 2.893 1.00 0.00 O ATOM 1531 CB VAL B 243 -5.034 -7.160 3.645 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.515 -8.350 4.478 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -3.848 -7.553 2.761 1.00 0.00 C ATOM 0 H VAL B 243 -5.271 -4.743 3.247 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.116 -7.058 1.826 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.697 -6.384 4.333 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.685 -8.742 5.065 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.312 -8.027 5.147 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -5.891 -9.130 3.815 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -3.051 -7.962 3.382 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.166 -8.304 2.038 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.481 -6.673 2.232 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.918 -6.140 4.411 1.00 0.00 N ATOM 1544 CA ASN B 244 -9.206 -6.324 5.058 1.00 0.00 C ATOM 1545 C ASN B 244 -10.319 -6.190 4.017 1.00 0.00 C ATOM 1546 O ASN B 244 -11.324 -6.895 4.084 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.436 -5.263 6.137 1.00 0.00 C ATOM 1548 CG ASN B 244 -9.220 -5.847 7.534 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.978 -6.267 7.760 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -10.122 -5.911 8.355 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.340 -5.402 4.813 1.00 0.00 H new ATOM 0 HA ASN B 244 -9.215 -7.313 5.517 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.756 -4.426 5.980 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.449 -4.870 6.056 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -11.053 -5.570 8.117 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.944 -6.305 9.279 1.00 0.00 H new ATOM 1557 N THR B 245 -10.101 -5.280 3.080 1.00 0.00 N ATOM 1558 CA THR B 245 -11.073 -5.045 2.026 1.00 0.00 C ATOM 1559 C THR B 245 -11.058 -6.196 1.018 1.00 0.00 C ATOM 1560 O THR B 245 -12.110 -6.645 0.568 1.00 0.00 O ATOM 1561 CB THR B 245 -10.768 -3.683 1.397 1.00 0.00 C ATOM 1562 OG1 THR B 245 -11.108 -2.746 2.414 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.718 -3.345 0.245 1.00 0.00 C ATOM 0 H THR B 245 -9.266 -4.697 3.028 1.00 0.00 H new ATOM 0 HA THR B 245 -12.087 -5.017 2.424 1.00 0.00 H new ATOM 0 HB THR B 245 -9.740 -3.672 1.035 1.00 0.00 H new ATOM 0 HG1 THR B 245 -10.346 -2.629 3.019 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.459 -2.369 -0.166 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.629 -4.102 -0.534 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.743 -3.323 0.614 1.00 0.00 H new