USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 881 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 33 TYR OH : rot 82:sc= 0.0417 USER MOD Set 1.2: A 67 LYS NZ :NH3+ 175:sc= 0.00859 (180deg=0) USER MOD Set 2.1: A 37 CYS SG : rot 171:sc= 1.1 USER MOD Set 2.2: A 40 CYS SG : rot 75:sc= -1.15 USER MOD Single : A 10 THR OG1 : rot 160:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN :FLIP amide:sc= 0.0439 F(o=-2.7!,f=0.044) USER MOD Single : A 17 TYR OH : rot -130:sc= -0.885 USER MOD Single : A 18 ASN : amide:sc= -0.169 X(o=-0.17,f=-0.17) USER MOD Single : A 25 THR OG1 : rot -21:sc= 0.463 USER MOD Single : A 26 LYS NZ :NH3+ -139:sc= 0.135 (180deg=0) USER MOD Single : A 39 HIS : no HD1:sc= -0.0574 X(o=-0.057,f=0) USER MOD Single : A 41 LYS NZ :NH3+ 150:sc= -0.0926 (180deg=-0.867) USER MOD Single : A 46 LYS NZ :NH3+ -153:sc= -0.24 (180deg=-0.975) USER MOD Single : A 47 TYR OH : rot 178:sc= -6.13! USER MOD Single : A 54 TYR OH : rot 30:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 111:sc= 1.07 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot -58:sc= 1.1 USER MOD Single : A 73 ASN : amide:sc= -5.99! C(o=-6!,f=-7.8!) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot -61:sc= -2.89! USER MOD Single : A 86 LYS NZ :NH3+ -131:sc= -0.142 (180deg=-1.61) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -157:sc=-0.00697 (180deg=-0.349) USER MOD Single : A 95 GLN : amide:sc= -1.51 X(o=-1.5,f=-1.9!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot 127:sc= 0.0673 USER MOD Single : A 100 SER OG : rot 180:sc= 0.0185 USER MOD Single : A 102 SER OG : rot -61:sc= -3.99! USER MOD Single : A 104 THR OG1 : rot 160:sc= -1.48 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -8.89! C(o=-8.9!,f=-20!) USER MOD Single : A 117 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00496) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 97 N VAL A 9 -4.059 9.236 1.751 1.00 0.00 N ATOM 98 CA VAL A 9 -3.499 7.900 1.915 1.00 0.00 C ATOM 99 C VAL A 9 -3.022 7.675 3.346 1.00 0.00 C ATOM 100 O VAL A 9 -2.665 8.622 4.048 1.00 0.00 O ATOM 101 CB VAL A 9 -2.318 7.663 0.954 1.00 0.00 C ATOM 102 CG1 VAL A 9 -1.917 6.196 0.951 1.00 0.00 C ATOM 103 CG2 VAL A 9 -2.669 8.130 -0.450 1.00 0.00 C ATOM 0 HA VAL A 9 -4.297 7.194 1.683 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.467 8.247 1.304 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -1.082 6.049 0.267 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -1.619 5.898 1.956 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -2.762 5.588 0.628 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -1.823 7.954 -1.114 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -3.535 7.576 -0.812 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -2.901 9.195 -0.432 1.00 0.00 H new ATOM 113 N THR A 10 -3.016 6.416 3.772 1.00 0.00 N ATOM 114 CA THR A 10 -2.579 6.066 5.119 1.00 0.00 C ATOM 115 C THR A 10 -1.070 6.248 5.261 1.00 0.00 C ATOM 116 O THR A 10 -0.314 5.990 4.325 1.00 0.00 O ATOM 117 CB THR A 10 -2.970 4.622 5.444 1.00 0.00 C ATOM 118 OG1 THR A 10 -4.376 4.459 5.387 1.00 0.00 O ATOM 119 CG2 THR A 10 -2.511 4.169 6.814 1.00 0.00 C ATOM 0 H THR A 10 -3.309 5.621 3.204 1.00 0.00 H new ATOM 0 HA THR A 10 -3.074 6.733 5.825 1.00 0.00 H new ATOM 0 HB THR A 10 -2.470 4.012 4.692 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.591 3.509 5.276 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.821 3.137 6.979 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.425 4.235 6.874 1.00 0.00 H new ATOM 0 HG23 THR A 10 -2.956 4.808 7.577 1.00 0.00 H new ATOM 127 N VAL A 11 -0.639 6.701 6.434 1.00 0.00 N ATOM 128 CA VAL A 11 0.779 6.923 6.691 1.00 0.00 C ATOM 129 C VAL A 11 1.378 5.804 7.537 1.00 0.00 C ATOM 130 O VAL A 11 0.964 5.582 8.674 1.00 0.00 O ATOM 131 CB VAL A 11 1.017 8.268 7.402 1.00 0.00 C ATOM 132 CG1 VAL A 11 0.785 9.427 6.444 1.00 0.00 C ATOM 133 CG2 VAL A 11 0.122 8.391 8.627 1.00 0.00 C ATOM 0 H VAL A 11 -1.250 6.921 7.220 1.00 0.00 H new ATOM 0 HA VAL A 11 1.271 6.937 5.719 1.00 0.00 H new ATOM 0 HB VAL A 11 2.055 8.304 7.734 1.00 0.00 H new ATOM 0 HG11 VAL A 11 0.958 10.369 6.964 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.472 9.346 5.602 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.242 9.397 6.079 1.00 0.00 H new ATOM 0 HG21 VAL A 11 0.304 9.348 9.116 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -0.923 8.333 8.322 1.00 0.00 H new ATOM 0 HG23 VAL A 11 0.343 7.580 9.322 1.00 0.00 H new ATOM 143 N VAL A 12 2.364 5.110 6.976 1.00 0.00 N ATOM 144 CA VAL A 12 3.031 4.022 7.682 1.00 0.00 C ATOM 145 C VAL A 12 4.445 4.432 8.085 1.00 0.00 C ATOM 146 O VAL A 12 5.381 4.339 7.292 1.00 0.00 O ATOM 147 CB VAL A 12 3.088 2.738 6.822 1.00 0.00 C ATOM 148 CG1 VAL A 12 4.089 1.738 7.390 1.00 0.00 C ATOM 149 CG2 VAL A 12 1.708 2.109 6.720 1.00 0.00 C ATOM 0 H VAL A 12 2.718 5.282 6.035 1.00 0.00 H new ATOM 0 HA VAL A 12 2.447 3.809 8.578 1.00 0.00 H new ATOM 0 HB VAL A 12 3.422 3.016 5.822 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.107 0.846 6.764 1.00 0.00 H new ATOM 0 HG12 VAL A 12 5.082 2.188 7.409 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.795 1.465 8.403 1.00 0.00 H new ATOM 0 HG21 VAL A 12 1.764 1.206 6.112 1.00 0.00 H new ATOM 0 HG22 VAL A 12 1.350 1.853 7.717 1.00 0.00 H new ATOM 0 HG23 VAL A 12 1.019 2.816 6.258 1.00 0.00 H new ATOM 159 N VAL A 13 4.586 4.883 9.325 1.00 0.00 N ATOM 160 CA VAL A 13 5.879 5.308 9.844 1.00 0.00 C ATOM 161 C VAL A 13 6.430 4.284 10.829 1.00 0.00 C ATOM 162 O VAL A 13 5.681 3.485 11.388 1.00 0.00 O ATOM 163 CB VAL A 13 5.785 6.677 10.547 1.00 0.00 C ATOM 164 CG1 VAL A 13 5.798 7.804 9.527 1.00 0.00 C ATOM 165 CG2 VAL A 13 4.539 6.751 11.418 1.00 0.00 C ATOM 0 H VAL A 13 3.818 4.964 9.991 1.00 0.00 H new ATOM 0 HA VAL A 13 6.551 5.395 8.990 1.00 0.00 H new ATOM 0 HB VAL A 13 6.656 6.791 11.192 1.00 0.00 H new ATOM 0 HG11 VAL A 13 5.731 8.762 10.042 1.00 0.00 H new ATOM 0 HG12 VAL A 13 6.724 7.765 8.953 1.00 0.00 H new ATOM 0 HG13 VAL A 13 4.949 7.694 8.853 1.00 0.00 H new ATOM 0 HG21 VAL A 13 4.493 7.725 11.905 1.00 0.00 H new ATOM 0 HG22 VAL A 13 3.653 6.612 10.798 1.00 0.00 H new ATOM 0 HG23 VAL A 13 4.578 5.968 12.176 1.00 0.00 H new ATOM 175 N ALA A 14 7.742 4.315 11.041 1.00 0.00 N ATOM 176 CA ALA A 14 8.392 3.389 11.964 1.00 0.00 C ATOM 177 C ALA A 14 7.649 3.317 13.298 1.00 0.00 C ATOM 178 O ALA A 14 7.709 2.307 13.998 1.00 0.00 O ATOM 179 CB ALA A 14 9.839 3.802 12.184 1.00 0.00 C ATOM 0 H ALA A 14 8.377 4.971 10.586 1.00 0.00 H new ATOM 0 HA ALA A 14 8.369 2.395 11.518 1.00 0.00 H new ATOM 0 HB1 ALA A 14 10.315 3.105 12.874 1.00 0.00 H new ATOM 0 HB2 ALA A 14 10.370 3.790 11.232 1.00 0.00 H new ATOM 0 HB3 ALA A 14 9.871 4.807 12.604 1.00 0.00 H new ATOM 185 N LYS A 15 6.952 4.396 13.642 1.00 0.00 N ATOM 186 CA LYS A 15 6.200 4.457 14.891 1.00 0.00 C ATOM 187 C LYS A 15 5.075 3.424 14.912 1.00 0.00 C ATOM 188 O LYS A 15 4.884 2.724 15.906 1.00 0.00 O ATOM 189 CB LYS A 15 5.620 5.859 15.089 1.00 0.00 C ATOM 190 CG LYS A 15 6.662 6.899 15.469 1.00 0.00 C ATOM 191 CD LYS A 15 6.014 8.212 15.876 1.00 0.00 C ATOM 192 CE LYS A 15 6.999 9.119 16.596 1.00 0.00 C ATOM 193 NZ LYS A 15 6.349 9.882 17.697 1.00 0.00 N ATOM 0 H LYS A 15 6.892 5.240 13.073 1.00 0.00 H new ATOM 0 HA LYS A 15 6.887 4.230 15.707 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.125 6.172 14.170 1.00 0.00 H new ATOM 0 HB3 LYS A 15 4.856 5.821 15.866 1.00 0.00 H new ATOM 0 HG2 LYS A 15 7.271 6.522 16.291 1.00 0.00 H new ATOM 0 HG3 LYS A 15 7.333 7.069 14.627 1.00 0.00 H new ATOM 0 HD2 LYS A 15 5.630 8.719 14.991 1.00 0.00 H new ATOM 0 HD3 LYS A 15 5.161 8.012 16.524 1.00 0.00 H new ATOM 0 HE2 LYS A 15 7.814 8.520 17.002 1.00 0.00 H new ATOM 0 HE3 LYS A 15 7.439 9.815 15.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 7.054 10.488 18.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 5.587 10.473 17.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 5.951 9.218 18.391 1.00 0.00 H new ATOM 207 N ASN A 16 4.332 3.335 13.812 1.00 0.00 N ATOM 208 CA ASN A 16 3.225 2.388 13.711 1.00 0.00 C ATOM 209 C ASN A 16 3.368 1.510 12.472 1.00 0.00 C ATOM 210 O ASN A 16 2.377 1.042 11.913 1.00 0.00 O ATOM 211 CB ASN A 16 1.884 3.128 13.674 1.00 0.00 C ATOM 212 CG ASN A 16 1.975 4.481 12.991 1.00 0.00 C ATOM 213 OD1 ASN A 16 2.428 4.487 11.743 1.00 0.00 O flip ATOM 214 ND2 ASN A 16 1.642 5.510 13.580 1.00 0.00 N flip ATOM 0 H ASN A 16 4.476 3.906 12.979 1.00 0.00 H new ATOM 0 HA ASN A 16 3.252 1.749 14.593 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.149 2.513 13.154 1.00 0.00 H new ATOM 0 HB3 ASN A 16 1.522 3.265 14.693 1.00 0.00 H new ATOM 0 HD21 ASN A 16 1.299 5.460 14.539 1.00 0.00 H new ATOM 0 HD22 ASN A 16 1.709 6.412 13.109 1.00 0.00 H new ATOM 221 N TYR A 17 4.606 1.290 12.052 1.00 0.00 N ATOM 222 CA TYR A 17 4.882 0.468 10.881 1.00 0.00 C ATOM 223 C TYR A 17 4.510 -0.985 11.143 1.00 0.00 C ATOM 224 O TYR A 17 3.859 -1.632 10.320 1.00 0.00 O ATOM 225 CB TYR A 17 6.363 0.565 10.514 1.00 0.00 C ATOM 226 CG TYR A 17 6.670 0.144 9.096 1.00 0.00 C ATOM 227 CD1 TYR A 17 6.411 -1.150 8.662 1.00 0.00 C ATOM 228 CD2 TYR A 17 7.220 1.043 8.192 1.00 0.00 C ATOM 229 CE1 TYR A 17 6.692 -1.536 7.365 1.00 0.00 C ATOM 230 CE2 TYR A 17 7.504 0.665 6.894 1.00 0.00 C ATOM 231 CZ TYR A 17 7.238 -0.624 6.486 1.00 0.00 C ATOM 232 OH TYR A 17 7.519 -1.004 5.196 1.00 0.00 O ATOM 0 H TYR A 17 5.437 1.670 12.505 1.00 0.00 H new ATOM 0 HA TYR A 17 4.279 0.836 10.051 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.697 1.593 10.658 1.00 0.00 H new ATOM 0 HB3 TYR A 17 6.939 -0.056 11.200 1.00 0.00 H new ATOM 0 HD1 TYR A 17 5.983 -1.865 9.349 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.429 2.054 8.509 1.00 0.00 H new ATOM 0 HE1 TYR A 17 6.485 -2.546 7.042 1.00 0.00 H new ATOM 0 HE2 TYR A 17 7.932 1.376 6.203 1.00 0.00 H new ATOM 0 HH TYR A 17 8.437 -0.744 4.971 1.00 0.00 H new ATOM 242 N ASN A 18 4.935 -1.490 12.293 1.00 0.00 N ATOM 243 CA ASN A 18 4.661 -2.869 12.674 1.00 0.00 C ATOM 244 C ASN A 18 3.180 -3.087 12.942 1.00 0.00 C ATOM 245 O ASN A 18 2.565 -3.952 12.342 1.00 0.00 O ATOM 246 CB ASN A 18 5.464 -3.248 13.917 1.00 0.00 C ATOM 247 CG ASN A 18 6.886 -2.719 13.879 1.00 0.00 C ATOM 248 OD1 ASN A 18 7.596 -2.886 12.888 1.00 0.00 O ATOM 249 ND2 ASN A 18 7.307 -2.076 14.962 1.00 0.00 N ATOM 0 H ASN A 18 5.473 -0.963 12.981 1.00 0.00 H new ATOM 0 HA ASN A 18 4.959 -3.505 11.840 1.00 0.00 H new ATOM 0 HB2 ASN A 18 4.960 -2.860 14.802 1.00 0.00 H new ATOM 0 HB3 ASN A 18 5.487 -4.334 14.013 1.00 0.00 H new ATOM 0 HD21 ASN A 18 8.254 -1.697 14.995 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.684 -1.961 15.761 1.00 0.00 H new ATOM 256 N GLU A 19 2.616 -2.310 13.855 1.00 0.00 N ATOM 257 CA GLU A 19 1.201 -2.442 14.205 1.00 0.00 C ATOM 258 C GLU A 19 0.308 -2.480 12.963 1.00 0.00 C ATOM 259 O GLU A 19 -0.713 -3.169 12.940 1.00 0.00 O ATOM 260 CB GLU A 19 0.775 -1.288 15.115 1.00 0.00 C ATOM 261 CG GLU A 19 0.797 -1.640 16.594 1.00 0.00 C ATOM 262 CD GLU A 19 2.185 -1.542 17.195 1.00 0.00 C ATOM 263 OE1 GLU A 19 2.758 -0.433 17.188 1.00 0.00 O ATOM 264 OE2 GLU A 19 2.698 -2.575 17.674 1.00 0.00 O ATOM 0 H GLU A 19 3.112 -1.581 14.369 1.00 0.00 H new ATOM 0 HA GLU A 19 1.080 -3.389 14.732 1.00 0.00 H new ATOM 0 HB2 GLU A 19 1.435 -0.438 14.943 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -0.231 -0.972 14.840 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.124 -0.973 17.133 1.00 0.00 H new ATOM 0 HG3 GLU A 19 0.417 -2.653 16.729 1.00 0.00 H new ATOM 271 N ILE A 20 0.693 -1.730 11.937 1.00 0.00 N ATOM 272 CA ILE A 20 -0.084 -1.670 10.701 1.00 0.00 C ATOM 273 C ILE A 20 0.076 -2.942 9.870 1.00 0.00 C ATOM 274 O ILE A 20 -0.793 -3.814 9.883 1.00 0.00 O ATOM 275 CB ILE A 20 0.311 -0.440 9.851 1.00 0.00 C ATOM 276 CG1 ILE A 20 -0.117 0.847 10.561 1.00 0.00 C ATOM 277 CG2 ILE A 20 -0.311 -0.513 8.460 1.00 0.00 C ATOM 278 CD1 ILE A 20 -1.617 1.042 10.616 1.00 0.00 C ATOM 0 H ILE A 20 1.536 -1.156 11.935 1.00 0.00 H new ATOM 0 HA ILE A 20 -1.131 -1.578 10.992 1.00 0.00 H new ATOM 0 HB ILE A 20 1.395 -0.437 9.734 1.00 0.00 H new ATOM 0 HG12 ILE A 20 0.277 0.839 11.577 1.00 0.00 H new ATOM 0 HG13 ILE A 20 0.333 1.699 10.052 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.017 0.364 7.884 1.00 0.00 H new ATOM 0 HG22 ILE A 20 0.036 -1.413 7.953 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -1.397 -0.542 8.548 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -1.844 1.974 11.133 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -2.016 1.083 9.602 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -2.073 0.209 11.152 1.00 0.00 H new ATOM 290 N VAL A 21 1.186 -3.037 9.142 1.00 0.00 N ATOM 291 CA VAL A 21 1.459 -4.197 8.295 1.00 0.00 C ATOM 292 C VAL A 21 1.133 -5.506 9.014 1.00 0.00 C ATOM 293 O VAL A 21 0.745 -6.493 8.388 1.00 0.00 O ATOM 294 CB VAL A 21 2.933 -4.215 7.848 1.00 0.00 C ATOM 295 CG1 VAL A 21 3.184 -5.346 6.863 1.00 0.00 C ATOM 296 CG2 VAL A 21 3.318 -2.874 7.241 1.00 0.00 C ATOM 0 H VAL A 21 1.914 -2.322 9.121 1.00 0.00 H new ATOM 0 HA VAL A 21 0.816 -4.111 7.419 1.00 0.00 H new ATOM 0 HB VAL A 21 3.557 -4.388 8.725 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.231 -5.340 6.561 1.00 0.00 H new ATOM 0 HG12 VAL A 21 2.949 -6.299 7.336 1.00 0.00 H new ATOM 0 HG13 VAL A 21 2.552 -5.211 5.985 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.362 -2.902 6.930 1.00 0.00 H new ATOM 0 HG22 VAL A 21 2.687 -2.672 6.376 1.00 0.00 H new ATOM 0 HG23 VAL A 21 3.181 -2.086 7.982 1.00 0.00 H new ATOM 306 N LEU A 22 1.294 -5.500 10.330 1.00 0.00 N ATOM 307 CA LEU A 22 1.022 -6.675 11.152 1.00 0.00 C ATOM 308 C LEU A 22 -0.466 -7.006 11.172 1.00 0.00 C ATOM 309 O LEU A 22 -0.848 -8.172 11.084 1.00 0.00 O ATOM 310 CB LEU A 22 1.513 -6.442 12.581 1.00 0.00 C ATOM 311 CG LEU A 22 3.019 -6.611 12.786 1.00 0.00 C ATOM 312 CD1 LEU A 22 3.424 -6.145 14.176 1.00 0.00 C ATOM 313 CD2 LEU A 22 3.426 -8.061 12.568 1.00 0.00 C ATOM 0 H LEU A 22 1.615 -4.687 10.857 1.00 0.00 H new ATOM 0 HA LEU A 22 1.556 -7.518 10.714 1.00 0.00 H new ATOM 0 HB2 LEU A 22 1.232 -5.434 12.885 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.992 -7.132 13.245 1.00 0.00 H new ATOM 0 HG LEU A 22 3.538 -5.994 12.053 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.499 -6.273 14.304 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.167 -5.093 14.296 1.00 0.00 H new ATOM 0 HD13 LEU A 22 2.897 -6.735 14.926 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.501 -8.164 12.718 1.00 0.00 H new ATOM 0 HD22 LEU A 22 2.898 -8.698 13.278 1.00 0.00 H new ATOM 0 HD23 LEU A 22 3.171 -8.362 11.552 1.00 0.00 H new ATOM 325 N ASP A 23 -1.302 -5.975 11.301 1.00 0.00 N ATOM 326 CA ASP A 23 -2.754 -6.159 11.346 1.00 0.00 C ATOM 327 C ASP A 23 -3.230 -7.123 10.259 1.00 0.00 C ATOM 328 O ASP A 23 -3.516 -6.715 9.134 1.00 0.00 O ATOM 329 CB ASP A 23 -3.462 -4.812 11.192 1.00 0.00 C ATOM 330 CG ASP A 23 -4.862 -4.825 11.773 1.00 0.00 C ATOM 331 OD1 ASP A 23 -4.999 -5.097 12.984 1.00 0.00 O ATOM 332 OD2 ASP A 23 -5.821 -4.564 11.017 1.00 0.00 O ATOM 0 H ASP A 23 -0.999 -5.004 11.376 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.004 -6.591 12.315 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.874 -4.037 11.685 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -3.513 -4.550 10.135 1.00 0.00 H new ATOM 337 N ASP A 24 -3.309 -8.404 10.610 1.00 0.00 N ATOM 338 CA ASP A 24 -3.747 -9.434 9.674 1.00 0.00 C ATOM 339 C ASP A 24 -5.272 -9.539 9.629 1.00 0.00 C ATOM 340 O ASP A 24 -5.828 -10.211 8.761 1.00 0.00 O ATOM 341 CB ASP A 24 -3.144 -10.787 10.058 1.00 0.00 C ATOM 342 CG ASP A 24 -1.835 -11.058 9.345 1.00 0.00 C ATOM 343 OD1 ASP A 24 -0.829 -10.396 9.678 1.00 0.00 O ATOM 344 OD2 ASP A 24 -1.814 -11.933 8.453 1.00 0.00 O ATOM 0 H ASP A 24 -3.074 -8.754 11.539 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.398 -9.150 8.681 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -2.981 -10.817 11.135 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.855 -11.579 9.821 1.00 0.00 H new ATOM 349 N THR A 25 -5.945 -8.878 10.567 1.00 0.00 N ATOM 350 CA THR A 25 -7.402 -8.910 10.623 1.00 0.00 C ATOM 351 C THR A 25 -8.018 -8.133 9.461 1.00 0.00 C ATOM 352 O THR A 25 -9.221 -8.221 9.215 1.00 0.00 O ATOM 353 CB THR A 25 -7.894 -8.334 11.952 1.00 0.00 C ATOM 354 OG1 THR A 25 -9.309 -8.280 11.983 1.00 0.00 O ATOM 355 CG2 THR A 25 -7.375 -6.939 12.227 1.00 0.00 C ATOM 0 H THR A 25 -5.506 -8.316 11.296 1.00 0.00 H new ATOM 0 HA THR A 25 -7.716 -9.951 10.543 1.00 0.00 H new ATOM 0 HB THR A 25 -7.508 -9.006 12.719 1.00 0.00 H new ATOM 0 HG1 THR A 25 -9.657 -8.293 11.067 1.00 0.00 H new ATOM 0 HG21 THR A 25 -7.761 -6.589 13.184 1.00 0.00 H new ATOM 0 HG22 THR A 25 -6.286 -6.956 12.259 1.00 0.00 H new ATOM 0 HG23 THR A 25 -7.704 -6.266 11.435 1.00 0.00 H new ATOM 363 N LYS A 26 -7.191 -7.373 8.748 1.00 0.00 N ATOM 364 CA LYS A 26 -7.661 -6.587 7.615 1.00 0.00 C ATOM 365 C LYS A 26 -6.652 -6.626 6.472 1.00 0.00 C ATOM 366 O LYS A 26 -5.503 -7.028 6.660 1.00 0.00 O ATOM 367 CB LYS A 26 -7.910 -5.139 8.043 1.00 0.00 C ATOM 368 CG LYS A 26 -9.313 -4.894 8.574 1.00 0.00 C ATOM 369 CD LYS A 26 -9.476 -3.470 9.087 1.00 0.00 C ATOM 370 CE LYS A 26 -9.718 -3.441 10.588 1.00 0.00 C ATOM 371 NZ LYS A 26 -11.168 -3.508 10.918 1.00 0.00 N ATOM 0 H LYS A 26 -6.192 -7.286 8.936 1.00 0.00 H new ATOM 0 HA LYS A 26 -8.597 -7.021 7.264 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -7.187 -4.867 8.812 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -7.733 -4.482 7.192 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -10.040 -5.082 7.784 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -9.527 -5.598 9.378 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -8.582 -2.893 8.851 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -10.310 -2.991 8.574 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -9.200 -4.279 11.055 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -9.292 -2.529 11.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -11.377 -2.853 11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -11.727 -3.241 10.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.415 -4.477 11.204 1.00 0.00 H new ATOM 385 N ASP A 27 -7.085 -6.204 5.289 1.00 0.00 N ATOM 386 CA ASP A 27 -6.215 -6.188 4.119 1.00 0.00 C ATOM 387 C ASP A 27 -5.329 -4.947 4.129 1.00 0.00 C ATOM 388 O ASP A 27 -5.822 -3.823 4.226 1.00 0.00 O ATOM 389 CB ASP A 27 -7.048 -6.226 2.835 1.00 0.00 C ATOM 390 CG ASP A 27 -7.119 -7.615 2.232 1.00 0.00 C ATOM 391 OD1 ASP A 27 -6.202 -8.423 2.492 1.00 0.00 O ATOM 392 OD2 ASP A 27 -8.091 -7.896 1.500 1.00 0.00 O ATOM 0 H ASP A 27 -8.032 -5.869 5.115 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.579 -7.072 4.153 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -8.057 -5.874 3.049 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -6.619 -5.538 2.106 1.00 0.00 H new ATOM 397 N VAL A 28 -4.019 -5.155 4.035 1.00 0.00 N ATOM 398 CA VAL A 28 -3.073 -4.048 4.041 1.00 0.00 C ATOM 399 C VAL A 28 -2.349 -3.931 2.706 1.00 0.00 C ATOM 400 O VAL A 28 -2.031 -4.932 2.067 1.00 0.00 O ATOM 401 CB VAL A 28 -2.035 -4.204 5.170 1.00 0.00 C ATOM 402 CG1 VAL A 28 -1.044 -3.048 5.158 1.00 0.00 C ATOM 403 CG2 VAL A 28 -2.730 -4.300 6.518 1.00 0.00 C ATOM 0 H VAL A 28 -3.591 -6.077 3.954 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.651 -3.140 4.213 1.00 0.00 H new ATOM 0 HB VAL A 28 -1.480 -5.126 5.000 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.321 -3.180 5.963 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -0.522 -3.027 4.202 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.579 -2.109 5.300 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.984 -4.410 7.305 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -3.311 -3.395 6.693 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -3.394 -5.164 6.524 1.00 0.00 H new ATOM 413 N LEU A 29 -2.087 -2.696 2.299 1.00 0.00 N ATOM 414 CA LEU A 29 -1.394 -2.429 1.045 1.00 0.00 C ATOM 415 C LEU A 29 -0.336 -1.352 1.247 1.00 0.00 C ATOM 416 O LEU A 29 -0.645 -0.162 1.236 1.00 0.00 O ATOM 417 CB LEU A 29 -2.389 -1.983 -0.031 1.00 0.00 C ATOM 418 CG LEU A 29 -2.184 -2.596 -1.421 1.00 0.00 C ATOM 419 CD1 LEU A 29 -3.086 -1.915 -2.437 1.00 0.00 C ATOM 420 CD2 LEU A 29 -0.726 -2.496 -1.855 1.00 0.00 C ATOM 0 H LEU A 29 -2.345 -1.859 2.822 1.00 0.00 H new ATOM 0 HA LEU A 29 -0.909 -3.348 0.717 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -3.396 -2.226 0.308 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -2.336 -0.898 -0.121 1.00 0.00 H new ATOM 0 HG LEU A 29 -2.449 -3.652 -1.367 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.929 -2.361 -3.419 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -4.128 -2.043 -2.142 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.849 -0.852 -2.479 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -0.610 -2.939 -2.844 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.427 -1.448 -1.889 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.097 -3.030 -1.143 1.00 0.00 H new ATOM 432 N ILE A 30 0.911 -1.769 1.432 1.00 0.00 N ATOM 433 CA ILE A 30 1.998 -0.822 1.637 1.00 0.00 C ATOM 434 C ILE A 30 2.974 -0.845 0.469 1.00 0.00 C ATOM 435 O ILE A 30 3.349 -1.911 -0.017 1.00 0.00 O ATOM 436 CB ILE A 30 2.767 -1.114 2.941 1.00 0.00 C ATOM 437 CG1 ILE A 30 3.855 -0.056 3.162 1.00 0.00 C ATOM 438 CG2 ILE A 30 3.370 -2.511 2.900 1.00 0.00 C ATOM 439 CD1 ILE A 30 4.772 -0.355 4.328 1.00 0.00 C ATOM 0 H ILE A 30 1.192 -2.749 1.444 1.00 0.00 H new ATOM 0 HA ILE A 30 1.543 0.166 1.709 1.00 0.00 H new ATOM 0 HB ILE A 30 2.070 -1.070 3.778 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.453 0.031 2.255 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.380 0.911 3.325 1.00 0.00 H new ATOM 0 HG21 ILE A 30 3.910 -2.702 3.828 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.575 -3.247 2.785 1.00 0.00 H new ATOM 0 HG23 ILE A 30 4.058 -2.586 2.058 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.514 0.438 4.420 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.187 -0.412 5.246 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.277 -1.306 4.159 1.00 0.00 H new ATOM 451 N GLU A 31 3.392 0.337 0.031 1.00 0.00 N ATOM 452 CA GLU A 31 4.338 0.441 -1.073 1.00 0.00 C ATOM 453 C GLU A 31 5.563 1.242 -0.655 1.00 0.00 C ATOM 454 O GLU A 31 5.457 2.227 0.074 1.00 0.00 O ATOM 455 CB GLU A 31 3.688 1.063 -2.316 1.00 0.00 C ATOM 456 CG GLU A 31 2.598 2.082 -2.022 1.00 0.00 C ATOM 457 CD GLU A 31 3.119 3.506 -2.002 1.00 0.00 C ATOM 458 OE1 GLU A 31 4.183 3.741 -1.393 1.00 0.00 O ATOM 459 OE2 GLU A 31 2.463 4.386 -2.597 1.00 0.00 O ATOM 0 H GLU A 31 3.093 1.231 0.420 1.00 0.00 H new ATOM 0 HA GLU A 31 4.653 -0.570 -1.334 1.00 0.00 H new ATOM 0 HB2 GLU A 31 4.464 1.543 -2.913 1.00 0.00 H new ATOM 0 HB3 GLU A 31 3.265 0.265 -2.926 1.00 0.00 H new ATOM 0 HG2 GLU A 31 1.814 1.997 -2.774 1.00 0.00 H new ATOM 0 HG3 GLU A 31 2.142 1.853 -1.059 1.00 0.00 H new ATOM 466 N PHE A 32 6.727 0.804 -1.116 1.00 0.00 N ATOM 467 CA PHE A 32 7.981 1.470 -0.785 1.00 0.00 C ATOM 468 C PHE A 32 8.485 2.286 -1.968 1.00 0.00 C ATOM 469 O PHE A 32 8.455 1.825 -3.109 1.00 0.00 O ATOM 470 CB PHE A 32 9.040 0.443 -0.359 1.00 0.00 C ATOM 471 CG PHE A 32 8.472 -0.745 0.374 1.00 0.00 C ATOM 472 CD1 PHE A 32 7.752 -1.719 -0.303 1.00 0.00 C ATOM 473 CD2 PHE A 32 8.653 -0.884 1.741 1.00 0.00 C ATOM 474 CE1 PHE A 32 7.223 -2.804 0.368 1.00 0.00 C ATOM 475 CE2 PHE A 32 8.128 -1.970 2.417 1.00 0.00 C ATOM 476 CZ PHE A 32 7.411 -2.930 1.729 1.00 0.00 C ATOM 0 H PHE A 32 6.830 -0.011 -1.721 1.00 0.00 H new ATOM 0 HA PHE A 32 7.797 2.147 0.049 1.00 0.00 H new ATOM 0 HB2 PHE A 32 9.570 0.093 -1.244 1.00 0.00 H new ATOM 0 HB3 PHE A 32 9.774 0.935 0.279 1.00 0.00 H new ATOM 0 HD1 PHE A 32 7.603 -1.627 -1.369 1.00 0.00 H new ATOM 0 HD2 PHE A 32 9.210 -0.136 2.284 1.00 0.00 H new ATOM 0 HE1 PHE A 32 6.663 -3.553 -0.172 1.00 0.00 H new ATOM 0 HE2 PHE A 32 8.278 -2.068 3.482 1.00 0.00 H new ATOM 0 HZ PHE A 32 6.998 -3.778 2.256 1.00 0.00 H new ATOM 486 N TYR A 33 8.942 3.502 -1.693 1.00 0.00 N ATOM 487 CA TYR A 33 9.446 4.379 -2.743 1.00 0.00 C ATOM 488 C TYR A 33 10.399 5.424 -2.175 1.00 0.00 C ATOM 489 O TYR A 33 10.497 5.596 -0.961 1.00 0.00 O ATOM 490 CB TYR A 33 8.285 5.069 -3.460 1.00 0.00 C ATOM 491 CG TYR A 33 7.447 5.945 -2.556 1.00 0.00 C ATOM 492 CD1 TYR A 33 6.717 5.398 -1.509 1.00 0.00 C ATOM 493 CD2 TYR A 33 7.386 7.318 -2.752 1.00 0.00 C ATOM 494 CE1 TYR A 33 5.949 6.195 -0.681 1.00 0.00 C ATOM 495 CE2 TYR A 33 6.621 8.123 -1.929 1.00 0.00 C ATOM 496 CZ TYR A 33 5.904 7.557 -0.896 1.00 0.00 C ATOM 497 OH TYR A 33 5.141 8.354 -0.075 1.00 0.00 O ATOM 0 H TYR A 33 8.974 3.902 -0.755 1.00 0.00 H new ATOM 0 HA TYR A 33 9.995 3.766 -3.458 1.00 0.00 H new ATOM 0 HB2 TYR A 33 8.681 5.676 -4.274 1.00 0.00 H new ATOM 0 HB3 TYR A 33 7.645 4.310 -3.911 1.00 0.00 H new ATOM 0 HD1 TYR A 33 6.750 4.332 -1.339 1.00 0.00 H new ATOM 0 HD2 TYR A 33 7.945 7.764 -3.561 1.00 0.00 H new ATOM 0 HE1 TYR A 33 5.388 5.754 0.129 1.00 0.00 H new ATOM 0 HE2 TYR A 33 6.585 9.190 -2.094 1.00 0.00 H new ATOM 0 HH TYR A 33 5.637 8.545 0.749 1.00 0.00 H new ATOM 507 N ALA A 34 11.098 6.122 -3.064 1.00 0.00 N ATOM 508 CA ALA A 34 12.042 7.153 -2.653 1.00 0.00 C ATOM 509 C ALA A 34 11.560 8.538 -3.079 1.00 0.00 C ATOM 510 O ALA A 34 11.021 8.705 -4.173 1.00 0.00 O ATOM 511 CB ALA A 34 13.418 6.868 -3.236 1.00 0.00 C ATOM 0 H ALA A 34 11.028 5.992 -4.073 1.00 0.00 H new ATOM 0 HA ALA A 34 12.110 7.139 -1.565 1.00 0.00 H new ATOM 0 HB1 ALA A 34 14.114 7.645 -2.922 1.00 0.00 H new ATOM 0 HB2 ALA A 34 13.770 5.900 -2.880 1.00 0.00 H new ATOM 0 HB3 ALA A 34 13.356 6.854 -4.324 1.00 0.00 H new ATOM 517 N PRO A 35 11.748 9.554 -2.219 1.00 0.00 N ATOM 518 CA PRO A 35 11.329 10.927 -2.517 1.00 0.00 C ATOM 519 C PRO A 35 12.217 11.599 -3.562 1.00 0.00 C ATOM 520 O PRO A 35 11.933 12.711 -4.006 1.00 0.00 O ATOM 521 CB PRO A 35 11.461 11.636 -1.168 1.00 0.00 C ATOM 522 CG PRO A 35 12.521 10.878 -0.447 1.00 0.00 C ATOM 523 CD PRO A 35 12.384 9.447 -0.891 1.00 0.00 C ATOM 0 HA PRO A 35 10.325 10.962 -2.939 1.00 0.00 H new ATOM 0 HB2 PRO A 35 11.739 12.682 -1.296 1.00 0.00 H new ATOM 0 HB3 PRO A 35 10.520 11.621 -0.619 1.00 0.00 H new ATOM 0 HG2 PRO A 35 13.510 11.268 -0.687 1.00 0.00 H new ATOM 0 HG3 PRO A 35 12.397 10.965 0.632 1.00 0.00 H new ATOM 0 HD2 PRO A 35 13.353 8.951 -0.949 1.00 0.00 H new ATOM 0 HD3 PRO A 35 11.771 8.869 -0.199 1.00 0.00 H new ATOM 531 N TRP A 36 13.293 10.920 -3.950 1.00 0.00 N ATOM 532 CA TRP A 36 14.218 11.457 -4.943 1.00 0.00 C ATOM 533 C TRP A 36 14.018 10.789 -6.301 1.00 0.00 C ATOM 534 O TRP A 36 14.374 11.351 -7.337 1.00 0.00 O ATOM 535 CB TRP A 36 15.669 11.280 -4.481 1.00 0.00 C ATOM 536 CG TRP A 36 15.914 10.005 -3.729 1.00 0.00 C ATOM 537 CD1 TRP A 36 15.664 9.772 -2.407 1.00 0.00 C ATOM 538 CD2 TRP A 36 16.458 8.790 -4.255 1.00 0.00 C ATOM 539 NE1 TRP A 36 16.019 8.485 -2.079 1.00 0.00 N ATOM 540 CE2 TRP A 36 16.510 7.862 -3.197 1.00 0.00 C ATOM 541 CE3 TRP A 36 16.907 8.395 -5.519 1.00 0.00 C ATOM 542 CZ2 TRP A 36 16.992 6.567 -3.365 1.00 0.00 C ATOM 543 CZ3 TRP A 36 17.385 7.109 -5.684 1.00 0.00 C ATOM 544 CH2 TRP A 36 17.424 6.208 -4.613 1.00 0.00 C ATOM 0 H TRP A 36 13.545 9.999 -3.593 1.00 0.00 H new ATOM 0 HA TRP A 36 14.008 12.521 -5.050 1.00 0.00 H new ATOM 0 HB2 TRP A 36 16.324 11.309 -5.352 1.00 0.00 H new ATOM 0 HB3 TRP A 36 15.944 12.123 -3.847 1.00 0.00 H new ATOM 0 HD1 TRP A 36 15.248 10.493 -1.719 1.00 0.00 H new ATOM 0 HE1 TRP A 36 15.931 8.063 -1.155 1.00 0.00 H new ATOM 0 HE3 TRP A 36 16.881 9.083 -6.351 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 17.024 5.871 -2.540 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 17.735 6.793 -6.656 1.00 0.00 H new ATOM 0 HH2 TRP A 36 17.803 5.210 -4.775 1.00 0.00 H new ATOM 555 N CYS A 37 13.446 9.588 -6.292 1.00 0.00 N ATOM 556 CA CYS A 37 13.200 8.849 -7.527 1.00 0.00 C ATOM 557 C CYS A 37 12.075 9.492 -8.332 1.00 0.00 C ATOM 558 O CYS A 37 11.083 9.957 -7.770 1.00 0.00 O ATOM 559 CB CYS A 37 12.852 7.393 -7.213 1.00 0.00 C ATOM 560 SG CYS A 37 12.564 6.372 -8.677 1.00 0.00 S ATOM 0 H CYS A 37 13.145 9.106 -5.445 1.00 0.00 H new ATOM 0 HA CYS A 37 14.111 8.877 -8.125 1.00 0.00 H new ATOM 0 HB2 CYS A 37 13.662 6.954 -6.631 1.00 0.00 H new ATOM 0 HB3 CYS A 37 11.961 7.371 -6.586 1.00 0.00 H new ATOM 0 HG CYS A 37 12.468 5.125 -8.324 1.00 0.00 H new ATOM 566 N GLY A 38 12.236 9.517 -9.651 1.00 0.00 N ATOM 567 CA GLY A 38 11.227 10.106 -10.512 1.00 0.00 C ATOM 568 C GLY A 38 10.080 9.157 -10.802 1.00 0.00 C ATOM 569 O GLY A 38 8.912 9.539 -10.720 1.00 0.00 O ATOM 0 H GLY A 38 13.048 9.140 -10.139 1.00 0.00 H new ATOM 0 HA2 GLY A 38 10.837 11.009 -10.043 1.00 0.00 H new ATOM 0 HA3 GLY A 38 11.689 10.409 -11.452 1.00 0.00 H new ATOM 573 N HIS A 39 10.411 7.915 -11.142 1.00 0.00 N ATOM 574 CA HIS A 39 9.398 6.909 -11.445 1.00 0.00 C ATOM 575 C HIS A 39 8.420 6.750 -10.284 1.00 0.00 C ATOM 576 O HIS A 39 7.269 6.359 -10.479 1.00 0.00 O ATOM 577 CB HIS A 39 10.060 5.565 -11.756 1.00 0.00 C ATOM 578 CG HIS A 39 9.137 4.580 -12.402 1.00 0.00 C ATOM 579 ND1 HIS A 39 9.166 3.228 -12.128 1.00 0.00 N ATOM 580 CD2 HIS A 39 8.152 4.755 -13.316 1.00 0.00 C ATOM 581 CE1 HIS A 39 8.240 2.615 -12.845 1.00 0.00 C ATOM 582 NE2 HIS A 39 7.611 3.519 -13.573 1.00 0.00 N ATOM 0 H HIS A 39 11.372 7.581 -11.215 1.00 0.00 H new ATOM 0 HA HIS A 39 8.842 7.245 -12.320 1.00 0.00 H new ATOM 0 HB2 HIS A 39 10.915 5.733 -12.411 1.00 0.00 H new ATOM 0 HB3 HIS A 39 10.446 5.137 -10.831 1.00 0.00 H new ATOM 0 HD2 HIS A 39 7.849 5.692 -13.760 1.00 0.00 H new ATOM 0 HE1 HIS A 39 8.033 1.555 -12.837 1.00 0.00 H new ATOM 0 HE2 HIS A 39 6.847 3.330 -14.222 1.00 0.00 H new ATOM 591 N CYS A 40 8.886 7.056 -9.077 1.00 0.00 N ATOM 592 CA CYS A 40 8.052 6.946 -7.886 1.00 0.00 C ATOM 593 C CYS A 40 7.055 8.099 -7.809 1.00 0.00 C ATOM 594 O CYS A 40 5.955 7.946 -7.278 1.00 0.00 O ATOM 595 CB CYS A 40 8.924 6.925 -6.630 1.00 0.00 C ATOM 596 SG CYS A 40 10.039 5.505 -6.531 1.00 0.00 S ATOM 0 H CYS A 40 9.836 7.382 -8.898 1.00 0.00 H new ATOM 0 HA CYS A 40 7.493 6.012 -7.949 1.00 0.00 H new ATOM 0 HB2 CYS A 40 9.515 7.840 -6.595 1.00 0.00 H new ATOM 0 HB3 CYS A 40 8.278 6.929 -5.752 1.00 0.00 H new ATOM 0 HG CYS A 40 11.028 5.671 -7.359 1.00 0.00 H new ATOM 602 N LYS A 41 7.446 9.252 -8.343 1.00 0.00 N ATOM 603 CA LYS A 41 6.584 10.428 -8.334 1.00 0.00 C ATOM 604 C LYS A 41 5.294 10.161 -9.103 1.00 0.00 C ATOM 605 O LYS A 41 4.207 10.527 -8.657 1.00 0.00 O ATOM 606 CB LYS A 41 7.314 11.629 -8.939 1.00 0.00 C ATOM 607 CG LYS A 41 8.170 12.389 -7.937 1.00 0.00 C ATOM 608 CD LYS A 41 7.541 13.721 -7.558 1.00 0.00 C ATOM 609 CE LYS A 41 8.289 14.890 -8.181 1.00 0.00 C ATOM 610 NZ LYS A 41 8.612 14.643 -9.613 1.00 0.00 N ATOM 0 H LYS A 41 8.353 9.397 -8.787 1.00 0.00 H new ATOM 0 HA LYS A 41 6.329 10.653 -7.298 1.00 0.00 H new ATOM 0 HB2 LYS A 41 7.946 11.285 -9.757 1.00 0.00 H new ATOM 0 HB3 LYS A 41 6.580 12.311 -9.369 1.00 0.00 H new ATOM 0 HG2 LYS A 41 8.307 11.783 -7.041 1.00 0.00 H new ATOM 0 HG3 LYS A 41 9.160 12.561 -8.360 1.00 0.00 H new ATOM 0 HD2 LYS A 41 6.501 13.739 -7.883 1.00 0.00 H new ATOM 0 HD3 LYS A 41 7.537 13.827 -6.473 1.00 0.00 H new ATOM 0 HE2 LYS A 41 7.686 15.794 -8.096 1.00 0.00 H new ATOM 0 HE3 LYS A 41 9.210 15.068 -7.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 8.637 15.548 -10.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 9.540 14.179 -9.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 7.885 14.029 -10.032 1.00 0.00 H new ATOM 624 N ALA A 42 5.423 9.519 -10.259 1.00 0.00 N ATOM 625 CA ALA A 42 4.266 9.201 -11.089 1.00 0.00 C ATOM 626 C ALA A 42 3.368 8.175 -10.407 1.00 0.00 C ATOM 627 O ALA A 42 2.143 8.237 -10.514 1.00 0.00 O ATOM 628 CB ALA A 42 4.717 8.691 -12.449 1.00 0.00 C ATOM 0 H ALA A 42 6.316 9.209 -10.643 1.00 0.00 H new ATOM 0 HA ALA A 42 3.688 10.114 -11.230 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.844 8.458 -13.058 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.312 9.457 -12.946 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.319 7.792 -12.319 1.00 0.00 H new ATOM 634 N LEU A 43 3.986 7.231 -9.704 1.00 0.00 N ATOM 635 CA LEU A 43 3.246 6.188 -9.001 1.00 0.00 C ATOM 636 C LEU A 43 2.599 6.732 -7.726 1.00 0.00 C ATOM 637 O LEU A 43 1.762 6.069 -7.114 1.00 0.00 O ATOM 638 CB LEU A 43 4.180 5.021 -8.661 1.00 0.00 C ATOM 639 CG LEU A 43 3.502 3.772 -8.084 1.00 0.00 C ATOM 640 CD1 LEU A 43 3.348 3.895 -6.575 1.00 0.00 C ATOM 641 CD2 LEU A 43 2.152 3.531 -8.746 1.00 0.00 C ATOM 0 H LEU A 43 4.999 7.167 -9.606 1.00 0.00 H new ATOM 0 HA LEU A 43 2.452 5.834 -9.658 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.718 4.735 -9.565 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.924 5.372 -7.945 1.00 0.00 H new ATOM 0 HG LEU A 43 4.138 2.913 -8.295 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.865 2.999 -6.184 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.331 4.007 -6.117 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.738 4.767 -6.341 1.00 0.00 H new ATOM 0 HD21 LEU A 43 1.692 2.640 -8.320 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.504 4.391 -8.575 1.00 0.00 H new ATOM 0 HD23 LEU A 43 2.292 3.389 -9.818 1.00 0.00 H new ATOM 653 N ALA A 44 2.993 7.940 -7.330 1.00 0.00 N ATOM 654 CA ALA A 44 2.453 8.568 -6.131 1.00 0.00 C ATOM 655 C ALA A 44 0.963 8.876 -6.278 1.00 0.00 C ATOM 656 O ALA A 44 0.151 8.431 -5.468 1.00 0.00 O ATOM 657 CB ALA A 44 3.226 9.839 -5.810 1.00 0.00 C ATOM 0 H ALA A 44 3.685 8.503 -7.824 1.00 0.00 H new ATOM 0 HA ALA A 44 2.565 7.863 -5.307 1.00 0.00 H new ATOM 0 HB1 ALA A 44 2.813 10.299 -4.912 1.00 0.00 H new ATOM 0 HB2 ALA A 44 4.275 9.594 -5.643 1.00 0.00 H new ATOM 0 HB3 ALA A 44 3.144 10.535 -6.645 1.00 0.00 H new ATOM 663 N PRO A 45 0.580 9.653 -7.309 1.00 0.00 N ATOM 664 CA PRO A 45 -0.823 10.020 -7.540 1.00 0.00 C ATOM 665 C PRO A 45 -1.717 8.810 -7.794 1.00 0.00 C ATOM 666 O PRO A 45 -2.858 8.764 -7.334 1.00 0.00 O ATOM 667 CB PRO A 45 -0.769 10.916 -8.784 1.00 0.00 C ATOM 668 CG PRO A 45 0.535 10.604 -9.434 1.00 0.00 C ATOM 669 CD PRO A 45 1.475 10.241 -8.320 1.00 0.00 C ATOM 0 HA PRO A 45 -1.254 10.509 -6.666 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -1.603 10.709 -9.455 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -0.832 11.970 -8.513 1.00 0.00 H new ATOM 0 HG2 PRO A 45 0.432 9.781 -10.141 1.00 0.00 H new ATOM 0 HG3 PRO A 45 0.907 11.462 -9.995 1.00 0.00 H new ATOM 0 HD2 PRO A 45 2.235 9.531 -8.648 1.00 0.00 H new ATOM 0 HD3 PRO A 45 2.000 11.115 -7.935 1.00 0.00 H new ATOM 677 N LYS A 46 -1.198 7.833 -8.530 1.00 0.00 N ATOM 678 CA LYS A 46 -1.960 6.627 -8.842 1.00 0.00 C ATOM 679 C LYS A 46 -2.304 5.854 -7.575 1.00 0.00 C ATOM 680 O LYS A 46 -3.475 5.600 -7.291 1.00 0.00 O ATOM 681 CB LYS A 46 -1.169 5.733 -9.800 1.00 0.00 C ATOM 682 CG LYS A 46 -0.744 6.436 -11.078 1.00 0.00 C ATOM 683 CD LYS A 46 -1.929 6.697 -11.995 1.00 0.00 C ATOM 684 CE LYS A 46 -1.784 5.964 -13.319 1.00 0.00 C ATOM 685 NZ LYS A 46 -3.065 5.928 -14.078 1.00 0.00 N ATOM 0 H LYS A 46 -0.256 7.851 -8.921 1.00 0.00 H new ATOM 0 HA LYS A 46 -2.890 6.931 -9.322 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.282 5.361 -9.288 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.776 4.865 -10.057 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.260 7.381 -10.830 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.006 5.827 -11.601 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -2.848 6.380 -11.502 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.019 7.768 -12.179 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.018 6.452 -13.922 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.443 4.945 -13.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.079 5.091 -14.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -3.862 5.880 -13.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -3.149 6.787 -14.657 1.00 0.00 H new ATOM 699 N TYR A 47 -1.281 5.484 -6.814 1.00 0.00 N ATOM 700 CA TYR A 47 -1.484 4.742 -5.577 1.00 0.00 C ATOM 701 C TYR A 47 -2.319 5.551 -4.589 1.00 0.00 C ATOM 702 O TYR A 47 -2.991 4.989 -3.725 1.00 0.00 O ATOM 703 CB TYR A 47 -0.141 4.377 -4.946 1.00 0.00 C ATOM 704 CG TYR A 47 -0.233 3.248 -3.946 1.00 0.00 C ATOM 705 CD1 TYR A 47 -0.300 1.926 -4.367 1.00 0.00 C ATOM 706 CD2 TYR A 47 -0.255 3.504 -2.581 1.00 0.00 C ATOM 707 CE1 TYR A 47 -0.386 0.891 -3.456 1.00 0.00 C ATOM 708 CE2 TYR A 47 -0.341 2.475 -1.664 1.00 0.00 C ATOM 709 CZ TYR A 47 -0.406 1.171 -2.107 1.00 0.00 C ATOM 710 OH TYR A 47 -0.492 0.143 -1.197 1.00 0.00 O ATOM 0 H TYR A 47 -0.305 5.685 -7.031 1.00 0.00 H new ATOM 0 HA TYR A 47 -2.023 3.826 -5.819 1.00 0.00 H new ATOM 0 HB2 TYR A 47 0.558 4.098 -5.734 1.00 0.00 H new ATOM 0 HB3 TYR A 47 0.271 5.257 -4.452 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -0.285 1.704 -5.424 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -0.204 4.524 -2.231 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -0.437 -0.132 -3.799 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -0.357 2.691 -0.606 1.00 0.00 H new ATOM 0 HH TYR A 47 -0.462 0.508 -0.288 1.00 0.00 H new ATOM 720 N GLU A 48 -2.271 6.872 -4.723 1.00 0.00 N ATOM 721 CA GLU A 48 -3.024 7.756 -3.842 1.00 0.00 C ATOM 722 C GLU A 48 -4.517 7.675 -4.139 1.00 0.00 C ATOM 723 O GLU A 48 -5.341 7.653 -3.225 1.00 0.00 O ATOM 724 CB GLU A 48 -2.539 9.199 -3.995 1.00 0.00 C ATOM 725 CG GLU A 48 -3.247 10.180 -3.074 1.00 0.00 C ATOM 726 CD GLU A 48 -3.375 11.562 -3.684 1.00 0.00 C ATOM 727 OE1 GLU A 48 -4.218 11.736 -4.590 1.00 0.00 O ATOM 728 OE2 GLU A 48 -2.634 12.471 -3.256 1.00 0.00 O ATOM 0 H GLU A 48 -1.719 7.353 -5.433 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.857 7.432 -2.815 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -1.468 9.236 -3.797 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.684 9.514 -5.028 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -4.240 9.798 -2.836 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.699 10.251 -2.134 1.00 0.00 H new ATOM 735 N GLU A 49 -4.859 7.632 -5.423 1.00 0.00 N ATOM 736 CA GLU A 49 -6.255 7.554 -5.834 1.00 0.00 C ATOM 737 C GLU A 49 -6.893 6.264 -5.333 1.00 0.00 C ATOM 738 O GLU A 49 -7.827 6.296 -4.535 1.00 0.00 O ATOM 739 CB GLU A 49 -6.365 7.635 -7.358 1.00 0.00 C ATOM 740 CG GLU A 49 -7.709 8.152 -7.844 1.00 0.00 C ATOM 741 CD GLU A 49 -8.671 7.034 -8.196 1.00 0.00 C ATOM 742 OE1 GLU A 49 -8.398 6.299 -9.168 1.00 0.00 O ATOM 743 OE2 GLU A 49 -9.699 6.894 -7.499 1.00 0.00 O ATOM 0 H GLU A 49 -4.191 7.650 -6.194 1.00 0.00 H new ATOM 0 HA GLU A 49 -6.788 8.398 -5.395 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.576 8.285 -7.737 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.192 6.645 -7.780 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -8.154 8.779 -7.071 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -7.556 8.784 -8.719 1.00 0.00 H new ATOM 750 N LEU A 50 -6.378 5.131 -5.802 1.00 0.00 N ATOM 751 CA LEU A 50 -6.897 3.826 -5.396 1.00 0.00 C ATOM 752 C LEU A 50 -6.848 3.666 -3.878 1.00 0.00 C ATOM 753 O LEU A 50 -7.686 2.980 -3.283 1.00 0.00 O ATOM 754 CB LEU A 50 -6.096 2.704 -6.065 1.00 0.00 C ATOM 755 CG LEU A 50 -6.549 1.280 -5.725 1.00 0.00 C ATOM 756 CD1 LEU A 50 -6.002 0.853 -4.371 1.00 0.00 C ATOM 757 CD2 LEU A 50 -8.069 1.177 -5.744 1.00 0.00 C ATOM 0 H LEU A 50 -5.602 5.089 -6.463 1.00 0.00 H new ATOM 0 HA LEU A 50 -7.937 3.762 -5.716 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -6.151 2.836 -7.146 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.048 2.811 -5.783 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.152 0.607 -6.485 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.335 -0.161 -4.147 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.913 0.881 -4.393 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -6.366 1.533 -3.601 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -8.368 0.158 -5.500 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -8.489 1.864 -5.010 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -8.439 1.436 -6.736 1.00 0.00 H new ATOM 769 N GLY A 51 -5.864 4.306 -3.255 1.00 0.00 N ATOM 770 CA GLY A 51 -5.726 4.226 -1.815 1.00 0.00 C ATOM 771 C GLY A 51 -7.004 4.608 -1.100 1.00 0.00 C ATOM 772 O GLY A 51 -7.642 3.769 -0.467 1.00 0.00 O ATOM 0 H GLY A 51 -5.161 4.878 -3.722 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -5.443 3.212 -1.534 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -4.919 4.883 -1.491 1.00 0.00 H new ATOM 776 N ALA A 52 -7.385 5.875 -1.214 1.00 0.00 N ATOM 777 CA ALA A 52 -8.603 6.359 -0.582 1.00 0.00 C ATOM 778 C ALA A 52 -9.833 5.735 -1.228 1.00 0.00 C ATOM 779 O ALA A 52 -10.893 5.657 -0.613 1.00 0.00 O ATOM 780 CB ALA A 52 -8.683 7.875 -0.656 1.00 0.00 C ATOM 0 H ALA A 52 -6.869 6.583 -1.737 1.00 0.00 H new ATOM 0 HA ALA A 52 -8.576 6.064 0.467 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -9.602 8.215 -0.177 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -7.825 8.310 -0.144 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -8.680 8.189 -1.700 1.00 0.00 H new ATOM 786 N LEU A 53 -9.693 5.294 -2.477 1.00 0.00 N ATOM 787 CA LEU A 53 -10.809 4.686 -3.196 1.00 0.00 C ATOM 788 C LEU A 53 -11.523 3.661 -2.321 1.00 0.00 C ATOM 789 O LEU A 53 -12.651 3.879 -1.900 1.00 0.00 O ATOM 790 CB LEU A 53 -10.309 4.007 -4.477 1.00 0.00 C ATOM 791 CG LEU A 53 -10.311 4.872 -5.742 1.00 0.00 C ATOM 792 CD1 LEU A 53 -10.055 4.013 -6.973 1.00 0.00 C ATOM 793 CD2 LEU A 53 -11.624 5.626 -5.882 1.00 0.00 C ATOM 0 H LEU A 53 -8.824 5.346 -3.008 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.513 5.476 -3.457 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -9.292 3.654 -4.304 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -10.925 3.127 -4.662 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.508 5.604 -5.655 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -10.060 4.642 -7.863 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -9.086 3.523 -6.880 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -10.836 3.258 -7.059 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -11.600 6.233 -6.787 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -12.447 4.914 -5.943 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -11.767 6.272 -5.016 1.00 0.00 H new ATOM 805 N TYR A 54 -10.852 2.551 -2.040 1.00 0.00 N ATOM 806 CA TYR A 54 -11.429 1.501 -1.202 1.00 0.00 C ATOM 807 C TYR A 54 -11.217 1.786 0.279 1.00 0.00 C ATOM 808 O TYR A 54 -12.047 1.426 1.114 1.00 0.00 O ATOM 809 CB TYR A 54 -10.829 0.139 -1.559 1.00 0.00 C ATOM 810 CG TYR A 54 -11.189 -0.351 -2.946 1.00 0.00 C ATOM 811 CD1 TYR A 54 -12.414 -0.039 -3.524 1.00 0.00 C ATOM 812 CD2 TYR A 54 -10.300 -1.130 -3.675 1.00 0.00 C ATOM 813 CE1 TYR A 54 -12.741 -0.490 -4.789 1.00 0.00 C ATOM 814 CE2 TYR A 54 -10.620 -1.584 -4.940 1.00 0.00 C ATOM 815 CZ TYR A 54 -11.841 -1.261 -5.492 1.00 0.00 C ATOM 816 OH TYR A 54 -12.164 -1.712 -6.752 1.00 0.00 O ATOM 0 H TYR A 54 -9.910 2.352 -2.378 1.00 0.00 H new ATOM 0 HA TYR A 54 -12.502 1.483 -1.394 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -9.744 0.199 -1.477 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -11.164 -0.596 -0.827 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -13.122 0.565 -2.976 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -9.342 -1.385 -3.246 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -13.697 -0.239 -5.224 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -9.917 -2.189 -5.494 1.00 0.00 H new ATOM 0 HH TYR A 54 -12.768 -1.072 -7.184 1.00 0.00 H new ATOM 826 N ALA A 55 -10.097 2.420 0.603 1.00 0.00 N ATOM 827 CA ALA A 55 -9.771 2.733 1.989 1.00 0.00 C ATOM 828 C ALA A 55 -10.948 3.371 2.718 1.00 0.00 C ATOM 829 O ALA A 55 -11.070 3.234 3.934 1.00 0.00 O ATOM 830 CB ALA A 55 -8.555 3.642 2.058 1.00 0.00 C ATOM 0 H ALA A 55 -9.399 2.727 -0.075 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.542 1.792 2.490 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.326 3.865 3.100 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.702 3.144 1.598 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.764 4.570 1.526 1.00 0.00 H new ATOM 836 N LYS A 56 -11.805 4.082 1.984 1.00 0.00 N ATOM 837 CA LYS A 56 -12.954 4.736 2.598 1.00 0.00 C ATOM 838 C LYS A 56 -14.274 4.416 1.890 1.00 0.00 C ATOM 839 O LYS A 56 -15.337 4.487 2.504 1.00 0.00 O ATOM 840 CB LYS A 56 -12.744 6.249 2.620 1.00 0.00 C ATOM 841 CG LYS A 56 -12.312 6.830 1.286 1.00 0.00 C ATOM 842 CD LYS A 56 -12.793 8.262 1.120 1.00 0.00 C ATOM 843 CE LYS A 56 -12.649 8.736 -0.317 1.00 0.00 C ATOM 844 NZ LYS A 56 -12.120 10.126 -0.393 1.00 0.00 N ATOM 0 H LYS A 56 -11.725 4.217 0.976 1.00 0.00 H new ATOM 0 HA LYS A 56 -13.029 4.347 3.614 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -13.671 6.730 2.931 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -11.992 6.491 3.371 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -11.225 6.799 1.209 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -12.706 6.216 0.476 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -13.837 8.334 1.425 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -12.223 8.917 1.779 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -11.981 8.064 -0.856 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -13.618 8.689 -0.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -12.037 10.412 -1.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -12.770 10.772 0.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -11.184 10.166 0.058 1.00 0.00 H new ATOM 858 N SER A 57 -14.224 4.110 0.595 1.00 0.00 N ATOM 859 CA SER A 57 -15.455 3.835 -0.145 1.00 0.00 C ATOM 860 C SER A 57 -15.997 2.417 0.067 1.00 0.00 C ATOM 861 O SER A 57 -17.142 2.244 0.485 1.00 0.00 O ATOM 862 CB SER A 57 -15.240 4.074 -1.640 1.00 0.00 C ATOM 863 OG SER A 57 -14.644 5.338 -1.874 1.00 0.00 O ATOM 0 H SER A 57 -13.366 4.047 0.046 1.00 0.00 H new ATOM 0 HA SER A 57 -16.201 4.524 0.251 1.00 0.00 H new ATOM 0 HB2 SER A 57 -14.606 3.288 -2.050 1.00 0.00 H new ATOM 0 HB3 SER A 57 -16.195 4.017 -2.162 1.00 0.00 H new ATOM 0 HG SER A 57 -13.728 5.213 -2.199 1.00 0.00 H new ATOM 869 N GLU A 58 -15.188 1.407 -0.253 1.00 0.00 N ATOM 870 CA GLU A 58 -15.621 0.013 -0.125 1.00 0.00 C ATOM 871 C GLU A 58 -15.160 -0.638 1.175 1.00 0.00 C ATOM 872 O GLU A 58 -15.976 -1.099 1.974 1.00 0.00 O ATOM 873 CB GLU A 58 -15.110 -0.802 -1.314 1.00 0.00 C ATOM 874 CG GLU A 58 -15.845 -0.511 -2.612 1.00 0.00 C ATOM 875 CD GLU A 58 -15.490 -1.489 -3.715 1.00 0.00 C ATOM 876 OE1 GLU A 58 -14.983 -2.585 -3.395 1.00 0.00 O ATOM 877 OE2 GLU A 58 -15.719 -1.159 -4.897 1.00 0.00 O ATOM 0 H GLU A 58 -14.236 1.525 -0.600 1.00 0.00 H new ATOM 0 HA GLU A 58 -16.711 0.023 -0.110 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -14.048 -0.598 -1.454 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -15.203 -1.863 -1.083 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -16.920 -0.546 -2.432 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -15.609 0.502 -2.940 1.00 0.00 H new ATOM 884 N PHE A 59 -13.848 -0.690 1.369 1.00 0.00 N ATOM 885 CA PHE A 59 -13.272 -1.306 2.558 1.00 0.00 C ATOM 886 C PHE A 59 -12.918 -0.252 3.596 1.00 0.00 C ATOM 887 O PHE A 59 -11.889 -0.338 4.265 1.00 0.00 O ATOM 888 CB PHE A 59 -12.032 -2.120 2.183 1.00 0.00 C ATOM 889 CG PHE A 59 -12.345 -3.521 1.738 1.00 0.00 C ATOM 890 CD1 PHE A 59 -13.406 -3.769 0.881 1.00 0.00 C ATOM 891 CD2 PHE A 59 -11.579 -4.588 2.177 1.00 0.00 C ATOM 892 CE1 PHE A 59 -13.696 -5.056 0.470 1.00 0.00 C ATOM 893 CE2 PHE A 59 -11.865 -5.878 1.770 1.00 0.00 C ATOM 894 CZ PHE A 59 -12.925 -6.112 0.916 1.00 0.00 C ATOM 0 H PHE A 59 -13.161 -0.312 0.716 1.00 0.00 H new ATOM 0 HA PHE A 59 -14.015 -1.975 2.992 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -11.497 -1.605 1.385 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -11.361 -2.161 3.041 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -14.013 -2.947 0.531 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -10.749 -4.410 2.845 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -14.524 -5.236 -0.199 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -11.260 -6.702 2.119 1.00 0.00 H new ATOM 0 HZ PHE A 59 -13.151 -7.119 0.597 1.00 0.00 H new ATOM 904 N LYS A 60 -13.784 0.745 3.714 1.00 0.00 N ATOM 905 CA LYS A 60 -13.590 1.839 4.657 1.00 0.00 C ATOM 906 C LYS A 60 -13.097 1.342 6.015 1.00 0.00 C ATOM 907 O LYS A 60 -12.178 1.916 6.599 1.00 0.00 O ATOM 908 CB LYS A 60 -14.894 2.612 4.816 1.00 0.00 C ATOM 909 CG LYS A 60 -16.084 1.736 5.170 1.00 0.00 C ATOM 910 CD LYS A 60 -17.343 2.563 5.374 1.00 0.00 C ATOM 911 CE LYS A 60 -18.564 1.874 4.786 1.00 0.00 C ATOM 912 NZ LYS A 60 -19.520 2.850 4.192 1.00 0.00 N ATOM 0 H LYS A 60 -14.638 0.819 3.161 1.00 0.00 H new ATOM 0 HA LYS A 60 -12.819 2.497 4.256 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -14.766 3.367 5.592 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -15.108 3.142 3.888 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -16.250 1.008 4.376 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -15.866 1.173 6.078 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -17.498 2.734 6.439 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -17.217 3.541 4.909 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -18.248 1.164 4.021 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -19.067 1.300 5.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -20.339 2.341 3.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -19.842 3.512 4.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -19.048 3.380 3.432 1.00 0.00 H new ATOM 926 N ASP A 61 -13.710 0.274 6.513 1.00 0.00 N ATOM 927 CA ASP A 61 -13.326 -0.293 7.801 1.00 0.00 C ATOM 928 C ASP A 61 -12.830 -1.727 7.643 1.00 0.00 C ATOM 929 O ASP A 61 -13.086 -2.578 8.495 1.00 0.00 O ATOM 930 CB ASP A 61 -14.509 -0.254 8.771 1.00 0.00 C ATOM 931 CG ASP A 61 -14.090 0.114 10.180 1.00 0.00 C ATOM 932 OD1 ASP A 61 -13.040 -0.385 10.637 1.00 0.00 O ATOM 933 OD2 ASP A 61 -14.810 0.903 10.827 1.00 0.00 O ATOM 0 H ASP A 61 -14.473 -0.216 6.046 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.512 0.309 8.205 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -15.244 0.467 8.414 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -14.998 -1.228 8.783 1.00 0.00 H new ATOM 938 N ARG A 62 -12.128 -1.995 6.546 1.00 0.00 N ATOM 939 CA ARG A 62 -11.613 -3.337 6.287 1.00 0.00 C ATOM 940 C ARG A 62 -10.237 -3.311 5.615 1.00 0.00 C ATOM 941 O ARG A 62 -9.448 -4.241 5.780 1.00 0.00 O ATOM 942 CB ARG A 62 -12.601 -4.119 5.418 1.00 0.00 C ATOM 943 CG ARG A 62 -13.361 -5.194 6.178 1.00 0.00 C ATOM 944 CD ARG A 62 -14.406 -4.593 7.105 1.00 0.00 C ATOM 945 NE ARG A 62 -15.740 -5.129 6.846 1.00 0.00 N ATOM 946 CZ ARG A 62 -16.749 -5.057 7.711 1.00 0.00 C ATOM 947 NH1 ARG A 62 -16.581 -4.475 8.892 1.00 0.00 N ATOM 948 NH2 ARG A 62 -17.931 -5.570 7.396 1.00 0.00 N ATOM 0 H ARG A 62 -11.904 -1.307 5.827 1.00 0.00 H new ATOM 0 HA ARG A 62 -11.497 -3.831 7.252 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -13.315 -3.423 4.978 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -12.059 -4.583 4.594 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -13.846 -5.867 5.470 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -12.660 -5.794 6.759 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -14.130 -4.792 8.140 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -14.420 -3.510 6.982 1.00 0.00 H new ATOM 0 HE ARG A 62 -15.908 -5.585 5.949 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -15.674 -4.080 9.141 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -17.358 -4.423 9.550 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -18.067 -6.020 6.491 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -18.704 -5.515 8.059 1.00 0.00 H new ATOM 962 N VAL A 63 -9.953 -2.261 4.848 1.00 0.00 N ATOM 963 CA VAL A 63 -8.672 -2.156 4.154 1.00 0.00 C ATOM 964 C VAL A 63 -7.869 -0.945 4.622 1.00 0.00 C ATOM 965 O VAL A 63 -8.431 0.047 5.088 1.00 0.00 O ATOM 966 CB VAL A 63 -8.865 -2.077 2.624 1.00 0.00 C ATOM 967 CG1 VAL A 63 -9.356 -0.698 2.203 1.00 0.00 C ATOM 968 CG2 VAL A 63 -7.572 -2.430 1.906 1.00 0.00 C ATOM 0 H VAL A 63 -10.587 -1.477 4.692 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.115 -3.060 4.399 1.00 0.00 H new ATOM 0 HB VAL A 63 -9.627 -2.803 2.341 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -9.483 -0.672 1.121 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -10.311 -0.489 2.686 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -8.626 0.055 2.501 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -7.726 -2.369 0.829 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -6.790 -1.731 2.201 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -7.272 -3.443 2.173 1.00 0.00 H new ATOM 978 N VAL A 64 -6.551 -1.036 4.482 1.00 0.00 N ATOM 979 CA VAL A 64 -5.658 0.047 4.875 1.00 0.00 C ATOM 980 C VAL A 64 -4.484 0.157 3.906 1.00 0.00 C ATOM 981 O VAL A 64 -3.570 -0.666 3.929 1.00 0.00 O ATOM 982 CB VAL A 64 -5.116 -0.159 6.301 1.00 0.00 C ATOM 983 CG1 VAL A 64 -4.345 1.069 6.763 1.00 0.00 C ATOM 984 CG2 VAL A 64 -6.250 -0.479 7.262 1.00 0.00 C ATOM 0 H VAL A 64 -6.076 -1.853 4.097 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.240 0.968 4.850 1.00 0.00 H new ATOM 0 HB VAL A 64 -4.430 -1.006 6.290 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.970 0.904 7.773 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -3.507 1.247 6.089 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -5.005 1.936 6.758 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.848 -0.621 8.265 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -6.963 0.345 7.271 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -6.753 -1.391 6.940 1.00 0.00 H new ATOM 994 N ILE A 65 -4.518 1.176 3.053 1.00 0.00 N ATOM 995 CA ILE A 65 -3.459 1.388 2.074 1.00 0.00 C ATOM 996 C ILE A 65 -2.584 2.576 2.459 1.00 0.00 C ATOM 997 O ILE A 65 -3.053 3.712 2.514 1.00 0.00 O ATOM 998 CB ILE A 65 -4.038 1.625 0.665 1.00 0.00 C ATOM 999 CG1 ILE A 65 -5.041 0.525 0.312 1.00 0.00 C ATOM 1000 CG2 ILE A 65 -2.921 1.686 -0.368 1.00 0.00 C ATOM 1001 CD1 ILE A 65 -5.654 0.684 -1.063 1.00 0.00 C ATOM 0 H ILE A 65 -5.267 1.867 3.020 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.852 0.483 2.062 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.559 2.582 0.659 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -4.542 -0.442 0.369 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -5.837 0.517 1.057 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -3.348 1.854 -1.357 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -2.243 2.503 -0.122 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -2.371 0.745 -0.365 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.355 -0.131 -1.245 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.182 1.636 -1.118 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -4.867 0.661 -1.817 1.00 0.00 H new ATOM 1013 N ALA A 66 -1.310 2.306 2.729 1.00 0.00 N ATOM 1014 CA ALA A 66 -0.375 3.354 3.113 1.00 0.00 C ATOM 1015 C ALA A 66 0.876 3.345 2.236 1.00 0.00 C ATOM 1016 O ALA A 66 1.205 2.340 1.601 1.00 0.00 O ATOM 1017 CB ALA A 66 0.009 3.201 4.576 1.00 0.00 C ATOM 0 H ALA A 66 -0.904 1.371 2.689 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.873 4.313 2.968 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.709 3.990 4.853 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.884 3.274 5.196 1.00 0.00 H new ATOM 0 HB3 ALA A 66 0.479 2.229 4.729 1.00 0.00 H new ATOM 1023 N LYS A 67 1.573 4.476 2.219 1.00 0.00 N ATOM 1024 CA LYS A 67 2.795 4.615 1.437 1.00 0.00 C ATOM 1025 C LYS A 67 3.962 4.977 2.346 1.00 0.00 C ATOM 1026 O LYS A 67 3.900 5.955 3.091 1.00 0.00 O ATOM 1027 CB LYS A 67 2.620 5.689 0.360 1.00 0.00 C ATOM 1028 CG LYS A 67 1.280 5.626 -0.354 1.00 0.00 C ATOM 1029 CD LYS A 67 1.184 6.675 -1.450 1.00 0.00 C ATOM 1030 CE LYS A 67 0.965 8.067 -0.877 1.00 0.00 C ATOM 1031 NZ LYS A 67 2.049 9.008 -1.272 1.00 0.00 N ATOM 0 H LYS A 67 1.311 5.313 2.740 1.00 0.00 H new ATOM 0 HA LYS A 67 3.006 3.662 0.951 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.732 6.672 0.818 1.00 0.00 H new ATOM 0 HB3 LYS A 67 3.418 5.587 -0.375 1.00 0.00 H new ATOM 0 HG2 LYS A 67 1.142 4.634 -0.785 1.00 0.00 H new ATOM 0 HG3 LYS A 67 0.475 5.775 0.366 1.00 0.00 H new ATOM 0 HD2 LYS A 67 2.098 6.665 -2.044 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.364 6.425 -2.123 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.006 8.454 -1.220 1.00 0.00 H new ATOM 0 HE3 LYS A 67 0.914 8.008 0.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 1.819 9.964 -0.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 2.948 8.698 -0.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.138 9.020 -2.308 1.00 0.00 H new ATOM 1045 N VAL A 68 5.023 4.181 2.290 1.00 0.00 N ATOM 1046 CA VAL A 68 6.195 4.422 3.119 1.00 0.00 C ATOM 1047 C VAL A 68 7.457 4.563 2.273 1.00 0.00 C ATOM 1048 O VAL A 68 7.622 3.878 1.265 1.00 0.00 O ATOM 1049 CB VAL A 68 6.397 3.288 4.144 1.00 0.00 C ATOM 1050 CG1 VAL A 68 6.633 1.960 3.439 1.00 0.00 C ATOM 1051 CG2 VAL A 68 7.549 3.614 5.084 1.00 0.00 C ATOM 0 H VAL A 68 5.095 3.366 1.681 1.00 0.00 H new ATOM 0 HA VAL A 68 6.018 5.357 3.650 1.00 0.00 H new ATOM 0 HB VAL A 68 5.488 3.198 4.738 1.00 0.00 H new ATOM 0 HG11 VAL A 68 6.773 1.174 4.181 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.772 1.721 2.815 1.00 0.00 H new ATOM 0 HG13 VAL A 68 7.524 2.033 2.815 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.676 2.802 5.800 1.00 0.00 H new ATOM 0 HG22 VAL A 68 8.466 3.736 4.507 1.00 0.00 H new ATOM 0 HG23 VAL A 68 7.332 4.538 5.619 1.00 0.00 H new ATOM 1061 N ASP A 69 8.347 5.453 2.696 1.00 0.00 N ATOM 1062 CA ASP A 69 9.597 5.679 1.984 1.00 0.00 C ATOM 1063 C ASP A 69 10.734 4.924 2.660 1.00 0.00 C ATOM 1064 O ASP A 69 10.782 4.824 3.883 1.00 0.00 O ATOM 1065 CB ASP A 69 9.926 7.173 1.930 1.00 0.00 C ATOM 1066 CG ASP A 69 8.686 8.049 1.888 1.00 0.00 C ATOM 1067 OD1 ASP A 69 7.755 7.722 1.123 1.00 0.00 O ATOM 1068 OD2 ASP A 69 8.649 9.060 2.619 1.00 0.00 O ATOM 0 H ASP A 69 8.225 6.029 3.529 1.00 0.00 H new ATOM 0 HA ASP A 69 9.480 5.310 0.965 1.00 0.00 H new ATOM 0 HB2 ASP A 69 10.524 7.440 2.801 1.00 0.00 H new ATOM 0 HB3 ASP A 69 10.537 7.374 1.050 1.00 0.00 H new ATOM 1073 N ALA A 70 11.649 4.391 1.861 1.00 0.00 N ATOM 1074 CA ALA A 70 12.780 3.643 2.398 1.00 0.00 C ATOM 1075 C ALA A 70 13.873 4.570 2.928 1.00 0.00 C ATOM 1076 O ALA A 70 14.904 4.107 3.414 1.00 0.00 O ATOM 1077 CB ALA A 70 13.345 2.714 1.336 1.00 0.00 C ATOM 0 H ALA A 70 11.632 4.462 0.844 1.00 0.00 H new ATOM 0 HA ALA A 70 12.417 3.050 3.238 1.00 0.00 H new ATOM 0 HB1 ALA A 70 14.189 2.161 1.748 1.00 0.00 H new ATOM 0 HB2 ALA A 70 12.573 2.014 1.017 1.00 0.00 H new ATOM 0 HB3 ALA A 70 13.679 3.300 0.480 1.00 0.00 H new ATOM 1083 N THR A 71 13.649 5.877 2.826 1.00 0.00 N ATOM 1084 CA THR A 71 14.627 6.855 3.291 1.00 0.00 C ATOM 1085 C THR A 71 14.069 7.725 4.417 1.00 0.00 C ATOM 1086 O THR A 71 14.401 8.907 4.510 1.00 0.00 O ATOM 1087 CB THR A 71 15.073 7.742 2.128 1.00 0.00 C ATOM 1088 OG1 THR A 71 16.054 8.671 2.553 1.00 0.00 O ATOM 1089 CG2 THR A 71 13.937 8.525 1.506 1.00 0.00 C ATOM 0 H THR A 71 12.802 6.282 2.427 1.00 0.00 H new ATOM 0 HA THR A 71 15.482 6.305 3.685 1.00 0.00 H new ATOM 0 HB THR A 71 15.476 7.059 1.380 1.00 0.00 H new ATOM 0 HG1 THR A 71 15.694 9.215 3.284 1.00 0.00 H new ATOM 0 HG21 THR A 71 14.320 9.134 0.687 1.00 0.00 H new ATOM 0 HG22 THR A 71 13.186 7.834 1.124 1.00 0.00 H new ATOM 0 HG23 THR A 71 13.486 9.172 2.259 1.00 0.00 H new ATOM 1097 N ALA A 72 13.225 7.150 5.275 1.00 0.00 N ATOM 1098 CA ALA A 72 12.649 7.915 6.380 1.00 0.00 C ATOM 1099 C ALA A 72 11.749 7.062 7.275 1.00 0.00 C ATOM 1100 O ALA A 72 10.631 7.463 7.601 1.00 0.00 O ATOM 1101 CB ALA A 72 11.873 9.108 5.842 1.00 0.00 C ATOM 0 H ALA A 72 12.930 6.175 5.228 1.00 0.00 H new ATOM 0 HA ALA A 72 13.478 8.264 6.996 1.00 0.00 H new ATOM 0 HB1 ALA A 72 11.448 9.671 6.673 1.00 0.00 H new ATOM 0 HB2 ALA A 72 12.544 9.752 5.273 1.00 0.00 H new ATOM 0 HB3 ALA A 72 11.070 8.757 5.194 1.00 0.00 H new ATOM 1107 N ASN A 73 12.240 5.896 7.687 1.00 0.00 N ATOM 1108 CA ASN A 73 11.472 5.009 8.562 1.00 0.00 C ATOM 1109 C ASN A 73 12.148 3.650 8.706 1.00 0.00 C ATOM 1110 O ASN A 73 13.222 3.415 8.153 1.00 0.00 O ATOM 1111 CB ASN A 73 10.042 4.822 8.043 1.00 0.00 C ATOM 1112 CG ASN A 73 9.973 4.725 6.534 1.00 0.00 C ATOM 1113 OD1 ASN A 73 10.244 3.673 5.956 1.00 0.00 O ATOM 1114 ND2 ASN A 73 9.605 5.825 5.889 1.00 0.00 N ATOM 0 H ASN A 73 13.162 5.543 7.431 1.00 0.00 H new ATOM 0 HA ASN A 73 11.431 5.483 9.543 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.617 3.919 8.480 1.00 0.00 H new ATOM 0 HB3 ASN A 73 9.427 5.658 8.377 1.00 0.00 H new ATOM 0 HD21 ASN A 73 9.537 5.821 4.871 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.390 6.674 6.411 1.00 0.00 H new ATOM 1121 N ASP A 74 11.508 2.759 9.459 1.00 0.00 N ATOM 1122 CA ASP A 74 12.039 1.421 9.688 1.00 0.00 C ATOM 1123 C ASP A 74 12.298 0.697 8.370 1.00 0.00 C ATOM 1124 O ASP A 74 13.432 0.326 8.070 1.00 0.00 O ATOM 1125 CB ASP A 74 11.070 0.607 10.548 1.00 0.00 C ATOM 1126 CG ASP A 74 11.722 -0.625 11.145 1.00 0.00 C ATOM 1127 OD1 ASP A 74 12.677 -1.148 10.532 1.00 0.00 O ATOM 1128 OD2 ASP A 74 11.279 -1.065 12.227 1.00 0.00 O ATOM 0 H ASP A 74 10.618 2.942 9.922 1.00 0.00 H new ATOM 0 HA ASP A 74 12.988 1.523 10.214 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.685 1.236 11.351 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.216 0.305 9.942 1.00 0.00 H new ATOM 1133 N VAL A 75 11.235 0.497 7.590 1.00 0.00 N ATOM 1134 CA VAL A 75 11.335 -0.185 6.301 1.00 0.00 C ATOM 1135 C VAL A 75 12.233 -1.422 6.390 1.00 0.00 C ATOM 1136 O VAL A 75 13.224 -1.539 5.668 1.00 0.00 O ATOM 1137 CB VAL A 75 11.863 0.762 5.201 1.00 0.00 C ATOM 1138 CG1 VAL A 75 13.225 1.326 5.575 1.00 0.00 C ATOM 1139 CG2 VAL A 75 11.923 0.048 3.857 1.00 0.00 C ATOM 0 H VAL A 75 10.291 0.800 7.831 1.00 0.00 H new ATOM 0 HA VAL A 75 10.327 -0.504 6.034 1.00 0.00 H new ATOM 0 HB VAL A 75 11.167 1.596 5.112 1.00 0.00 H new ATOM 0 HG11 VAL A 75 13.574 1.989 4.784 1.00 0.00 H new ATOM 0 HG12 VAL A 75 13.144 1.885 6.507 1.00 0.00 H new ATOM 0 HG13 VAL A 75 13.935 0.509 5.702 1.00 0.00 H new ATOM 0 HG21 VAL A 75 12.298 0.734 3.097 1.00 0.00 H new ATOM 0 HG22 VAL A 75 12.590 -0.811 3.931 1.00 0.00 H new ATOM 0 HG23 VAL A 75 10.925 -0.290 3.580 1.00 0.00 H new ATOM 1149 N PRO A 76 11.893 -2.366 7.286 1.00 0.00 N ATOM 1150 CA PRO A 76 12.669 -3.598 7.472 1.00 0.00 C ATOM 1151 C PRO A 76 12.684 -4.469 6.221 1.00 0.00 C ATOM 1152 O PRO A 76 13.664 -5.161 5.947 1.00 0.00 O ATOM 1153 CB PRO A 76 11.943 -4.317 8.616 1.00 0.00 C ATOM 1154 CG PRO A 76 10.573 -3.733 8.632 1.00 0.00 C ATOM 1155 CD PRO A 76 10.727 -2.308 8.184 1.00 0.00 C ATOM 0 HA PRO A 76 13.717 -3.386 7.685 1.00 0.00 H new ATOM 0 HB2 PRO A 76 11.911 -5.393 8.448 1.00 0.00 H new ATOM 0 HB3 PRO A 76 12.451 -4.158 9.567 1.00 0.00 H new ATOM 0 HG2 PRO A 76 9.907 -4.282 7.966 1.00 0.00 H new ATOM 0 HG3 PRO A 76 10.139 -3.784 9.630 1.00 0.00 H new ATOM 0 HD2 PRO A 76 9.837 -1.949 7.667 1.00 0.00 H new ATOM 0 HD3 PRO A 76 10.899 -1.637 9.026 1.00 0.00 H new ATOM 1163 N ASP A 77 11.591 -4.431 5.465 1.00 0.00 N ATOM 1164 CA ASP A 77 11.482 -5.220 4.242 1.00 0.00 C ATOM 1165 C ASP A 77 12.616 -4.888 3.275 1.00 0.00 C ATOM 1166 O ASP A 77 12.993 -3.727 3.120 1.00 0.00 O ATOM 1167 CB ASP A 77 10.132 -4.970 3.568 1.00 0.00 C ATOM 1168 CG ASP A 77 8.968 -5.139 4.525 1.00 0.00 C ATOM 1169 OD1 ASP A 77 8.964 -6.131 5.285 1.00 0.00 O ATOM 1170 OD2 ASP A 77 8.061 -4.281 4.514 1.00 0.00 O ATOM 0 H ASP A 77 10.770 -3.864 5.677 1.00 0.00 H new ATOM 0 HA ASP A 77 11.557 -6.273 4.512 1.00 0.00 H new ATOM 0 HB2 ASP A 77 10.116 -3.961 3.156 1.00 0.00 H new ATOM 0 HB3 ASP A 77 10.014 -5.658 2.731 1.00 0.00 H new ATOM 1175 N GLU A 78 13.155 -5.917 2.628 1.00 0.00 N ATOM 1176 CA GLU A 78 14.246 -5.734 1.677 1.00 0.00 C ATOM 1177 C GLU A 78 13.708 -5.354 0.302 1.00 0.00 C ATOM 1178 O GLU A 78 12.639 -5.810 -0.105 1.00 0.00 O ATOM 1179 CB GLU A 78 15.082 -7.011 1.577 1.00 0.00 C ATOM 1180 CG GLU A 78 14.255 -8.264 1.339 1.00 0.00 C ATOM 1181 CD GLU A 78 15.102 -9.453 0.931 1.00 0.00 C ATOM 1182 OE1 GLU A 78 15.434 -9.562 -0.268 1.00 0.00 O ATOM 1183 OE2 GLU A 78 15.433 -10.276 1.810 1.00 0.00 O ATOM 0 H GLU A 78 12.855 -6.885 2.745 1.00 0.00 H new ATOM 0 HA GLU A 78 14.878 -4.922 2.037 1.00 0.00 H new ATOM 0 HB2 GLU A 78 15.802 -6.901 0.766 1.00 0.00 H new ATOM 0 HB3 GLU A 78 15.655 -7.133 2.496 1.00 0.00 H new ATOM 0 HG2 GLU A 78 13.705 -8.509 2.247 1.00 0.00 H new ATOM 0 HG3 GLU A 78 13.516 -8.065 0.562 1.00 0.00 H new ATOM 1190 N ILE A 79 14.453 -4.514 -0.410 1.00 0.00 N ATOM 1191 CA ILE A 79 14.045 -4.070 -1.738 1.00 0.00 C ATOM 1192 C ILE A 79 15.238 -3.974 -2.684 1.00 0.00 C ATOM 1193 O ILE A 79 16.340 -3.610 -2.274 1.00 0.00 O ATOM 1194 CB ILE A 79 13.362 -2.686 -1.692 1.00 0.00 C ATOM 1195 CG1 ILE A 79 12.453 -2.555 -0.465 1.00 0.00 C ATOM 1196 CG2 ILE A 79 12.574 -2.442 -2.969 1.00 0.00 C ATOM 1197 CD1 ILE A 79 11.215 -3.426 -0.523 1.00 0.00 C ATOM 0 H ILE A 79 15.341 -4.128 -0.090 1.00 0.00 H new ATOM 0 HA ILE A 79 13.339 -4.816 -2.103 1.00 0.00 H new ATOM 0 HB ILE A 79 14.141 -1.928 -1.611 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.024 -2.811 0.427 1.00 0.00 H new ATOM 0 HG13 ILE A 79 12.148 -1.514 -0.360 1.00 0.00 H new ATOM 0 HG21 ILE A 79 12.098 -1.462 -2.921 1.00 0.00 H new ATOM 0 HG22 ILE A 79 13.248 -2.477 -3.825 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.810 -3.212 -3.078 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.623 -3.278 0.380 1.00 0.00 H new ATOM 0 HD12 ILE A 79 10.620 -3.155 -1.395 1.00 0.00 H new ATOM 0 HD13 ILE A 79 11.510 -4.473 -0.596 1.00 0.00 H new ATOM 1209 N GLN A 80 15.001 -4.265 -3.960 1.00 0.00 N ATOM 1210 CA GLN A 80 16.048 -4.171 -4.971 1.00 0.00 C ATOM 1211 C GLN A 80 16.271 -2.702 -5.295 1.00 0.00 C ATOM 1212 O GLN A 80 17.400 -2.213 -5.338 1.00 0.00 O ATOM 1213 CB GLN A 80 15.643 -4.938 -6.231 1.00 0.00 C ATOM 1214 CG GLN A 80 15.797 -6.444 -6.102 1.00 0.00 C ATOM 1215 CD GLN A 80 14.814 -7.207 -6.968 1.00 0.00 C ATOM 1216 OE1 GLN A 80 14.921 -7.210 -8.194 1.00 0.00 O ATOM 1217 NE2 GLN A 80 13.847 -7.860 -6.332 1.00 0.00 N ATOM 0 H GLN A 80 14.095 -4.567 -4.317 1.00 0.00 H new ATOM 0 HA GLN A 80 16.970 -4.612 -4.592 1.00 0.00 H new ATOM 0 HB2 GLN A 80 14.605 -4.706 -6.469 1.00 0.00 H new ATOM 0 HB3 GLN A 80 16.248 -4.590 -7.068 1.00 0.00 H new ATOM 0 HG2 GLN A 80 16.813 -6.726 -6.377 1.00 0.00 H new ATOM 0 HG3 GLN A 80 15.657 -6.732 -5.060 1.00 0.00 H new ATOM 0 HE21 GLN A 80 13.796 -7.830 -5.314 1.00 0.00 H new ATOM 0 HE22 GLN A 80 13.156 -8.391 -6.862 1.00 0.00 H new ATOM 1226 N GLY A 81 15.158 -2.004 -5.473 1.00 0.00 N ATOM 1227 CA GLY A 81 15.173 -0.582 -5.739 1.00 0.00 C ATOM 1228 C GLY A 81 14.228 0.112 -4.785 1.00 0.00 C ATOM 1229 O GLY A 81 14.600 0.424 -3.655 1.00 0.00 O ATOM 0 H GLY A 81 14.224 -2.411 -5.436 1.00 0.00 H new ATOM 0 HA2 GLY A 81 16.183 -0.188 -5.620 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.875 -0.389 -6.770 1.00 0.00 H new ATOM 1233 N PHE A 82 12.983 0.287 -5.215 1.00 0.00 N ATOM 1234 CA PHE A 82 11.955 0.877 -4.368 1.00 0.00 C ATOM 1235 C PHE A 82 10.602 0.717 -4.927 1.00 0.00 C ATOM 1236 O PHE A 82 9.752 0.131 -4.288 1.00 0.00 O ATOM 1237 CB PHE A 82 12.110 2.351 -4.106 1.00 0.00 C ATOM 1238 CG PHE A 82 13.520 2.822 -3.893 1.00 0.00 C ATOM 1239 CD1 PHE A 82 14.305 3.209 -4.967 1.00 0.00 C ATOM 1240 CD2 PHE A 82 14.058 2.878 -2.618 1.00 0.00 C ATOM 1241 CE1 PHE A 82 15.603 3.643 -4.772 1.00 0.00 C ATOM 1242 CE2 PHE A 82 15.355 3.310 -2.417 1.00 0.00 C ATOM 1243 CZ PHE A 82 16.129 3.693 -3.496 1.00 0.00 C ATOM 0 H PHE A 82 12.662 0.028 -6.148 1.00 0.00 H new ATOM 0 HA PHE A 82 12.085 0.326 -3.437 1.00 0.00 H new ATOM 0 HB2 PHE A 82 11.685 2.899 -4.947 1.00 0.00 H new ATOM 0 HB3 PHE A 82 11.521 2.610 -3.226 1.00 0.00 H new ATOM 0 HD1 PHE A 82 13.899 3.171 -5.967 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.457 2.581 -1.771 1.00 0.00 H new ATOM 0 HE1 PHE A 82 16.205 3.943 -5.617 1.00 0.00 H new ATOM 0 HE2 PHE A 82 15.763 3.348 -1.418 1.00 0.00 H new ATOM 0 HZ PHE A 82 17.143 4.031 -3.342 1.00 0.00 H new ATOM 1253 N PRO A 83 10.356 1.255 -6.112 1.00 0.00 N ATOM 1254 CA PRO A 83 9.056 1.162 -6.720 1.00 0.00 C ATOM 1255 C PRO A 83 8.489 -0.221 -6.530 1.00 0.00 C ATOM 1256 O PRO A 83 8.470 -1.068 -7.423 1.00 0.00 O ATOM 1257 CB PRO A 83 9.321 1.469 -8.156 1.00 0.00 C ATOM 1258 CG PRO A 83 10.802 1.588 -8.310 1.00 0.00 C ATOM 1259 CD PRO A 83 11.294 1.986 -6.963 1.00 0.00 C ATOM 0 HA PRO A 83 8.319 1.839 -6.288 1.00 0.00 H new ATOM 0 HB2 PRO A 83 8.928 0.680 -8.798 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.827 2.395 -8.450 1.00 0.00 H new ATOM 0 HG2 PRO A 83 11.244 0.644 -8.629 1.00 0.00 H new ATOM 0 HG3 PRO A 83 11.063 2.332 -9.062 1.00 0.00 H new ATOM 0 HD2 PRO A 83 12.328 1.686 -6.794 1.00 0.00 H new ATOM 0 HD3 PRO A 83 11.245 3.063 -6.805 1.00 0.00 H new ATOM 1267 N THR A 84 8.110 -0.421 -5.301 1.00 0.00 N ATOM 1268 CA THR A 84 7.607 -1.681 -4.809 1.00 0.00 C ATOM 1269 C THR A 84 6.182 -1.562 -4.295 1.00 0.00 C ATOM 1270 O THR A 84 5.779 -0.525 -3.769 1.00 0.00 O ATOM 1271 CB THR A 84 8.536 -2.155 -3.689 1.00 0.00 C ATOM 1272 OG1 THR A 84 9.007 -1.063 -2.926 1.00 0.00 O ATOM 1273 CG2 THR A 84 9.741 -2.906 -4.201 1.00 0.00 C ATOM 0 H THR A 84 8.142 0.308 -4.588 1.00 0.00 H new ATOM 0 HA THR A 84 7.587 -2.401 -5.627 1.00 0.00 H new ATOM 0 HB THR A 84 7.933 -2.827 -3.079 1.00 0.00 H new ATOM 0 HG1 THR A 84 9.518 -0.458 -3.502 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.361 -3.216 -3.360 1.00 0.00 H new ATOM 0 HG22 THR A 84 9.413 -3.786 -4.754 1.00 0.00 H new ATOM 0 HG23 THR A 84 10.320 -2.259 -4.860 1.00 0.00 H new ATOM 1281 N ILE A 85 5.434 -2.644 -4.442 1.00 0.00 N ATOM 1282 CA ILE A 85 4.051 -2.693 -3.989 1.00 0.00 C ATOM 1283 C ILE A 85 3.753 -4.054 -3.369 1.00 0.00 C ATOM 1284 O ILE A 85 3.665 -5.060 -4.074 1.00 0.00 O ATOM 1285 CB ILE A 85 3.061 -2.435 -5.146 1.00 0.00 C ATOM 1286 CG1 ILE A 85 3.586 -1.338 -6.089 1.00 0.00 C ATOM 1287 CG2 ILE A 85 1.689 -2.069 -4.595 1.00 0.00 C ATOM 1288 CD1 ILE A 85 3.365 0.073 -5.583 1.00 0.00 C ATOM 0 H ILE A 85 5.764 -3.507 -4.875 1.00 0.00 H new ATOM 0 HA ILE A 85 3.922 -1.906 -3.246 1.00 0.00 H new ATOM 0 HB ILE A 85 2.966 -3.352 -5.727 1.00 0.00 H new ATOM 0 HG12 ILE A 85 4.653 -1.492 -6.249 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.100 -1.445 -7.059 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.001 -1.890 -5.421 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.313 -2.888 -3.981 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.769 -1.167 -3.988 1.00 0.00 H new ATOM 0 HD11 ILE A 85 3.763 0.785 -6.306 1.00 0.00 H new ATOM 0 HD12 ILE A 85 2.297 0.249 -5.451 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.875 0.201 -4.628 1.00 0.00 H new ATOM 1300 N LYS A 86 3.615 -4.085 -2.047 1.00 0.00 N ATOM 1301 CA LYS A 86 3.347 -5.332 -1.338 1.00 0.00 C ATOM 1302 C LYS A 86 1.933 -5.364 -0.769 1.00 0.00 C ATOM 1303 O LYS A 86 1.386 -4.335 -0.367 1.00 0.00 O ATOM 1304 CB LYS A 86 4.364 -5.528 -0.212 1.00 0.00 C ATOM 1305 CG LYS A 86 5.662 -6.175 -0.669 1.00 0.00 C ATOM 1306 CD LYS A 86 6.158 -7.202 0.336 1.00 0.00 C ATOM 1307 CE LYS A 86 7.233 -6.622 1.241 1.00 0.00 C ATOM 1308 NZ LYS A 86 8.438 -6.203 0.474 1.00 0.00 N ATOM 0 H LYS A 86 3.684 -3.264 -1.446 1.00 0.00 H new ATOM 0 HA LYS A 86 3.438 -6.146 -2.057 1.00 0.00 H new ATOM 0 HB2 LYS A 86 4.588 -4.560 0.236 1.00 0.00 H new ATOM 0 HB3 LYS A 86 3.916 -6.144 0.568 1.00 0.00 H new ATOM 0 HG2 LYS A 86 5.510 -6.655 -1.636 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.422 -5.407 -0.811 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.322 -7.554 0.941 1.00 0.00 H new ATOM 0 HD3 LYS A 86 6.555 -8.068 -0.193 1.00 0.00 H new ATOM 0 HE2 LYS A 86 6.830 -5.765 1.780 1.00 0.00 H new ATOM 0 HE3 LYS A 86 7.518 -7.363 1.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 9.290 -6.589 0.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 8.372 -6.563 -0.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 8.495 -5.165 0.456 1.00 0.00 H new ATOM 1322 N LEU A 87 1.353 -6.560 -0.732 1.00 0.00 N ATOM 1323 CA LEU A 87 0.006 -6.750 -0.208 1.00 0.00 C ATOM 1324 C LEU A 87 -0.001 -7.830 0.869 1.00 0.00 C ATOM 1325 O LEU A 87 0.401 -8.968 0.624 1.00 0.00 O ATOM 1326 CB LEU A 87 -0.955 -7.131 -1.341 1.00 0.00 C ATOM 1327 CG LEU A 87 -2.443 -7.162 -0.970 1.00 0.00 C ATOM 1328 CD1 LEU A 87 -2.739 -8.310 -0.016 1.00 0.00 C ATOM 1329 CD2 LEU A 87 -2.879 -5.835 -0.364 1.00 0.00 C ATOM 0 H LEU A 87 1.799 -7.416 -1.061 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.326 -5.812 0.237 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.819 -6.426 -2.161 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.673 -8.115 -1.717 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.014 -7.322 -1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.800 -8.312 0.233 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.476 -9.255 -0.491 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.153 -8.187 0.895 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.938 -5.882 -0.109 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -2.297 -5.638 0.537 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.714 -5.034 -1.085 1.00 0.00 H new ATOM 1341 N TYR A 88 -0.465 -7.464 2.060 1.00 0.00 N ATOM 1342 CA TYR A 88 -0.532 -8.398 3.177 1.00 0.00 C ATOM 1343 C TYR A 88 -1.931 -9.005 3.286 1.00 0.00 C ATOM 1344 O TYR A 88 -2.872 -8.334 3.711 1.00 0.00 O ATOM 1345 CB TYR A 88 -0.166 -7.687 4.483 1.00 0.00 C ATOM 1346 CG TYR A 88 1.002 -8.316 5.208 1.00 0.00 C ATOM 1347 CD1 TYR A 88 2.292 -8.225 4.699 1.00 0.00 C ATOM 1348 CD2 TYR A 88 0.816 -9.002 6.403 1.00 0.00 C ATOM 1349 CE1 TYR A 88 3.362 -8.798 5.359 1.00 0.00 C ATOM 1350 CE2 TYR A 88 1.881 -9.577 7.069 1.00 0.00 C ATOM 1351 CZ TYR A 88 3.151 -9.473 6.543 1.00 0.00 C ATOM 1352 OH TYR A 88 4.215 -10.045 7.203 1.00 0.00 O ATOM 0 H TYR A 88 -0.801 -6.525 2.276 1.00 0.00 H new ATOM 0 HA TYR A 88 0.183 -9.201 2.998 1.00 0.00 H new ATOM 0 HB2 TYR A 88 0.070 -6.645 4.266 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -1.034 -7.686 5.142 1.00 0.00 H new ATOM 0 HD1 TYR A 88 2.461 -7.697 3.772 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -0.178 -9.087 6.817 1.00 0.00 H new ATOM 0 HE1 TYR A 88 4.358 -8.718 4.950 1.00 0.00 H new ATOM 0 HE2 TYR A 88 1.719 -10.105 7.997 1.00 0.00 H new ATOM 0 HH TYR A 88 3.896 -10.481 8.021 1.00 0.00 H new ATOM 1362 N PRO A 89 -2.091 -10.285 2.901 1.00 0.00 N ATOM 1363 CA PRO A 89 -3.389 -10.967 2.961 1.00 0.00 C ATOM 1364 C PRO A 89 -3.881 -11.151 4.392 1.00 0.00 C ATOM 1365 O PRO A 89 -3.212 -11.776 5.214 1.00 0.00 O ATOM 1366 CB PRO A 89 -3.115 -12.327 2.310 1.00 0.00 C ATOM 1367 CG PRO A 89 -1.648 -12.533 2.455 1.00 0.00 C ATOM 1368 CD PRO A 89 -1.030 -11.166 2.379 1.00 0.00 C ATOM 0 HA PRO A 89 -4.170 -10.394 2.462 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -3.676 -13.121 2.803 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -3.413 -12.330 1.261 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -1.413 -13.015 3.404 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -1.265 -13.179 1.665 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -0.122 -11.101 2.979 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.756 -10.904 1.357 1.00 0.00 H new ATOM 1376 N ALA A 90 -5.056 -10.600 4.682 1.00 0.00 N ATOM 1377 CA ALA A 90 -5.639 -10.702 6.014 1.00 0.00 C ATOM 1378 C ALA A 90 -5.859 -12.159 6.407 1.00 0.00 C ATOM 1379 O ALA A 90 -6.519 -12.912 5.692 1.00 0.00 O ATOM 1380 CB ALA A 90 -6.950 -9.933 6.076 1.00 0.00 C ATOM 0 H ALA A 90 -5.622 -10.079 4.012 1.00 0.00 H new ATOM 0 HA ALA A 90 -4.939 -10.263 6.725 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -7.375 -10.018 7.076 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -6.767 -8.883 5.847 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -7.649 -10.346 5.349 1.00 0.00 H new ATOM 1386 N GLY A 91 -5.301 -12.548 7.548 1.00 0.00 N ATOM 1387 CA GLY A 91 -5.447 -13.914 8.017 1.00 0.00 C ATOM 1388 C GLY A 91 -4.262 -14.784 7.645 1.00 0.00 C ATOM 1389 O GLY A 91 -3.944 -15.744 8.346 1.00 0.00 O ATOM 0 H GLY A 91 -4.750 -11.942 8.157 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -5.567 -13.912 9.100 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -6.356 -14.344 7.597 1.00 0.00 H new ATOM 1393 N ALA A 92 -3.608 -14.447 6.538 1.00 0.00 N ATOM 1394 CA ALA A 92 -2.452 -15.203 6.073 1.00 0.00 C ATOM 1395 C ALA A 92 -1.157 -14.445 6.342 1.00 0.00 C ATOM 1396 O ALA A 92 -0.548 -13.890 5.427 1.00 0.00 O ATOM 1397 CB ALA A 92 -2.587 -15.513 4.590 1.00 0.00 C ATOM 0 H ALA A 92 -3.859 -13.655 5.947 1.00 0.00 H new ATOM 0 HA ALA A 92 -2.415 -16.141 6.627 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -1.717 -16.078 4.256 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -3.489 -16.102 4.422 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -2.652 -14.581 4.028 1.00 0.00 H new ATOM 1403 N LYS A 93 -0.740 -14.424 7.604 1.00 0.00 N ATOM 1404 CA LYS A 93 0.483 -13.733 7.994 1.00 0.00 C ATOM 1405 C LYS A 93 1.717 -14.492 7.513 1.00 0.00 C ATOM 1406 O LYS A 93 2.516 -14.974 8.316 1.00 0.00 O ATOM 1407 CB LYS A 93 0.534 -13.562 9.514 1.00 0.00 C ATOM 1408 CG LYS A 93 0.504 -14.879 10.275 1.00 0.00 C ATOM 1409 CD LYS A 93 1.826 -15.150 10.977 1.00 0.00 C ATOM 1410 CE LYS A 93 2.219 -16.616 10.879 1.00 0.00 C ATOM 1411 NZ LYS A 93 1.104 -17.518 11.279 1.00 0.00 N ATOM 0 H LYS A 93 -1.232 -14.878 8.374 1.00 0.00 H new ATOM 0 HA LYS A 93 0.480 -12.749 7.524 1.00 0.00 H new ATOM 0 HB2 LYS A 93 1.441 -13.018 9.780 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.310 -12.949 9.831 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.301 -14.857 11.010 1.00 0.00 H new ATOM 0 HG3 LYS A 93 0.284 -15.694 9.585 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.607 -14.532 10.534 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.748 -14.862 12.025 1.00 0.00 H new ATOM 0 HE2 LYS A 93 2.521 -16.843 9.857 1.00 0.00 H new ATOM 0 HE3 LYS A 93 3.084 -16.803 11.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.490 -18.437 11.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.580 -17.092 12.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.462 -17.656 10.472 1.00 0.00 H new ATOM 1425 N GLY A 94 1.866 -14.594 6.196 1.00 0.00 N ATOM 1426 CA GLY A 94 3.005 -15.295 5.632 1.00 0.00 C ATOM 1427 C GLY A 94 2.856 -15.553 4.145 1.00 0.00 C ATOM 1428 O GLY A 94 3.265 -16.602 3.647 1.00 0.00 O ATOM 0 H GLY A 94 1.219 -14.204 5.510 1.00 0.00 H new ATOM 0 HA2 GLY A 94 3.909 -14.711 5.806 1.00 0.00 H new ATOM 0 HA3 GLY A 94 3.135 -16.245 6.150 1.00 0.00 H new ATOM 1432 N GLN A 95 2.273 -14.594 3.432 1.00 0.00 N ATOM 1433 CA GLN A 95 2.077 -14.725 1.993 1.00 0.00 C ATOM 1434 C GLN A 95 1.977 -13.353 1.325 1.00 0.00 C ATOM 1435 O GLN A 95 1.042 -13.089 0.568 1.00 0.00 O ATOM 1436 CB GLN A 95 0.816 -15.542 1.703 1.00 0.00 C ATOM 1437 CG GLN A 95 0.964 -17.022 2.018 1.00 0.00 C ATOM 1438 CD GLN A 95 2.114 -17.665 1.268 1.00 0.00 C ATOM 1439 OE1 GLN A 95 2.929 -18.379 1.852 1.00 0.00 O ATOM 1440 NE2 GLN A 95 2.186 -17.413 -0.034 1.00 0.00 N ATOM 0 H GLN A 95 1.929 -13.719 3.827 1.00 0.00 H new ATOM 0 HA GLN A 95 2.942 -15.244 1.580 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -0.012 -15.136 2.285 1.00 0.00 H new ATOM 0 HB3 GLN A 95 0.553 -15.427 0.652 1.00 0.00 H new ATOM 0 HG2 GLN A 95 1.118 -17.148 3.090 1.00 0.00 H new ATOM 0 HG3 GLN A 95 0.037 -17.538 1.766 1.00 0.00 H new ATOM 0 HE21 GLN A 95 1.488 -16.815 -0.477 1.00 0.00 H new ATOM 0 HE22 GLN A 95 2.939 -17.817 -0.591 1.00 0.00 H new ATOM 1449 N PRO A 96 2.943 -12.457 1.595 1.00 0.00 N ATOM 1450 CA PRO A 96 2.954 -11.112 1.014 1.00 0.00 C ATOM 1451 C PRO A 96 3.447 -11.108 -0.429 1.00 0.00 C ATOM 1452 O PRO A 96 4.495 -11.676 -0.738 1.00 0.00 O ATOM 1453 CB PRO A 96 3.933 -10.360 1.913 1.00 0.00 C ATOM 1454 CG PRO A 96 4.891 -11.403 2.373 1.00 0.00 C ATOM 1455 CD PRO A 96 4.100 -12.681 2.486 1.00 0.00 C ATOM 0 HA PRO A 96 1.958 -10.672 0.973 1.00 0.00 H new ATOM 0 HB2 PRO A 96 4.443 -9.565 1.368 1.00 0.00 H new ATOM 0 HB3 PRO A 96 3.421 -9.892 2.754 1.00 0.00 H new ATOM 0 HG2 PRO A 96 5.713 -11.515 1.666 1.00 0.00 H new ATOM 0 HG3 PRO A 96 5.331 -11.131 3.333 1.00 0.00 H new ATOM 0 HD2 PRO A 96 4.687 -13.544 2.171 1.00 0.00 H new ATOM 0 HD3 PRO A 96 3.785 -12.867 3.513 1.00 0.00 H new ATOM 1463 N VAL A 97 2.688 -10.463 -1.309 1.00 0.00 N ATOM 1464 CA VAL A 97 3.056 -10.387 -2.719 1.00 0.00 C ATOM 1465 C VAL A 97 4.063 -9.267 -2.960 1.00 0.00 C ATOM 1466 O VAL A 97 4.094 -8.280 -2.227 1.00 0.00 O ATOM 1467 CB VAL A 97 1.823 -10.163 -3.616 1.00 0.00 C ATOM 1468 CG1 VAL A 97 0.828 -11.301 -3.452 1.00 0.00 C ATOM 1469 CG2 VAL A 97 1.168 -8.825 -3.307 1.00 0.00 C ATOM 0 H VAL A 97 1.817 -9.987 -1.072 1.00 0.00 H new ATOM 0 HA VAL A 97 3.509 -11.343 -2.980 1.00 0.00 H new ATOM 0 HB VAL A 97 2.154 -10.146 -4.654 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.036 -11.125 -4.093 1.00 0.00 H new ATOM 0 HG12 VAL A 97 1.302 -12.242 -3.732 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.503 -11.354 -2.413 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.300 -8.687 -3.952 1.00 0.00 H new ATOM 0 HG22 VAL A 97 0.852 -8.807 -2.264 1.00 0.00 H new ATOM 0 HG23 VAL A 97 1.882 -8.021 -3.484 1.00 0.00 H new ATOM 1479 N THR A 98 4.887 -9.427 -3.992 1.00 0.00 N ATOM 1480 CA THR A 98 5.895 -8.427 -4.325 1.00 0.00 C ATOM 1481 C THR A 98 5.772 -7.989 -5.781 1.00 0.00 C ATOM 1482 O THR A 98 5.863 -8.807 -6.696 1.00 0.00 O ATOM 1483 CB THR A 98 7.297 -8.979 -4.064 1.00 0.00 C ATOM 1484 OG1 THR A 98 7.361 -9.604 -2.794 1.00 0.00 O ATOM 1485 CG2 THR A 98 8.376 -7.919 -4.110 1.00 0.00 C ATOM 0 H THR A 98 4.876 -10.238 -4.610 1.00 0.00 H new ATOM 0 HA THR A 98 5.729 -7.557 -3.689 1.00 0.00 H new ATOM 0 HB THR A 98 7.480 -9.694 -4.866 1.00 0.00 H new ATOM 0 HG1 THR A 98 8.265 -9.952 -2.646 1.00 0.00 H new ATOM 0 HG21 THR A 98 9.346 -8.378 -3.917 1.00 0.00 H new ATOM 0 HG22 THR A 98 8.386 -7.452 -5.095 1.00 0.00 H new ATOM 0 HG23 THR A 98 8.175 -7.162 -3.352 1.00 0.00 H new ATOM 1493 N TYR A 99 5.565 -6.692 -5.987 1.00 0.00 N ATOM 1494 CA TYR A 99 5.432 -6.143 -7.331 1.00 0.00 C ATOM 1495 C TYR A 99 6.761 -5.574 -7.819 1.00 0.00 C ATOM 1496 O TYR A 99 7.480 -4.918 -7.065 1.00 0.00 O ATOM 1497 CB TYR A 99 4.355 -5.055 -7.354 1.00 0.00 C ATOM 1498 CG TYR A 99 3.167 -5.393 -8.227 1.00 0.00 C ATOM 1499 CD1 TYR A 99 3.338 -6.017 -9.457 1.00 0.00 C ATOM 1500 CD2 TYR A 99 1.874 -5.088 -7.821 1.00 0.00 C ATOM 1501 CE1 TYR A 99 2.255 -6.326 -10.257 1.00 0.00 C ATOM 1502 CE2 TYR A 99 0.785 -5.395 -8.615 1.00 0.00 C ATOM 1503 CZ TYR A 99 0.981 -6.014 -9.832 1.00 0.00 C ATOM 1504 OH TYR A 99 -0.100 -6.321 -10.625 1.00 0.00 O ATOM 0 H TYR A 99 5.486 -6.002 -5.240 1.00 0.00 H new ATOM 0 HA TYR A 99 5.137 -6.950 -8.001 1.00 0.00 H new ATOM 0 HB2 TYR A 99 4.008 -4.878 -6.336 1.00 0.00 H new ATOM 0 HB3 TYR A 99 4.799 -4.124 -7.705 1.00 0.00 H new ATOM 0 HD1 TYR A 99 4.334 -6.264 -9.793 1.00 0.00 H new ATOM 0 HD2 TYR A 99 1.717 -4.603 -6.869 1.00 0.00 H new ATOM 0 HE1 TYR A 99 2.406 -6.810 -11.211 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -0.214 -5.152 -8.284 1.00 0.00 H new ATOM 0 HH TYR A 99 -0.750 -6.839 -10.106 1.00 0.00 H new ATOM 1514 N SER A 100 7.082 -5.831 -9.082 1.00 0.00 N ATOM 1515 CA SER A 100 8.326 -5.345 -9.669 1.00 0.00 C ATOM 1516 C SER A 100 8.105 -4.034 -10.421 1.00 0.00 C ATOM 1517 O SER A 100 8.887 -3.676 -11.302 1.00 0.00 O ATOM 1518 CB SER A 100 8.911 -6.395 -10.615 1.00 0.00 C ATOM 1519 OG SER A 100 7.899 -6.987 -11.410 1.00 0.00 O ATOM 0 H SER A 100 6.498 -6.373 -9.719 1.00 0.00 H new ATOM 0 HA SER A 100 9.030 -5.160 -8.858 1.00 0.00 H new ATOM 0 HB2 SER A 100 9.659 -5.932 -11.259 1.00 0.00 H new ATOM 0 HB3 SER A 100 9.421 -7.166 -10.037 1.00 0.00 H new ATOM 0 HG SER A 100 8.300 -7.653 -12.007 1.00 0.00 H new ATOM 1525 N GLY A 101 7.039 -3.321 -10.069 1.00 0.00 N ATOM 1526 CA GLY A 101 6.742 -2.060 -10.723 1.00 0.00 C ATOM 1527 C GLY A 101 5.475 -2.121 -11.553 1.00 0.00 C ATOM 1528 O GLY A 101 5.487 -2.611 -12.682 1.00 0.00 O ATOM 0 H GLY A 101 6.376 -3.594 -9.343 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.642 -1.278 -9.970 1.00 0.00 H new ATOM 0 HA3 GLY A 101 7.579 -1.780 -11.363 1.00 0.00 H new ATOM 1532 N SER A 102 4.378 -1.622 -10.992 1.00 0.00 N ATOM 1533 CA SER A 102 3.097 -1.621 -11.688 1.00 0.00 C ATOM 1534 C SER A 102 3.139 -0.701 -12.904 1.00 0.00 C ATOM 1535 O SER A 102 3.945 0.227 -12.964 1.00 0.00 O ATOM 1536 CB SER A 102 1.978 -1.183 -10.741 1.00 0.00 C ATOM 1537 OG SER A 102 2.221 -1.636 -9.421 1.00 0.00 O ATOM 0 H SER A 102 4.351 -1.213 -10.058 1.00 0.00 H new ATOM 0 HA SER A 102 2.897 -2.637 -12.030 1.00 0.00 H new ATOM 0 HB2 SER A 102 1.897 -0.096 -10.747 1.00 0.00 H new ATOM 0 HB3 SER A 102 1.024 -1.575 -11.094 1.00 0.00 H new ATOM 0 HG SER A 102 2.254 -2.615 -9.412 1.00 0.00 H new ATOM 1543 N ARG A 103 2.266 -0.965 -13.870 1.00 0.00 N ATOM 1544 CA ARG A 103 2.203 -0.160 -15.085 1.00 0.00 C ATOM 1545 C ARG A 103 0.960 0.724 -15.089 1.00 0.00 C ATOM 1546 O ARG A 103 0.963 1.813 -15.663 1.00 0.00 O ATOM 1547 CB ARG A 103 2.208 -1.063 -16.320 1.00 0.00 C ATOM 1548 CG ARG A 103 3.568 -1.168 -16.991 1.00 0.00 C ATOM 1549 CD ARG A 103 3.712 -0.160 -18.119 1.00 0.00 C ATOM 1550 NE ARG A 103 3.399 -0.746 -19.421 1.00 0.00 N ATOM 1551 CZ ARG A 103 4.200 -1.592 -20.064 1.00 0.00 C ATOM 1552 NH1 ARG A 103 5.361 -1.954 -19.531 1.00 0.00 N ATOM 1553 NH2 ARG A 103 3.840 -2.078 -21.244 1.00 0.00 N ATOM 0 H ARG A 103 1.592 -1.730 -13.836 1.00 0.00 H new ATOM 0 HA ARG A 103 3.082 0.484 -15.111 1.00 0.00 H new ATOM 0 HB2 ARG A 103 1.876 -2.061 -16.032 1.00 0.00 H new ATOM 0 HB3 ARG A 103 1.485 -0.682 -17.041 1.00 0.00 H new ATOM 0 HG2 ARG A 103 4.353 -1.004 -16.253 1.00 0.00 H new ATOM 0 HG3 ARG A 103 3.705 -2.176 -17.383 1.00 0.00 H new ATOM 0 HD2 ARG A 103 3.051 0.687 -17.935 1.00 0.00 H new ATOM 0 HD3 ARG A 103 4.731 0.227 -18.131 1.00 0.00 H new ATOM 0 HE ARG A 103 2.515 -0.492 -19.862 1.00 0.00 H new ATOM 0 HH11 ARG A 103 5.643 -1.583 -18.624 1.00 0.00 H new ATOM 0 HH12 ARG A 103 5.971 -2.603 -20.029 1.00 0.00 H new ATOM 0 HH21 ARG A 103 2.949 -1.803 -21.658 1.00 0.00 H new ATOM 0 HH22 ARG A 103 4.454 -2.726 -21.737 1.00 0.00 H new ATOM 1567 N THR A 104 -0.101 0.249 -14.445 1.00 0.00 N ATOM 1568 CA THR A 104 -1.351 0.997 -14.376 1.00 0.00 C ATOM 1569 C THR A 104 -2.040 0.783 -13.033 1.00 0.00 C ATOM 1570 O THR A 104 -1.607 -0.039 -12.225 1.00 0.00 O ATOM 1571 CB THR A 104 -2.284 0.577 -15.513 1.00 0.00 C ATOM 1572 OG1 THR A 104 -3.582 1.110 -15.319 1.00 0.00 O ATOM 1573 CG2 THR A 104 -2.420 -0.924 -15.650 1.00 0.00 C ATOM 0 H THR A 104 -0.120 -0.650 -13.964 1.00 0.00 H new ATOM 0 HA THR A 104 -1.117 2.057 -14.479 1.00 0.00 H new ATOM 0 HB THR A 104 -1.828 0.969 -16.422 1.00 0.00 H new ATOM 0 HG1 THR A 104 -4.065 1.115 -16.172 1.00 0.00 H new ATOM 0 HG21 THR A 104 -3.095 -1.154 -16.474 1.00 0.00 H new ATOM 0 HG22 THR A 104 -1.442 -1.361 -15.849 1.00 0.00 H new ATOM 0 HG23 THR A 104 -2.821 -1.339 -14.725 1.00 0.00 H new ATOM 1581 N VAL A 105 -3.114 1.530 -12.800 1.00 0.00 N ATOM 1582 CA VAL A 105 -3.863 1.422 -11.554 1.00 0.00 C ATOM 1583 C VAL A 105 -4.802 0.221 -11.579 1.00 0.00 C ATOM 1584 O VAL A 105 -4.943 -0.489 -10.585 1.00 0.00 O ATOM 1585 CB VAL A 105 -4.687 2.695 -11.280 1.00 0.00 C ATOM 1586 CG1 VAL A 105 -5.307 2.642 -9.892 1.00 0.00 C ATOM 1587 CG2 VAL A 105 -3.823 3.939 -11.441 1.00 0.00 C ATOM 0 H VAL A 105 -3.485 2.216 -13.457 1.00 0.00 H new ATOM 0 HA VAL A 105 -3.131 1.293 -10.757 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.494 2.746 -12.011 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.885 3.549 -9.717 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.963 1.774 -9.819 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -4.518 2.564 -9.144 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -4.423 4.827 -11.243 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -2.992 3.899 -10.737 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -3.434 3.983 -12.458 1.00 0.00 H new ATOM 1597 N GLU A 106 -5.444 0.001 -12.722 1.00 0.00 N ATOM 1598 CA GLU A 106 -6.373 -1.113 -12.878 1.00 0.00 C ATOM 1599 C GLU A 106 -5.697 -2.443 -12.558 1.00 0.00 C ATOM 1600 O GLU A 106 -6.345 -3.385 -12.100 1.00 0.00 O ATOM 1601 CB GLU A 106 -6.931 -1.141 -14.302 1.00 0.00 C ATOM 1602 CG GLU A 106 -5.863 -1.308 -15.370 1.00 0.00 C ATOM 1603 CD GLU A 106 -6.435 -1.290 -16.774 1.00 0.00 C ATOM 1604 OE1 GLU A 106 -6.927 -0.225 -17.202 1.00 0.00 O ATOM 1605 OE2 GLU A 106 -6.390 -2.342 -17.447 1.00 0.00 O ATOM 0 H GLU A 106 -5.338 0.580 -13.555 1.00 0.00 H new ATOM 0 HA GLU A 106 -7.192 -0.968 -12.174 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -7.648 -1.957 -14.386 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -7.477 -0.216 -14.488 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -5.127 -0.510 -15.271 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -5.336 -2.249 -15.208 1.00 0.00 H new ATOM 1612 N ASP A 107 -4.393 -2.514 -12.802 1.00 0.00 N ATOM 1613 CA ASP A 107 -3.632 -3.731 -12.539 1.00 0.00 C ATOM 1614 C ASP A 107 -3.355 -3.890 -11.048 1.00 0.00 C ATOM 1615 O ASP A 107 -3.425 -4.994 -10.507 1.00 0.00 O ATOM 1616 CB ASP A 107 -2.313 -3.709 -13.315 1.00 0.00 C ATOM 1617 CG ASP A 107 -1.937 -5.076 -13.853 1.00 0.00 C ATOM 1618 OD1 ASP A 107 -2.229 -6.083 -13.174 1.00 0.00 O ATOM 1619 OD2 ASP A 107 -1.349 -5.139 -14.954 1.00 0.00 O ATOM 0 H ASP A 107 -3.841 -1.745 -13.181 1.00 0.00 H new ATOM 0 HA ASP A 107 -4.228 -4.581 -12.871 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -2.393 -3.005 -14.143 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -1.517 -3.346 -12.664 1.00 0.00 H new ATOM 1624 N LEU A 108 -3.040 -2.780 -10.388 1.00 0.00 N ATOM 1625 CA LEU A 108 -2.752 -2.796 -8.958 1.00 0.00 C ATOM 1626 C LEU A 108 -3.993 -3.174 -8.155 1.00 0.00 C ATOM 1627 O LEU A 108 -3.898 -3.835 -7.120 1.00 0.00 O ATOM 1628 CB LEU A 108 -2.237 -1.427 -8.507 1.00 0.00 C ATOM 1629 CG LEU A 108 -0.741 -1.195 -8.723 1.00 0.00 C ATOM 1630 CD1 LEU A 108 -0.401 0.279 -8.561 1.00 0.00 C ATOM 1631 CD2 LEU A 108 0.074 -2.042 -7.757 1.00 0.00 C ATOM 0 H LEU A 108 -2.978 -1.858 -10.820 1.00 0.00 H new ATOM 0 HA LEU A 108 -1.983 -3.546 -8.776 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.790 -0.654 -9.041 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.459 -1.303 -7.447 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.489 -1.495 -9.740 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.668 0.425 -8.718 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.959 0.864 -9.293 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.668 0.606 -7.556 1.00 0.00 H new ATOM 0 HD21 LEU A 108 1.136 -1.865 -7.925 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -0.182 -1.773 -6.732 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -0.148 -3.096 -7.921 1.00 0.00 H new ATOM 1643 N ILE A 109 -5.156 -2.750 -8.638 1.00 0.00 N ATOM 1644 CA ILE A 109 -6.417 -3.041 -7.967 1.00 0.00 C ATOM 1645 C ILE A 109 -6.771 -4.520 -8.082 1.00 0.00 C ATOM 1646 O ILE A 109 -7.030 -5.188 -7.080 1.00 0.00 O ATOM 1647 CB ILE A 109 -7.571 -2.200 -8.548 1.00 0.00 C ATOM 1648 CG1 ILE A 109 -7.179 -0.722 -8.607 1.00 0.00 C ATOM 1649 CG2 ILE A 109 -8.834 -2.385 -7.719 1.00 0.00 C ATOM 1650 CD1 ILE A 109 -7.800 0.022 -9.768 1.00 0.00 C ATOM 0 H ILE A 109 -5.251 -2.203 -9.493 1.00 0.00 H new ATOM 0 HA ILE A 109 -6.284 -2.782 -6.917 1.00 0.00 H new ATOM 0 HB ILE A 109 -7.772 -2.543 -9.563 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -7.475 -0.239 -7.676 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -6.094 -0.645 -8.675 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -9.639 -1.784 -8.143 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -9.123 -3.436 -7.726 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -8.646 -2.067 -6.693 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -7.478 1.063 -9.747 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -7.484 -0.436 -10.705 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -8.886 -0.024 -9.690 1.00 0.00 H new ATOM 1662 N LYS A 110 -6.781 -5.026 -9.311 1.00 0.00 N ATOM 1663 CA LYS A 110 -7.103 -6.427 -9.560 1.00 0.00 C ATOM 1664 C LYS A 110 -6.165 -7.352 -8.788 1.00 0.00 C ATOM 1665 O LYS A 110 -6.516 -8.492 -8.483 1.00 0.00 O ATOM 1666 CB LYS A 110 -7.021 -6.731 -11.058 1.00 0.00 C ATOM 1667 CG LYS A 110 -8.160 -7.601 -11.565 1.00 0.00 C ATOM 1668 CD LYS A 110 -8.662 -7.128 -12.920 1.00 0.00 C ATOM 1669 CE LYS A 110 -9.343 -8.252 -13.685 1.00 0.00 C ATOM 1670 NZ LYS A 110 -10.538 -7.772 -14.432 1.00 0.00 N ATOM 0 H LYS A 110 -6.570 -4.487 -10.151 1.00 0.00 H new ATOM 0 HA LYS A 110 -8.121 -6.606 -9.214 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -7.018 -5.792 -11.611 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.074 -7.228 -11.268 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -7.823 -8.635 -11.641 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -8.979 -7.585 -10.846 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -9.362 -6.304 -12.782 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -7.827 -6.743 -13.504 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.634 -8.698 -14.383 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -9.641 -9.036 -12.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.973 -8.569 -14.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -11.226 -7.370 -13.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.251 -7.042 -15.115 1.00 0.00 H new ATOM 1684 N PHE A 111 -4.973 -6.854 -8.475 1.00 0.00 N ATOM 1685 CA PHE A 111 -3.987 -7.637 -7.739 1.00 0.00 C ATOM 1686 C PHE A 111 -4.388 -7.779 -6.275 1.00 0.00 C ATOM 1687 O PHE A 111 -4.317 -8.867 -5.704 1.00 0.00 O ATOM 1688 CB PHE A 111 -2.608 -6.984 -7.838 1.00 0.00 C ATOM 1689 CG PHE A 111 -1.476 -7.972 -7.864 1.00 0.00 C ATOM 1690 CD1 PHE A 111 -1.534 -9.092 -8.678 1.00 0.00 C ATOM 1691 CD2 PHE A 111 -0.355 -7.781 -7.073 1.00 0.00 C ATOM 1692 CE1 PHE A 111 -0.494 -10.002 -8.703 1.00 0.00 C ATOM 1693 CE2 PHE A 111 0.688 -8.687 -7.094 1.00 0.00 C ATOM 1694 CZ PHE A 111 0.618 -9.799 -7.910 1.00 0.00 C ATOM 0 H PHE A 111 -4.667 -5.912 -8.719 1.00 0.00 H new ATOM 0 HA PHE A 111 -3.945 -8.631 -8.185 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.568 -6.374 -8.740 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.472 -6.311 -6.992 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -2.402 -9.256 -9.300 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -0.296 -6.914 -6.432 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -0.551 -10.871 -9.342 1.00 0.00 H new ATOM 0 HE2 PHE A 111 1.557 -8.526 -6.473 1.00 0.00 H new ATOM 0 HZ PHE A 111 1.432 -10.509 -7.928 1.00 0.00 H new ATOM 1704 N ILE A 112 -4.810 -6.672 -5.672 1.00 0.00 N ATOM 1705 CA ILE A 112 -5.222 -6.671 -4.273 1.00 0.00 C ATOM 1706 C ILE A 112 -6.310 -7.710 -4.020 1.00 0.00 C ATOM 1707 O ILE A 112 -6.248 -8.463 -3.049 1.00 0.00 O ATOM 1708 CB ILE A 112 -5.739 -5.284 -3.840 1.00 0.00 C ATOM 1709 CG1 ILE A 112 -4.698 -4.208 -4.150 1.00 0.00 C ATOM 1710 CG2 ILE A 112 -6.082 -5.282 -2.356 1.00 0.00 C ATOM 1711 CD1 ILE A 112 -5.299 -2.907 -4.636 1.00 0.00 C ATOM 0 H ILE A 112 -4.876 -5.763 -6.131 1.00 0.00 H new ATOM 0 HA ILE A 112 -4.340 -6.921 -3.683 1.00 0.00 H new ATOM 0 HB ILE A 112 -6.646 -5.061 -4.403 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -4.110 -4.014 -3.253 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -4.011 -4.586 -4.907 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -6.445 -4.295 -2.068 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -6.855 -6.025 -2.160 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -5.191 -5.524 -1.776 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.502 -2.191 -4.836 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -5.864 -3.086 -5.551 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -5.964 -2.506 -3.872 1.00 0.00 H new ATOM 1723 N ALA A 113 -7.303 -7.747 -4.901 1.00 0.00 N ATOM 1724 CA ALA A 113 -8.401 -8.696 -4.772 1.00 0.00 C ATOM 1725 C ALA A 113 -7.979 -10.096 -5.210 1.00 0.00 C ATOM 1726 O ALA A 113 -8.599 -11.088 -4.828 1.00 0.00 O ATOM 1727 CB ALA A 113 -9.603 -8.225 -5.579 1.00 0.00 C ATOM 0 H ALA A 113 -7.370 -7.131 -5.711 1.00 0.00 H new ATOM 0 HA ALA A 113 -8.681 -8.747 -3.720 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -10.416 -8.943 -5.474 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -9.929 -7.252 -5.212 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -9.326 -8.142 -6.630 1.00 0.00 H new ATOM 1733 N GLU A 114 -6.923 -10.170 -6.015 1.00 0.00 N ATOM 1734 CA GLU A 114 -6.424 -11.450 -6.504 1.00 0.00 C ATOM 1735 C GLU A 114 -5.568 -12.145 -5.449 1.00 0.00 C ATOM 1736 O GLU A 114 -5.748 -13.331 -5.173 1.00 0.00 O ATOM 1737 CB GLU A 114 -5.611 -11.249 -7.784 1.00 0.00 C ATOM 1738 CG GLU A 114 -6.445 -11.321 -9.052 1.00 0.00 C ATOM 1739 CD GLU A 114 -6.315 -12.655 -9.760 1.00 0.00 C ATOM 1740 OE1 GLU A 114 -5.936 -13.644 -9.098 1.00 0.00 O ATOM 1741 OE2 GLU A 114 -6.593 -12.712 -10.976 1.00 0.00 O ATOM 0 H GLU A 114 -6.397 -9.359 -6.342 1.00 0.00 H new ATOM 0 HA GLU A 114 -7.283 -12.084 -6.721 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -5.114 -10.280 -7.740 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -4.829 -12.006 -7.830 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -7.492 -11.146 -8.804 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -6.140 -10.523 -9.729 1.00 0.00 H new ATOM 1748 N ASN A 115 -4.634 -11.401 -4.864 1.00 0.00 N ATOM 1749 CA ASN A 115 -3.750 -11.951 -3.843 1.00 0.00 C ATOM 1750 C ASN A 115 -4.327 -11.741 -2.445 1.00 0.00 C ATOM 1751 O ASN A 115 -4.168 -12.586 -1.565 1.00 0.00 O ATOM 1752 CB ASN A 115 -2.361 -11.313 -3.941 1.00 0.00 C ATOM 1753 CG ASN A 115 -2.373 -9.835 -3.602 1.00 0.00 C ATOM 1754 OD1 ASN A 115 -2.716 -9.445 -2.487 1.00 0.00 O ATOM 1755 ND2 ASN A 115 -1.996 -9.002 -4.565 1.00 0.00 N ATOM 0 H ASN A 115 -4.470 -10.418 -5.079 1.00 0.00 H new ATOM 0 HA ASN A 115 -3.661 -13.023 -4.017 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -1.679 -11.831 -3.267 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -1.974 -11.447 -4.951 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -1.983 -7.997 -4.394 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -1.719 -9.368 -5.476 1.00 0.00 H new ATOM 1762 N GLY A 116 -4.995 -10.609 -2.248 1.00 0.00 N ATOM 1763 CA GLY A 116 -5.583 -10.311 -0.955 1.00 0.00 C ATOM 1764 C GLY A 116 -6.588 -11.359 -0.519 1.00 0.00 C ATOM 1765 O GLY A 116 -7.572 -11.613 -1.214 1.00 0.00 O ATOM 0 H GLY A 116 -5.140 -9.893 -2.960 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -4.792 -10.237 -0.208 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -6.073 -9.338 -0.998 1.00 0.00 H new ATOM 1769 N LYS A 117 -6.341 -11.970 0.636 1.00 0.00 N ATOM 1770 CA LYS A 117 -7.233 -12.996 1.165 1.00 0.00 C ATOM 1771 C LYS A 117 -8.643 -12.446 1.356 1.00 0.00 C ATOM 1772 O LYS A 117 -9.629 -13.119 1.056 1.00 0.00 O ATOM 1773 CB LYS A 117 -6.697 -13.532 2.494 1.00 0.00 C ATOM 1774 CG LYS A 117 -6.929 -15.022 2.687 1.00 0.00 C ATOM 1775 CD LYS A 117 -6.110 -15.567 3.846 1.00 0.00 C ATOM 1776 CE LYS A 117 -6.827 -16.712 4.544 1.00 0.00 C ATOM 1777 NZ LYS A 117 -6.145 -17.105 5.808 1.00 0.00 N ATOM 0 H LYS A 117 -5.531 -11.772 1.223 1.00 0.00 H new ATOM 0 HA LYS A 117 -7.276 -13.812 0.443 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -5.628 -13.329 2.554 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -7.171 -12.990 3.312 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.988 -15.206 2.870 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -6.666 -15.554 1.773 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -5.143 -15.911 3.480 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -5.914 -14.769 4.562 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -7.854 -16.419 4.762 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -6.876 -17.571 3.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -6.645 -17.910 6.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -5.162 -17.377 5.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -6.151 -16.303 6.470 1.00 0.00 H new ATOM 1791 N TYR A 118 -8.729 -11.217 1.855 1.00 0.00 N ATOM 1792 CA TYR A 118 -10.018 -10.573 2.085 1.00 0.00 C ATOM 1793 C TYR A 118 -10.625 -10.066 0.776 1.00 0.00 C ATOM 1794 O TYR A 118 -11.782 -9.648 0.743 1.00 0.00 O ATOM 1795 CB TYR A 118 -9.861 -9.414 3.072 1.00 0.00 C ATOM 1796 CG TYR A 118 -10.422 -9.707 4.445 1.00 0.00 C ATOM 1797 CD1 TYR A 118 -10.148 -10.908 5.086 1.00 0.00 C ATOM 1798 CD2 TYR A 118 -11.226 -8.782 5.099 1.00 0.00 C ATOM 1799 CE1 TYR A 118 -10.659 -11.180 6.341 1.00 0.00 C ATOM 1800 CE2 TYR A 118 -11.741 -9.046 6.354 1.00 0.00 C ATOM 1801 CZ TYR A 118 -11.455 -10.246 6.971 1.00 0.00 C ATOM 1802 OH TYR A 118 -11.965 -10.513 8.220 1.00 0.00 O ATOM 0 H TYR A 118 -7.922 -10.647 2.108 1.00 0.00 H new ATOM 0 HA TYR A 118 -10.694 -11.316 2.508 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -8.803 -9.169 3.166 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -10.358 -8.533 2.666 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -9.525 -11.642 4.596 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -11.452 -7.841 4.619 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -10.436 -12.119 6.826 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -12.364 -8.316 6.849 1.00 0.00 H new ATOM 0 HH TYR A 118 -12.503 -9.752 8.523 1.00 0.00 H new ATOM 1812 N LYS A 119 -9.840 -10.103 -0.299 1.00 0.00 N ATOM 1813 CA LYS A 119 -10.308 -9.644 -1.602 1.00 0.00 C ATOM 1814 C LYS A 119 -10.645 -8.156 -1.563 1.00 0.00 C ATOM 1815 O LYS A 119 -11.753 -7.748 -1.914 1.00 0.00 O ATOM 1816 CB LYS A 119 -11.532 -10.451 -2.043 1.00 0.00 C ATOM 1817 CG LYS A 119 -11.183 -11.682 -2.865 1.00 0.00 C ATOM 1818 CD LYS A 119 -11.849 -12.933 -2.312 1.00 0.00 C ATOM 1819 CE LYS A 119 -12.182 -13.922 -3.417 1.00 0.00 C ATOM 1820 NZ LYS A 119 -10.998 -14.735 -3.811 1.00 0.00 N ATOM 0 H LYS A 119 -8.879 -10.446 -0.292 1.00 0.00 H new ATOM 0 HA LYS A 119 -9.507 -9.797 -2.325 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -12.091 -10.760 -1.160 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -12.190 -9.808 -2.628 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -11.494 -11.530 -3.898 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -10.102 -11.819 -2.875 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -11.189 -13.407 -1.585 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -12.761 -12.657 -1.782 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -12.982 -14.583 -3.083 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -12.557 -13.382 -4.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -11.267 -15.397 -4.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -10.244 -14.106 -4.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -10.655 -15.270 -2.988 1.00 0.00 H new ATOM 1834 N ALA A 120 -9.681 -7.349 -1.131 1.00 0.00 N ATOM 1835 CA ALA A 120 -9.874 -5.906 -1.043 1.00 0.00 C ATOM 1836 C ALA A 120 -10.058 -5.288 -2.425 1.00 0.00 C ATOM 1837 O ALA A 120 -9.134 -4.693 -2.979 1.00 0.00 O ATOM 1838 CB ALA A 120 -8.699 -5.261 -0.321 1.00 0.00 C ATOM 0 H ALA A 120 -8.759 -7.670 -0.837 1.00 0.00 H new ATOM 0 HA ALA A 120 -10.783 -5.720 -0.472 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -8.855 -4.184 -0.262 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -8.620 -5.672 0.685 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -7.779 -5.465 -0.869 1.00 0.00 H new ATOM 1844 N ALA A 121 -11.260 -5.431 -2.976 1.00 0.00 N ATOM 1845 CA ALA A 121 -11.571 -4.885 -4.292 1.00 0.00 C ATOM 1846 C ALA A 121 -13.005 -5.212 -4.696 1.00 0.00 C ATOM 1847 O ALA A 121 -13.815 -4.269 -4.815 1.00 0.00 O ATOM 1848 CB ALA A 121 -10.595 -5.414 -5.333 1.00 0.00 C ATOM 1849 OXT ALA A 121 -13.306 -6.409 -4.889 1.00 0.00 O ATOM 0 H ALA A 121 -12.035 -5.921 -2.530 1.00 0.00 H new ATOM 0 HA ALA A 121 -11.472 -3.801 -4.238 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -10.842 -4.996 -6.309 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -9.580 -5.124 -5.061 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -10.663 -6.501 -5.376 1.00 0.00 H new