USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 877 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 Single : A 3 SER OG : rot -26:sc= 0.318 USER MOD Single : A 5 SER OG : rot 180:sc= 0.00268 USER MOD Single : A 9 CYS SG : rot -102:sc= 0.337 USER MOD Single : A 11 TYR OH : rot -149:sc= -4.39! USER MOD Single : A 12 SER OG : rot 33:sc= -1.06 USER MOD Single : A 17 HIS : no HD1:sc= -0.125 X(o=-0.12,f=-0.49) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.841 USER MOD Single : A 24 THR OG1 : rot -173:sc= -2.85! USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= 1.14 K(o=1.1,f=-0.058) USER MOD Single : A 33 LYS NZ :NH3+ 168:sc= -0.0301 (180deg=-0.254) USER MOD Single : A 38 ASN : amide:sc= 0.105 K(o=0.11,f=-2.8!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc=-0.00623 K(o=-0.0062,f=-0.91) USER MOD Single : A 55 ASN : amide:sc= 0.0386 K(o=0.039,f=-6.7!) USER MOD Single : A 58 SER OG : rot -150:sc= 0.59 USER MOD Single : B 103 TYR OH : rot 180:sc= -0.682 USER MOD Single : B 106 SER OG : rot 180:sc= -0.408 USER MOD Single : B 107 TYR OH : rot 175:sc= -1.56! USER MOD Single : B 115 ASN : amide:sc= -2.06! X(o=-2.1!,f=-1.7) USER MOD Single : B 116 SER OG : rot 180:sc= 0.0782 USER MOD Single : B 117 SER OG : rot 180:sc= 0 USER MOD Single : B 119 SER OG : rot -25:sc= 1.24 USER MOD Single : B 121 LYS NZ :NH3+ 171:sc= 0.732 (180deg=0.483) USER MOD Single : B 124 LYS NZ :NH3+ -121:sc= 1.07 (180deg=-2.83!) USER MOD Single : B 125 LYS NZ :NH3+ -144:sc= 1.2 (180deg=0.133) USER MOD Single : B 129 SER OG : rot -145:sc= 0.681 USER MOD Single : B 140 ASN : amide:sc=-0.00659 X(o=-0.0066,f=0) USER MOD Single : B 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 144 SER OG : rot -8:sc= 1.25 USER MOD Single : B 147 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : B 149 LYS NZ :NH3+ -168:sc= 0.543 (180deg=0.47) USER MOD Single : B 150 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : B 157 GLN :FLIP amide:sc= 0 F(o=-0.83,f=0) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -2.009 6.963 -11.285 1.00 0.00 N ATOM 31 CA SER A 3 -2.163 5.731 -12.027 1.00 0.00 C ATOM 32 C SER A 3 -2.095 4.572 -11.059 1.00 0.00 C ATOM 33 O SER A 3 -1.227 4.520 -10.197 1.00 0.00 O ATOM 34 CB SER A 3 -1.080 5.627 -13.107 1.00 0.00 C ATOM 35 OG SER A 3 0.179 6.070 -12.621 1.00 0.00 O ATOM 0 HA SER A 3 -3.129 5.712 -12.532 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.999 4.594 -13.445 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.368 6.224 -13.973 1.00 0.00 H new ATOM 0 HG SER A 3 0.041 6.717 -11.898 1.00 0.00 H new ATOM 41 N VAL A 4 -3.054 3.673 -11.190 1.00 0.00 N ATOM 42 CA VAL A 4 -3.206 2.536 -10.299 1.00 0.00 C ATOM 43 C VAL A 4 -1.921 1.715 -10.184 1.00 0.00 C ATOM 44 O VAL A 4 -1.675 1.089 -9.161 1.00 0.00 O ATOM 45 CB VAL A 4 -4.380 1.667 -10.793 1.00 0.00 C ATOM 46 CG1 VAL A 4 -4.200 0.191 -10.461 1.00 0.00 C ATOM 47 CG2 VAL A 4 -5.675 2.195 -10.209 1.00 0.00 C ATOM 0 H VAL A 4 -3.758 3.712 -11.927 1.00 0.00 H new ATOM 0 HA VAL A 4 -3.420 2.907 -9.297 1.00 0.00 H new ATOM 0 HB VAL A 4 -4.410 1.734 -11.881 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -5.056 -0.372 -10.832 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -3.290 -0.180 -10.932 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -4.125 0.068 -9.381 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -6.507 1.583 -10.556 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -5.626 2.157 -9.121 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -5.825 3.226 -10.529 1.00 0.00 H new ATOM 57 N SER A 5 -1.092 1.742 -11.216 1.00 0.00 N ATOM 58 CA SER A 5 0.192 1.062 -11.165 1.00 0.00 C ATOM 59 C SER A 5 1.074 1.773 -10.149 1.00 0.00 C ATOM 60 O SER A 5 1.600 1.177 -9.201 1.00 0.00 O ATOM 61 CB SER A 5 0.847 1.103 -12.545 1.00 0.00 C ATOM 62 OG SER A 5 -0.111 0.889 -13.570 1.00 0.00 O ATOM 0 H SER A 5 -1.284 2.224 -12.094 1.00 0.00 H new ATOM 0 HA SER A 5 0.057 0.021 -10.872 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.333 2.068 -12.692 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.625 0.342 -12.605 1.00 0.00 H new ATOM 0 HG SER A 5 0.332 0.922 -14.444 1.00 0.00 H new ATOM 68 N GLU A 6 1.178 3.073 -10.346 1.00 0.00 N ATOM 69 CA GLU A 6 1.916 3.951 -9.469 1.00 0.00 C ATOM 70 C GLU A 6 1.402 3.820 -8.040 1.00 0.00 C ATOM 71 O GLU A 6 2.164 3.561 -7.109 1.00 0.00 O ATOM 72 CB GLU A 6 1.740 5.376 -9.982 1.00 0.00 C ATOM 73 CG GLU A 6 2.509 6.436 -9.231 1.00 0.00 C ATOM 74 CD GLU A 6 2.375 7.786 -9.899 1.00 0.00 C ATOM 75 OE1 GLU A 6 2.911 7.950 -11.016 1.00 0.00 O ATOM 76 OE2 GLU A 6 1.716 8.677 -9.329 1.00 0.00 O ATOM 0 H GLU A 6 0.744 3.553 -11.134 1.00 0.00 H new ATOM 0 HA GLU A 6 2.974 3.687 -9.462 1.00 0.00 H new ATOM 0 HB2 GLU A 6 2.041 5.407 -11.029 1.00 0.00 H new ATOM 0 HB3 GLU A 6 0.680 5.628 -9.948 1.00 0.00 H new ATOM 0 HG2 GLU A 6 2.143 6.497 -8.206 1.00 0.00 H new ATOM 0 HG3 GLU A 6 3.561 6.157 -9.178 1.00 0.00 H new ATOM 83 N LEU A 7 0.096 3.976 -7.897 1.00 0.00 N ATOM 84 CA LEU A 7 -0.578 3.870 -6.619 1.00 0.00 C ATOM 85 C LEU A 7 -0.373 2.491 -5.981 1.00 0.00 C ATOM 86 O LEU A 7 -0.260 2.384 -4.764 1.00 0.00 O ATOM 87 CB LEU A 7 -2.069 4.159 -6.821 1.00 0.00 C ATOM 88 CG LEU A 7 -2.735 4.918 -5.701 1.00 0.00 C ATOM 89 CD1 LEU A 7 -2.278 6.360 -5.698 1.00 0.00 C ATOM 90 CD2 LEU A 7 -4.237 4.827 -5.877 1.00 0.00 C ATOM 0 H LEU A 7 -0.530 4.182 -8.675 1.00 0.00 H new ATOM 0 HA LEU A 7 -0.149 4.601 -5.934 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -2.191 4.725 -7.744 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -2.591 3.212 -6.957 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.458 4.481 -4.742 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.767 6.895 -4.884 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -1.197 6.399 -5.560 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -2.540 6.827 -6.648 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -4.731 5.372 -5.073 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -4.518 5.262 -6.836 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.544 3.782 -5.849 1.00 0.00 H new ATOM 102 N ALA A 8 -0.310 1.437 -6.793 1.00 0.00 N ATOM 103 CA ALA A 8 -0.100 0.089 -6.265 1.00 0.00 C ATOM 104 C ALA A 8 1.310 -0.066 -5.725 1.00 0.00 C ATOM 105 O ALA A 8 1.541 -0.782 -4.748 1.00 0.00 O ATOM 106 CB ALA A 8 -0.367 -0.968 -7.321 1.00 0.00 C ATOM 0 H ALA A 8 -0.400 1.488 -7.808 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.809 -0.054 -5.450 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -0.202 -1.958 -6.895 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -1.399 -0.888 -7.663 1.00 0.00 H new ATOM 0 HB3 ALA A 8 0.307 -0.818 -8.164 1.00 0.00 H new ATOM 112 N CYS A 9 2.253 0.618 -6.354 1.00 0.00 N ATOM 113 CA CYS A 9 3.628 0.591 -5.891 1.00 0.00 C ATOM 114 C CYS A 9 3.712 1.366 -4.591 1.00 0.00 C ATOM 115 O CYS A 9 4.439 1.002 -3.659 1.00 0.00 O ATOM 116 CB CYS A 9 4.552 1.206 -6.926 1.00 0.00 C ATOM 117 SG CYS A 9 6.286 0.755 -6.710 1.00 0.00 S ATOM 0 H CYS A 9 2.092 1.194 -7.180 1.00 0.00 H new ATOM 0 HA CYS A 9 3.941 -0.441 -5.733 1.00 0.00 H new ATOM 0 HB2 CYS A 9 4.227 0.898 -7.920 1.00 0.00 H new ATOM 0 HB3 CYS A 9 4.460 2.291 -6.883 1.00 0.00 H new ATOM 0 HG CYS A 9 6.924 1.740 -6.151 1.00 0.00 H new ATOM 123 N ILE A 10 2.941 2.440 -4.550 1.00 0.00 N ATOM 124 CA ILE A 10 2.732 3.193 -3.339 1.00 0.00 C ATOM 125 C ILE A 10 2.302 2.256 -2.215 1.00 0.00 C ATOM 126 O ILE A 10 2.947 2.173 -1.177 1.00 0.00 O ATOM 127 CB ILE A 10 1.634 4.255 -3.545 1.00 0.00 C ATOM 128 CG1 ILE A 10 2.047 5.306 -4.565 1.00 0.00 C ATOM 129 CG2 ILE A 10 1.266 4.925 -2.241 1.00 0.00 C ATOM 130 CD1 ILE A 10 0.956 6.321 -4.815 1.00 0.00 C ATOM 0 H ILE A 10 2.444 2.809 -5.361 1.00 0.00 H new ATOM 0 HA ILE A 10 3.668 3.687 -3.078 1.00 0.00 H new ATOM 0 HB ILE A 10 0.760 3.730 -3.930 1.00 0.00 H new ATOM 0 HG12 ILE A 10 2.943 5.818 -4.214 1.00 0.00 H new ATOM 0 HG13 ILE A 10 2.307 4.816 -5.503 1.00 0.00 H new ATOM 0 HG21 ILE A 10 0.489 5.668 -2.420 1.00 0.00 H new ATOM 0 HG22 ILE A 10 0.897 4.177 -1.539 1.00 0.00 H new ATOM 0 HG23 ILE A 10 2.146 5.413 -1.822 1.00 0.00 H new ATOM 0 HD11 ILE A 10 1.298 7.050 -5.550 1.00 0.00 H new ATOM 0 HD12 ILE A 10 0.068 5.815 -5.193 1.00 0.00 H new ATOM 0 HD13 ILE A 10 0.714 6.832 -3.883 1.00 0.00 H new ATOM 142 N TYR A 11 1.231 1.514 -2.465 1.00 0.00 N ATOM 143 CA TYR A 11 0.626 0.672 -1.434 1.00 0.00 C ATOM 144 C TYR A 11 1.541 -0.467 -1.037 1.00 0.00 C ATOM 145 O TYR A 11 1.631 -0.786 0.137 1.00 0.00 O ATOM 146 CB TYR A 11 -0.705 0.097 -1.898 1.00 0.00 C ATOM 147 CG TYR A 11 -1.714 1.159 -2.218 1.00 0.00 C ATOM 148 CD1 TYR A 11 -1.839 2.273 -1.408 1.00 0.00 C ATOM 149 CD2 TYR A 11 -2.533 1.053 -3.331 1.00 0.00 C ATOM 150 CE1 TYR A 11 -2.753 3.254 -1.692 1.00 0.00 C ATOM 151 CE2 TYR A 11 -3.457 2.031 -3.624 1.00 0.00 C ATOM 152 CZ TYR A 11 -3.563 3.128 -2.801 1.00 0.00 C ATOM 153 OH TYR A 11 -4.494 4.090 -3.076 1.00 0.00 O ATOM 0 H TYR A 11 0.762 1.476 -3.370 1.00 0.00 H new ATOM 0 HA TYR A 11 0.460 1.313 -0.569 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -0.541 -0.521 -2.781 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -1.104 -0.556 -1.122 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -1.207 2.371 -0.538 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -2.445 0.192 -3.977 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -2.838 4.120 -1.052 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -4.093 1.938 -4.492 1.00 0.00 H new ATOM 0 HH TYR A 11 -5.264 3.682 -3.525 1.00 0.00 H new ATOM 163 N SER A 12 2.207 -1.091 -1.999 1.00 0.00 N ATOM 164 CA SER A 12 3.157 -2.144 -1.677 1.00 0.00 C ATOM 165 C SER A 12 4.225 -1.600 -0.731 1.00 0.00 C ATOM 166 O SER A 12 4.600 -2.253 0.250 1.00 0.00 O ATOM 167 CB SER A 12 3.774 -2.718 -2.951 1.00 0.00 C ATOM 168 OG SER A 12 4.003 -1.707 -3.911 1.00 0.00 O ATOM 0 H SER A 12 2.109 -0.890 -2.994 1.00 0.00 H new ATOM 0 HA SER A 12 2.637 -2.958 -1.173 1.00 0.00 H new ATOM 0 HB2 SER A 12 4.714 -3.214 -2.711 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.112 -3.476 -3.369 1.00 0.00 H new ATOM 0 HG SER A 12 4.227 -0.868 -3.456 1.00 0.00 H new ATOM 174 N ALA A 13 4.672 -0.378 -1.012 1.00 0.00 N ATOM 175 CA ALA A 13 5.567 0.338 -0.117 1.00 0.00 C ATOM 176 C ALA A 13 4.893 0.609 1.224 1.00 0.00 C ATOM 177 O ALA A 13 5.542 0.620 2.269 1.00 0.00 O ATOM 178 CB ALA A 13 5.990 1.648 -0.745 1.00 0.00 C ATOM 0 H ALA A 13 4.425 0.136 -1.858 1.00 0.00 H new ATOM 0 HA ALA A 13 6.445 -0.284 0.054 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.660 2.177 -0.067 1.00 0.00 H new ATOM 0 HB2 ALA A 13 6.506 1.451 -1.685 1.00 0.00 H new ATOM 0 HB3 ALA A 13 5.109 2.261 -0.936 1.00 0.00 H new ATOM 184 N LEU A 14 3.584 0.827 1.181 1.00 0.00 N ATOM 185 CA LEU A 14 2.811 1.106 2.373 1.00 0.00 C ATOM 186 C LEU A 14 2.813 -0.106 3.309 1.00 0.00 C ATOM 187 O LEU A 14 3.247 0.004 4.456 1.00 0.00 O ATOM 188 CB LEU A 14 1.391 1.506 2.017 1.00 0.00 C ATOM 189 CG LEU A 14 1.096 3.008 2.083 1.00 0.00 C ATOM 190 CD1 LEU A 14 1.777 3.666 3.266 1.00 0.00 C ATOM 191 CD2 LEU A 14 1.445 3.717 0.798 1.00 0.00 C ATOM 0 H LEU A 14 3.036 0.814 0.321 1.00 0.00 H new ATOM 0 HA LEU A 14 3.277 1.944 2.892 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.174 1.154 1.008 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.706 0.988 2.689 1.00 0.00 H new ATOM 0 HG LEU A 14 0.019 3.102 2.224 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.542 4.730 3.275 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.424 3.208 4.190 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.856 3.534 3.185 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.218 4.779 0.895 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.507 3.591 0.590 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.862 3.295 -0.021 1.00 0.00 H new ATOM 203 N ILE A 15 2.343 -1.265 2.817 1.00 0.00 N ATOM 204 CA ILE A 15 2.357 -2.501 3.616 1.00 0.00 C ATOM 205 C ILE A 15 3.766 -2.781 4.110 1.00 0.00 C ATOM 206 O ILE A 15 3.976 -3.059 5.290 1.00 0.00 O ATOM 207 CB ILE A 15 1.870 -3.759 2.851 1.00 0.00 C ATOM 208 CG1 ILE A 15 1.502 -3.464 1.393 1.00 0.00 C ATOM 209 CG2 ILE A 15 0.681 -4.360 3.576 1.00 0.00 C ATOM 210 CD1 ILE A 15 0.068 -3.014 1.195 1.00 0.00 C ATOM 0 H ILE A 15 1.953 -1.371 1.881 1.00 0.00 H new ATOM 0 HA ILE A 15 1.661 -2.322 4.435 1.00 0.00 H new ATOM 0 HB ILE A 15 2.698 -4.467 2.828 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.170 -2.692 1.010 1.00 0.00 H new ATOM 0 HG13 ILE A 15 1.676 -4.360 0.797 1.00 0.00 H new ATOM 0 HG21 ILE A 15 0.337 -5.244 3.040 1.00 0.00 H new ATOM 0 HG22 ILE A 15 0.975 -4.640 4.587 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.125 -3.628 3.622 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.111 -2.826 0.136 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -0.609 -3.793 1.545 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.108 -2.099 1.761 1.00 0.00 H new ATOM 222 N LEU A 16 4.724 -2.685 3.197 1.00 0.00 N ATOM 223 CA LEU A 16 6.130 -2.895 3.518 1.00 0.00 C ATOM 224 C LEU A 16 6.559 -2.015 4.685 1.00 0.00 C ATOM 225 O LEU A 16 7.277 -2.448 5.584 1.00 0.00 O ATOM 226 CB LEU A 16 6.966 -2.564 2.287 1.00 0.00 C ATOM 227 CG LEU A 16 8.164 -3.470 2.052 1.00 0.00 C ATOM 228 CD1 LEU A 16 7.730 -4.919 2.151 1.00 0.00 C ATOM 229 CD2 LEU A 16 8.778 -3.177 0.693 1.00 0.00 C ATOM 0 H LEU A 16 4.550 -2.460 2.217 1.00 0.00 H new ATOM 0 HA LEU A 16 6.279 -3.935 3.808 1.00 0.00 H new ATOM 0 HB2 LEU A 16 6.322 -2.606 1.409 1.00 0.00 H new ATOM 0 HB3 LEU A 16 7.320 -1.537 2.374 1.00 0.00 H new ATOM 0 HG LEU A 16 8.921 -3.281 2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.589 -5.568 1.982 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.320 -5.109 3.143 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.968 -5.123 1.399 1.00 0.00 H new ATOM 0 HD21 LEU A 16 9.636 -3.830 0.533 1.00 0.00 H new ATOM 0 HD22 LEU A 16 8.037 -3.353 -0.087 1.00 0.00 H new ATOM 0 HD23 LEU A 16 9.102 -2.137 0.657 1.00 0.00 H new ATOM 241 N HIS A 17 6.091 -0.783 4.660 1.00 0.00 N ATOM 242 CA HIS A 17 6.424 0.202 5.680 1.00 0.00 C ATOM 243 C HIS A 17 5.603 0.001 6.969 1.00 0.00 C ATOM 244 O HIS A 17 5.937 0.568 8.007 1.00 0.00 O ATOM 245 CB HIS A 17 6.233 1.616 5.101 1.00 0.00 C ATOM 246 CG HIS A 17 6.329 2.737 6.091 1.00 0.00 C ATOM 247 ND1 HIS A 17 7.362 2.881 6.995 1.00 0.00 N ATOM 248 CD2 HIS A 17 5.492 3.775 6.308 1.00 0.00 C ATOM 249 CE1 HIS A 17 7.151 3.959 7.730 1.00 0.00 C ATOM 250 NE2 HIS A 17 6.022 4.520 7.333 1.00 0.00 N ATOM 0 H HIS A 17 5.468 -0.432 3.933 1.00 0.00 H new ATOM 0 HA HIS A 17 7.468 0.070 5.963 1.00 0.00 H new ATOM 0 HB2 HIS A 17 6.981 1.776 4.324 1.00 0.00 H new ATOM 0 HB3 HIS A 17 5.257 1.663 4.618 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.576 3.981 5.774 1.00 0.00 H new ATOM 0 HE1 HIS A 17 7.792 4.320 8.521 1.00 0.00 H new ATOM 0 HE2 HIS A 17 5.611 5.368 7.724 1.00 0.00 H new ATOM 259 N ASP A 18 4.546 -0.804 6.917 1.00 0.00 N ATOM 260 CA ASP A 18 3.765 -1.099 8.123 1.00 0.00 C ATOM 261 C ASP A 18 4.570 -1.986 9.062 1.00 0.00 C ATOM 262 O ASP A 18 4.689 -1.704 10.254 1.00 0.00 O ATOM 263 CB ASP A 18 2.434 -1.782 7.790 1.00 0.00 C ATOM 264 CG ASP A 18 1.666 -2.178 9.043 1.00 0.00 C ATOM 265 OD1 ASP A 18 1.006 -1.302 9.646 1.00 0.00 O ATOM 266 OD2 ASP A 18 1.729 -3.366 9.441 1.00 0.00 O ATOM 0 H ASP A 18 4.211 -1.260 6.068 1.00 0.00 H new ATOM 0 HA ASP A 18 3.543 -0.149 8.608 1.00 0.00 H new ATOM 0 HB2 ASP A 18 1.823 -1.110 7.188 1.00 0.00 H new ATOM 0 HB3 ASP A 18 2.623 -2.669 7.185 1.00 0.00 H new ATOM 271 N ASP A 19 5.149 -3.044 8.508 1.00 0.00 N ATOM 272 CA ASP A 19 5.951 -3.972 9.297 1.00 0.00 C ATOM 273 C ASP A 19 7.402 -3.534 9.276 1.00 0.00 C ATOM 274 O ASP A 19 8.239 -4.013 10.044 1.00 0.00 O ATOM 275 CB ASP A 19 5.811 -5.395 8.752 1.00 0.00 C ATOM 276 CG ASP A 19 6.539 -6.429 9.592 1.00 0.00 C ATOM 277 OD1 ASP A 19 6.014 -6.811 10.658 1.00 0.00 O ATOM 278 OD2 ASP A 19 7.633 -6.872 9.186 1.00 0.00 O ATOM 0 H ASP A 19 5.079 -3.281 7.518 1.00 0.00 H new ATOM 0 HA ASP A 19 5.594 -3.967 10.327 1.00 0.00 H new ATOM 0 HB2 ASP A 19 4.754 -5.656 8.701 1.00 0.00 H new ATOM 0 HB3 ASP A 19 6.196 -5.427 7.733 1.00 0.00 H new ATOM 283 N GLU A 20 7.659 -2.581 8.383 1.00 0.00 N ATOM 284 CA GLU A 20 8.988 -2.048 8.132 1.00 0.00 C ATOM 285 C GLU A 20 9.937 -3.166 7.775 1.00 0.00 C ATOM 286 O GLU A 20 11.023 -3.312 8.339 1.00 0.00 O ATOM 287 CB GLU A 20 9.478 -1.220 9.315 1.00 0.00 C ATOM 288 CG GLU A 20 8.558 -0.049 9.602 1.00 0.00 C ATOM 289 CD GLU A 20 9.182 0.997 10.493 1.00 0.00 C ATOM 290 OE1 GLU A 20 9.220 0.787 11.719 1.00 0.00 O ATOM 291 OE2 GLU A 20 9.613 2.047 9.969 1.00 0.00 O ATOM 0 H GLU A 20 6.935 -2.153 7.806 1.00 0.00 H new ATOM 0 HA GLU A 20 8.945 -1.371 7.279 1.00 0.00 H new ATOM 0 HB2 GLU A 20 9.546 -1.854 10.199 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.483 -0.851 9.109 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.266 0.414 8.659 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.646 -0.419 10.071 1.00 0.00 H new ATOM 298 N VAL A 21 9.503 -3.933 6.798 1.00 0.00 N ATOM 299 CA VAL A 21 10.194 -5.095 6.350 1.00 0.00 C ATOM 300 C VAL A 21 10.972 -4.755 5.088 1.00 0.00 C ATOM 301 O VAL A 21 10.619 -3.818 4.373 1.00 0.00 O ATOM 302 CB VAL A 21 9.175 -6.232 6.133 1.00 0.00 C ATOM 303 CG1 VAL A 21 8.016 -5.772 5.274 1.00 0.00 C ATOM 304 CG2 VAL A 21 9.833 -7.467 5.548 1.00 0.00 C ATOM 0 H VAL A 21 8.638 -3.751 6.289 1.00 0.00 H new ATOM 0 HA VAL A 21 10.913 -5.438 7.094 1.00 0.00 H new ATOM 0 HB VAL A 21 8.779 -6.505 7.111 1.00 0.00 H new ATOM 0 HG11 VAL A 21 7.314 -6.595 5.139 1.00 0.00 H new ATOM 0 HG12 VAL A 21 7.509 -4.940 5.762 1.00 0.00 H new ATOM 0 HG13 VAL A 21 8.389 -5.450 4.302 1.00 0.00 H new ATOM 0 HG21 VAL A 21 9.084 -8.247 5.409 1.00 0.00 H new ATOM 0 HG22 VAL A 21 10.282 -7.219 4.586 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.607 -7.824 6.228 1.00 0.00 H new ATOM 314 N THR A 22 12.047 -5.489 4.885 1.00 0.00 N ATOM 315 CA THR A 22 13.013 -5.256 3.804 1.00 0.00 C ATOM 316 C THR A 22 12.392 -4.751 2.519 1.00 0.00 C ATOM 317 O THR A 22 11.454 -5.336 1.978 1.00 0.00 O ATOM 318 CB THR A 22 13.801 -6.530 3.505 1.00 0.00 C ATOM 319 OG1 THR A 22 12.902 -7.627 3.301 1.00 0.00 O ATOM 320 CG2 THR A 22 14.738 -6.834 4.641 1.00 0.00 C ATOM 0 H THR A 22 12.289 -6.285 5.475 1.00 0.00 H new ATOM 0 HA THR A 22 13.672 -4.470 4.172 1.00 0.00 H new ATOM 0 HB THR A 22 14.385 -6.380 2.597 1.00 0.00 H new ATOM 0 HG1 THR A 22 13.415 -8.439 3.108 1.00 0.00 H new ATOM 0 HG21 THR A 22 15.296 -7.744 4.419 1.00 0.00 H new ATOM 0 HG22 THR A 22 15.433 -6.005 4.771 1.00 0.00 H new ATOM 0 HG23 THR A 22 14.165 -6.974 5.558 1.00 0.00 H new ATOM 328 N VAL A 23 12.950 -3.662 2.038 1.00 0.00 N ATOM 329 CA VAL A 23 12.455 -2.997 0.860 1.00 0.00 C ATOM 330 C VAL A 23 13.303 -3.356 -0.349 1.00 0.00 C ATOM 331 O VAL A 23 14.432 -2.886 -0.494 1.00 0.00 O ATOM 332 CB VAL A 23 12.484 -1.483 1.061 1.00 0.00 C ATOM 333 CG1 VAL A 23 11.907 -0.778 -0.161 1.00 0.00 C ATOM 334 CG2 VAL A 23 11.737 -1.116 2.331 1.00 0.00 C ATOM 0 H VAL A 23 13.764 -3.213 2.458 1.00 0.00 H new ATOM 0 HA VAL A 23 11.429 -3.324 0.689 1.00 0.00 H new ATOM 0 HB VAL A 23 13.516 -1.150 1.173 1.00 0.00 H new ATOM 0 HG11 VAL A 23 11.933 0.300 -0.005 1.00 0.00 H new ATOM 0 HG12 VAL A 23 12.498 -1.032 -1.041 1.00 0.00 H new ATOM 0 HG13 VAL A 23 10.876 -1.098 -0.312 1.00 0.00 H new ATOM 0 HG21 VAL A 23 11.762 -0.035 2.468 1.00 0.00 H new ATOM 0 HG22 VAL A 23 10.702 -1.448 2.253 1.00 0.00 H new ATOM 0 HG23 VAL A 23 12.211 -1.601 3.185 1.00 0.00 H new ATOM 344 N THR A 24 12.754 -4.188 -1.208 1.00 0.00 N ATOM 345 CA THR A 24 13.458 -4.630 -2.398 1.00 0.00 C ATOM 346 C THR A 24 12.492 -4.708 -3.567 1.00 0.00 C ATOM 347 O THR A 24 11.289 -4.893 -3.360 1.00 0.00 O ATOM 348 CB THR A 24 14.135 -6.011 -2.216 1.00 0.00 C ATOM 349 OG1 THR A 24 13.154 -7.019 -1.936 1.00 0.00 O ATOM 350 CG2 THR A 24 15.153 -5.986 -1.091 1.00 0.00 C ATOM 0 H THR A 24 11.816 -4.575 -1.105 1.00 0.00 H new ATOM 0 HA THR A 24 14.242 -3.898 -2.590 1.00 0.00 H new ATOM 0 HB THR A 24 14.648 -6.245 -3.149 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.604 -7.861 -1.715 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.609 -6.971 -0.991 1.00 0.00 H new ATOM 0 HG22 THR A 24 15.925 -5.250 -1.315 1.00 0.00 H new ATOM 0 HG23 THR A 24 14.657 -5.719 -0.158 1.00 0.00 H new ATOM 358 N GLU A 25 13.003 -4.566 -4.779 1.00 0.00 N ATOM 359 CA GLU A 25 12.165 -4.632 -5.970 1.00 0.00 C ATOM 360 C GLU A 25 11.306 -5.896 -5.959 1.00 0.00 C ATOM 361 O GLU A 25 10.096 -5.846 -6.189 1.00 0.00 O ATOM 362 CB GLU A 25 13.033 -4.583 -7.227 1.00 0.00 C ATOM 363 CG GLU A 25 14.207 -5.546 -7.201 1.00 0.00 C ATOM 364 CD GLU A 25 15.007 -5.531 -8.485 1.00 0.00 C ATOM 365 OE1 GLU A 25 14.460 -5.932 -9.533 1.00 0.00 O ATOM 366 OE2 GLU A 25 16.193 -5.136 -8.449 1.00 0.00 O ATOM 0 H GLU A 25 13.993 -4.404 -4.966 1.00 0.00 H new ATOM 0 HA GLU A 25 11.498 -3.770 -5.972 1.00 0.00 H new ATOM 0 HB2 GLU A 25 12.412 -4.806 -8.095 1.00 0.00 H new ATOM 0 HB3 GLU A 25 13.410 -3.569 -7.357 1.00 0.00 H new ATOM 0 HG2 GLU A 25 14.862 -5.291 -6.368 1.00 0.00 H new ATOM 0 HG3 GLU A 25 13.839 -6.556 -7.020 1.00 0.00 H new ATOM 373 N ASP A 26 11.944 -7.012 -5.651 1.00 0.00 N ATOM 374 CA ASP A 26 11.271 -8.305 -5.540 1.00 0.00 C ATOM 375 C ASP A 26 10.159 -8.265 -4.495 1.00 0.00 C ATOM 376 O ASP A 26 9.090 -8.834 -4.696 1.00 0.00 O ATOM 377 CB ASP A 26 12.289 -9.386 -5.178 1.00 0.00 C ATOM 378 CG ASP A 26 11.653 -10.746 -4.967 1.00 0.00 C ATOM 379 OD1 ASP A 26 11.250 -11.053 -3.827 1.00 0.00 O ATOM 380 OD2 ASP A 26 11.573 -11.525 -5.937 1.00 0.00 O ATOM 0 H ASP A 26 12.947 -7.052 -5.469 1.00 0.00 H new ATOM 0 HA ASP A 26 10.817 -8.537 -6.504 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.034 -9.457 -5.971 1.00 0.00 H new ATOM 0 HB3 ASP A 26 12.817 -9.092 -4.271 1.00 0.00 H new ATOM 385 N LYS A 27 10.406 -7.559 -3.394 1.00 0.00 N ATOM 386 CA LYS A 27 9.455 -7.466 -2.304 1.00 0.00 C ATOM 387 C LYS A 27 8.201 -6.750 -2.790 1.00 0.00 C ATOM 388 O LYS A 27 7.073 -7.226 -2.630 1.00 0.00 O ATOM 389 CB LYS A 27 10.094 -6.670 -1.170 1.00 0.00 C ATOM 390 CG LYS A 27 9.609 -7.038 0.210 1.00 0.00 C ATOM 391 CD LYS A 27 10.145 -8.395 0.646 1.00 0.00 C ATOM 392 CE LYS A 27 11.655 -8.479 0.485 1.00 0.00 C ATOM 393 NZ LYS A 27 12.162 -9.855 0.722 1.00 0.00 N ATOM 0 H LYS A 27 11.270 -7.039 -3.239 1.00 0.00 H new ATOM 0 HA LYS A 27 9.185 -8.462 -1.952 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.174 -6.810 -1.210 1.00 0.00 H new ATOM 0 HB3 LYS A 27 9.904 -5.610 -1.336 1.00 0.00 H new ATOM 0 HG2 LYS A 27 9.923 -6.275 0.923 1.00 0.00 H new ATOM 0 HG3 LYS A 27 8.519 -7.055 0.221 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.879 -8.574 1.688 1.00 0.00 H new ATOM 0 HD3 LYS A 27 9.672 -9.180 0.057 1.00 0.00 H new ATOM 0 HE2 LYS A 27 11.931 -8.158 -0.519 1.00 0.00 H new ATOM 0 HE3 LYS A 27 12.133 -7.791 1.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 13.195 -9.870 0.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 11.921 -10.152 1.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 11.725 -10.508 0.040 1.00 0.00 H new ATOM 407 N ILE A 28 8.432 -5.609 -3.417 1.00 0.00 N ATOM 408 CA ILE A 28 7.366 -4.783 -3.949 1.00 0.00 C ATOM 409 C ILE A 28 6.585 -5.543 -5.018 1.00 0.00 C ATOM 410 O ILE A 28 5.359 -5.467 -5.075 1.00 0.00 O ATOM 411 CB ILE A 28 7.953 -3.476 -4.517 1.00 0.00 C ATOM 412 CG1 ILE A 28 8.704 -2.744 -3.403 1.00 0.00 C ATOM 413 CG2 ILE A 28 6.865 -2.591 -5.108 1.00 0.00 C ATOM 414 CD1 ILE A 28 9.471 -1.529 -3.865 1.00 0.00 C ATOM 0 H ILE A 28 9.366 -5.230 -3.571 1.00 0.00 H new ATOM 0 HA ILE A 28 6.674 -4.532 -3.145 1.00 0.00 H new ATOM 0 HB ILE A 28 8.643 -3.718 -5.325 1.00 0.00 H new ATOM 0 HG12 ILE A 28 7.989 -2.439 -2.639 1.00 0.00 H new ATOM 0 HG13 ILE A 28 9.398 -3.439 -2.931 1.00 0.00 H new ATOM 0 HG21 ILE A 28 7.312 -1.677 -5.500 1.00 0.00 H new ATOM 0 HG22 ILE A 28 6.361 -3.123 -5.915 1.00 0.00 H new ATOM 0 HG23 ILE A 28 6.141 -2.337 -4.333 1.00 0.00 H new ATOM 0 HD11 ILE A 28 9.973 -1.070 -3.013 1.00 0.00 H new ATOM 0 HD12 ILE A 28 10.212 -1.827 -4.606 1.00 0.00 H new ATOM 0 HD13 ILE A 28 8.782 -0.811 -4.309 1.00 0.00 H new ATOM 426 N ASN A 29 7.300 -6.310 -5.835 1.00 0.00 N ATOM 427 CA ASN A 29 6.662 -7.146 -6.849 1.00 0.00 C ATOM 428 C ASN A 29 5.878 -8.283 -6.201 1.00 0.00 C ATOM 429 O ASN A 29 4.872 -8.742 -6.742 1.00 0.00 O ATOM 430 CB ASN A 29 7.690 -7.712 -7.836 1.00 0.00 C ATOM 431 CG ASN A 29 8.052 -6.724 -8.934 1.00 0.00 C ATOM 432 OD1 ASN A 29 7.386 -6.655 -9.966 1.00 0.00 O ATOM 433 ND2 ASN A 29 9.113 -5.962 -8.728 1.00 0.00 N ATOM 0 H ASN A 29 8.318 -6.371 -5.816 1.00 0.00 H new ATOM 0 HA ASN A 29 5.969 -6.513 -7.404 1.00 0.00 H new ATOM 0 HB2 ASN A 29 8.593 -7.993 -7.293 1.00 0.00 H new ATOM 0 HB3 ASN A 29 7.293 -8.621 -8.287 1.00 0.00 H new ATOM 0 HD21 ASN A 29 9.403 -5.289 -9.438 1.00 0.00 H new ATOM 0 HD22 ASN A 29 9.641 -6.047 -7.860 1.00 0.00 H new ATOM 440 N ALA A 30 6.335 -8.732 -5.039 1.00 0.00 N ATOM 441 CA ALA A 30 5.627 -9.757 -4.286 1.00 0.00 C ATOM 442 C ALA A 30 4.282 -9.226 -3.800 1.00 0.00 C ATOM 443 O ALA A 30 3.284 -9.951 -3.808 1.00 0.00 O ATOM 444 CB ALA A 30 6.471 -10.256 -3.123 1.00 0.00 C ATOM 0 H ALA A 30 7.193 -8.402 -4.598 1.00 0.00 H new ATOM 0 HA ALA A 30 5.441 -10.603 -4.947 1.00 0.00 H new ATOM 0 HB1 ALA A 30 5.920 -11.021 -2.576 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.400 -10.680 -3.503 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.698 -9.425 -2.455 1.00 0.00 H new ATOM 450 N LEU A 31 4.248 -7.958 -3.378 1.00 0.00 N ATOM 451 CA LEU A 31 2.970 -7.308 -3.064 1.00 0.00 C ATOM 452 C LEU A 31 2.125 -7.174 -4.328 1.00 0.00 C ATOM 453 O LEU A 31 0.926 -7.469 -4.324 1.00 0.00 O ATOM 454 CB LEU A 31 3.159 -5.914 -2.448 1.00 0.00 C ATOM 455 CG LEU A 31 3.527 -5.856 -0.962 1.00 0.00 C ATOM 456 CD1 LEU A 31 2.836 -6.965 -0.186 1.00 0.00 C ATOM 457 CD2 LEU A 31 5.033 -5.896 -0.768 1.00 0.00 C ATOM 0 H LEU A 31 5.072 -7.371 -3.248 1.00 0.00 H new ATOM 0 HA LEU A 31 2.467 -7.940 -2.332 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.937 -5.397 -3.010 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.236 -5.352 -2.591 1.00 0.00 H new ATOM 0 HG LEU A 31 3.172 -4.905 -0.565 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.114 -6.901 0.866 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.756 -6.858 -0.283 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.142 -7.933 -0.584 1.00 0.00 H new ATOM 0 HD21 LEU A 31 5.264 -5.853 0.296 1.00 0.00 H new ATOM 0 HD22 LEU A 31 5.430 -6.820 -1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.488 -5.043 -1.272 1.00 0.00 H new ATOM 469 N ILE A 32 2.772 -6.722 -5.399 1.00 0.00 N ATOM 470 CA ILE A 32 2.141 -6.569 -6.712 1.00 0.00 C ATOM 471 C ILE A 32 1.383 -7.833 -7.116 1.00 0.00 C ATOM 472 O ILE A 32 0.206 -7.773 -7.493 1.00 0.00 O ATOM 473 CB ILE A 32 3.216 -6.236 -7.778 1.00 0.00 C ATOM 474 CG1 ILE A 32 3.686 -4.787 -7.619 1.00 0.00 C ATOM 475 CG2 ILE A 32 2.700 -6.484 -9.190 1.00 0.00 C ATOM 476 CD1 ILE A 32 4.899 -4.443 -8.460 1.00 0.00 C ATOM 0 H ILE A 32 3.755 -6.449 -5.383 1.00 0.00 H new ATOM 0 HA ILE A 32 1.424 -5.751 -6.648 1.00 0.00 H new ATOM 0 HB ILE A 32 4.065 -6.901 -7.620 1.00 0.00 H new ATOM 0 HG12 ILE A 32 2.868 -4.118 -7.886 1.00 0.00 H new ATOM 0 HG13 ILE A 32 3.918 -4.603 -6.570 1.00 0.00 H new ATOM 0 HG21 ILE A 32 3.480 -6.240 -9.911 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.422 -7.533 -9.297 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.827 -5.857 -9.374 1.00 0.00 H new ATOM 0 HD11 ILE A 32 5.173 -3.401 -8.295 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.732 -5.086 -8.177 1.00 0.00 H new ATOM 0 HD13 ILE A 32 4.666 -4.594 -9.514 1.00 0.00 H new ATOM 488 N LYS A 33 2.060 -8.967 -7.009 1.00 0.00 N ATOM 489 CA LYS A 33 1.505 -10.244 -7.358 1.00 0.00 C ATOM 490 C LYS A 33 0.457 -10.699 -6.343 1.00 0.00 C ATOM 491 O LYS A 33 -0.559 -11.284 -6.715 1.00 0.00 O ATOM 492 CB LYS A 33 2.649 -11.234 -7.448 1.00 0.00 C ATOM 493 CG LYS A 33 2.176 -12.641 -7.573 1.00 0.00 C ATOM 494 CD LYS A 33 1.722 -12.974 -8.982 1.00 0.00 C ATOM 495 CE LYS A 33 1.372 -14.449 -9.118 1.00 0.00 C ATOM 496 NZ LYS A 33 0.422 -14.907 -8.066 1.00 0.00 N ATOM 0 H LYS A 33 3.022 -9.015 -6.672 1.00 0.00 H new ATOM 0 HA LYS A 33 0.990 -10.175 -8.316 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.273 -10.986 -8.306 1.00 0.00 H new ATOM 0 HB3 LYS A 33 3.276 -11.142 -6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 33 2.979 -13.319 -7.283 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.352 -12.808 -6.879 1.00 0.00 H new ATOM 0 HD2 LYS A 33 0.854 -12.367 -9.239 1.00 0.00 H new ATOM 0 HD3 LYS A 33 2.510 -12.719 -9.690 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.935 -14.627 -10.101 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.284 -15.043 -9.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.057 -15.849 -8.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.914 -14.956 -7.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.370 -14.236 -7.998 1.00 0.00 H new ATOM 510 N ALA A 34 0.702 -10.419 -5.068 1.00 0.00 N ATOM 511 CA ALA A 34 -0.233 -10.796 -4.013 1.00 0.00 C ATOM 512 C ALA A 34 -1.601 -10.165 -4.230 1.00 0.00 C ATOM 513 O ALA A 34 -2.635 -10.811 -4.045 1.00 0.00 O ATOM 514 CB ALA A 34 0.312 -10.392 -2.654 1.00 0.00 C ATOM 0 H ALA A 34 1.537 -9.934 -4.740 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.349 -11.879 -4.047 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.397 -10.680 -1.878 1.00 0.00 H new ATOM 0 HB2 ALA A 34 1.264 -10.893 -2.480 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.460 -9.312 -2.628 1.00 0.00 H new ATOM 520 N ALA A 35 -1.606 -8.901 -4.624 1.00 0.00 N ATOM 521 CA ALA A 35 -2.850 -8.192 -4.869 1.00 0.00 C ATOM 522 C ALA A 35 -3.365 -8.452 -6.277 1.00 0.00 C ATOM 523 O ALA A 35 -4.574 -8.499 -6.508 1.00 0.00 O ATOM 524 CB ALA A 35 -2.664 -6.705 -4.645 1.00 0.00 C ATOM 0 H ALA A 35 -0.764 -8.347 -4.780 1.00 0.00 H new ATOM 0 HA ALA A 35 -3.592 -8.566 -4.164 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.605 -6.188 -4.833 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -2.352 -6.528 -3.616 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -1.901 -6.327 -5.325 1.00 0.00 H new ATOM 530 N GLY A 36 -2.440 -8.625 -7.210 1.00 0.00 N ATOM 531 CA GLY A 36 -2.805 -8.859 -8.591 1.00 0.00 C ATOM 532 C GLY A 36 -2.780 -7.582 -9.402 1.00 0.00 C ATOM 533 O GLY A 36 -3.381 -7.502 -10.475 1.00 0.00 O ATOM 0 H GLY A 36 -1.436 -8.607 -7.032 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.119 -9.583 -9.031 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.802 -9.298 -8.634 1.00 0.00 H new ATOM 537 N VAL A 37 -2.081 -6.576 -8.891 1.00 0.00 N ATOM 538 CA VAL A 37 -2.032 -5.280 -9.543 1.00 0.00 C ATOM 539 C VAL A 37 -0.607 -4.889 -9.879 1.00 0.00 C ATOM 540 O VAL A 37 0.246 -4.724 -9.008 1.00 0.00 O ATOM 541 CB VAL A 37 -2.727 -4.191 -8.696 1.00 0.00 C ATOM 542 CG1 VAL A 37 -2.220 -4.188 -7.266 1.00 0.00 C ATOM 543 CG2 VAL A 37 -2.596 -2.810 -9.335 1.00 0.00 C ATOM 0 H VAL A 37 -1.542 -6.636 -8.027 1.00 0.00 H new ATOM 0 HA VAL A 37 -2.583 -5.365 -10.479 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.789 -4.437 -8.667 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -2.731 -3.409 -6.700 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -2.417 -5.157 -6.808 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.147 -3.995 -7.261 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.097 -2.071 -8.710 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -1.541 -2.551 -9.428 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.056 -2.821 -10.323 1.00 0.00 H new ATOM 553 N ASN A 38 -0.382 -4.745 -11.167 1.00 0.00 N ATOM 554 CA ASN A 38 0.944 -4.540 -11.713 1.00 0.00 C ATOM 555 C ASN A 38 1.285 -3.065 -11.753 1.00 0.00 C ATOM 556 O ASN A 38 0.405 -2.204 -11.766 1.00 0.00 O ATOM 557 CB ASN A 38 0.999 -5.156 -13.110 1.00 0.00 C ATOM 558 CG ASN A 38 2.383 -5.116 -13.735 1.00 0.00 C ATOM 559 OD1 ASN A 38 3.400 -5.180 -13.038 1.00 0.00 O ATOM 560 ND2 ASN A 38 2.426 -5.008 -15.053 1.00 0.00 N ATOM 0 H ASN A 38 -1.120 -4.767 -11.871 1.00 0.00 H new ATOM 0 HA ASN A 38 1.683 -5.025 -11.076 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.663 -6.192 -13.055 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.300 -4.628 -13.759 1.00 0.00 H new ATOM 0 HD21 ASN A 38 3.325 -4.975 -15.533 1.00 0.00 H new ATOM 0 HD22 ASN A 38 1.560 -4.958 -15.589 1.00 0.00 H new ATOM 567 N VAL A 39 2.572 -2.795 -11.772 1.00 0.00 N ATOM 568 CA VAL A 39 3.086 -1.455 -11.668 1.00 0.00 C ATOM 569 C VAL A 39 4.037 -1.161 -12.820 1.00 0.00 C ATOM 570 O VAL A 39 4.531 -2.079 -13.469 1.00 0.00 O ATOM 571 CB VAL A 39 3.834 -1.314 -10.344 1.00 0.00 C ATOM 572 CG1 VAL A 39 4.490 0.054 -10.199 1.00 0.00 C ATOM 573 CG2 VAL A 39 2.903 -1.605 -9.182 1.00 0.00 C ATOM 0 H VAL A 39 3.295 -3.509 -11.861 1.00 0.00 H new ATOM 0 HA VAL A 39 2.257 -0.748 -11.710 1.00 0.00 H new ATOM 0 HB VAL A 39 4.640 -2.048 -10.337 1.00 0.00 H new ATOM 0 HG11 VAL A 39 5.010 0.109 -9.243 1.00 0.00 H new ATOM 0 HG12 VAL A 39 5.204 0.203 -11.009 1.00 0.00 H new ATOM 0 HG13 VAL A 39 3.726 0.830 -10.241 1.00 0.00 H new ATOM 0 HG21 VAL A 39 3.448 -1.501 -8.244 1.00 0.00 H new ATOM 0 HG22 VAL A 39 2.071 -0.901 -9.198 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.520 -2.622 -9.268 1.00 0.00 H new ATOM 583 N GLU A 40 4.278 0.118 -13.065 1.00 0.00 N ATOM 584 CA GLU A 40 5.306 0.544 -13.977 1.00 0.00 C ATOM 585 C GLU A 40 6.652 0.200 -13.349 1.00 0.00 C ATOM 586 O GLU A 40 7.062 0.849 -12.396 1.00 0.00 O ATOM 587 CB GLU A 40 5.176 2.039 -14.203 1.00 0.00 C ATOM 588 CG GLU A 40 6.237 2.583 -15.110 1.00 0.00 C ATOM 589 CD GLU A 40 5.979 2.283 -16.570 1.00 0.00 C ATOM 590 OE1 GLU A 40 5.085 2.924 -17.162 1.00 0.00 O ATOM 591 OE2 GLU A 40 6.680 1.421 -17.134 1.00 0.00 O ATOM 0 H GLU A 40 3.761 0.883 -12.632 1.00 0.00 H new ATOM 0 HA GLU A 40 5.217 0.045 -14.942 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.196 2.254 -14.628 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.226 2.553 -13.243 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.305 3.662 -14.973 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.202 2.164 -14.824 1.00 0.00 H new ATOM 598 N PRO A 41 7.334 -0.833 -13.866 1.00 0.00 N ATOM 599 CA PRO A 41 8.459 -1.499 -13.178 1.00 0.00 C ATOM 600 C PRO A 41 9.555 -0.561 -12.640 1.00 0.00 C ATOM 601 O PRO A 41 10.206 -0.861 -11.614 1.00 0.00 O ATOM 602 CB PRO A 41 9.029 -2.416 -14.256 1.00 0.00 C ATOM 603 CG PRO A 41 7.866 -2.720 -15.125 1.00 0.00 C ATOM 604 CD PRO A 41 7.052 -1.459 -15.169 1.00 0.00 C ATOM 0 HA PRO A 41 8.105 -2.001 -12.278 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.827 -1.927 -14.815 1.00 0.00 H new ATOM 0 HB3 PRO A 41 9.452 -3.323 -13.825 1.00 0.00 H new ATOM 0 HG2 PRO A 41 8.189 -3.012 -16.124 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.283 -3.549 -14.723 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.349 -0.816 -15.998 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.990 -1.669 -15.294 1.00 0.00 H new ATOM 612 N PHE A 42 9.769 0.566 -13.320 1.00 0.00 N ATOM 613 CA PHE A 42 10.763 1.533 -12.869 1.00 0.00 C ATOM 614 C PHE A 42 10.407 2.027 -11.471 1.00 0.00 C ATOM 615 O PHE A 42 11.282 2.420 -10.703 1.00 0.00 O ATOM 616 CB PHE A 42 10.894 2.710 -13.853 1.00 0.00 C ATOM 617 CG PHE A 42 10.090 3.930 -13.492 1.00 0.00 C ATOM 618 CD1 PHE A 42 10.617 4.897 -12.651 1.00 0.00 C ATOM 619 CD2 PHE A 42 8.819 4.114 -13.996 1.00 0.00 C ATOM 620 CE1 PHE A 42 9.887 6.020 -12.318 1.00 0.00 C ATOM 621 CE2 PHE A 42 8.081 5.234 -13.668 1.00 0.00 C ATOM 622 CZ PHE A 42 8.616 6.188 -12.827 1.00 0.00 C ATOM 0 H PHE A 42 9.274 0.827 -14.173 1.00 0.00 H new ATOM 0 HA PHE A 42 11.733 1.036 -12.832 1.00 0.00 H new ATOM 0 HB2 PHE A 42 11.945 2.992 -13.921 1.00 0.00 H new ATOM 0 HB3 PHE A 42 10.590 2.372 -14.844 1.00 0.00 H new ATOM 0 HD1 PHE A 42 11.612 4.770 -12.251 1.00 0.00 H new ATOM 0 HD2 PHE A 42 8.395 3.372 -14.656 1.00 0.00 H new ATOM 0 HE1 PHE A 42 10.310 6.765 -11.661 1.00 0.00 H new ATOM 0 HE2 PHE A 42 7.087 5.363 -14.069 1.00 0.00 H new ATOM 0 HZ PHE A 42 8.041 7.065 -12.568 1.00 0.00 H new ATOM 632 N TRP A 43 9.117 1.988 -11.149 1.00 0.00 N ATOM 633 CA TRP A 43 8.652 2.354 -9.825 1.00 0.00 C ATOM 634 C TRP A 43 9.179 1.379 -8.780 1.00 0.00 C ATOM 635 O TRP A 43 9.885 1.807 -7.899 1.00 0.00 O ATOM 636 CB TRP A 43 7.128 2.424 -9.758 1.00 0.00 C ATOM 637 CG TRP A 43 6.548 3.698 -10.226 1.00 0.00 C ATOM 638 CD1 TRP A 43 5.583 3.835 -11.155 1.00 0.00 C ATOM 639 CD2 TRP A 43 6.875 5.009 -9.782 1.00 0.00 C ATOM 640 NE1 TRP A 43 5.254 5.139 -11.305 1.00 0.00 N ATOM 641 CE2 TRP A 43 6.043 5.896 -10.472 1.00 0.00 C ATOM 642 CE3 TRP A 43 7.786 5.509 -8.866 1.00 0.00 C ATOM 643 CZ2 TRP A 43 6.097 7.271 -10.265 1.00 0.00 C ATOM 644 CZ3 TRP A 43 7.845 6.873 -8.658 1.00 0.00 C ATOM 645 CH2 TRP A 43 7.001 7.740 -9.354 1.00 0.00 C ATOM 0 H TRP A 43 8.378 1.705 -11.792 1.00 0.00 H new ATOM 0 HA TRP A 43 9.041 3.349 -9.610 1.00 0.00 H new ATOM 0 HB2 TRP A 43 6.714 1.611 -10.355 1.00 0.00 H new ATOM 0 HB3 TRP A 43 6.815 2.255 -8.728 1.00 0.00 H new ATOM 0 HD1 TRP A 43 5.135 3.019 -11.703 1.00 0.00 H new ATOM 0 HE1 TRP A 43 4.537 5.501 -11.934 1.00 0.00 H new ATOM 0 HE3 TRP A 43 8.440 4.843 -8.323 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 5.447 7.944 -10.805 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 8.553 7.274 -7.948 1.00 0.00 H new ATOM 0 HH2 TRP A 43 7.064 8.802 -9.169 1.00 0.00 H new ATOM 656 N PRO A 44 8.847 0.063 -8.834 1.00 0.00 N ATOM 657 CA PRO A 44 9.427 -0.920 -7.912 1.00 0.00 C ATOM 658 C PRO A 44 10.930 -0.729 -7.735 1.00 0.00 C ATOM 659 O PRO A 44 11.440 -0.740 -6.606 1.00 0.00 O ATOM 660 CB PRO A 44 9.131 -2.252 -8.594 1.00 0.00 C ATOM 661 CG PRO A 44 7.852 -2.016 -9.318 1.00 0.00 C ATOM 662 CD PRO A 44 7.871 -0.571 -9.746 1.00 0.00 C ATOM 0 HA PRO A 44 9.012 -0.838 -6.907 1.00 0.00 H new ATOM 0 HB2 PRO A 44 9.930 -2.535 -9.279 1.00 0.00 H new ATOM 0 HB3 PRO A 44 9.034 -3.059 -7.867 1.00 0.00 H new ATOM 0 HG2 PRO A 44 7.766 -2.676 -10.181 1.00 0.00 H new ATOM 0 HG3 PRO A 44 6.997 -2.220 -8.674 1.00 0.00 H new ATOM 0 HD2 PRO A 44 8.174 -0.468 -10.788 1.00 0.00 H new ATOM 0 HD3 PRO A 44 6.885 -0.115 -9.654 1.00 0.00 H new ATOM 670 N GLY A 45 11.633 -0.524 -8.853 1.00 0.00 N ATOM 671 CA GLY A 45 13.060 -0.258 -8.778 1.00 0.00 C ATOM 672 C GLY A 45 13.373 1.004 -7.979 1.00 0.00 C ATOM 673 O GLY A 45 14.042 0.951 -6.940 1.00 0.00 O ATOM 0 H GLY A 45 11.243 -0.538 -9.796 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.562 -1.110 -8.319 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.462 -0.156 -9.786 1.00 0.00 H new ATOM 677 N LEU A 46 12.855 2.131 -8.451 1.00 0.00 N ATOM 678 CA LEU A 46 13.097 3.435 -7.842 1.00 0.00 C ATOM 679 C LEU A 46 12.518 3.523 -6.423 1.00 0.00 C ATOM 680 O LEU A 46 12.984 4.302 -5.600 1.00 0.00 O ATOM 681 CB LEU A 46 12.511 4.504 -8.771 1.00 0.00 C ATOM 682 CG LEU A 46 12.150 5.849 -8.149 1.00 0.00 C ATOM 683 CD1 LEU A 46 13.393 6.577 -7.655 1.00 0.00 C ATOM 684 CD2 LEU A 46 11.406 6.697 -9.162 1.00 0.00 C ATOM 0 H LEU A 46 12.251 2.167 -9.272 1.00 0.00 H new ATOM 0 HA LEU A 46 14.169 3.596 -7.727 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.228 4.684 -9.572 1.00 0.00 H new ATOM 0 HB3 LEU A 46 11.613 4.094 -9.233 1.00 0.00 H new ATOM 0 HG LEU A 46 11.506 5.671 -7.288 1.00 0.00 H new ATOM 0 HD11 LEU A 46 13.105 7.532 -7.217 1.00 0.00 H new ATOM 0 HD12 LEU A 46 13.896 5.969 -6.903 1.00 0.00 H new ATOM 0 HD13 LEU A 46 14.069 6.751 -8.492 1.00 0.00 H new ATOM 0 HD21 LEU A 46 11.150 7.657 -8.714 1.00 0.00 H new ATOM 0 HD22 LEU A 46 12.039 6.861 -10.034 1.00 0.00 H new ATOM 0 HD23 LEU A 46 10.494 6.184 -9.467 1.00 0.00 H new ATOM 696 N PHE A 47 11.526 2.708 -6.137 1.00 0.00 N ATOM 697 CA PHE A 47 10.923 2.652 -4.815 1.00 0.00 C ATOM 698 C PHE A 47 11.849 1.956 -3.843 1.00 0.00 C ATOM 699 O PHE A 47 12.043 2.423 -2.725 1.00 0.00 O ATOM 700 CB PHE A 47 9.584 1.926 -4.866 1.00 0.00 C ATOM 701 CG PHE A 47 8.395 2.841 -4.898 1.00 0.00 C ATOM 702 CD1 PHE A 47 8.034 3.515 -6.057 1.00 0.00 C ATOM 703 CD2 PHE A 47 7.626 3.009 -3.764 1.00 0.00 C ATOM 704 CE1 PHE A 47 6.921 4.339 -6.079 1.00 0.00 C ATOM 705 CE2 PHE A 47 6.516 3.831 -3.779 1.00 0.00 C ATOM 706 CZ PHE A 47 6.160 4.495 -4.939 1.00 0.00 C ATOM 0 H PHE A 47 11.112 2.064 -6.811 1.00 0.00 H new ATOM 0 HA PHE A 47 10.754 3.673 -4.474 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.562 1.287 -5.749 1.00 0.00 H new ATOM 0 HB3 PHE A 47 9.503 1.272 -3.998 1.00 0.00 H new ATOM 0 HD1 PHE A 47 8.628 3.395 -6.951 1.00 0.00 H new ATOM 0 HD2 PHE A 47 7.895 2.492 -2.855 1.00 0.00 H new ATOM 0 HE1 PHE A 47 6.650 4.858 -6.986 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.925 3.955 -2.884 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.289 5.134 -4.952 1.00 0.00 H new ATOM 716 N ALA A 48 12.440 0.848 -4.275 1.00 0.00 N ATOM 717 CA ALA A 48 13.397 0.143 -3.439 1.00 0.00 C ATOM 718 C ALA A 48 14.611 1.036 -3.220 1.00 0.00 C ATOM 719 O ALA A 48 15.256 1.002 -2.171 1.00 0.00 O ATOM 720 CB ALA A 48 13.802 -1.179 -4.079 1.00 0.00 C ATOM 0 H ALA A 48 12.275 0.425 -5.188 1.00 0.00 H new ATOM 0 HA ALA A 48 12.940 -0.087 -2.477 1.00 0.00 H new ATOM 0 HB1 ALA A 48 14.519 -1.690 -3.436 1.00 0.00 H new ATOM 0 HB2 ALA A 48 12.920 -1.806 -4.209 1.00 0.00 H new ATOM 0 HB3 ALA A 48 14.258 -0.988 -5.051 1.00 0.00 H new ATOM 726 N LYS A 49 14.888 1.838 -4.239 1.00 0.00 N ATOM 727 CA LYS A 49 15.914 2.870 -4.186 1.00 0.00 C ATOM 728 C LYS A 49 15.566 3.967 -3.176 1.00 0.00 C ATOM 729 O LYS A 49 16.370 4.313 -2.310 1.00 0.00 O ATOM 730 CB LYS A 49 16.047 3.490 -5.564 1.00 0.00 C ATOM 731 CG LYS A 49 16.662 2.570 -6.595 1.00 0.00 C ATOM 732 CD LYS A 49 18.069 2.975 -6.892 1.00 0.00 C ATOM 733 CE LYS A 49 18.117 4.305 -7.629 1.00 0.00 C ATOM 734 NZ LYS A 49 19.496 4.651 -8.064 1.00 0.00 N ATOM 0 H LYS A 49 14.402 1.790 -5.134 1.00 0.00 H new ATOM 0 HA LYS A 49 16.850 2.408 -3.870 1.00 0.00 H new ATOM 0 HB2 LYS A 49 15.060 3.798 -5.909 1.00 0.00 H new ATOM 0 HB3 LYS A 49 16.654 4.392 -5.488 1.00 0.00 H new ATOM 0 HG2 LYS A 49 16.643 1.543 -6.230 1.00 0.00 H new ATOM 0 HG3 LYS A 49 16.070 2.594 -7.510 1.00 0.00 H new ATOM 0 HD2 LYS A 49 18.632 3.052 -5.962 1.00 0.00 H new ATOM 0 HD3 LYS A 49 18.552 2.205 -7.494 1.00 0.00 H new ATOM 0 HE2 LYS A 49 17.463 4.261 -8.500 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.733 5.093 -6.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 19.484 5.564 -8.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 20.116 4.719 -7.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 19.854 3.913 -8.703 1.00 0.00 H new ATOM 748 N ALA A 50 14.361 4.507 -3.294 1.00 0.00 N ATOM 749 CA ALA A 50 13.968 5.698 -2.549 1.00 0.00 C ATOM 750 C ALA A 50 13.568 5.400 -1.108 1.00 0.00 C ATOM 751 O ALA A 50 13.937 6.147 -0.205 1.00 0.00 O ATOM 752 CB ALA A 50 12.832 6.410 -3.267 1.00 0.00 C ATOM 0 H ALA A 50 13.632 4.136 -3.904 1.00 0.00 H new ATOM 0 HA ALA A 50 14.846 6.343 -2.504 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.545 7.298 -2.704 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.159 6.703 -4.265 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.976 5.740 -3.348 1.00 0.00 H new ATOM 758 N LEU A 51 12.837 4.308 -0.881 1.00 0.00 N ATOM 759 CA LEU A 51 12.259 4.024 0.437 1.00 0.00 C ATOM 760 C LEU A 51 13.325 3.727 1.495 1.00 0.00 C ATOM 761 O LEU A 51 13.004 3.459 2.652 1.00 0.00 O ATOM 762 CB LEU A 51 11.271 2.860 0.334 1.00 0.00 C ATOM 763 CG LEU A 51 9.896 3.215 -0.220 1.00 0.00 C ATOM 764 CD1 LEU A 51 9.322 2.007 -0.937 1.00 0.00 C ATOM 765 CD2 LEU A 51 8.961 3.675 0.899 1.00 0.00 C ATOM 0 H LEU A 51 12.630 3.605 -1.591 1.00 0.00 H new ATOM 0 HA LEU A 51 11.734 4.923 0.761 1.00 0.00 H new ATOM 0 HB2 LEU A 51 11.710 2.088 -0.298 1.00 0.00 H new ATOM 0 HB3 LEU A 51 11.143 2.426 1.326 1.00 0.00 H new ATOM 0 HG LEU A 51 9.995 4.040 -0.926 1.00 0.00 H new ATOM 0 HD11 LEU A 51 8.338 2.254 -1.336 1.00 0.00 H new ATOM 0 HD12 LEU A 51 9.984 1.721 -1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.231 1.177 -0.236 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.986 3.923 0.480 1.00 0.00 H new ATOM 0 HD22 LEU A 51 8.848 2.875 1.631 1.00 0.00 H new ATOM 0 HD23 LEU A 51 9.381 4.555 1.385 1.00 0.00 H new ATOM 777 N ALA A 52 14.588 3.779 1.101 1.00 0.00 N ATOM 778 CA ALA A 52 15.684 3.632 2.043 1.00 0.00 C ATOM 779 C ALA A 52 16.067 4.985 2.637 1.00 0.00 C ATOM 780 O ALA A 52 16.713 5.056 3.682 1.00 0.00 O ATOM 781 CB ALA A 52 16.882 2.987 1.361 1.00 0.00 C ATOM 0 H ALA A 52 14.879 3.922 0.134 1.00 0.00 H new ATOM 0 HA ALA A 52 15.358 2.984 2.856 1.00 0.00 H new ATOM 0 HB1 ALA A 52 17.696 2.883 2.078 1.00 0.00 H new ATOM 0 HB2 ALA A 52 16.601 2.003 0.986 1.00 0.00 H new ATOM 0 HB3 ALA A 52 17.208 3.613 0.530 1.00 0.00 H new ATOM 787 N ASN A 53 15.648 6.060 1.974 1.00 0.00 N ATOM 788 CA ASN A 53 16.032 7.413 2.377 1.00 0.00 C ATOM 789 C ASN A 53 14.825 8.341 2.470 1.00 0.00 C ATOM 790 O ASN A 53 14.749 9.185 3.365 1.00 0.00 O ATOM 791 CB ASN A 53 17.053 7.993 1.396 1.00 0.00 C ATOM 792 CG ASN A 53 18.409 7.327 1.505 1.00 0.00 C ATOM 793 OD1 ASN A 53 18.826 6.912 2.585 1.00 0.00 O ATOM 794 ND2 ASN A 53 19.105 7.210 0.387 1.00 0.00 N ATOM 0 H ASN A 53 15.042 6.022 1.154 1.00 0.00 H new ATOM 0 HA ASN A 53 16.480 7.340 3.368 1.00 0.00 H new ATOM 0 HB2 ASN A 53 16.678 7.881 0.379 1.00 0.00 H new ATOM 0 HB3 ASN A 53 17.161 9.062 1.580 1.00 0.00 H new ATOM 0 HD21 ASN A 53 20.022 6.763 0.401 1.00 0.00 H new ATOM 0 HD22 ASN A 53 18.725 7.567 -0.490 1.00 0.00 H new ATOM 801 N VAL A 54 13.882 8.190 1.549 1.00 0.00 N ATOM 802 CA VAL A 54 12.690 9.023 1.540 1.00 0.00 C ATOM 803 C VAL A 54 11.635 8.437 2.464 1.00 0.00 C ATOM 804 O VAL A 54 11.869 7.434 3.139 1.00 0.00 O ATOM 805 CB VAL A 54 12.084 9.166 0.122 1.00 0.00 C ATOM 806 CG1 VAL A 54 13.159 9.530 -0.891 1.00 0.00 C ATOM 807 CG2 VAL A 54 11.342 7.900 -0.292 1.00 0.00 C ATOM 0 H VAL A 54 13.921 7.499 0.800 1.00 0.00 H new ATOM 0 HA VAL A 54 12.993 10.012 1.884 1.00 0.00 H new ATOM 0 HB VAL A 54 11.358 9.978 0.148 1.00 0.00 H new ATOM 0 HG11 VAL A 54 12.710 9.625 -1.880 1.00 0.00 H new ATOM 0 HG12 VAL A 54 13.619 10.477 -0.609 1.00 0.00 H new ATOM 0 HG13 VAL A 54 13.919 8.749 -0.911 1.00 0.00 H new ATOM 0 HG21 VAL A 54 10.928 8.031 -1.292 1.00 0.00 H new ATOM 0 HG22 VAL A 54 12.033 7.057 -0.293 1.00 0.00 H new ATOM 0 HG23 VAL A 54 10.534 7.705 0.413 1.00 0.00 H new ATOM 817 N ASN A 55 10.481 9.068 2.487 1.00 0.00 N ATOM 818 CA ASN A 55 9.365 8.580 3.269 1.00 0.00 C ATOM 819 C ASN A 55 8.187 8.274 2.345 1.00 0.00 C ATOM 820 O ASN A 55 8.202 8.645 1.173 1.00 0.00 O ATOM 821 CB ASN A 55 8.977 9.621 4.332 1.00 0.00 C ATOM 822 CG ASN A 55 7.930 9.123 5.316 1.00 0.00 C ATOM 823 OD1 ASN A 55 6.730 9.264 5.087 1.00 0.00 O ATOM 824 ND2 ASN A 55 8.374 8.540 6.418 1.00 0.00 N ATOM 0 H ASN A 55 10.290 9.926 1.969 1.00 0.00 H new ATOM 0 HA ASN A 55 9.650 7.661 3.781 1.00 0.00 H new ATOM 0 HB2 ASN A 55 9.870 9.916 4.883 1.00 0.00 H new ATOM 0 HB3 ASN A 55 8.600 10.514 3.834 1.00 0.00 H new ATOM 0 HD21 ASN A 55 7.713 8.190 7.112 1.00 0.00 H new ATOM 0 HD22 ASN A 55 9.377 8.441 6.574 1.00 0.00 H new ATOM 831 N ILE A 56 7.173 7.602 2.859 1.00 0.00 N ATOM 832 CA ILE A 56 5.991 7.292 2.070 1.00 0.00 C ATOM 833 C ILE A 56 5.246 8.582 1.717 1.00 0.00 C ATOM 834 O ILE A 56 4.625 8.688 0.658 1.00 0.00 O ATOM 835 CB ILE A 56 5.088 6.294 2.830 1.00 0.00 C ATOM 836 CG1 ILE A 56 4.130 5.590 1.879 1.00 0.00 C ATOM 837 CG2 ILE A 56 4.330 6.967 3.962 1.00 0.00 C ATOM 838 CD1 ILE A 56 4.747 4.367 1.247 1.00 0.00 C ATOM 0 H ILE A 56 7.143 7.260 3.819 1.00 0.00 H new ATOM 0 HA ILE A 56 6.291 6.816 1.137 1.00 0.00 H new ATOM 0 HB ILE A 56 5.740 5.543 3.275 1.00 0.00 H new ATOM 0 HG12 ILE A 56 3.230 5.301 2.421 1.00 0.00 H new ATOM 0 HG13 ILE A 56 3.822 6.284 1.097 1.00 0.00 H new ATOM 0 HG21 ILE A 56 3.707 6.231 4.471 1.00 0.00 H new ATOM 0 HG22 ILE A 56 5.039 7.395 4.671 1.00 0.00 H new ATOM 0 HG23 ILE A 56 3.699 7.759 3.557 1.00 0.00 H new ATOM 0 HD11 ILE A 56 4.025 3.900 0.577 1.00 0.00 H new ATOM 0 HD12 ILE A 56 5.632 4.657 0.681 1.00 0.00 H new ATOM 0 HD13 ILE A 56 5.031 3.659 2.026 1.00 0.00 H new ATOM 850 N GLY A 57 5.381 9.595 2.567 1.00 0.00 N ATOM 851 CA GLY A 57 4.788 10.882 2.279 1.00 0.00 C ATOM 852 C GLY A 57 5.536 11.589 1.171 1.00 0.00 C ATOM 853 O GLY A 57 5.035 12.540 0.575 1.00 0.00 O ATOM 0 H GLY A 57 5.891 9.545 3.449 1.00 0.00 H new ATOM 0 HA2 GLY A 57 3.745 10.749 1.991 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.795 11.499 3.178 1.00 0.00 H new ATOM 857 N SER A 58 6.734 11.094 0.876 1.00 0.00 N ATOM 858 CA SER A 58 7.556 11.654 -0.174 1.00 0.00 C ATOM 859 C SER A 58 7.062 11.172 -1.529 1.00 0.00 C ATOM 860 O SER A 58 7.325 11.789 -2.560 1.00 0.00 O ATOM 861 CB SER A 58 9.009 11.238 0.017 1.00 0.00 C ATOM 862 OG SER A 58 9.477 11.576 1.313 1.00 0.00 O ATOM 0 H SER A 58 7.154 10.299 1.358 1.00 0.00 H new ATOM 0 HA SER A 58 7.489 12.741 -0.130 1.00 0.00 H new ATOM 0 HB2 SER A 58 9.105 10.163 -0.138 1.00 0.00 H new ATOM 0 HB3 SER A 58 9.630 11.725 -0.735 1.00 0.00 H new ATOM 0 HG SER A 58 10.440 11.755 1.277 1.00 0.00 H new ATOM 868 N LEU A 59 6.337 10.060 -1.512 1.00 0.00 N ATOM 869 CA LEU A 59 5.797 9.469 -2.727 1.00 0.00 C ATOM 870 C LEU A 59 4.850 10.438 -3.419 1.00 0.00 C ATOM 871 O LEU A 59 4.811 10.536 -4.643 1.00 0.00 O ATOM 872 CB LEU A 59 5.052 8.190 -2.375 1.00 0.00 C ATOM 873 CG LEU A 59 5.862 7.123 -1.692 1.00 0.00 C ATOM 874 CD1 LEU A 59 5.052 5.844 -1.661 1.00 0.00 C ATOM 875 CD2 LEU A 59 7.210 6.929 -2.364 1.00 0.00 C ATOM 0 H LEU A 59 6.109 9.546 -0.661 1.00 0.00 H new ATOM 0 HA LEU A 59 6.620 9.244 -3.406 1.00 0.00 H new ATOM 0 HB2 LEU A 59 4.211 8.448 -1.731 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.635 7.772 -3.291 1.00 0.00 H new ATOM 0 HG LEU A 59 6.079 7.430 -0.669 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.628 5.061 -1.168 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.125 6.013 -1.112 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.819 5.536 -2.680 1.00 0.00 H new ATOM 0 HD21 LEU A 59 7.767 6.150 -1.843 1.00 0.00 H new ATOM 0 HD22 LEU A 59 7.060 6.635 -3.403 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.772 7.862 -2.329 1.00 0.00 H new ATOM 887 N ILE A 60 4.114 11.177 -2.607 1.00 0.00 N ATOM 888 CA ILE A 60 3.167 12.170 -3.080 1.00 0.00 C ATOM 889 C ILE A 60 3.875 13.247 -3.908 1.00 0.00 C ATOM 890 O ILE A 60 3.269 13.920 -4.744 1.00 0.00 O ATOM 891 CB ILE A 60 2.451 12.770 -1.850 1.00 0.00 C ATOM 892 CG1 ILE A 60 1.052 12.194 -1.714 1.00 0.00 C ATOM 893 CG2 ILE A 60 2.401 14.294 -1.881 1.00 0.00 C ATOM 894 CD1 ILE A 60 0.617 12.063 -0.278 1.00 0.00 C ATOM 0 H ILE A 60 4.158 11.103 -1.591 1.00 0.00 H new ATOM 0 HA ILE A 60 2.430 11.709 -3.738 1.00 0.00 H new ATOM 0 HB ILE A 60 3.040 12.492 -0.976 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.347 12.832 -2.247 1.00 0.00 H new ATOM 0 HG13 ILE A 60 1.018 11.214 -2.191 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.887 14.659 -0.992 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.416 14.691 -1.902 1.00 0.00 H new ATOM 0 HG23 ILE A 60 1.865 14.622 -2.771 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.390 11.647 -0.239 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.304 11.402 0.251 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.622 13.045 0.195 1.00 0.00 H new ATOM 1057 N TYR B 103 -3.535 -1.588 7.735 1.00 0.00 N ATOM 1058 CA TYR B 103 -3.938 -2.580 6.731 1.00 0.00 C ATOM 1059 C TYR B 103 -4.774 -1.947 5.613 1.00 0.00 C ATOM 1060 O TYR B 103 -5.084 -2.600 4.609 1.00 0.00 O ATOM 1061 CB TYR B 103 -4.741 -3.704 7.388 1.00 0.00 C ATOM 1062 CG TYR B 103 -4.026 -4.371 8.541 1.00 0.00 C ATOM 1063 CD1 TYR B 103 -2.994 -5.270 8.316 1.00 0.00 C ATOM 1064 CD2 TYR B 103 -4.373 -4.088 9.857 1.00 0.00 C ATOM 1065 CE1 TYR B 103 -2.331 -5.868 9.367 1.00 0.00 C ATOM 1066 CE2 TYR B 103 -3.712 -4.681 10.912 1.00 0.00 C ATOM 1067 CZ TYR B 103 -2.692 -5.568 10.662 1.00 0.00 C ATOM 1068 OH TYR B 103 -2.027 -6.159 11.713 1.00 0.00 O ATOM 0 HA TYR B 103 -3.027 -2.985 6.291 1.00 0.00 H new ATOM 0 HB2 TYR B 103 -5.689 -3.300 7.745 1.00 0.00 H new ATOM 0 HB3 TYR B 103 -4.978 -4.456 6.636 1.00 0.00 H new ATOM 0 HD1 TYR B 103 -2.705 -5.505 7.302 1.00 0.00 H new ATOM 0 HD2 TYR B 103 -5.174 -3.392 10.057 1.00 0.00 H new ATOM 0 HE1 TYR B 103 -1.532 -6.569 9.175 1.00 0.00 H new ATOM 0 HE2 TYR B 103 -3.994 -4.450 11.929 1.00 0.00 H new ATOM 0 HH TYR B 103 -2.403 -5.839 12.559 1.00 0.00 H new ATOM 1078 N VAL B 104 -5.144 -0.675 5.804 1.00 0.00 N ATOM 1079 CA VAL B 104 -5.787 0.106 4.753 1.00 0.00 C ATOM 1080 C VAL B 104 -5.061 -0.095 3.432 1.00 0.00 C ATOM 1081 O VAL B 104 -5.676 -0.342 2.402 1.00 0.00 O ATOM 1082 CB VAL B 104 -5.785 1.618 5.056 1.00 0.00 C ATOM 1083 CG1 VAL B 104 -6.826 1.971 6.098 1.00 0.00 C ATOM 1084 CG2 VAL B 104 -4.413 2.087 5.504 1.00 0.00 C ATOM 0 H VAL B 104 -5.007 -0.169 6.679 1.00 0.00 H new ATOM 0 HA VAL B 104 -6.818 -0.245 4.699 1.00 0.00 H new ATOM 0 HB VAL B 104 -6.039 2.134 4.130 1.00 0.00 H new ATOM 0 HG11 VAL B 104 -6.800 3.044 6.290 1.00 0.00 H new ATOM 0 HG12 VAL B 104 -7.815 1.692 5.734 1.00 0.00 H new ATOM 0 HG13 VAL B 104 -6.614 1.432 7.021 1.00 0.00 H new ATOM 0 HG21 VAL B 104 -4.444 3.157 5.710 1.00 0.00 H new ATOM 0 HG22 VAL B 104 -4.123 1.551 6.408 1.00 0.00 H new ATOM 0 HG23 VAL B 104 -3.686 1.890 4.716 1.00 0.00 H new ATOM 1094 N ALA B 105 -3.735 -0.029 3.497 1.00 0.00 N ATOM 1095 CA ALA B 105 -2.895 -0.072 2.316 1.00 0.00 C ATOM 1096 C ALA B 105 -3.016 -1.408 1.601 1.00 0.00 C ATOM 1097 O ALA B 105 -2.884 -1.493 0.379 1.00 0.00 O ATOM 1098 CB ALA B 105 -1.456 0.184 2.709 1.00 0.00 C ATOM 0 H ALA B 105 -3.217 0.056 4.372 1.00 0.00 H new ATOM 0 HA ALA B 105 -3.228 0.704 1.627 1.00 0.00 H new ATOM 0 HB1 ALA B 105 -0.825 0.152 1.821 1.00 0.00 H new ATOM 0 HB2 ALA B 105 -1.375 1.166 3.176 1.00 0.00 H new ATOM 0 HB3 ALA B 105 -1.130 -0.581 3.414 1.00 0.00 H new ATOM 1104 N SER B 106 -3.281 -2.445 2.375 1.00 0.00 N ATOM 1105 CA SER B 106 -3.395 -3.793 1.842 1.00 0.00 C ATOM 1106 C SER B 106 -4.740 -3.938 1.148 1.00 0.00 C ATOM 1107 O SER B 106 -4.870 -4.598 0.111 1.00 0.00 O ATOM 1108 CB SER B 106 -3.284 -4.807 2.973 1.00 0.00 C ATOM 1109 OG SER B 106 -2.339 -4.386 3.941 1.00 0.00 O ATOM 0 H SER B 106 -3.422 -2.379 3.383 1.00 0.00 H new ATOM 0 HA SER B 106 -2.592 -3.975 1.127 1.00 0.00 H new ATOM 0 HB2 SER B 106 -4.258 -4.940 3.444 1.00 0.00 H new ATOM 0 HB3 SER B 106 -2.990 -5.776 2.570 1.00 0.00 H new ATOM 0 HG SER B 106 -2.286 -5.052 4.658 1.00 0.00 H new ATOM 1115 N TYR B 107 -5.728 -3.287 1.741 1.00 0.00 N ATOM 1116 CA TYR B 107 -7.075 -3.241 1.205 1.00 0.00 C ATOM 1117 C TYR B 107 -7.034 -2.517 -0.127 1.00 0.00 C ATOM 1118 O TYR B 107 -7.589 -2.962 -1.132 1.00 0.00 O ATOM 1119 CB TYR B 107 -7.947 -2.493 2.216 1.00 0.00 C ATOM 1120 CG TYR B 107 -9.433 -2.469 1.937 1.00 0.00 C ATOM 1121 CD1 TYR B 107 -9.986 -1.568 1.035 1.00 0.00 C ATOM 1122 CD2 TYR B 107 -10.285 -3.314 2.629 1.00 0.00 C ATOM 1123 CE1 TYR B 107 -11.351 -1.519 0.823 1.00 0.00 C ATOM 1124 CE2 TYR B 107 -11.648 -3.279 2.424 1.00 0.00 C ATOM 1125 CZ TYR B 107 -12.180 -2.380 1.521 1.00 0.00 C ATOM 1126 OH TYR B 107 -13.539 -2.343 1.308 1.00 0.00 O ATOM 0 H TYR B 107 -5.615 -2.772 2.614 1.00 0.00 H new ATOM 0 HA TYR B 107 -7.486 -4.237 1.043 1.00 0.00 H new ATOM 0 HB2 TYR B 107 -7.791 -2.940 3.198 1.00 0.00 H new ATOM 0 HB3 TYR B 107 -7.594 -1.463 2.275 1.00 0.00 H new ATOM 0 HD1 TYR B 107 -9.339 -0.896 0.491 1.00 0.00 H new ATOM 0 HD2 TYR B 107 -9.874 -4.013 3.342 1.00 0.00 H new ATOM 0 HE1 TYR B 107 -11.767 -0.814 0.118 1.00 0.00 H new ATOM 0 HE2 TYR B 107 -12.296 -3.951 2.967 1.00 0.00 H new ATOM 0 HH TYR B 107 -13.969 -3.063 1.814 1.00 0.00 H new ATOM 1136 N LEU B 108 -6.331 -1.401 -0.119 1.00 0.00 N ATOM 1137 CA LEU B 108 -6.126 -0.608 -1.307 1.00 0.00 C ATOM 1138 C LEU B 108 -5.443 -1.428 -2.393 1.00 0.00 C ATOM 1139 O LEU B 108 -5.856 -1.398 -3.550 1.00 0.00 O ATOM 1140 CB LEU B 108 -5.277 0.614 -0.968 1.00 0.00 C ATOM 1141 CG LEU B 108 -5.968 1.749 -0.197 1.00 0.00 C ATOM 1142 CD1 LEU B 108 -7.350 1.362 0.323 1.00 0.00 C ATOM 1143 CD2 LEU B 108 -5.078 2.214 0.946 1.00 0.00 C ATOM 0 H LEU B 108 -5.886 -1.021 0.716 1.00 0.00 H new ATOM 0 HA LEU B 108 -7.097 -0.284 -1.681 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -4.420 0.280 -0.383 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -4.887 1.025 -1.899 1.00 0.00 H new ATOM 0 HG LEU B 108 -6.122 2.567 -0.900 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -7.786 2.205 0.859 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -7.992 1.093 -0.516 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -7.260 0.511 0.998 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -5.574 3.019 1.489 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -4.891 1.381 1.624 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -4.131 2.576 0.546 1.00 0.00 H new ATOM 1155 N LEU B 109 -4.399 -2.155 -2.008 1.00 0.00 N ATOM 1156 CA LEU B 109 -3.676 -3.009 -2.934 1.00 0.00 C ATOM 1157 C LEU B 109 -4.612 -3.991 -3.606 1.00 0.00 C ATOM 1158 O LEU B 109 -4.620 -4.112 -4.826 1.00 0.00 O ATOM 1159 CB LEU B 109 -2.598 -3.799 -2.210 1.00 0.00 C ATOM 1160 CG LEU B 109 -1.341 -4.071 -3.037 1.00 0.00 C ATOM 1161 CD1 LEU B 109 -0.767 -2.774 -3.573 1.00 0.00 C ATOM 1162 CD2 LEU B 109 -0.309 -4.805 -2.202 1.00 0.00 C ATOM 0 H LEU B 109 -4.036 -2.167 -1.055 1.00 0.00 H new ATOM 0 HA LEU B 109 -3.221 -2.360 -3.683 1.00 0.00 H new ATOM 0 HB2 LEU B 109 -2.313 -3.257 -1.308 1.00 0.00 H new ATOM 0 HB3 LEU B 109 -3.019 -4.752 -1.889 1.00 0.00 H new ATOM 0 HG LEU B 109 -1.613 -4.701 -3.884 1.00 0.00 H new ATOM 0 HD11 LEU B 109 0.127 -2.987 -4.159 1.00 0.00 H new ATOM 0 HD12 LEU B 109 -1.507 -2.282 -4.205 1.00 0.00 H new ATOM 0 HD13 LEU B 109 -0.508 -2.119 -2.741 1.00 0.00 H new ATOM 0 HD21 LEU B 109 0.580 -4.992 -2.804 1.00 0.00 H new ATOM 0 HD22 LEU B 109 -0.041 -4.197 -1.338 1.00 0.00 H new ATOM 0 HD23 LEU B 109 -0.724 -5.754 -1.863 1.00 0.00 H new ATOM 1174 N ALA B 110 -5.401 -4.695 -2.805 1.00 0.00 N ATOM 1175 CA ALA B 110 -6.277 -5.723 -3.335 1.00 0.00 C ATOM 1176 C ALA B 110 -7.315 -5.131 -4.276 1.00 0.00 C ATOM 1177 O ALA B 110 -7.622 -5.707 -5.320 1.00 0.00 O ATOM 1178 CB ALA B 110 -6.965 -6.480 -2.222 1.00 0.00 C ATOM 0 H ALA B 110 -5.450 -4.572 -1.794 1.00 0.00 H new ATOM 0 HA ALA B 110 -5.655 -6.419 -3.898 1.00 0.00 H new ATOM 0 HB1 ALA B 110 -7.615 -7.244 -2.649 1.00 0.00 H new ATOM 0 HB2 ALA B 110 -6.216 -6.954 -1.587 1.00 0.00 H new ATOM 0 HB3 ALA B 110 -7.561 -5.789 -1.626 1.00 0.00 H new ATOM 1184 N ALA B 111 -7.848 -3.978 -3.902 1.00 0.00 N ATOM 1185 CA ALA B 111 -8.833 -3.294 -4.721 1.00 0.00 C ATOM 1186 C ALA B 111 -8.218 -2.857 -6.044 1.00 0.00 C ATOM 1187 O ALA B 111 -8.879 -2.871 -7.081 1.00 0.00 O ATOM 1188 CB ALA B 111 -9.419 -2.119 -3.958 1.00 0.00 C ATOM 0 H ALA B 111 -7.613 -3.496 -3.034 1.00 0.00 H new ATOM 0 HA ALA B 111 -9.646 -3.982 -4.952 1.00 0.00 H new ATOM 0 HB1 ALA B 111 -10.157 -1.612 -4.580 1.00 0.00 H new ATOM 0 HB2 ALA B 111 -9.898 -2.479 -3.048 1.00 0.00 H new ATOM 0 HB3 ALA B 111 -8.623 -1.421 -3.698 1.00 0.00 H new ATOM 1194 N LEU B 112 -6.945 -2.501 -6.001 1.00 0.00 N ATOM 1195 CA LEU B 112 -6.195 -2.186 -7.207 1.00 0.00 C ATOM 1196 C LEU B 112 -5.929 -3.451 -7.999 1.00 0.00 C ATOM 1197 O LEU B 112 -5.973 -3.454 -9.230 1.00 0.00 O ATOM 1198 CB LEU B 112 -4.866 -1.522 -6.859 1.00 0.00 C ATOM 1199 CG LEU B 112 -4.842 -0.008 -7.008 1.00 0.00 C ATOM 1200 CD1 LEU B 112 -5.895 0.644 -6.134 1.00 0.00 C ATOM 1201 CD2 LEU B 112 -3.469 0.526 -6.674 1.00 0.00 C ATOM 0 H LEU B 112 -6.406 -2.422 -5.139 1.00 0.00 H new ATOM 0 HA LEU B 112 -6.790 -1.496 -7.806 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -4.610 -1.774 -5.830 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.088 -1.946 -7.494 1.00 0.00 H new ATOM 0 HG LEU B 112 -5.072 0.237 -8.045 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -5.854 1.726 -6.261 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -6.882 0.282 -6.422 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -5.707 0.394 -5.090 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -3.464 1.610 -6.784 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -3.217 0.264 -5.646 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.734 0.089 -7.350 1.00 0.00 H new ATOM 1213 N GLY B 113 -5.650 -4.527 -7.270 1.00 0.00 N ATOM 1214 CA GLY B 113 -5.383 -5.810 -7.882 1.00 0.00 C ATOM 1215 C GLY B 113 -6.570 -6.317 -8.664 1.00 0.00 C ATOM 1216 O GLY B 113 -6.429 -7.128 -9.580 1.00 0.00 O ATOM 0 H GLY B 113 -5.604 -4.528 -6.251 1.00 0.00 H new ATOM 0 HA2 GLY B 113 -4.521 -5.724 -8.544 1.00 0.00 H new ATOM 0 HA3 GLY B 113 -5.121 -6.533 -7.110 1.00 0.00 H new ATOM 1220 N GLY B 114 -7.743 -5.832 -8.300 1.00 0.00 N ATOM 1221 CA GLY B 114 -8.937 -6.201 -9.007 1.00 0.00 C ATOM 1222 C GLY B 114 -10.072 -6.580 -8.085 1.00 0.00 C ATOM 1223 O GLY B 114 -11.135 -6.992 -8.549 1.00 0.00 O ATOM 0 H GLY B 114 -7.886 -5.187 -7.523 1.00 0.00 H new ATOM 0 HA2 GLY B 114 -9.251 -5.370 -9.639 1.00 0.00 H new ATOM 0 HA3 GLY B 114 -8.717 -7.039 -9.668 1.00 0.00 H new ATOM 1227 N ASN B 115 -9.876 -6.440 -6.779 1.00 0.00 N ATOM 1228 CA ASN B 115 -10.912 -6.792 -5.844 1.00 0.00 C ATOM 1229 C ASN B 115 -11.324 -5.549 -5.105 1.00 0.00 C ATOM 1230 O ASN B 115 -10.774 -5.222 -4.063 1.00 0.00 O ATOM 1231 CB ASN B 115 -10.418 -7.861 -4.882 1.00 0.00 C ATOM 1232 CG ASN B 115 -11.478 -8.298 -3.895 1.00 0.00 C ATOM 1233 OD1 ASN B 115 -12.674 -8.260 -4.186 1.00 0.00 O ATOM 1234 ND2 ASN B 115 -11.043 -8.724 -2.725 1.00 0.00 N ATOM 0 H ASN B 115 -9.016 -6.089 -6.357 1.00 0.00 H new ATOM 0 HA ASN B 115 -11.772 -7.203 -6.373 1.00 0.00 H new ATOM 0 HB2 ASN B 115 -10.079 -8.727 -5.451 1.00 0.00 H new ATOM 0 HB3 ASN B 115 -9.555 -7.481 -4.336 1.00 0.00 H new ATOM 0 HD21 ASN B 115 -11.707 -9.039 -2.018 1.00 0.00 H new ATOM 0 HD22 ASN B 115 -10.042 -8.738 -2.527 1.00 0.00 H new ATOM 1241 N SER B 116 -12.319 -4.879 -5.650 1.00 0.00 N ATOM 1242 CA SER B 116 -12.685 -3.531 -5.233 1.00 0.00 C ATOM 1243 C SER B 116 -13.456 -3.562 -3.918 1.00 0.00 C ATOM 1244 O SER B 116 -14.234 -2.665 -3.592 1.00 0.00 O ATOM 1245 CB SER B 116 -13.516 -2.867 -6.316 1.00 0.00 C ATOM 1246 OG SER B 116 -13.368 -3.550 -7.554 1.00 0.00 O ATOM 0 H SER B 116 -12.902 -5.252 -6.399 1.00 0.00 H new ATOM 0 HA SER B 116 -11.773 -2.954 -5.077 1.00 0.00 H new ATOM 0 HB2 SER B 116 -14.566 -2.860 -6.022 1.00 0.00 H new ATOM 0 HB3 SER B 116 -13.210 -1.827 -6.430 1.00 0.00 H new ATOM 0 HG SER B 116 -13.912 -3.108 -8.239 1.00 0.00 H new ATOM 1252 N SER B 117 -13.193 -4.612 -3.179 1.00 0.00 N ATOM 1253 CA SER B 117 -13.827 -4.886 -1.904 1.00 0.00 C ATOM 1254 C SER B 117 -13.096 -6.039 -1.230 1.00 0.00 C ATOM 1255 O SER B 117 -13.608 -7.151 -1.084 1.00 0.00 O ATOM 1256 CB SER B 117 -15.297 -5.196 -2.099 1.00 0.00 C ATOM 1257 OG SER B 117 -15.956 -5.405 -0.862 1.00 0.00 O ATOM 0 H SER B 117 -12.513 -5.322 -3.452 1.00 0.00 H new ATOM 0 HA SER B 117 -13.767 -4.008 -1.262 1.00 0.00 H new ATOM 0 HB2 SER B 117 -15.775 -4.374 -2.632 1.00 0.00 H new ATOM 0 HB3 SER B 117 -15.402 -6.084 -2.722 1.00 0.00 H new ATOM 0 HG SER B 117 -16.902 -5.601 -1.025 1.00 0.00 H new ATOM 1263 N PRO B 118 -11.862 -5.746 -0.840 1.00 0.00 N ATOM 1264 CA PRO B 118 -10.929 -6.689 -0.228 1.00 0.00 C ATOM 1265 C PRO B 118 -11.390 -7.113 1.150 1.00 0.00 C ATOM 1266 O PRO B 118 -12.115 -6.380 1.821 1.00 0.00 O ATOM 1267 CB PRO B 118 -9.632 -5.876 -0.121 1.00 0.00 C ATOM 1268 CG PRO B 118 -9.835 -4.751 -1.069 1.00 0.00 C ATOM 1269 CD PRO B 118 -11.278 -4.424 -0.966 1.00 0.00 C ATOM 0 HA PRO B 118 -10.828 -7.609 -0.804 1.00 0.00 H new ATOM 0 HB2 PRO B 118 -9.468 -5.517 0.895 1.00 0.00 H new ATOM 0 HB3 PRO B 118 -8.762 -6.474 -0.392 1.00 0.00 H new ATOM 0 HG2 PRO B 118 -9.215 -3.894 -0.804 1.00 0.00 H new ATOM 0 HG3 PRO B 118 -9.566 -5.037 -2.086 1.00 0.00 H new ATOM 0 HD2 PRO B 118 -11.496 -3.795 -0.103 1.00 0.00 H new ATOM 0 HD3 PRO B 118 -11.643 -3.896 -1.847 1.00 0.00 H new ATOM 1277 N SER B 119 -10.976 -8.286 1.578 1.00 0.00 N ATOM 1278 CA SER B 119 -11.343 -8.747 2.898 1.00 0.00 C ATOM 1279 C SER B 119 -10.114 -9.034 3.732 1.00 0.00 C ATOM 1280 O SER B 119 -8.991 -8.857 3.265 1.00 0.00 O ATOM 1281 CB SER B 119 -12.258 -9.968 2.828 1.00 0.00 C ATOM 1282 OG SER B 119 -11.606 -11.074 2.218 1.00 0.00 O ATOM 0 H SER B 119 -10.394 -8.929 1.041 1.00 0.00 H new ATOM 0 HA SER B 119 -11.901 -7.947 3.385 1.00 0.00 H new ATOM 0 HB2 SER B 119 -12.578 -10.242 3.833 1.00 0.00 H new ATOM 0 HB3 SER B 119 -13.157 -9.718 2.264 1.00 0.00 H new ATOM 0 HG SER B 119 -10.896 -10.749 1.626 1.00 0.00 H new ATOM 1288 N ALA B 120 -10.329 -9.489 4.947 1.00 0.00 N ATOM 1289 CA ALA B 120 -9.253 -9.644 5.907 1.00 0.00 C ATOM 1290 C ALA B 120 -8.292 -10.695 5.415 1.00 0.00 C ATOM 1291 O ALA B 120 -7.076 -10.570 5.536 1.00 0.00 O ATOM 1292 CB ALA B 120 -9.813 -10.034 7.255 1.00 0.00 C ATOM 0 H ALA B 120 -11.247 -9.761 5.298 1.00 0.00 H new ATOM 0 HA ALA B 120 -8.724 -8.697 6.014 1.00 0.00 H new ATOM 0 HB1 ALA B 120 -8.997 -10.148 7.969 1.00 0.00 H new ATOM 0 HB2 ALA B 120 -10.495 -9.258 7.604 1.00 0.00 H new ATOM 0 HB3 ALA B 120 -10.352 -10.977 7.166 1.00 0.00 H new ATOM 1298 N LYS B 121 -8.874 -11.720 4.834 1.00 0.00 N ATOM 1299 CA LYS B 121 -8.129 -12.799 4.234 1.00 0.00 C ATOM 1300 C LYS B 121 -7.320 -12.304 3.041 1.00 0.00 C ATOM 1301 O LYS B 121 -6.224 -12.794 2.786 1.00 0.00 O ATOM 1302 CB LYS B 121 -9.091 -13.899 3.841 1.00 0.00 C ATOM 1303 CG LYS B 121 -9.462 -14.819 4.997 1.00 0.00 C ATOM 1304 CD LYS B 121 -10.229 -14.082 6.063 1.00 0.00 C ATOM 1305 CE LYS B 121 -10.410 -14.915 7.320 1.00 0.00 C ATOM 1306 NZ LYS B 121 -9.113 -15.203 7.999 1.00 0.00 N ATOM 0 H LYS B 121 -9.886 -11.827 4.765 1.00 0.00 H new ATOM 0 HA LYS B 121 -7.414 -13.197 4.954 1.00 0.00 H new ATOM 0 HB2 LYS B 121 -9.999 -13.451 3.437 1.00 0.00 H new ATOM 0 HB3 LYS B 121 -8.646 -14.492 3.042 1.00 0.00 H new ATOM 0 HG2 LYS B 121 -10.061 -15.650 4.625 1.00 0.00 H new ATOM 0 HG3 LYS B 121 -8.557 -15.247 5.428 1.00 0.00 H new ATOM 0 HD2 LYS B 121 -9.705 -13.160 6.313 1.00 0.00 H new ATOM 0 HD3 LYS B 121 -11.207 -13.798 5.674 1.00 0.00 H new ATOM 0 HE2 LYS B 121 -11.070 -14.389 8.010 1.00 0.00 H new ATOM 0 HE3 LYS B 121 -10.900 -15.854 7.064 1.00 0.00 H new ATOM 0 HZ1 LYS B 121 -9.295 -15.639 8.925 1.00 0.00 H new ATOM 0 HZ2 LYS B 121 -8.552 -15.855 7.414 1.00 0.00 H new ATOM 0 HZ3 LYS B 121 -8.586 -14.316 8.132 1.00 0.00 H new ATOM 1320 N ASP B 122 -7.837 -11.299 2.335 1.00 0.00 N ATOM 1321 CA ASP B 122 -7.090 -10.709 1.224 1.00 0.00 C ATOM 1322 C ASP B 122 -5.945 -9.885 1.777 1.00 0.00 C ATOM 1323 O ASP B 122 -4.830 -9.950 1.272 1.00 0.00 O ATOM 1324 CB ASP B 122 -7.968 -9.803 0.348 1.00 0.00 C ATOM 1325 CG ASP B 122 -9.084 -10.537 -0.358 1.00 0.00 C ATOM 1326 OD1 ASP B 122 -8.822 -11.153 -1.410 1.00 0.00 O ATOM 1327 OD2 ASP B 122 -10.232 -10.474 0.120 1.00 0.00 O ATOM 0 H ASP B 122 -8.752 -10.883 2.507 1.00 0.00 H new ATOM 0 HA ASP B 122 -6.724 -11.527 0.603 1.00 0.00 H new ATOM 0 HB2 ASP B 122 -8.398 -9.018 0.970 1.00 0.00 H new ATOM 0 HB3 ASP B 122 -7.340 -9.313 -0.396 1.00 0.00 H new ATOM 1332 N ILE B 123 -6.229 -9.110 2.818 1.00 0.00 N ATOM 1333 CA ILE B 123 -5.199 -8.337 3.500 1.00 0.00 C ATOM 1334 C ILE B 123 -4.091 -9.267 3.947 1.00 0.00 C ATOM 1335 O ILE B 123 -2.912 -9.044 3.661 1.00 0.00 O ATOM 1336 CB ILE B 123 -5.745 -7.621 4.751 1.00 0.00 C ATOM 1337 CG1 ILE B 123 -7.020 -6.849 4.432 1.00 0.00 C ATOM 1338 CG2 ILE B 123 -4.691 -6.690 5.328 1.00 0.00 C ATOM 1339 CD1 ILE B 123 -6.852 -5.815 3.351 1.00 0.00 C ATOM 0 H ILE B 123 -7.165 -9.001 3.208 1.00 0.00 H new ATOM 0 HA ILE B 123 -4.836 -7.588 2.796 1.00 0.00 H new ATOM 0 HB ILE B 123 -5.990 -8.380 5.494 1.00 0.00 H new ATOM 0 HG12 ILE B 123 -7.794 -7.554 4.130 1.00 0.00 H new ATOM 0 HG13 ILE B 123 -7.373 -6.358 5.339 1.00 0.00 H new ATOM 0 HG21 ILE B 123 -5.090 -6.191 6.211 1.00 0.00 H new ATOM 0 HG22 ILE B 123 -3.809 -7.267 5.605 1.00 0.00 H new ATOM 0 HG23 ILE B 123 -4.417 -5.944 4.582 1.00 0.00 H new ATOM 0 HD11 ILE B 123 -7.802 -5.308 3.181 1.00 0.00 H new ATOM 0 HD12 ILE B 123 -6.102 -5.086 3.658 1.00 0.00 H new ATOM 0 HD13 ILE B 123 -6.530 -6.301 2.430 1.00 0.00 H new ATOM 1351 N LYS B 124 -4.509 -10.336 4.618 1.00 0.00 N ATOM 1352 CA LYS B 124 -3.597 -11.310 5.168 1.00 0.00 C ATOM 1353 C LYS B 124 -2.799 -11.939 4.052 1.00 0.00 C ATOM 1354 O LYS B 124 -1.626 -12.217 4.206 1.00 0.00 O ATOM 1355 CB LYS B 124 -4.378 -12.388 5.918 1.00 0.00 C ATOM 1356 CG LYS B 124 -3.516 -13.266 6.806 1.00 0.00 C ATOM 1357 CD LYS B 124 -3.061 -12.519 8.042 1.00 0.00 C ATOM 1358 CE LYS B 124 -4.222 -12.340 8.996 1.00 0.00 C ATOM 1359 NZ LYS B 124 -4.679 -13.635 9.569 1.00 0.00 N ATOM 0 H LYS B 124 -5.493 -10.544 4.791 1.00 0.00 H new ATOM 0 HA LYS B 124 -2.919 -10.816 5.863 1.00 0.00 H new ATOM 0 HB2 LYS B 124 -5.143 -11.909 6.530 1.00 0.00 H new ATOM 0 HB3 LYS B 124 -4.896 -13.017 5.194 1.00 0.00 H new ATOM 0 HG2 LYS B 124 -4.078 -14.152 7.100 1.00 0.00 H new ATOM 0 HG3 LYS B 124 -2.647 -13.611 6.246 1.00 0.00 H new ATOM 0 HD2 LYS B 124 -2.257 -13.068 8.533 1.00 0.00 H new ATOM 0 HD3 LYS B 124 -2.657 -11.546 7.761 1.00 0.00 H new ATOM 0 HE2 LYS B 124 -3.927 -11.670 9.804 1.00 0.00 H new ATOM 0 HE3 LYS B 124 -5.051 -11.863 8.473 1.00 0.00 H new ATOM 0 HZ1 LYS B 124 -5.679 -13.787 9.329 1.00 0.00 H new ATOM 0 HZ2 LYS B 124 -4.107 -14.410 9.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 124 -4.570 -13.615 10.603 1.00 0.00 H new ATOM 1373 N LYS B 125 -3.445 -12.128 2.913 1.00 0.00 N ATOM 1374 CA LYS B 125 -2.827 -12.766 1.790 1.00 0.00 C ATOM 1375 C LYS B 125 -1.785 -11.840 1.136 1.00 0.00 C ATOM 1376 O LYS B 125 -0.656 -12.268 0.841 1.00 0.00 O ATOM 1377 CB LYS B 125 -3.955 -13.222 0.853 1.00 0.00 C ATOM 1378 CG LYS B 125 -3.663 -13.137 -0.617 1.00 0.00 C ATOM 1379 CD LYS B 125 -4.288 -11.911 -1.232 1.00 0.00 C ATOM 1380 CE LYS B 125 -5.748 -12.164 -1.566 1.00 0.00 C ATOM 1381 NZ LYS B 125 -6.352 -11.055 -2.346 1.00 0.00 N ATOM 0 H LYS B 125 -4.410 -11.840 2.753 1.00 0.00 H new ATOM 0 HA LYS B 125 -2.253 -13.645 2.084 1.00 0.00 H new ATOM 0 HB2 LYS B 125 -4.206 -14.255 1.094 1.00 0.00 H new ATOM 0 HB3 LYS B 125 -4.840 -12.621 1.063 1.00 0.00 H new ATOM 0 HG2 LYS B 125 -2.585 -13.115 -0.775 1.00 0.00 H new ATOM 0 HG3 LYS B 125 -4.040 -14.029 -1.117 1.00 0.00 H new ATOM 0 HD2 LYS B 125 -4.208 -11.071 -0.542 1.00 0.00 H new ATOM 0 HD3 LYS B 125 -3.745 -11.634 -2.136 1.00 0.00 H new ATOM 0 HE2 LYS B 125 -5.832 -13.091 -2.133 1.00 0.00 H new ATOM 0 HE3 LYS B 125 -6.310 -12.303 -0.642 1.00 0.00 H new ATOM 0 HZ1 LYS B 125 -7.342 -10.924 -2.055 1.00 0.00 H new ATOM 0 HZ2 LYS B 125 -5.821 -10.178 -2.171 1.00 0.00 H new ATOM 0 HZ3 LYS B 125 -6.317 -11.284 -3.360 1.00 0.00 H new ATOM 1395 N ILE B 126 -2.145 -10.563 0.963 1.00 0.00 N ATOM 1396 CA ILE B 126 -1.201 -9.553 0.478 1.00 0.00 C ATOM 1397 C ILE B 126 0.048 -9.514 1.357 1.00 0.00 C ATOM 1398 O ILE B 126 1.170 -9.614 0.858 1.00 0.00 O ATOM 1399 CB ILE B 126 -1.838 -8.128 0.407 1.00 0.00 C ATOM 1400 CG1 ILE B 126 -2.467 -7.874 -0.966 1.00 0.00 C ATOM 1401 CG2 ILE B 126 -0.819 -7.033 0.716 1.00 0.00 C ATOM 1402 CD1 ILE B 126 -3.757 -8.616 -1.199 1.00 0.00 C ATOM 0 H ILE B 126 -3.082 -10.206 1.152 1.00 0.00 H new ATOM 0 HA ILE B 126 -0.925 -9.845 -0.535 1.00 0.00 H new ATOM 0 HB ILE B 126 -2.617 -8.094 1.168 1.00 0.00 H new ATOM 0 HG12 ILE B 126 -2.650 -6.805 -1.078 1.00 0.00 H new ATOM 0 HG13 ILE B 126 -1.753 -8.158 -1.739 1.00 0.00 H new ATOM 0 HG21 ILE B 126 -1.303 -6.058 0.656 1.00 0.00 H new ATOM 0 HG22 ILE B 126 -0.421 -7.179 1.720 1.00 0.00 H new ATOM 0 HG23 ILE B 126 -0.005 -7.079 -0.007 1.00 0.00 H new ATOM 0 HD11 ILE B 126 -4.137 -8.382 -2.193 1.00 0.00 H new ATOM 0 HD12 ILE B 126 -3.579 -9.689 -1.122 1.00 0.00 H new ATOM 0 HD13 ILE B 126 -4.490 -8.315 -0.450 1.00 0.00 H new ATOM 1414 N LEU B 127 -0.143 -9.393 2.665 1.00 0.00 N ATOM 1415 CA LEU B 127 0.988 -9.254 3.569 1.00 0.00 C ATOM 1416 C LEU B 127 1.687 -10.590 3.812 1.00 0.00 C ATOM 1417 O LEU B 127 2.879 -10.619 4.101 1.00 0.00 O ATOM 1418 CB LEU B 127 0.563 -8.584 4.885 1.00 0.00 C ATOM 1419 CG LEU B 127 -0.689 -9.143 5.565 1.00 0.00 C ATOM 1420 CD1 LEU B 127 -0.359 -10.357 6.419 1.00 0.00 C ATOM 1421 CD2 LEU B 127 -1.352 -8.063 6.402 1.00 0.00 C ATOM 0 H LEU B 127 -1.057 -9.388 3.117 1.00 0.00 H new ATOM 0 HA LEU B 127 1.716 -8.601 3.088 1.00 0.00 H new ATOM 0 HB2 LEU B 127 1.393 -8.656 5.588 1.00 0.00 H new ATOM 0 HB3 LEU B 127 0.401 -7.524 4.691 1.00 0.00 H new ATOM 0 HG LEU B 127 -1.384 -9.466 4.789 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -1.269 -10.730 6.888 1.00 0.00 H new ATOM 0 HD12 LEU B 127 0.072 -11.137 5.791 1.00 0.00 H new ATOM 0 HD13 LEU B 127 0.358 -10.075 7.191 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -2.242 -8.470 6.882 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -0.655 -7.715 7.165 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -1.635 -7.228 5.761 1.00 0.00 H new ATOM 1433 N ASP B 128 0.960 -11.690 3.669 1.00 0.00 N ATOM 1434 CA ASP B 128 1.550 -13.020 3.829 1.00 0.00 C ATOM 1435 C ASP B 128 2.542 -13.287 2.710 1.00 0.00 C ATOM 1436 O ASP B 128 3.553 -13.961 2.913 1.00 0.00 O ATOM 1437 CB ASP B 128 0.471 -14.103 3.833 1.00 0.00 C ATOM 1438 CG ASP B 128 1.006 -15.467 4.214 1.00 0.00 C ATOM 1439 OD1 ASP B 128 1.092 -15.757 5.427 1.00 0.00 O ATOM 1440 OD2 ASP B 128 1.329 -16.261 3.306 1.00 0.00 O ATOM 0 H ASP B 128 -0.035 -11.692 3.444 1.00 0.00 H new ATOM 0 HA ASP B 128 2.068 -13.048 4.788 1.00 0.00 H new ATOM 0 HB2 ASP B 128 -0.318 -13.820 4.530 1.00 0.00 H new ATOM 0 HB3 ASP B 128 0.017 -14.160 2.844 1.00 0.00 H new ATOM 1445 N SER B 129 2.245 -12.746 1.531 1.00 0.00 N ATOM 1446 CA SER B 129 3.137 -12.853 0.378 1.00 0.00 C ATOM 1447 C SER B 129 4.565 -12.403 0.731 1.00 0.00 C ATOM 1448 O SER B 129 5.541 -13.055 0.357 1.00 0.00 O ATOM 1449 CB SER B 129 2.578 -12.010 -0.776 1.00 0.00 C ATOM 1450 OG SER B 129 3.318 -12.186 -1.975 1.00 0.00 O ATOM 0 H SER B 129 1.387 -12.225 1.348 1.00 0.00 H new ATOM 0 HA SER B 129 3.190 -13.898 0.074 1.00 0.00 H new ATOM 0 HB2 SER B 129 1.537 -12.281 -0.950 1.00 0.00 H new ATOM 0 HB3 SER B 129 2.591 -10.957 -0.494 1.00 0.00 H new ATOM 0 HG SER B 129 3.351 -11.339 -2.467 1.00 0.00 H new ATOM 1456 N VAL B 130 4.684 -11.299 1.468 1.00 0.00 N ATOM 1457 CA VAL B 130 5.999 -10.778 1.853 1.00 0.00 C ATOM 1458 C VAL B 130 6.367 -11.142 3.290 1.00 0.00 C ATOM 1459 O VAL B 130 7.486 -10.896 3.733 1.00 0.00 O ATOM 1460 CB VAL B 130 6.091 -9.253 1.678 1.00 0.00 C ATOM 1461 CG1 VAL B 130 6.226 -8.898 0.206 1.00 0.00 C ATOM 1462 CG2 VAL B 130 4.879 -8.565 2.290 1.00 0.00 C ATOM 0 H VAL B 130 3.894 -10.751 1.809 1.00 0.00 H new ATOM 0 HA VAL B 130 6.711 -11.253 1.179 1.00 0.00 H new ATOM 0 HB VAL B 130 6.979 -8.899 2.202 1.00 0.00 H new ATOM 0 HG11 VAL B 130 6.290 -7.815 0.097 1.00 0.00 H new ATOM 0 HG12 VAL B 130 7.128 -9.357 -0.198 1.00 0.00 H new ATOM 0 HG13 VAL B 130 5.357 -9.267 -0.338 1.00 0.00 H new ATOM 0 HG21 VAL B 130 4.966 -7.487 2.154 1.00 0.00 H new ATOM 0 HG22 VAL B 130 3.973 -8.921 1.800 1.00 0.00 H new ATOM 0 HG23 VAL B 130 4.830 -8.794 3.355 1.00 0.00 H new ATOM 1472 N GLY B 131 5.425 -11.739 4.003 1.00 0.00 N ATOM 1473 CA GLY B 131 5.681 -12.171 5.366 1.00 0.00 C ATOM 1474 C GLY B 131 5.515 -11.058 6.385 1.00 0.00 C ATOM 1475 O GLY B 131 6.366 -10.872 7.253 1.00 0.00 O ATOM 0 H GLY B 131 4.483 -11.934 3.663 1.00 0.00 H new ATOM 0 HA2 GLY B 131 5.003 -12.988 5.615 1.00 0.00 H new ATOM 0 HA3 GLY B 131 6.695 -12.567 5.431 1.00 0.00 H new ATOM 1479 N ILE B 132 4.426 -10.313 6.274 1.00 0.00 N ATOM 1480 CA ILE B 132 4.119 -9.259 7.228 1.00 0.00 C ATOM 1481 C ILE B 132 3.175 -9.777 8.310 1.00 0.00 C ATOM 1482 O ILE B 132 2.208 -10.477 8.016 1.00 0.00 O ATOM 1483 CB ILE B 132 3.532 -8.025 6.527 1.00 0.00 C ATOM 1484 CG1 ILE B 132 4.665 -7.413 5.739 1.00 0.00 C ATOM 1485 CG2 ILE B 132 2.953 -7.030 7.531 1.00 0.00 C ATOM 1486 CD1 ILE B 132 4.356 -6.060 5.145 1.00 0.00 C ATOM 0 H ILE B 132 3.737 -10.420 5.529 1.00 0.00 H new ATOM 0 HA ILE B 132 5.050 -8.952 7.704 1.00 0.00 H new ATOM 0 HB ILE B 132 2.703 -8.304 5.876 1.00 0.00 H new ATOM 0 HG12 ILE B 132 5.534 -7.320 6.390 1.00 0.00 H new ATOM 0 HG13 ILE B 132 4.941 -8.095 4.934 1.00 0.00 H new ATOM 0 HG21 ILE B 132 2.547 -6.170 6.998 1.00 0.00 H new ATOM 0 HG22 ILE B 132 2.159 -7.510 8.103 1.00 0.00 H new ATOM 0 HG23 ILE B 132 3.739 -6.698 8.209 1.00 0.00 H new ATOM 0 HD11 ILE B 132 5.225 -5.696 4.597 1.00 0.00 H new ATOM 0 HD12 ILE B 132 3.508 -6.146 4.465 1.00 0.00 H new ATOM 0 HD13 ILE B 132 4.111 -5.359 5.943 1.00 0.00 H new ATOM 1498 N GLU B 133 3.477 -9.461 9.559 1.00 0.00 N ATOM 1499 CA GLU B 133 2.671 -9.936 10.676 1.00 0.00 C ATOM 1500 C GLU B 133 1.417 -9.093 10.844 1.00 0.00 C ATOM 1501 O GLU B 133 1.477 -7.860 10.841 1.00 0.00 O ATOM 1502 CB GLU B 133 3.494 -9.939 11.958 1.00 0.00 C ATOM 1503 CG GLU B 133 4.644 -10.924 11.914 1.00 0.00 C ATOM 1504 CD GLU B 133 5.448 -10.937 13.192 1.00 0.00 C ATOM 1505 OE1 GLU B 133 5.022 -11.612 14.154 1.00 0.00 O ATOM 1506 OE2 GLU B 133 6.499 -10.263 13.245 1.00 0.00 O ATOM 0 H GLU B 133 4.271 -8.880 9.826 1.00 0.00 H new ATOM 0 HA GLU B 133 2.359 -10.958 10.460 1.00 0.00 H new ATOM 0 HB2 GLU B 133 3.886 -8.937 12.135 1.00 0.00 H new ATOM 0 HB3 GLU B 133 2.846 -10.181 12.800 1.00 0.00 H new ATOM 0 HG2 GLU B 133 4.254 -11.924 11.725 1.00 0.00 H new ATOM 0 HG3 GLU B 133 5.299 -10.674 11.080 1.00 0.00 H new ATOM 1513 N ALA B 134 0.284 -9.769 10.977 1.00 0.00 N ATOM 1514 CA ALA B 134 -1.007 -9.108 11.051 1.00 0.00 C ATOM 1515 C ALA B 134 -1.958 -9.845 11.982 1.00 0.00 C ATOM 1516 O ALA B 134 -1.824 -11.054 12.195 1.00 0.00 O ATOM 1517 CB ALA B 134 -1.608 -9.051 9.665 1.00 0.00 C ATOM 0 H ALA B 134 0.236 -10.786 11.036 1.00 0.00 H new ATOM 0 HA ALA B 134 -0.858 -8.104 11.447 1.00 0.00 H new ATOM 0 HB1 ALA B 134 -2.578 -8.556 9.709 1.00 0.00 H new ATOM 0 HB2 ALA B 134 -0.946 -8.492 9.004 1.00 0.00 H new ATOM 0 HB3 ALA B 134 -1.734 -10.063 9.281 1.00 0.00 H new ATOM 1523 N ASP B 135 -2.916 -9.114 12.541 1.00 0.00 N ATOM 1524 CA ASP B 135 -3.982 -9.734 13.314 1.00 0.00 C ATOM 1525 C ASP B 135 -5.253 -9.805 12.474 1.00 0.00 C ATOM 1526 O ASP B 135 -5.666 -8.808 11.840 1.00 0.00 O ATOM 1527 CB ASP B 135 -4.248 -8.978 14.612 1.00 0.00 C ATOM 1528 CG ASP B 135 -3.057 -8.955 15.548 1.00 0.00 C ATOM 1529 OD1 ASP B 135 -2.857 -9.941 16.287 1.00 0.00 O ATOM 1530 OD2 ASP B 135 -2.340 -7.935 15.569 1.00 0.00 O ATOM 0 H ASP B 135 -2.975 -8.098 12.473 1.00 0.00 H new ATOM 0 HA ASP B 135 -3.665 -10.742 13.580 1.00 0.00 H new ATOM 0 HB2 ASP B 135 -4.535 -7.953 14.375 1.00 0.00 H new ATOM 0 HB3 ASP B 135 -5.095 -9.436 15.124 1.00 0.00 H new ATOM 1535 N ASP B 136 -5.900 -10.968 12.524 1.00 0.00 N ATOM 1536 CA ASP B 136 -6.958 -11.317 11.583 1.00 0.00 C ATOM 1537 C ASP B 136 -8.224 -10.541 11.878 1.00 0.00 C ATOM 1538 O ASP B 136 -9.153 -10.511 11.076 1.00 0.00 O ATOM 1539 CB ASP B 136 -7.231 -12.820 11.625 1.00 0.00 C ATOM 1540 CG ASP B 136 -8.006 -13.319 10.417 1.00 0.00 C ATOM 1541 OD1 ASP B 136 -7.375 -13.537 9.356 1.00 0.00 O ATOM 1542 OD2 ASP B 136 -9.232 -13.514 10.519 1.00 0.00 O ATOM 0 H ASP B 136 -5.705 -11.691 13.216 1.00 0.00 H new ATOM 0 HA ASP B 136 -6.624 -11.049 10.581 1.00 0.00 H new ATOM 0 HB2 ASP B 136 -6.283 -13.354 11.687 1.00 0.00 H new ATOM 0 HB3 ASP B 136 -7.790 -13.057 12.531 1.00 0.00 H new ATOM 1547 N ASP B 137 -8.253 -9.893 13.023 1.00 0.00 N ATOM 1548 CA ASP B 137 -9.363 -9.044 13.361 1.00 0.00 C ATOM 1549 C ASP B 137 -9.052 -7.599 13.032 1.00 0.00 C ATOM 1550 O ASP B 137 -9.940 -6.828 12.677 1.00 0.00 O ATOM 1551 CB ASP B 137 -9.724 -9.175 14.837 1.00 0.00 C ATOM 1552 CG ASP B 137 -10.699 -8.104 15.294 1.00 0.00 C ATOM 1553 OD1 ASP B 137 -11.907 -8.213 14.996 1.00 0.00 O ATOM 1554 OD2 ASP B 137 -10.257 -7.146 15.960 1.00 0.00 O ATOM 0 H ASP B 137 -7.520 -9.941 13.731 1.00 0.00 H new ATOM 0 HA ASP B 137 -10.218 -9.365 12.766 1.00 0.00 H new ATOM 0 HB2 ASP B 137 -10.159 -10.158 15.015 1.00 0.00 H new ATOM 0 HB3 ASP B 137 -8.816 -9.115 15.437 1.00 0.00 H new ATOM 1559 N ARG B 138 -7.779 -7.247 13.109 1.00 0.00 N ATOM 1560 CA ARG B 138 -7.366 -5.868 12.909 1.00 0.00 C ATOM 1561 C ARG B 138 -7.618 -5.478 11.478 1.00 0.00 C ATOM 1562 O ARG B 138 -8.190 -4.421 11.177 1.00 0.00 O ATOM 1563 CB ARG B 138 -5.895 -5.692 13.228 1.00 0.00 C ATOM 1564 CG ARG B 138 -5.556 -6.109 14.628 1.00 0.00 C ATOM 1565 CD ARG B 138 -5.876 -5.031 15.645 1.00 0.00 C ATOM 1566 NE ARG B 138 -5.287 -5.342 16.945 1.00 0.00 N ATOM 1567 CZ ARG B 138 -5.916 -5.202 18.109 1.00 0.00 C ATOM 1568 NH1 ARG B 138 -7.181 -4.808 18.154 1.00 0.00 N ATOM 1569 NH2 ARG B 138 -5.272 -5.481 19.234 1.00 0.00 N ATOM 0 H ARG B 138 -7.016 -7.895 13.308 1.00 0.00 H new ATOM 0 HA ARG B 138 -7.943 -5.231 13.579 1.00 0.00 H new ATOM 0 HB2 ARG B 138 -5.302 -6.277 12.525 1.00 0.00 H new ATOM 0 HB3 ARG B 138 -5.619 -4.647 13.087 1.00 0.00 H new ATOM 0 HG2 ARG B 138 -6.107 -7.016 14.878 1.00 0.00 H new ATOM 0 HG3 ARG B 138 -4.496 -6.355 14.684 1.00 0.00 H new ATOM 0 HD2 ARG B 138 -5.500 -4.071 15.292 1.00 0.00 H new ATOM 0 HD3 ARG B 138 -6.957 -4.932 15.746 1.00 0.00 H new ATOM 0 HE ARG B 138 -4.328 -5.690 16.962 1.00 0.00 H new ATOM 0 HH11 ARG B 138 -7.684 -4.608 17.289 1.00 0.00 H new ATOM 0 HH12 ARG B 138 -7.651 -4.705 19.053 1.00 0.00 H new ATOM 0 HH21 ARG B 138 -4.304 -5.800 19.202 1.00 0.00 H new ATOM 0 HH22 ARG B 138 -5.745 -5.377 20.132 1.00 0.00 H new ATOM 1583 N LEU B 139 -7.213 -6.362 10.589 1.00 0.00 N ATOM 1584 CA LEU B 139 -7.423 -6.102 9.183 1.00 0.00 C ATOM 1585 C LEU B 139 -8.888 -6.247 8.812 1.00 0.00 C ATOM 1586 O LEU B 139 -9.385 -5.475 8.026 1.00 0.00 O ATOM 1587 CB LEU B 139 -6.533 -6.962 8.291 1.00 0.00 C ATOM 1588 CG LEU B 139 -6.045 -8.268 8.892 1.00 0.00 C ATOM 1589 CD1 LEU B 139 -7.218 -9.195 9.106 1.00 0.00 C ATOM 1590 CD2 LEU B 139 -4.996 -8.900 7.990 1.00 0.00 C ATOM 0 H LEU B 139 -6.749 -7.244 10.808 1.00 0.00 H new ATOM 0 HA LEU B 139 -7.132 -5.067 9.006 1.00 0.00 H new ATOM 0 HB2 LEU B 139 -7.081 -7.189 7.377 1.00 0.00 H new ATOM 0 HB3 LEU B 139 -5.663 -6.371 8.003 1.00 0.00 H new ATOM 0 HG LEU B 139 -5.579 -8.075 9.858 1.00 0.00 H new ATOM 0 HD11 LEU B 139 -6.867 -10.132 9.537 1.00 0.00 H new ATOM 0 HD12 LEU B 139 -7.932 -8.728 9.785 1.00 0.00 H new ATOM 0 HD13 LEU B 139 -7.703 -9.395 8.151 1.00 0.00 H new ATOM 0 HD21 LEU B 139 -4.653 -9.836 8.431 1.00 0.00 H new ATOM 0 HD22 LEU B 139 -5.430 -9.098 7.010 1.00 0.00 H new ATOM 0 HD23 LEU B 139 -4.152 -8.219 7.882 1.00 0.00 H new ATOM 1602 N ASN B 140 -9.589 -7.197 9.408 1.00 0.00 N ATOM 1603 CA ASN B 140 -11.021 -7.360 9.132 1.00 0.00 C ATOM 1604 C ASN B 140 -11.776 -6.124 9.606 1.00 0.00 C ATOM 1605 O ASN B 140 -12.816 -5.741 9.055 1.00 0.00 O ATOM 1606 CB ASN B 140 -11.551 -8.625 9.819 1.00 0.00 C ATOM 1607 CG ASN B 140 -13.041 -8.819 9.633 1.00 0.00 C ATOM 1608 OD1 ASN B 140 -13.488 -9.374 8.628 1.00 0.00 O ATOM 1609 ND2 ASN B 140 -13.813 -8.390 10.616 1.00 0.00 N ATOM 0 H ASN B 140 -9.204 -7.863 10.078 1.00 0.00 H new ATOM 0 HA ASN B 140 -11.174 -7.471 8.058 1.00 0.00 H new ATOM 0 HB2 ASN B 140 -11.025 -9.494 9.424 1.00 0.00 H new ATOM 0 HB3 ASN B 140 -11.327 -8.574 10.885 1.00 0.00 H new ATOM 0 HD21 ASN B 140 -14.824 -8.513 10.561 1.00 0.00 H new ATOM 0 HD22 ASN B 140 -13.398 -7.936 11.429 1.00 0.00 H new ATOM 1616 N LYS B 141 -11.194 -5.477 10.595 1.00 0.00 N ATOM 1617 CA LYS B 141 -11.731 -4.249 11.138 1.00 0.00 C ATOM 1618 C LYS B 141 -11.569 -3.135 10.119 1.00 0.00 C ATOM 1619 O LYS B 141 -12.534 -2.457 9.758 1.00 0.00 O ATOM 1620 CB LYS B 141 -11.006 -3.910 12.441 1.00 0.00 C ATOM 1621 CG LYS B 141 -10.929 -2.428 12.732 1.00 0.00 C ATOM 1622 CD LYS B 141 -10.190 -2.161 14.030 1.00 0.00 C ATOM 1623 CE LYS B 141 -10.140 -0.679 14.347 1.00 0.00 C ATOM 1624 NZ LYS B 141 -9.357 -0.406 15.581 1.00 0.00 N ATOM 0 H LYS B 141 -10.334 -5.790 11.045 1.00 0.00 H new ATOM 0 HA LYS B 141 -12.793 -4.367 11.355 1.00 0.00 H new ATOM 0 HB2 LYS B 141 -11.514 -4.407 13.268 1.00 0.00 H new ATOM 0 HB3 LYS B 141 -9.995 -4.315 12.399 1.00 0.00 H new ATOM 0 HG2 LYS B 141 -10.423 -1.919 11.911 1.00 0.00 H new ATOM 0 HG3 LYS B 141 -11.935 -2.014 12.792 1.00 0.00 H new ATOM 0 HD2 LYS B 141 -10.681 -2.692 14.845 1.00 0.00 H new ATOM 0 HD3 LYS B 141 -9.176 -2.553 13.960 1.00 0.00 H new ATOM 0 HE2 LYS B 141 -9.696 -0.142 13.508 1.00 0.00 H new ATOM 0 HE3 LYS B 141 -11.154 -0.298 14.468 1.00 0.00 H new ATOM 0 HZ1 LYS B 141 -9.345 0.617 15.765 1.00 0.00 H new ATOM 0 HZ2 LYS B 141 -9.795 -0.898 16.386 1.00 0.00 H new ATOM 0 HZ3 LYS B 141 -8.382 -0.746 15.456 1.00 0.00 H new ATOM 1638 N VAL B 142 -10.348 -2.979 9.621 1.00 0.00 N ATOM 1639 CA VAL B 142 -10.084 -1.975 8.604 1.00 0.00 C ATOM 1640 C VAL B 142 -10.889 -2.288 7.343 1.00 0.00 C ATOM 1641 O VAL B 142 -11.320 -1.383 6.638 1.00 0.00 O ATOM 1642 CB VAL B 142 -8.578 -1.859 8.295 1.00 0.00 C ATOM 1643 CG1 VAL B 142 -8.047 -3.067 7.556 1.00 0.00 C ATOM 1644 CG2 VAL B 142 -8.287 -0.586 7.530 1.00 0.00 C ATOM 0 H VAL B 142 -9.536 -3.529 9.902 1.00 0.00 H new ATOM 0 HA VAL B 142 -10.401 -1.006 8.989 1.00 0.00 H new ATOM 0 HB VAL B 142 -8.056 -1.819 9.251 1.00 0.00 H new ATOM 0 HG11 VAL B 142 -6.982 -2.936 7.362 1.00 0.00 H new ATOM 0 HG12 VAL B 142 -8.198 -3.960 8.162 1.00 0.00 H new ATOM 0 HG13 VAL B 142 -8.577 -3.177 6.610 1.00 0.00 H new ATOM 0 HG21 VAL B 142 -7.219 -0.523 7.322 1.00 0.00 H new ATOM 0 HG22 VAL B 142 -8.840 -0.591 6.591 1.00 0.00 H new ATOM 0 HG23 VAL B 142 -8.592 0.274 8.126 1.00 0.00 H new ATOM 1654 N ILE B 143 -11.106 -3.577 7.087 1.00 0.00 N ATOM 1655 CA ILE B 143 -12.023 -4.019 6.044 1.00 0.00 C ATOM 1656 C ILE B 143 -13.360 -3.325 6.187 1.00 0.00 C ATOM 1657 O ILE B 143 -13.758 -2.534 5.336 1.00 0.00 O ATOM 1658 CB ILE B 143 -12.299 -5.546 6.112 1.00 0.00 C ATOM 1659 CG1 ILE B 143 -11.030 -6.362 6.020 1.00 0.00 C ATOM 1660 CG2 ILE B 143 -13.253 -5.984 5.028 1.00 0.00 C ATOM 1661 CD1 ILE B 143 -10.171 -5.996 4.857 1.00 0.00 C ATOM 0 H ILE B 143 -10.654 -4.338 7.594 1.00 0.00 H new ATOM 0 HA ILE B 143 -11.544 -3.774 5.096 1.00 0.00 H new ATOM 0 HB ILE B 143 -12.754 -5.727 7.086 1.00 0.00 H new ATOM 0 HG12 ILE B 143 -10.458 -6.234 6.939 1.00 0.00 H new ATOM 0 HG13 ILE B 143 -11.291 -7.418 5.951 1.00 0.00 H new ATOM 0 HG21 ILE B 143 -13.424 -7.058 5.105 1.00 0.00 H new ATOM 0 HG22 ILE B 143 -14.200 -5.457 5.142 1.00 0.00 H new ATOM 0 HG23 ILE B 143 -12.825 -5.754 4.052 1.00 0.00 H new ATOM 0 HD11 ILE B 143 -9.278 -6.621 4.853 1.00 0.00 H new ATOM 0 HD12 ILE B 143 -10.726 -6.151 3.932 1.00 0.00 H new ATOM 0 HD13 ILE B 143 -9.880 -4.948 4.935 1.00 0.00 H new ATOM 1673 N SER B 144 -14.046 -3.643 7.272 1.00 0.00 N ATOM 1674 CA SER B 144 -15.367 -3.081 7.541 1.00 0.00 C ATOM 1675 C SER B 144 -15.352 -1.549 7.509 1.00 0.00 C ATOM 1676 O SER B 144 -16.341 -0.922 7.116 1.00 0.00 O ATOM 1677 CB SER B 144 -15.905 -3.595 8.882 1.00 0.00 C ATOM 1678 OG SER B 144 -15.030 -3.287 9.957 1.00 0.00 O ATOM 0 H SER B 144 -13.712 -4.290 7.986 1.00 0.00 H new ATOM 0 HA SER B 144 -16.036 -3.413 6.747 1.00 0.00 H new ATOM 0 HB2 SER B 144 -16.884 -3.155 9.073 1.00 0.00 H new ATOM 0 HB3 SER B 144 -16.046 -4.674 8.827 1.00 0.00 H new ATOM 0 HG SER B 144 -14.196 -2.913 9.603 1.00 0.00 H new ATOM 1684 N GLU B 145 -14.228 -0.946 7.895 1.00 0.00 N ATOM 1685 CA GLU B 145 -14.111 0.508 7.884 1.00 0.00 C ATOM 1686 C GLU B 145 -13.942 1.061 6.466 1.00 0.00 C ATOM 1687 O GLU B 145 -14.472 2.128 6.147 1.00 0.00 O ATOM 1688 CB GLU B 145 -12.948 0.969 8.761 1.00 0.00 C ATOM 1689 CG GLU B 145 -13.150 0.690 10.243 1.00 0.00 C ATOM 1690 CD GLU B 145 -12.148 1.428 11.103 1.00 0.00 C ATOM 1691 OE1 GLU B 145 -12.282 2.658 11.251 1.00 0.00 O ATOM 1692 OE2 GLU B 145 -11.208 0.795 11.622 1.00 0.00 O ATOM 0 H GLU B 145 -13.394 -1.438 8.216 1.00 0.00 H new ATOM 0 HA GLU B 145 -15.043 0.901 8.290 1.00 0.00 H new ATOM 0 HB2 GLU B 145 -12.036 0.474 8.428 1.00 0.00 H new ATOM 0 HB3 GLU B 145 -12.800 2.039 8.619 1.00 0.00 H new ATOM 0 HG2 GLU B 145 -14.160 0.982 10.532 1.00 0.00 H new ATOM 0 HG3 GLU B 145 -13.064 -0.381 10.425 1.00 0.00 H new ATOM 1699 N LEU B 146 -13.208 0.352 5.615 1.00 0.00 N ATOM 1700 CA LEU B 146 -12.969 0.829 4.256 1.00 0.00 C ATOM 1701 C LEU B 146 -14.089 0.389 3.327 1.00 0.00 C ATOM 1702 O LEU B 146 -14.261 0.946 2.243 1.00 0.00 O ATOM 1703 CB LEU B 146 -11.649 0.314 3.679 1.00 0.00 C ATOM 1704 CG LEU B 146 -10.410 0.411 4.566 1.00 0.00 C ATOM 1705 CD1 LEU B 146 -9.159 0.308 3.713 1.00 0.00 C ATOM 1706 CD2 LEU B 146 -10.378 1.700 5.369 1.00 0.00 C ATOM 0 H LEU B 146 -12.773 -0.543 5.837 1.00 0.00 H new ATOM 0 HA LEU B 146 -12.926 1.916 4.322 1.00 0.00 H new ATOM 0 HB2 LEU B 146 -11.786 -0.732 3.405 1.00 0.00 H new ATOM 0 HB3 LEU B 146 -11.448 0.861 2.758 1.00 0.00 H new ATOM 0 HG LEU B 146 -10.449 -0.416 5.275 1.00 0.00 H new ATOM 0 HD11 LEU B 146 -8.277 0.378 4.350 1.00 0.00 H new ATOM 0 HD12 LEU B 146 -9.153 -0.648 3.189 1.00 0.00 H new ATOM 0 HD13 LEU B 146 -9.146 1.120 2.986 1.00 0.00 H new ATOM 0 HD21 LEU B 146 -9.479 1.723 5.984 1.00 0.00 H new ATOM 0 HD22 LEU B 146 -10.375 2.552 4.689 1.00 0.00 H new ATOM 0 HD23 LEU B 146 -11.258 1.751 6.010 1.00 0.00 H new ATOM 1718 N ASN B 147 -14.827 -0.631 3.750 1.00 0.00 N ATOM 1719 CA ASN B 147 -15.884 -1.212 2.933 1.00 0.00 C ATOM 1720 C ASN B 147 -16.875 -0.145 2.480 1.00 0.00 C ATOM 1721 O ASN B 147 -17.523 0.507 3.302 1.00 0.00 O ATOM 1722 CB ASN B 147 -16.605 -2.324 3.697 1.00 0.00 C ATOM 1723 CG ASN B 147 -17.657 -3.016 2.849 1.00 0.00 C ATOM 1724 OD1 ASN B 147 -18.816 -2.600 2.808 1.00 0.00 O ATOM 1725 ND2 ASN B 147 -17.261 -4.083 2.176 1.00 0.00 N ATOM 0 H ASN B 147 -14.711 -1.075 4.661 1.00 0.00 H new ATOM 0 HA ASN B 147 -15.424 -1.644 2.045 1.00 0.00 H new ATOM 0 HB2 ASN B 147 -15.876 -3.059 4.039 1.00 0.00 H new ATOM 0 HB3 ASN B 147 -17.076 -1.905 4.586 1.00 0.00 H new ATOM 0 HD21 ASN B 147 -17.925 -4.595 1.595 1.00 0.00 H new ATOM 0 HD22 ASN B 147 -16.292 -4.394 2.238 1.00 0.00 H new ATOM 1732 N GLY B 148 -16.964 0.033 1.169 1.00 0.00 N ATOM 1733 CA GLY B 148 -17.840 1.040 0.607 1.00 0.00 C ATOM 1734 C GLY B 148 -17.105 2.326 0.285 1.00 0.00 C ATOM 1735 O GLY B 148 -17.647 3.417 0.454 1.00 0.00 O ATOM 0 H GLY B 148 -16.440 -0.507 0.480 1.00 0.00 H new ATOM 0 HA2 GLY B 148 -18.302 0.651 -0.300 1.00 0.00 H new ATOM 0 HA3 GLY B 148 -18.646 1.251 1.310 1.00 0.00 H new ATOM 1739 N LYS B 149 -15.863 2.199 -0.168 1.00 0.00 N ATOM 1740 CA LYS B 149 -15.048 3.355 -0.518 1.00 0.00 C ATOM 1741 C LYS B 149 -14.434 3.179 -1.901 1.00 0.00 C ATOM 1742 O LYS B 149 -14.405 2.073 -2.443 1.00 0.00 O ATOM 1743 CB LYS B 149 -13.931 3.551 0.509 1.00 0.00 C ATOM 1744 CG LYS B 149 -14.005 4.868 1.272 1.00 0.00 C ATOM 1745 CD LYS B 149 -15.151 4.885 2.271 1.00 0.00 C ATOM 1746 CE LYS B 149 -14.954 3.850 3.369 1.00 0.00 C ATOM 1747 NZ LYS B 149 -16.017 3.933 4.404 1.00 0.00 N ATOM 0 H LYS B 149 -15.397 1.302 -0.302 1.00 0.00 H new ATOM 0 HA LYS B 149 -15.693 4.233 -0.522 1.00 0.00 H new ATOM 0 HB2 LYS B 149 -13.962 2.728 1.223 1.00 0.00 H new ATOM 0 HB3 LYS B 149 -12.970 3.494 -0.002 1.00 0.00 H new ATOM 0 HG2 LYS B 149 -13.064 5.036 1.797 1.00 0.00 H new ATOM 0 HG3 LYS B 149 -14.127 5.689 0.566 1.00 0.00 H new ATOM 0 HD2 LYS B 149 -15.232 5.877 2.716 1.00 0.00 H new ATOM 0 HD3 LYS B 149 -16.090 4.691 1.752 1.00 0.00 H new ATOM 0 HE2 LYS B 149 -14.951 2.852 2.931 1.00 0.00 H new ATOM 0 HE3 LYS B 149 -13.980 3.997 3.836 1.00 0.00 H new ATOM 0 HZ1 LYS B 149 -15.744 3.362 5.229 1.00 0.00 H new ATOM 0 HZ2 LYS B 149 -16.142 4.924 4.695 1.00 0.00 H new ATOM 0 HZ3 LYS B 149 -16.911 3.572 4.013 1.00 0.00 H new ATOM 1761 N ASN B 150 -13.928 4.275 -2.453 1.00 0.00 N ATOM 1762 CA ASN B 150 -13.268 4.263 -3.748 1.00 0.00 C ATOM 1763 C ASN B 150 -11.776 4.359 -3.517 1.00 0.00 C ATOM 1764 O ASN B 150 -11.225 5.455 -3.470 1.00 0.00 O ATOM 1765 CB ASN B 150 -13.741 5.433 -4.621 1.00 0.00 C ATOM 1766 CG ASN B 150 -15.221 5.370 -4.937 1.00 0.00 C ATOM 1767 OD1 ASN B 150 -15.806 4.290 -5.028 1.00 0.00 O ATOM 1768 ND2 ASN B 150 -15.838 6.527 -5.110 1.00 0.00 N ATOM 0 H ASN B 150 -13.965 5.195 -2.014 1.00 0.00 H new ATOM 0 HA ASN B 150 -13.516 3.340 -4.273 1.00 0.00 H new ATOM 0 HB2 ASN B 150 -13.523 6.372 -4.112 1.00 0.00 H new ATOM 0 HB3 ASN B 150 -13.175 5.437 -5.553 1.00 0.00 H new ATOM 0 HD21 ASN B 150 -16.834 6.546 -5.327 1.00 0.00 H new ATOM 0 HD22 ASN B 150 -15.317 7.400 -5.026 1.00 0.00 H new ATOM 1775 N ILE B 151 -11.151 3.201 -3.360 1.00 0.00 N ATOM 1776 CA ILE B 151 -9.759 3.085 -2.915 1.00 0.00 C ATOM 1777 C ILE B 151 -8.826 4.153 -3.508 1.00 0.00 C ATOM 1778 O ILE B 151 -8.298 4.984 -2.776 1.00 0.00 O ATOM 1779 CB ILE B 151 -9.208 1.682 -3.204 1.00 0.00 C ATOM 1780 CG1 ILE B 151 -9.657 0.684 -2.132 1.00 0.00 C ATOM 1781 CG2 ILE B 151 -7.703 1.714 -3.264 1.00 0.00 C ATOM 1782 CD1 ILE B 151 -11.139 0.449 -2.100 1.00 0.00 C ATOM 0 H ILE B 151 -11.597 2.301 -3.539 1.00 0.00 H new ATOM 0 HA ILE B 151 -9.779 3.257 -1.839 1.00 0.00 H new ATOM 0 HB ILE B 151 -9.602 1.359 -4.168 1.00 0.00 H new ATOM 0 HG12 ILE B 151 -9.152 -0.267 -2.301 1.00 0.00 H new ATOM 0 HG13 ILE B 151 -9.336 1.046 -1.155 1.00 0.00 H new ATOM 0 HG21 ILE B 151 -7.326 0.712 -3.470 1.00 0.00 H new ATOM 0 HG22 ILE B 151 -7.385 2.391 -4.056 1.00 0.00 H new ATOM 0 HG23 ILE B 151 -7.308 2.062 -2.309 1.00 0.00 H new ATOM 0 HD11 ILE B 151 -11.377 -0.269 -1.315 1.00 0.00 H new ATOM 0 HD12 ILE B 151 -11.652 1.389 -1.899 1.00 0.00 H new ATOM 0 HD13 ILE B 151 -11.466 0.056 -3.063 1.00 0.00 H new ATOM 1794 N GLU B 152 -8.634 4.139 -4.820 1.00 0.00 N ATOM 1795 CA GLU B 152 -7.670 5.035 -5.455 1.00 0.00 C ATOM 1796 C GLU B 152 -7.990 6.484 -5.159 1.00 0.00 C ATOM 1797 O GLU B 152 -7.094 7.293 -5.009 1.00 0.00 O ATOM 1798 CB GLU B 152 -7.642 4.833 -6.971 1.00 0.00 C ATOM 1799 CG GLU B 152 -7.439 3.398 -7.393 1.00 0.00 C ATOM 1800 CD GLU B 152 -8.744 2.655 -7.622 1.00 0.00 C ATOM 1801 OE1 GLU B 152 -9.484 2.423 -6.642 1.00 0.00 O ATOM 1802 OE2 GLU B 152 -9.046 2.310 -8.785 1.00 0.00 O ATOM 0 H GLU B 152 -9.128 3.522 -5.464 1.00 0.00 H new ATOM 0 HA GLU B 152 -6.692 4.791 -5.041 1.00 0.00 H new ATOM 0 HB2 GLU B 152 -8.579 5.197 -7.394 1.00 0.00 H new ATOM 0 HB3 GLU B 152 -6.843 5.442 -7.394 1.00 0.00 H new ATOM 0 HG2 GLU B 152 -6.849 3.375 -8.309 1.00 0.00 H new ATOM 0 HG3 GLU B 152 -6.861 2.879 -6.628 1.00 0.00 H new ATOM 1809 N ASP B 153 -9.265 6.797 -5.081 1.00 0.00 N ATOM 1810 CA ASP B 153 -9.700 8.150 -4.754 1.00 0.00 C ATOM 1811 C ASP B 153 -9.423 8.470 -3.290 1.00 0.00 C ATOM 1812 O ASP B 153 -9.027 9.589 -2.958 1.00 0.00 O ATOM 1813 CB ASP B 153 -11.179 8.327 -5.089 1.00 0.00 C ATOM 1814 CG ASP B 153 -11.819 9.490 -4.358 1.00 0.00 C ATOM 1815 OD1 ASP B 153 -11.650 10.651 -4.800 1.00 0.00 O ATOM 1816 OD2 ASP B 153 -12.512 9.250 -3.346 1.00 0.00 O ATOM 0 H ASP B 153 -10.025 6.136 -5.239 1.00 0.00 H new ATOM 0 HA ASP B 153 -9.128 8.854 -5.359 1.00 0.00 H new ATOM 0 HB2 ASP B 153 -11.287 8.477 -6.163 1.00 0.00 H new ATOM 0 HB3 ASP B 153 -11.714 7.410 -4.840 1.00 0.00 H new ATOM 1821 N VAL B 154 -9.612 7.482 -2.418 1.00 0.00 N ATOM 1822 CA VAL B 154 -9.255 7.618 -1.007 1.00 0.00 C ATOM 1823 C VAL B 154 -7.799 8.059 -0.895 1.00 0.00 C ATOM 1824 O VAL B 154 -7.467 9.008 -0.183 1.00 0.00 O ATOM 1825 CB VAL B 154 -9.432 6.282 -0.230 1.00 0.00 C ATOM 1826 CG1 VAL B 154 -9.090 6.457 1.240 1.00 0.00 C ATOM 1827 CG2 VAL B 154 -10.840 5.727 -0.383 1.00 0.00 C ATOM 0 H VAL B 154 -10.011 6.576 -2.664 1.00 0.00 H new ATOM 0 HA VAL B 154 -9.922 8.360 -0.568 1.00 0.00 H new ATOM 0 HB VAL B 154 -8.738 5.562 -0.664 1.00 0.00 H new ATOM 0 HG11 VAL B 154 -9.222 5.508 1.760 1.00 0.00 H new ATOM 0 HG12 VAL B 154 -8.054 6.782 1.336 1.00 0.00 H new ATOM 0 HG13 VAL B 154 -9.748 7.206 1.680 1.00 0.00 H new ATOM 0 HG21 VAL B 154 -10.926 4.794 0.173 1.00 0.00 H new ATOM 0 HG22 VAL B 154 -11.559 6.448 0.005 1.00 0.00 H new ATOM 0 HG23 VAL B 154 -11.045 5.541 -1.437 1.00 0.00 H new ATOM 1837 N ILE B 155 -6.942 7.374 -1.635 1.00 0.00 N ATOM 1838 CA ILE B 155 -5.513 7.656 -1.614 1.00 0.00 C ATOM 1839 C ILE B 155 -5.076 8.342 -2.908 1.00 0.00 C ATOM 1840 O ILE B 155 -3.998 8.104 -3.434 1.00 0.00 O ATOM 1841 CB ILE B 155 -4.653 6.384 -1.404 1.00 0.00 C ATOM 1842 CG1 ILE B 155 -5.175 5.526 -0.253 1.00 0.00 C ATOM 1843 CG2 ILE B 155 -3.206 6.761 -1.110 1.00 0.00 C ATOM 1844 CD1 ILE B 155 -6.457 4.798 -0.560 1.00 0.00 C ATOM 0 H ILE B 155 -7.211 6.615 -2.261 1.00 0.00 H new ATOM 0 HA ILE B 155 -5.349 8.318 -0.764 1.00 0.00 H new ATOM 0 HB ILE B 155 -4.713 5.807 -2.327 1.00 0.00 H new ATOM 0 HG12 ILE B 155 -4.411 4.797 0.017 1.00 0.00 H new ATOM 0 HG13 ILE B 155 -5.331 6.162 0.618 1.00 0.00 H new ATOM 0 HG21 ILE B 155 -2.616 5.856 -0.965 1.00 0.00 H new ATOM 0 HG22 ILE B 155 -2.800 7.328 -1.948 1.00 0.00 H new ATOM 0 HG23 ILE B 155 -3.165 7.369 -0.206 1.00 0.00 H new ATOM 0 HD11 ILE B 155 -6.760 4.212 0.308 1.00 0.00 H new ATOM 0 HD12 ILE B 155 -7.237 5.520 -0.800 1.00 0.00 H new ATOM 0 HD13 ILE B 155 -6.303 4.134 -1.410 1.00 0.00 H new ATOM 1856 N ALA B 156 -5.927 9.182 -3.445 1.00 0.00 N ATOM 1857 CA ALA B 156 -5.508 10.046 -4.528 1.00 0.00 C ATOM 1858 C ALA B 156 -5.238 11.419 -3.950 1.00 0.00 C ATOM 1859 O ALA B 156 -4.881 12.364 -4.653 1.00 0.00 O ATOM 1860 CB ALA B 156 -6.539 10.072 -5.646 1.00 0.00 C ATOM 0 H ALA B 156 -6.900 9.288 -3.158 1.00 0.00 H new ATOM 0 HA ALA B 156 -4.594 9.667 -4.986 1.00 0.00 H new ATOM 0 HB1 ALA B 156 -6.194 10.730 -6.444 1.00 0.00 H new ATOM 0 HB2 ALA B 156 -6.674 9.065 -6.040 1.00 0.00 H new ATOM 0 HB3 ALA B 156 -7.488 10.440 -5.257 1.00 0.00 H new ATOM 1866 N GLN B 157 -5.403 11.492 -2.631 1.00 0.00 N ATOM 1867 CA GLN B 157 -5.144 12.698 -1.864 1.00 0.00 C ATOM 1868 C GLN B 157 -4.510 12.349 -0.511 1.00 0.00 C ATOM 1869 O GLN B 157 -4.469 13.183 0.390 1.00 0.00 O ATOM 1870 CB GLN B 157 -6.454 13.462 -1.634 1.00 0.00 C ATOM 1871 CG GLN B 157 -7.139 13.903 -2.920 1.00 0.00 C ATOM 1872 CD GLN B 157 -8.428 14.672 -2.685 1.00 0.00 C ATOM 1873 OE1 GLN B 157 -8.489 15.435 -1.605 1.00 0.00 O flip ATOM 1874 NE2 GLN B 157 -9.358 14.597 -3.490 1.00 0.00 N flip ATOM 0 H GLN B 157 -5.723 10.707 -2.064 1.00 0.00 H new ATOM 0 HA GLN B 157 -4.452 13.324 -2.427 1.00 0.00 H new ATOM 0 HB2 GLN B 157 -7.138 12.831 -1.067 1.00 0.00 H new ATOM 0 HB3 GLN B 157 -6.249 14.340 -1.022 1.00 0.00 H new ATOM 0 HG2 GLN B 157 -6.452 14.526 -3.493 1.00 0.00 H new ATOM 0 HG3 GLN B 157 -7.355 13.024 -3.528 1.00 0.00 H new ATOM 0 HE21 GLN B 157 -9.275 13.998 -4.311 1.00 0.00 H new ATOM 0 HE22 GLN B 157 -10.211 15.134 -3.335 1.00 0.00 H new ATOM 1883 N GLY B 158 -3.998 11.120 -0.374 1.00 0.00 N ATOM 1884 CA GLY B 158 -3.530 10.679 0.934 1.00 0.00 C ATOM 1885 C GLY B 158 -2.549 9.514 0.913 1.00 0.00 C ATOM 1886 O GLY B 158 -2.688 8.584 1.698 1.00 0.00 O ATOM 0 H GLY B 158 -3.901 10.438 -1.127 1.00 0.00 H new ATOM 0 HA2 GLY B 158 -3.057 11.523 1.436 1.00 0.00 H new ATOM 0 HA3 GLY B 158 -4.394 10.395 1.534 1.00 0.00 H new ATOM 1890 N ILE B 159 -1.558 9.577 0.028 1.00 0.00 N ATOM 1891 CA ILE B 159 -0.490 8.556 -0.059 1.00 0.00 C ATOM 1892 C ILE B 159 0.277 8.422 1.263 1.00 0.00 C ATOM 1893 O ILE B 159 0.829 7.366 1.569 1.00 0.00 O ATOM 1894 CB ILE B 159 0.487 8.901 -1.210 1.00 0.00 C ATOM 1895 CG1 ILE B 159 -0.079 8.495 -2.558 1.00 0.00 C ATOM 1896 CG2 ILE B 159 1.815 8.250 -1.001 1.00 0.00 C ATOM 1897 CD1 ILE B 159 -1.286 9.285 -2.940 1.00 0.00 C ATOM 0 H ILE B 159 -1.463 10.331 -0.652 1.00 0.00 H new ATOM 0 HA ILE B 159 -0.965 7.597 -0.265 1.00 0.00 H new ATOM 0 HB ILE B 159 0.621 9.983 -1.204 1.00 0.00 H new ATOM 0 HG12 ILE B 159 0.688 8.620 -3.322 1.00 0.00 H new ATOM 0 HG13 ILE B 159 -0.336 7.436 -2.535 1.00 0.00 H new ATOM 0 HG21 ILE B 159 2.481 8.509 -1.824 1.00 0.00 H new ATOM 0 HG22 ILE B 159 2.246 8.597 -0.062 1.00 0.00 H new ATOM 0 HG23 ILE B 159 1.688 7.168 -0.964 1.00 0.00 H new ATOM 0 HD11 ILE B 159 -1.647 8.951 -3.913 1.00 0.00 H new ATOM 0 HD12 ILE B 159 -2.067 9.140 -2.194 1.00 0.00 H new ATOM 0 HD13 ILE B 159 -1.027 10.342 -2.993 1.00 0.00 H new ATOM 1909 N GLY B 160 0.295 9.482 2.053 1.00 0.00 N ATOM 1910 CA GLY B 160 1.029 9.444 3.301 1.00 0.00 C ATOM 1911 C GLY B 160 0.178 8.998 4.476 1.00 0.00 C ATOM 1912 O GLY B 160 0.399 7.930 5.045 1.00 0.00 O ATOM 0 H GLY B 160 -0.181 10.362 1.856 1.00 0.00 H new ATOM 0 HA2 GLY B 160 1.878 8.768 3.197 1.00 0.00 H new ATOM 0 HA3 GLY B 160 1.434 10.434 3.508 1.00 0.00 H new