USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 893 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 115 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 118 CYS SG : rot -23:sc= 0.776 USER MOD Set 1.3: A 119 GLN : amide:sc= -2.04! C(o=-1.3!,f=-2.4!) USER MOD Set 2.1: A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 108 THR OG1 : rot 72:sc= -0.468 USER MOD Set 3.1: A 98 THR OG1 : rot 180:sc= 0.0348 USER MOD Set 3.2: A 111 LYS NZ :NH3+ 131:sc= -0.152 (180deg=-0.907) USER MOD Set 4.1: A 41 SER OG : rot 180:sc= -0.0753 USER MOD Set 4.2: A 77 GLN : amide:sc= -0.346 K(o=-0.42,f=0.41) USER MOD Set 5.1: A 39 SER OG : rot 83:sc= 1.31 USER MOD Set 5.2: A 48 SER OG : rot -94:sc= 0.97 USER MOD Set 5.3: A 53 CYS SG : rot 177:sc= -0.608 USER MOD Set 5.4: A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot -36:sc= 0.135 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 HIS : no HE2:sc= -5.45! C(o=-5.5!,f=-4.2!) USER MOD Single : A 31 SER OG : rot 180:sc= 0.042 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.00312 USER MOD Single : A 37 TYR OH : rot 180:sc= -0.861 USER MOD Single : A 42 LYS NZ :NH3+ 138:sc=-0.00608 (180deg=-0.108) USER MOD Single : A 50 CYS SG : rot 180:sc= -1.1 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.197 X(o=-0.2,f=0) USER MOD Single : A 68 THR OG1 : rot -53:sc= 0.341 USER MOD Single : A 71 CYS SG : rot 149:sc= -0.125 USER MOD Single : A 76 CYS SG : rot 180:sc= -0.13 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -0.492 K(o=-0.49,f=-4.2!) USER MOD Single : A 89 ASN : amide:sc= -2.65! C(o=-2.7!,f=-4!) USER MOD Single : A 93 GLN : amide:sc= 0.188 K(o=0.19,f=-0.5) USER MOD Single : A 94 LYS NZ :NH3+ -113:sc= 0.0859 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 143:sc= -0.262 (180deg=-1.05) USER MOD Single : A 102 THR OG1 : rot -16:sc= 0.139 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -0.122 X(o=-0.12,f=0) USER MOD Single : A 117 CYS SG : rot 68:sc= 0.506 USER MOD Single : A 120 SER OG : rot 180:sc= 0.0241 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 154:sc= -0.166 (180deg=-0.686) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 102 N THR A 10 0.582 4.345 6.797 1.00 0.00 N ATOM 103 CA THR A 10 0.128 3.376 7.786 1.00 0.00 C ATOM 104 C THR A 10 -0.195 2.036 7.135 1.00 0.00 C ATOM 105 O THR A 10 -0.991 1.964 6.199 1.00 0.00 O ATOM 106 CB THR A 10 -1.118 3.882 8.538 1.00 0.00 C ATOM 107 OG1 THR A 10 -2.105 4.333 7.603 1.00 0.00 O ATOM 108 CG2 THR A 10 -0.755 5.015 9.486 1.00 0.00 C ATOM 0 HA THR A 10 0.944 3.244 8.497 1.00 0.00 H new ATOM 0 HB THR A 10 -1.523 3.056 9.123 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.662 4.758 6.839 1.00 0.00 H new ATOM 0 HG21 THR A 10 -1.651 5.356 10.006 1.00 0.00 H new ATOM 0 HG22 THR A 10 -0.026 4.660 10.214 1.00 0.00 H new ATOM 0 HG23 THR A 10 -0.328 5.842 8.918 1.00 0.00 H new ATOM 116 N PHE A 11 0.428 0.974 7.637 1.00 0.00 N ATOM 117 CA PHE A 11 0.207 -0.365 7.104 1.00 0.00 C ATOM 118 C PHE A 11 -0.489 -1.252 8.132 1.00 0.00 C ATOM 119 O PHE A 11 -0.257 -1.124 9.334 1.00 0.00 O ATOM 120 CB PHE A 11 1.537 -0.996 6.686 1.00 0.00 C ATOM 121 CG PHE A 11 2.209 -1.763 7.788 1.00 0.00 C ATOM 122 CD1 PHE A 11 2.924 -1.101 8.774 1.00 0.00 C ATOM 123 CD2 PHE A 11 2.126 -3.145 7.840 1.00 0.00 C ATOM 124 CE1 PHE A 11 3.545 -1.805 9.789 1.00 0.00 C ATOM 125 CE2 PHE A 11 2.744 -3.854 8.853 1.00 0.00 C ATOM 126 CZ PHE A 11 3.454 -3.182 9.829 1.00 0.00 C ATOM 0 H PHE A 11 1.090 1.015 8.412 1.00 0.00 H new ATOM 0 HA PHE A 11 -0.438 -0.279 6.229 1.00 0.00 H new ATOM 0 HB2 PHE A 11 1.364 -1.664 5.842 1.00 0.00 H new ATOM 0 HB3 PHE A 11 2.209 -0.211 6.338 1.00 0.00 H new ATOM 0 HD1 PHE A 11 2.997 -0.024 8.749 1.00 0.00 H new ATOM 0 HD2 PHE A 11 1.572 -3.675 7.080 1.00 0.00 H new ATOM 0 HE1 PHE A 11 4.101 -1.278 10.550 1.00 0.00 H new ATOM 0 HE2 PHE A 11 2.672 -4.931 8.881 1.00 0.00 H new ATOM 0 HZ PHE A 11 3.937 -3.733 10.622 1.00 0.00 H new ATOM 136 N GLU A 12 -1.342 -2.149 7.650 1.00 0.00 N ATOM 137 CA GLU A 12 -2.073 -3.057 8.527 1.00 0.00 C ATOM 138 C GLU A 12 -2.102 -4.468 7.948 1.00 0.00 C ATOM 139 O GLU A 12 -2.697 -4.707 6.898 1.00 0.00 O ATOM 140 CB GLU A 12 -3.501 -2.553 8.743 1.00 0.00 C ATOM 141 CG GLU A 12 -4.390 -3.540 9.481 1.00 0.00 C ATOM 142 CD GLU A 12 -5.824 -3.060 9.596 1.00 0.00 C ATOM 143 OE1 GLU A 12 -6.138 -2.360 10.581 1.00 0.00 O ATOM 144 OE2 GLU A 12 -6.632 -3.386 8.701 1.00 0.00 O ATOM 0 H GLU A 12 -1.544 -2.267 6.657 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.557 -3.088 9.487 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.467 -1.619 9.303 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.948 -2.328 7.775 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.372 -4.498 8.962 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.987 -3.711 10.479 1.00 0.00 H new ATOM 151 N GLU A 13 -1.454 -5.399 8.641 1.00 0.00 N ATOM 152 CA GLU A 13 -1.404 -6.786 8.195 1.00 0.00 C ATOM 153 C GLU A 13 -2.633 -7.556 8.671 1.00 0.00 C ATOM 154 O GLU A 13 -2.879 -7.673 9.872 1.00 0.00 O ATOM 155 CB GLU A 13 -0.133 -7.466 8.709 1.00 0.00 C ATOM 156 CG GLU A 13 -0.062 -8.949 8.386 1.00 0.00 C ATOM 157 CD GLU A 13 -0.351 -9.242 6.926 1.00 0.00 C ATOM 158 OE1 GLU A 13 -1.466 -8.919 6.465 1.00 0.00 O ATOM 159 OE2 GLU A 13 0.539 -9.794 6.245 1.00 0.00 O ATOM 0 H GLU A 13 -0.957 -5.218 9.513 1.00 0.00 H new ATOM 0 HA GLU A 13 -1.394 -6.789 7.105 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.735 -6.967 8.278 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.073 -7.335 9.789 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.929 -9.325 8.639 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -0.776 -9.487 9.009 1.00 0.00 H new ATOM 166 N VAL A 14 -3.402 -8.077 7.721 1.00 0.00 N ATOM 167 CA VAL A 14 -4.605 -8.836 8.042 1.00 0.00 C ATOM 168 C VAL A 14 -4.448 -10.304 7.662 1.00 0.00 C ATOM 169 O VAL A 14 -4.416 -10.650 6.481 1.00 0.00 O ATOM 170 CB VAL A 14 -5.840 -8.261 7.323 1.00 0.00 C ATOM 171 CG1 VAL A 14 -7.072 -9.102 7.620 1.00 0.00 C ATOM 172 CG2 VAL A 14 -6.065 -6.811 7.727 1.00 0.00 C ATOM 0 H VAL A 14 -3.214 -7.988 6.723 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.750 -8.756 9.119 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.659 -8.292 6.249 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.934 -8.680 7.103 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.907 -10.123 7.276 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.259 -9.107 8.694 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -6.941 -6.421 7.210 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.224 -6.754 8.804 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -5.191 -6.218 7.457 1.00 0.00 H new ATOM 182 N SER A 15 -4.350 -11.163 8.671 1.00 0.00 N ATOM 183 CA SER A 15 -4.192 -12.595 8.443 1.00 0.00 C ATOM 184 C SER A 15 -5.542 -13.256 8.186 1.00 0.00 C ATOM 185 O SER A 15 -6.410 -13.282 9.058 1.00 0.00 O ATOM 186 CB SER A 15 -3.510 -13.252 9.645 1.00 0.00 C ATOM 187 OG SER A 15 -3.441 -14.658 9.487 1.00 0.00 O ATOM 0 H SER A 15 -4.377 -10.893 9.654 1.00 0.00 H new ATOM 0 HA SER A 15 -3.567 -12.731 7.561 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.505 -12.847 9.763 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.060 -13.012 10.555 1.00 0.00 H new ATOM 0 HG SER A 15 -3.000 -15.054 10.267 1.00 0.00 H new ATOM 193 N VAL A 16 -5.712 -13.790 6.980 1.00 0.00 N ATOM 194 CA VAL A 16 -6.956 -14.453 6.606 1.00 0.00 C ATOM 195 C VAL A 16 -6.682 -15.758 5.868 1.00 0.00 C ATOM 196 O VAL A 16 -5.577 -15.985 5.373 1.00 0.00 O ATOM 197 CB VAL A 16 -7.829 -13.547 5.717 1.00 0.00 C ATOM 198 CG1 VAL A 16 -8.359 -12.366 6.516 1.00 0.00 C ATOM 199 CG2 VAL A 16 -7.042 -13.072 4.505 1.00 0.00 C ATOM 0 H VAL A 16 -5.004 -13.776 6.246 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.492 -14.667 7.531 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.681 -14.127 5.363 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -8.973 -11.737 5.872 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.961 -12.731 7.348 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.523 -11.783 6.901 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.674 -12.433 3.888 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -6.170 -12.508 4.836 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.718 -13.934 3.921 1.00 0.00 H new ATOM 209 N LEU A 17 -7.695 -16.615 5.797 1.00 0.00 N ATOM 210 CA LEU A 17 -7.565 -17.900 5.119 1.00 0.00 C ATOM 211 C LEU A 17 -8.735 -18.135 4.169 1.00 0.00 C ATOM 212 O LEU A 17 -9.897 -18.045 4.564 1.00 0.00 O ATOM 213 CB LEU A 17 -7.488 -19.034 6.142 1.00 0.00 C ATOM 214 CG LEU A 17 -6.678 -20.262 5.724 1.00 0.00 C ATOM 215 CD1 LEU A 17 -6.391 -21.147 6.927 1.00 0.00 C ATOM 216 CD2 LEU A 17 -7.415 -21.045 4.647 1.00 0.00 C ATOM 0 H LEU A 17 -8.616 -16.443 6.201 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.645 -17.883 4.535 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -7.060 -18.637 7.063 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -8.503 -19.355 6.375 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.727 -19.924 5.313 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.814 -22.016 6.610 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.822 -20.583 7.666 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -7.331 -21.477 7.368 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.824 -21.915 4.361 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.381 -21.372 5.032 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.568 -20.409 3.775 1.00 0.00 H new ATOM 228 N GLY A 18 -8.420 -18.439 2.913 1.00 0.00 N ATOM 229 CA GLY A 18 -9.456 -18.684 1.927 1.00 0.00 C ATOM 230 C GLY A 18 -9.825 -17.436 1.151 1.00 0.00 C ATOM 231 O GLY A 18 -9.344 -16.343 1.453 1.00 0.00 O ATOM 0 H GLY A 18 -7.466 -18.520 2.561 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.118 -19.453 1.233 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.343 -19.073 2.426 1.00 0.00 H new ATOM 235 N PHE A 19 -10.680 -17.597 0.146 1.00 0.00 N ATOM 236 CA PHE A 19 -11.111 -16.474 -0.678 1.00 0.00 C ATOM 237 C PHE A 19 -12.193 -15.664 0.030 1.00 0.00 C ATOM 238 O PHE A 19 -12.198 -14.434 -0.025 1.00 0.00 O ATOM 239 CB PHE A 19 -11.634 -16.974 -2.026 1.00 0.00 C ATOM 240 CG PHE A 19 -11.869 -15.876 -3.023 1.00 0.00 C ATOM 241 CD1 PHE A 19 -12.912 -14.980 -2.853 1.00 0.00 C ATOM 242 CD2 PHE A 19 -11.047 -15.739 -4.130 1.00 0.00 C ATOM 243 CE1 PHE A 19 -13.132 -13.969 -3.769 1.00 0.00 C ATOM 244 CE2 PHE A 19 -11.261 -14.729 -5.049 1.00 0.00 C ATOM 245 CZ PHE A 19 -12.304 -13.842 -4.868 1.00 0.00 C ATOM 0 H PHE A 19 -11.088 -18.494 -0.117 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.249 -15.828 -0.847 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.920 -17.685 -2.442 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -12.567 -17.515 -1.867 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.561 -15.073 -1.995 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -10.230 -16.429 -4.276 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -13.950 -13.279 -3.626 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -10.613 -14.634 -5.908 1.00 0.00 H new ATOM 0 HZ PHE A 19 -12.472 -13.051 -5.584 1.00 0.00 H new ATOM 255 N GLU A 20 -13.108 -16.363 0.695 1.00 0.00 N ATOM 256 CA GLU A 20 -14.196 -15.708 1.412 1.00 0.00 C ATOM 257 C GLU A 20 -13.659 -14.625 2.344 1.00 0.00 C ATOM 258 O GLU A 20 -13.935 -13.440 2.158 1.00 0.00 O ATOM 259 CB GLU A 20 -14.998 -16.735 2.215 1.00 0.00 C ATOM 260 CG GLU A 20 -15.675 -17.787 1.353 1.00 0.00 C ATOM 261 CD GLU A 20 -16.753 -17.204 0.460 1.00 0.00 C ATOM 262 OE1 GLU A 20 -17.739 -16.660 1.001 1.00 0.00 O ATOM 263 OE2 GLU A 20 -16.612 -17.293 -0.777 1.00 0.00 O ATOM 0 H GLU A 20 -13.117 -17.381 0.752 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.851 -15.239 0.677 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.333 -17.230 2.923 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -15.756 -16.214 2.801 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.926 -18.283 0.736 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -16.114 -18.550 1.995 1.00 0.00 H new ATOM 270 N GLU A 21 -12.891 -15.042 3.346 1.00 0.00 N ATOM 271 CA GLU A 21 -12.317 -14.107 4.307 1.00 0.00 C ATOM 272 C GLU A 21 -11.557 -12.993 3.594 1.00 0.00 C ATOM 273 O GLU A 21 -11.728 -11.813 3.903 1.00 0.00 O ATOM 274 CB GLU A 21 -11.383 -14.842 5.270 1.00 0.00 C ATOM 275 CG GLU A 21 -12.111 -15.723 6.271 1.00 0.00 C ATOM 276 CD GLU A 21 -13.149 -16.614 5.617 1.00 0.00 C ATOM 277 OE1 GLU A 21 -12.773 -17.420 4.741 1.00 0.00 O ATOM 278 OE2 GLU A 21 -14.339 -16.505 5.982 1.00 0.00 O ATOM 0 H GLU A 21 -12.652 -16.019 3.513 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.134 -13.660 4.874 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.691 -15.456 4.694 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.784 -14.110 5.811 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.386 -16.343 6.799 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -12.596 -15.094 7.018 1.00 0.00 H new ATOM 285 N PHE A 22 -10.715 -13.375 2.640 1.00 0.00 N ATOM 286 CA PHE A 22 -9.926 -12.409 1.884 1.00 0.00 C ATOM 287 C PHE A 22 -10.811 -11.289 1.343 1.00 0.00 C ATOM 288 O PHE A 22 -10.648 -10.125 1.708 1.00 0.00 O ATOM 289 CB PHE A 22 -9.201 -13.103 0.729 1.00 0.00 C ATOM 290 CG PHE A 22 -8.693 -12.153 -0.318 1.00 0.00 C ATOM 291 CD1 PHE A 22 -8.015 -11.001 0.044 1.00 0.00 C ATOM 292 CD2 PHE A 22 -8.895 -12.413 -1.664 1.00 0.00 C ATOM 293 CE1 PHE A 22 -7.548 -10.125 -0.917 1.00 0.00 C ATOM 294 CE2 PHE A 22 -8.429 -11.541 -2.630 1.00 0.00 C ATOM 295 CZ PHE A 22 -7.754 -10.396 -2.256 1.00 0.00 C ATOM 0 H PHE A 22 -10.561 -14.347 2.372 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.188 -11.973 2.558 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -8.362 -13.674 1.128 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -9.879 -13.817 0.262 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -7.849 -10.785 1.089 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.423 -13.307 -1.962 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.022 -9.229 -0.622 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -8.593 -11.755 -3.676 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.388 -9.714 -3.009 1.00 0.00 H new ATOM 305 N ASP A 23 -11.746 -11.650 0.472 1.00 0.00 N ATOM 306 CA ASP A 23 -12.657 -10.677 -0.119 1.00 0.00 C ATOM 307 C ASP A 23 -13.232 -9.753 0.949 1.00 0.00 C ATOM 308 O ASP A 23 -13.262 -8.533 0.780 1.00 0.00 O ATOM 309 CB ASP A 23 -13.790 -11.391 -0.858 1.00 0.00 C ATOM 310 CG ASP A 23 -14.598 -10.448 -1.728 1.00 0.00 C ATOM 311 OD1 ASP A 23 -14.640 -9.240 -1.413 1.00 0.00 O ATOM 312 OD2 ASP A 23 -15.190 -10.917 -2.722 1.00 0.00 O ATOM 0 H ASP A 23 -11.893 -12.610 0.159 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.094 -10.073 -0.831 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.372 -12.185 -1.478 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.450 -11.867 -0.133 1.00 0.00 H new ATOM 317 N LYS A 24 -13.690 -10.341 2.049 1.00 0.00 N ATOM 318 CA LYS A 24 -14.265 -9.571 3.146 1.00 0.00 C ATOM 319 C LYS A 24 -13.319 -8.459 3.585 1.00 0.00 C ATOM 320 O LYS A 24 -13.674 -7.281 3.555 1.00 0.00 O ATOM 321 CB LYS A 24 -14.576 -10.488 4.331 1.00 0.00 C ATOM 322 CG LYS A 24 -15.593 -9.908 5.299 1.00 0.00 C ATOM 323 CD LYS A 24 -17.016 -10.176 4.838 1.00 0.00 C ATOM 324 CE LYS A 24 -18.033 -9.536 5.771 1.00 0.00 C ATOM 325 NZ LYS A 24 -18.370 -10.424 6.918 1.00 0.00 N ATOM 0 H LYS A 24 -13.674 -11.349 2.205 1.00 0.00 H new ATOM 0 HA LYS A 24 -15.191 -9.117 2.792 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -14.948 -11.441 3.954 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -13.652 -10.697 4.870 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.443 -10.340 6.288 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.436 -8.833 5.393 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.152 -9.788 3.828 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.189 -11.251 4.792 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -17.638 -8.592 6.146 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -18.940 -9.302 5.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.066 -9.952 7.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -18.771 -11.315 6.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -17.509 -10.627 7.465 1.00 0.00 H new ATOM 339 N ALA A 25 -12.112 -8.840 3.990 1.00 0.00 N ATOM 340 CA ALA A 25 -11.113 -7.874 4.431 1.00 0.00 C ATOM 341 C ALA A 25 -10.830 -6.842 3.345 1.00 0.00 C ATOM 342 O ALA A 25 -10.609 -5.666 3.634 1.00 0.00 O ATOM 343 CB ALA A 25 -9.830 -8.587 4.832 1.00 0.00 C ATOM 0 H ALA A 25 -11.802 -9.811 4.022 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.510 -7.349 5.300 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.093 -7.853 5.159 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.038 -9.280 5.647 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.438 -9.139 3.978 1.00 0.00 H new ATOM 349 N VAL A 26 -10.838 -7.290 2.093 1.00 0.00 N ATOM 350 CA VAL A 26 -10.582 -6.405 0.963 1.00 0.00 C ATOM 351 C VAL A 26 -11.623 -5.294 0.888 1.00 0.00 C ATOM 352 O VAL A 26 -11.320 -4.126 1.135 1.00 0.00 O ATOM 353 CB VAL A 26 -10.579 -7.181 -0.368 1.00 0.00 C ATOM 354 CG1 VAL A 26 -10.625 -6.220 -1.546 1.00 0.00 C ATOM 355 CG2 VAL A 26 -9.358 -8.085 -0.454 1.00 0.00 C ATOM 0 H VAL A 26 -11.019 -8.260 1.836 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.597 -5.966 1.122 1.00 0.00 H new ATOM 0 HB VAL A 26 -11.470 -7.807 -0.406 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -10.622 -6.786 -2.478 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -11.532 -5.618 -1.490 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.754 -5.566 -1.516 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.372 -8.626 -1.400 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.453 -7.481 -0.394 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.374 -8.797 0.371 1.00 0.00 H new ATOM 365 N LYS A 27 -12.852 -5.665 0.547 1.00 0.00 N ATOM 366 CA LYS A 27 -13.941 -4.701 0.441 1.00 0.00 C ATOM 367 C LYS A 27 -14.056 -3.868 1.713 1.00 0.00 C ATOM 368 O LYS A 27 -14.631 -2.780 1.703 1.00 0.00 O ATOM 369 CB LYS A 27 -15.264 -5.422 0.169 1.00 0.00 C ATOM 370 CG LYS A 27 -15.284 -6.180 -1.147 1.00 0.00 C ATOM 371 CD LYS A 27 -16.417 -7.192 -1.190 1.00 0.00 C ATOM 372 CE LYS A 27 -17.773 -6.507 -1.259 1.00 0.00 C ATOM 373 NZ LYS A 27 -18.184 -6.231 -2.664 1.00 0.00 N ATOM 0 H LYS A 27 -13.119 -6.627 0.339 1.00 0.00 H new ATOM 0 HA LYS A 27 -13.721 -4.032 -0.391 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -15.462 -6.119 0.983 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -16.073 -4.692 0.170 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -15.392 -5.476 -1.972 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -14.332 -6.692 -1.288 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -16.292 -7.843 -2.055 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -16.373 -7.827 -0.305 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -18.522 -7.136 -0.778 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -17.736 -5.571 -0.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -19.113 -5.764 -2.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -17.482 -5.610 -3.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -18.244 -7.126 -3.190 1.00 0.00 H new ATOM 387 N GLU A 28 -13.504 -4.386 2.806 1.00 0.00 N ATOM 388 CA GLU A 28 -13.545 -3.688 4.086 1.00 0.00 C ATOM 389 C GLU A 28 -12.588 -2.499 4.088 1.00 0.00 C ATOM 390 O GLU A 28 -12.825 -1.498 4.765 1.00 0.00 O ATOM 391 CB GLU A 28 -13.189 -4.645 5.225 1.00 0.00 C ATOM 392 CG GLU A 28 -14.387 -5.386 5.795 1.00 0.00 C ATOM 393 CD GLU A 28 -14.046 -6.175 7.044 1.00 0.00 C ATOM 394 OE1 GLU A 28 -13.098 -5.781 7.755 1.00 0.00 O ATOM 395 OE2 GLU A 28 -14.728 -7.187 7.310 1.00 0.00 O ATOM 0 H GLU A 28 -13.024 -5.285 2.831 1.00 0.00 H new ATOM 0 HA GLU A 28 -14.559 -3.317 4.236 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.461 -5.372 4.864 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -12.707 -4.082 6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -15.176 -4.670 6.026 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -14.783 -6.064 5.039 1.00 0.00 H new ATOM 402 N HIS A 29 -11.505 -2.617 3.326 1.00 0.00 N ATOM 403 CA HIS A 29 -10.511 -1.552 3.240 1.00 0.00 C ATOM 404 C HIS A 29 -10.519 -0.913 1.855 1.00 0.00 C ATOM 405 O HIS A 29 -9.601 -0.176 1.496 1.00 0.00 O ATOM 406 CB HIS A 29 -9.119 -2.099 3.554 1.00 0.00 C ATOM 407 CG HIS A 29 -9.075 -2.957 4.781 1.00 0.00 C ATOM 408 ND1 HIS A 29 -9.430 -2.500 6.032 1.00 0.00 N ATOM 409 CD2 HIS A 29 -8.716 -4.252 4.943 1.00 0.00 C ATOM 410 CE1 HIS A 29 -9.290 -3.476 6.912 1.00 0.00 C ATOM 411 NE2 HIS A 29 -8.858 -4.550 6.276 1.00 0.00 N ATOM 0 H HIS A 29 -11.293 -3.438 2.760 1.00 0.00 H new ATOM 0 HA HIS A 29 -10.767 -0.789 3.975 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -8.765 -2.679 2.702 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -8.429 -1.264 3.680 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -9.751 -1.556 6.245 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -8.380 -4.925 4.168 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -9.494 -3.407 7.970 1.00 0.00 H new ATOM 420 N GLU A 30 -11.561 -1.202 1.081 1.00 0.00 N ATOM 421 CA GLU A 30 -11.686 -0.656 -0.265 1.00 0.00 C ATOM 422 C GLU A 30 -11.459 0.853 -0.264 1.00 0.00 C ATOM 423 O GLU A 30 -10.980 1.421 -1.246 1.00 0.00 O ATOM 424 CB GLU A 30 -13.067 -0.974 -0.843 1.00 0.00 C ATOM 425 CG GLU A 30 -14.208 -0.302 -0.097 1.00 0.00 C ATOM 426 CD GLU A 30 -15.570 -0.709 -0.625 1.00 0.00 C ATOM 427 OE1 GLU A 30 -15.727 -0.791 -1.861 1.00 0.00 O ATOM 428 OE2 GLU A 30 -16.478 -0.946 0.199 1.00 0.00 O ATOM 0 H GLU A 30 -12.330 -1.810 1.363 1.00 0.00 H new ATOM 0 HA GLU A 30 -10.923 -1.121 -0.889 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -13.095 -0.664 -1.888 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -13.219 -2.053 -0.827 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.143 -0.553 0.962 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -14.101 0.780 -0.175 1.00 0.00 H new ATOM 435 N SER A 31 -11.807 1.497 0.846 1.00 0.00 N ATOM 436 CA SER A 31 -11.645 2.940 0.975 1.00 0.00 C ATOM 437 C SER A 31 -10.181 3.340 0.817 1.00 0.00 C ATOM 438 O SER A 31 -9.870 4.415 0.303 1.00 0.00 O ATOM 439 CB SER A 31 -12.171 3.415 2.331 1.00 0.00 C ATOM 440 OG SER A 31 -13.275 2.633 2.751 1.00 0.00 O ATOM 0 H SER A 31 -12.203 1.042 1.669 1.00 0.00 H new ATOM 0 HA SER A 31 -12.221 3.417 0.182 1.00 0.00 H new ATOM 0 HB2 SER A 31 -11.376 3.356 3.074 1.00 0.00 H new ATOM 0 HB3 SER A 31 -12.467 4.462 2.263 1.00 0.00 H new ATOM 0 HG SER A 31 -13.592 2.955 3.621 1.00 0.00 H new ATOM 446 N LYS A 32 -9.285 2.465 1.261 1.00 0.00 N ATOM 447 CA LYS A 32 -7.853 2.723 1.169 1.00 0.00 C ATOM 448 C LYS A 32 -7.147 1.609 0.404 1.00 0.00 C ATOM 449 O LYS A 32 -7.719 0.544 0.168 1.00 0.00 O ATOM 450 CB LYS A 32 -7.247 2.858 2.568 1.00 0.00 C ATOM 451 CG LYS A 32 -7.884 1.940 3.598 1.00 0.00 C ATOM 452 CD LYS A 32 -7.675 2.458 5.011 1.00 0.00 C ATOM 453 CE LYS A 32 -8.001 1.394 6.048 1.00 0.00 C ATOM 454 NZ LYS A 32 -7.319 1.657 7.346 1.00 0.00 N ATOM 0 H LYS A 32 -9.526 1.571 1.688 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.712 3.658 0.627 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.179 2.645 2.515 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -7.350 3.891 2.901 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -8.951 1.851 3.396 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.458 0.941 3.509 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.641 2.781 5.132 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.304 3.333 5.176 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.079 1.358 6.205 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.701 0.416 5.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.567 0.910 8.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -6.289 1.666 7.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -7.625 2.579 7.718 1.00 0.00 H new ATOM 468 N THR A 33 -5.900 1.859 0.018 1.00 0.00 N ATOM 469 CA THR A 33 -5.116 0.877 -0.721 1.00 0.00 C ATOM 470 C THR A 33 -5.084 -0.461 0.008 1.00 0.00 C ATOM 471 O THR A 33 -5.187 -0.513 1.234 1.00 0.00 O ATOM 472 CB THR A 33 -3.671 1.363 -0.943 1.00 0.00 C ATOM 473 OG1 THR A 33 -3.676 2.718 -1.407 1.00 0.00 O ATOM 474 CG2 THR A 33 -2.952 0.479 -1.950 1.00 0.00 C ATOM 0 H THR A 33 -5.411 2.734 0.205 1.00 0.00 H new ATOM 0 HA THR A 33 -5.601 0.749 -1.689 1.00 0.00 H new ATOM 0 HB THR A 33 -3.142 1.307 0.008 1.00 0.00 H new ATOM 0 HG1 THR A 33 -2.754 3.020 -1.544 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.934 0.841 -2.091 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.925 -0.546 -1.580 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.482 0.507 -2.902 1.00 0.00 H new ATOM 482 N ILE A 34 -4.939 -1.541 -0.752 1.00 0.00 N ATOM 483 CA ILE A 34 -4.891 -2.879 -0.177 1.00 0.00 C ATOM 484 C ILE A 34 -3.769 -3.705 -0.799 1.00 0.00 C ATOM 485 O ILE A 34 -3.366 -3.467 -1.937 1.00 0.00 O ATOM 486 CB ILE A 34 -6.226 -3.622 -0.368 1.00 0.00 C ATOM 487 CG1 ILE A 34 -7.323 -2.971 0.477 1.00 0.00 C ATOM 488 CG2 ILE A 34 -6.072 -5.091 -0.004 1.00 0.00 C ATOM 489 CD1 ILE A 34 -8.721 -3.251 -0.027 1.00 0.00 C ATOM 0 H ILE A 34 -4.853 -1.515 -1.768 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.701 -2.757 0.889 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.514 -3.556 -1.417 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.238 -3.326 1.504 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.162 -1.893 0.498 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.024 -5.602 -0.144 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.317 -5.547 -0.644 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.764 -5.177 1.038 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.447 -2.758 0.620 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.824 -2.871 -1.043 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.901 -4.326 -0.022 1.00 0.00 H new ATOM 501 N PHE A 35 -3.270 -4.678 -0.044 1.00 0.00 N ATOM 502 CA PHE A 35 -2.195 -5.540 -0.520 1.00 0.00 C ATOM 503 C PHE A 35 -2.419 -6.983 -0.078 1.00 0.00 C ATOM 504 O PHE A 35 -2.285 -7.311 1.100 1.00 0.00 O ATOM 505 CB PHE A 35 -0.845 -5.041 -0.003 1.00 0.00 C ATOM 506 CG PHE A 35 -0.289 -3.890 -0.793 1.00 0.00 C ATOM 507 CD1 PHE A 35 0.317 -4.104 -2.021 1.00 0.00 C ATOM 508 CD2 PHE A 35 -0.372 -2.595 -0.307 1.00 0.00 C ATOM 509 CE1 PHE A 35 0.830 -3.047 -2.749 1.00 0.00 C ATOM 510 CE2 PHE A 35 0.138 -1.534 -1.031 1.00 0.00 C ATOM 511 CZ PHE A 35 0.739 -1.760 -2.254 1.00 0.00 C ATOM 0 H PHE A 35 -3.593 -4.889 0.900 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.193 -5.508 -1.610 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.953 -4.738 1.038 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.131 -5.864 -0.023 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.389 -5.108 -2.413 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.841 -2.413 0.649 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.302 -3.227 -3.704 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.067 -0.529 -0.641 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.137 -0.932 -2.822 1.00 0.00 H new ATOM 521 N ALA A 36 -2.762 -7.842 -1.033 1.00 0.00 N ATOM 522 CA ALA A 36 -3.004 -9.250 -0.744 1.00 0.00 C ATOM 523 C ALA A 36 -1.759 -10.087 -1.015 1.00 0.00 C ATOM 524 O ALA A 36 -1.113 -9.939 -2.053 1.00 0.00 O ATOM 525 CB ALA A 36 -4.177 -9.764 -1.565 1.00 0.00 C ATOM 0 H ALA A 36 -2.878 -7.587 -2.014 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.249 -9.341 0.314 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.346 -10.817 -1.339 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.072 -9.192 -1.319 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.955 -9.652 -2.626 1.00 0.00 H new ATOM 531 N TYR A 37 -1.427 -10.967 -0.077 1.00 0.00 N ATOM 532 CA TYR A 37 -0.257 -11.826 -0.213 1.00 0.00 C ATOM 533 C TYR A 37 -0.661 -13.297 -0.235 1.00 0.00 C ATOM 534 O TYR A 37 -0.882 -13.908 0.811 1.00 0.00 O ATOM 535 CB TYR A 37 0.724 -11.573 0.932 1.00 0.00 C ATOM 536 CG TYR A 37 2.017 -12.347 0.805 1.00 0.00 C ATOM 537 CD1 TYR A 37 2.851 -12.170 -0.292 1.00 0.00 C ATOM 538 CD2 TYR A 37 2.403 -13.257 1.781 1.00 0.00 C ATOM 539 CE1 TYR A 37 4.032 -12.876 -0.413 1.00 0.00 C ATOM 540 CE2 TYR A 37 3.583 -13.967 1.669 1.00 0.00 C ATOM 541 CZ TYR A 37 4.394 -13.772 0.570 1.00 0.00 C ATOM 542 OH TYR A 37 5.570 -14.478 0.454 1.00 0.00 O ATOM 0 H TYR A 37 -1.952 -11.104 0.787 1.00 0.00 H new ATOM 0 HA TYR A 37 0.229 -11.587 -1.159 1.00 0.00 H new ATOM 0 HB2 TYR A 37 0.951 -10.508 0.976 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.244 -11.836 1.875 1.00 0.00 H new ATOM 0 HD1 TYR A 37 2.571 -11.468 -1.064 1.00 0.00 H new ATOM 0 HD2 TYR A 37 1.770 -13.412 2.642 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.668 -12.727 -1.273 1.00 0.00 H new ATOM 0 HE2 TYR A 37 3.869 -14.670 2.437 1.00 0.00 H new ATOM 0 HH TYR A 37 5.677 -15.065 1.231 1.00 0.00 H new ATOM 552 N PHE A 38 -0.756 -13.860 -1.435 1.00 0.00 N ATOM 553 CA PHE A 38 -1.133 -15.260 -1.596 1.00 0.00 C ATOM 554 C PHE A 38 0.069 -16.175 -1.383 1.00 0.00 C ATOM 555 O PHE A 38 0.952 -16.265 -2.236 1.00 0.00 O ATOM 556 CB PHE A 38 -1.728 -15.493 -2.986 1.00 0.00 C ATOM 557 CG PHE A 38 -2.789 -14.498 -3.359 1.00 0.00 C ATOM 558 CD1 PHE A 38 -4.054 -14.571 -2.798 1.00 0.00 C ATOM 559 CD2 PHE A 38 -2.522 -13.490 -4.272 1.00 0.00 C ATOM 560 CE1 PHE A 38 -5.033 -13.656 -3.139 1.00 0.00 C ATOM 561 CE2 PHE A 38 -3.496 -12.573 -4.616 1.00 0.00 C ATOM 562 CZ PHE A 38 -4.754 -12.657 -4.050 1.00 0.00 C ATOM 0 H PHE A 38 -0.577 -13.368 -2.311 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.885 -15.497 -0.843 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -0.928 -15.454 -3.726 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.152 -16.496 -3.027 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -4.278 -15.352 -2.086 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.541 -13.421 -4.719 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -6.014 -13.723 -2.693 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.275 -11.791 -5.327 1.00 0.00 H new ATOM 0 HZ PHE A 38 -5.517 -11.942 -4.320 1.00 0.00 H new ATOM 572 N SER A 39 0.095 -16.853 -0.240 1.00 0.00 N ATOM 573 CA SER A 39 1.190 -17.758 0.087 1.00 0.00 C ATOM 574 C SER A 39 0.686 -18.951 0.894 1.00 0.00 C ATOM 575 O SER A 39 -0.257 -18.832 1.675 1.00 0.00 O ATOM 576 CB SER A 39 2.274 -17.018 0.872 1.00 0.00 C ATOM 577 OG SER A 39 2.980 -17.902 1.725 1.00 0.00 O ATOM 0 H SER A 39 -0.630 -16.793 0.475 1.00 0.00 H new ATOM 0 HA SER A 39 1.615 -18.127 -0.846 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.969 -16.544 0.179 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.820 -16.222 1.463 1.00 0.00 H new ATOM 0 HG SER A 39 3.683 -18.356 1.216 1.00 0.00 H new ATOM 583 N GLY A 40 1.323 -20.101 0.699 1.00 0.00 N ATOM 584 CA GLY A 40 0.926 -21.300 1.416 1.00 0.00 C ATOM 585 C GLY A 40 0.622 -21.028 2.876 1.00 0.00 C ATOM 586 O GLY A 40 1.069 -20.026 3.434 1.00 0.00 O ATOM 0 H GLY A 40 2.107 -20.225 0.058 1.00 0.00 H new ATOM 0 HA2 GLY A 40 0.046 -21.730 0.939 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.721 -22.042 1.346 1.00 0.00 H new ATOM 590 N SER A 41 -0.142 -21.922 3.495 1.00 0.00 N ATOM 591 CA SER A 41 -0.510 -21.772 4.898 1.00 0.00 C ATOM 592 C SER A 41 0.696 -22.001 5.804 1.00 0.00 C ATOM 593 O SER A 41 1.694 -22.592 5.392 1.00 0.00 O ATOM 594 CB SER A 41 -1.628 -22.751 5.261 1.00 0.00 C ATOM 595 OG SER A 41 -1.968 -22.650 6.633 1.00 0.00 O ATOM 0 H SER A 41 -0.518 -22.758 3.047 1.00 0.00 H new ATOM 0 HA SER A 41 -0.866 -20.753 5.048 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.507 -22.547 4.649 1.00 0.00 H new ATOM 0 HB3 SER A 41 -1.312 -23.769 5.035 1.00 0.00 H new ATOM 0 HG SER A 41 -2.686 -23.284 6.840 1.00 0.00 H new ATOM 601 N LYS A 42 0.596 -21.527 7.041 1.00 0.00 N ATOM 602 CA LYS A 42 1.677 -21.680 8.009 1.00 0.00 C ATOM 603 C LYS A 42 1.810 -23.133 8.450 1.00 0.00 C ATOM 604 O LYS A 42 0.941 -23.959 8.171 1.00 0.00 O ATOM 605 CB LYS A 42 1.429 -20.786 9.226 1.00 0.00 C ATOM 606 CG LYS A 42 1.278 -19.315 8.881 1.00 0.00 C ATOM 607 CD LYS A 42 0.514 -18.564 9.959 1.00 0.00 C ATOM 608 CE LYS A 42 0.554 -17.062 9.726 1.00 0.00 C ATOM 609 NZ LYS A 42 0.012 -16.693 8.389 1.00 0.00 N ATOM 0 H LYS A 42 -0.222 -21.034 7.398 1.00 0.00 H new ATOM 0 HA LYS A 42 2.608 -21.379 7.528 1.00 0.00 H new ATOM 0 HB2 LYS A 42 0.528 -21.125 9.737 1.00 0.00 H new ATOM 0 HB3 LYS A 42 2.256 -20.903 9.926 1.00 0.00 H new ATOM 0 HG2 LYS A 42 2.264 -18.867 8.754 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.757 -19.215 7.929 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -0.522 -18.903 9.976 1.00 0.00 H new ATOM 0 HD3 LYS A 42 0.940 -18.793 10.936 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.022 -16.559 10.503 1.00 0.00 H new ATOM 0 HE3 LYS A 42 1.582 -16.709 9.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -0.587 -15.848 8.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.799 -16.492 7.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.554 -17.481 8.015 1.00 0.00 H new ATOM 693 N SER A 48 5.470 -20.871 6.487 1.00 0.00 N ATOM 694 CA SER A 48 4.922 -21.557 5.323 1.00 0.00 C ATOM 695 C SER A 48 5.808 -22.731 4.918 1.00 0.00 C ATOM 696 O SER A 48 7.017 -22.717 5.145 1.00 0.00 O ATOM 697 CB SER A 48 4.778 -20.584 4.151 1.00 0.00 C ATOM 698 OG SER A 48 3.637 -19.759 4.311 1.00 0.00 O ATOM 0 HA SER A 48 3.937 -21.942 5.589 1.00 0.00 H new ATOM 0 HB2 SER A 48 5.671 -19.964 4.077 1.00 0.00 H new ATOM 0 HB3 SER A 48 4.699 -21.142 3.218 1.00 0.00 H new ATOM 0 HG SER A 48 2.875 -20.160 3.843 1.00 0.00 H new ATOM 704 N TRP A 49 5.196 -23.745 4.317 1.00 0.00 N ATOM 705 CA TRP A 49 5.929 -24.928 3.879 1.00 0.00 C ATOM 706 C TRP A 49 7.002 -24.559 2.862 1.00 0.00 C ATOM 707 O TRP A 49 8.121 -25.069 2.914 1.00 0.00 O ATOM 708 CB TRP A 49 4.968 -25.954 3.276 1.00 0.00 C ATOM 709 CG TRP A 49 3.921 -25.341 2.395 1.00 0.00 C ATOM 710 CD1 TRP A 49 2.662 -24.960 2.761 1.00 0.00 C ATOM 711 CD2 TRP A 49 4.044 -25.041 1.000 1.00 0.00 C ATOM 712 NE1 TRP A 49 1.995 -24.441 1.678 1.00 0.00 N ATOM 713 CE2 TRP A 49 2.821 -24.478 0.586 1.00 0.00 C ATOM 714 CE3 TRP A 49 5.068 -25.191 0.061 1.00 0.00 C ATOM 715 CZ2 TRP A 49 2.597 -24.068 -0.726 1.00 0.00 C ATOM 716 CZ3 TRP A 49 4.844 -24.783 -1.240 1.00 0.00 C ATOM 717 CH2 TRP A 49 3.617 -24.227 -1.624 1.00 0.00 C ATOM 0 H TRP A 49 4.195 -23.772 4.122 1.00 0.00 H new ATOM 0 HA TRP A 49 6.417 -25.365 4.750 1.00 0.00 H new ATOM 0 HB2 TRP A 49 5.539 -26.680 2.698 1.00 0.00 H new ATOM 0 HB3 TRP A 49 4.479 -26.501 4.082 1.00 0.00 H new ATOM 0 HD1 TRP A 49 2.251 -25.053 3.755 1.00 0.00 H new ATOM 0 HE1 TRP A 49 1.039 -24.085 1.686 1.00 0.00 H new ATOM 0 HE3 TRP A 49 6.018 -25.618 0.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 1.651 -23.640 -1.024 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 5.629 -24.895 -1.974 1.00 0.00 H new ATOM 0 HH2 TRP A 49 3.473 -23.918 -2.649 1.00 0.00 H new ATOM 728 N CYS A 50 6.655 -23.669 1.939 1.00 0.00 N ATOM 729 CA CYS A 50 7.590 -23.231 0.908 1.00 0.00 C ATOM 730 C CYS A 50 8.785 -22.516 1.528 1.00 0.00 C ATOM 731 O CYS A 50 8.644 -21.667 2.409 1.00 0.00 O ATOM 732 CB CYS A 50 6.887 -22.308 -0.088 1.00 0.00 C ATOM 733 SG CYS A 50 7.905 -21.845 -1.509 1.00 0.00 S ATOM 0 H CYS A 50 5.733 -23.236 1.883 1.00 0.00 H new ATOM 0 HA CYS A 50 7.952 -24.113 0.380 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.983 -22.800 -0.447 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.573 -21.402 0.431 1.00 0.00 H new ATOM 0 HG CYS A 50 7.224 -21.066 -2.295 1.00 0.00 H new ATOM 739 N PRO A 51 9.993 -22.865 1.059 1.00 0.00 N ATOM 740 CA PRO A 51 11.237 -22.269 1.554 1.00 0.00 C ATOM 741 C PRO A 51 11.388 -20.811 1.134 1.00 0.00 C ATOM 742 O PRO A 51 12.137 -20.052 1.749 1.00 0.00 O ATOM 743 CB PRO A 51 12.325 -23.128 0.904 1.00 0.00 C ATOM 744 CG PRO A 51 11.689 -23.678 -0.326 1.00 0.00 C ATOM 745 CD PRO A 51 10.235 -23.869 0.009 1.00 0.00 C ATOM 0 HA PRO A 51 11.278 -22.257 2.643 1.00 0.00 H new ATOM 0 HB2 PRO A 51 13.206 -22.534 0.662 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.651 -23.926 1.572 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.809 -22.994 -1.166 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.150 -24.622 -0.615 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.597 -23.704 -0.860 1.00 0.00 H new ATOM 0 HD3 PRO A 51 10.034 -24.879 0.365 1.00 0.00 H new ATOM 753 N ASP A 52 10.672 -20.425 0.084 1.00 0.00 N ATOM 754 CA ASP A 52 10.725 -19.057 -0.417 1.00 0.00 C ATOM 755 C ASP A 52 9.782 -18.153 0.370 1.00 0.00 C ATOM 756 O ASP A 52 10.139 -17.030 0.731 1.00 0.00 O ATOM 757 CB ASP A 52 10.364 -19.020 -1.903 1.00 0.00 C ATOM 758 CG ASP A 52 11.271 -19.901 -2.741 1.00 0.00 C ATOM 759 OD1 ASP A 52 10.996 -21.115 -2.834 1.00 0.00 O ATOM 760 OD2 ASP A 52 12.255 -19.376 -3.302 1.00 0.00 O ATOM 0 H ASP A 52 10.048 -21.041 -0.437 1.00 0.00 H new ATOM 0 HA ASP A 52 11.743 -18.690 -0.289 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.330 -19.342 -2.031 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.425 -17.993 -2.263 1.00 0.00 H new ATOM 765 N CYS A 53 8.578 -18.648 0.633 1.00 0.00 N ATOM 766 CA CYS A 53 7.582 -17.884 1.376 1.00 0.00 C ATOM 767 C CYS A 53 8.113 -17.491 2.751 1.00 0.00 C ATOM 768 O CYS A 53 7.799 -16.418 3.266 1.00 0.00 O ATOM 769 CB CYS A 53 6.294 -18.696 1.527 1.00 0.00 C ATOM 770 SG CYS A 53 5.396 -18.949 -0.022 1.00 0.00 S ATOM 0 H CYS A 53 8.268 -19.575 0.343 1.00 0.00 H new ATOM 0 HA CYS A 53 7.366 -16.974 0.816 1.00 0.00 H new ATOM 0 HB2 CYS A 53 6.538 -19.668 1.956 1.00 0.00 H new ATOM 0 HB3 CYS A 53 5.639 -18.190 2.236 1.00 0.00 H new ATOM 0 HG CYS A 53 4.358 -19.700 0.196 1.00 0.00 H new ATOM 776 N VAL A 54 8.919 -18.368 3.341 1.00 0.00 N ATOM 777 CA VAL A 54 9.494 -18.113 4.657 1.00 0.00 C ATOM 778 C VAL A 54 10.598 -17.065 4.580 1.00 0.00 C ATOM 779 O VAL A 54 10.881 -16.376 5.560 1.00 0.00 O ATOM 780 CB VAL A 54 10.066 -19.401 5.278 1.00 0.00 C ATOM 781 CG1 VAL A 54 10.580 -19.133 6.685 1.00 0.00 C ATOM 782 CG2 VAL A 54 9.015 -20.501 5.287 1.00 0.00 C ATOM 0 H VAL A 54 9.189 -19.261 2.929 1.00 0.00 H new ATOM 0 HA VAL A 54 8.687 -17.741 5.289 1.00 0.00 H new ATOM 0 HB VAL A 54 10.905 -19.736 4.668 1.00 0.00 H new ATOM 0 HG11 VAL A 54 10.980 -20.054 7.108 1.00 0.00 H new ATOM 0 HG12 VAL A 54 11.366 -18.379 6.648 1.00 0.00 H new ATOM 0 HG13 VAL A 54 9.762 -18.773 7.309 1.00 0.00 H new ATOM 0 HG21 VAL A 54 9.437 -21.404 5.729 1.00 0.00 H new ATOM 0 HG22 VAL A 54 8.155 -20.178 5.873 1.00 0.00 H new ATOM 0 HG23 VAL A 54 8.699 -20.711 4.265 1.00 0.00 H new ATOM 792 N GLU A 55 11.217 -16.949 3.410 1.00 0.00 N ATOM 793 CA GLU A 55 12.291 -15.984 3.206 1.00 0.00 C ATOM 794 C GLU A 55 11.753 -14.693 2.596 1.00 0.00 C ATOM 795 O GLU A 55 12.459 -13.687 2.523 1.00 0.00 O ATOM 796 CB GLU A 55 13.374 -16.576 2.301 1.00 0.00 C ATOM 797 CG GLU A 55 14.485 -15.597 1.963 1.00 0.00 C ATOM 798 CD GLU A 55 15.603 -16.237 1.162 1.00 0.00 C ATOM 799 OE1 GLU A 55 15.298 -16.970 0.198 1.00 0.00 O ATOM 800 OE2 GLU A 55 16.782 -16.005 1.501 1.00 0.00 O ATOM 0 H GLU A 55 10.993 -17.511 2.589 1.00 0.00 H new ATOM 0 HA GLU A 55 12.727 -15.753 4.178 1.00 0.00 H new ATOM 0 HB2 GLU A 55 13.807 -17.449 2.789 1.00 0.00 H new ATOM 0 HB3 GLU A 55 12.913 -16.923 1.376 1.00 0.00 H new ATOM 0 HG2 GLU A 55 14.070 -14.763 1.398 1.00 0.00 H new ATOM 0 HG3 GLU A 55 14.894 -15.185 2.885 1.00 0.00 H new ATOM 807 N ALA A 56 10.498 -14.729 2.160 1.00 0.00 N ATOM 808 CA ALA A 56 9.865 -13.562 1.558 1.00 0.00 C ATOM 809 C ALA A 56 8.919 -12.882 2.542 1.00 0.00 C ATOM 810 O ALA A 56 8.799 -11.658 2.556 1.00 0.00 O ATOM 811 CB ALA A 56 9.117 -13.961 0.294 1.00 0.00 C ATOM 0 H ALA A 56 9.900 -15.553 2.212 1.00 0.00 H new ATOM 0 HA ALA A 56 10.647 -12.850 1.295 1.00 0.00 H new ATOM 0 HB1 ALA A 56 8.649 -13.080 -0.145 1.00 0.00 H new ATOM 0 HB2 ALA A 56 9.816 -14.395 -0.421 1.00 0.00 H new ATOM 0 HB3 ALA A 56 8.349 -14.694 0.542 1.00 0.00 H new ATOM 817 N GLU A 57 8.248 -13.685 3.362 1.00 0.00 N ATOM 818 CA GLU A 57 7.312 -13.159 4.348 1.00 0.00 C ATOM 819 C GLU A 57 7.869 -11.903 5.012 1.00 0.00 C ATOM 820 O GLU A 57 7.217 -10.860 5.070 1.00 0.00 O ATOM 821 CB GLU A 57 7.007 -14.218 5.410 1.00 0.00 C ATOM 822 CG GLU A 57 5.566 -14.198 5.893 1.00 0.00 C ATOM 823 CD GLU A 57 5.353 -13.248 7.055 1.00 0.00 C ATOM 824 OE1 GLU A 57 5.966 -13.466 8.121 1.00 0.00 O ATOM 825 OE2 GLU A 57 4.573 -12.285 6.898 1.00 0.00 O ATOM 0 H GLU A 57 8.335 -14.701 3.363 1.00 0.00 H new ATOM 0 HA GLU A 57 6.389 -12.897 3.831 1.00 0.00 H new ATOM 0 HB2 GLU A 57 7.231 -15.204 5.003 1.00 0.00 H new ATOM 0 HB3 GLU A 57 7.669 -14.067 6.262 1.00 0.00 H new ATOM 0 HG2 GLU A 57 4.914 -13.909 5.068 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.273 -15.204 6.193 1.00 0.00 H new ATOM 832 N PRO A 58 9.104 -12.004 5.525 1.00 0.00 N ATOM 833 CA PRO A 58 9.777 -10.886 6.194 1.00 0.00 C ATOM 834 C PRO A 58 10.165 -9.778 5.222 1.00 0.00 C ATOM 835 O PRO A 58 10.001 -8.594 5.517 1.00 0.00 O ATOM 836 CB PRO A 58 11.027 -11.533 6.795 1.00 0.00 C ATOM 837 CG PRO A 58 11.288 -12.722 5.936 1.00 0.00 C ATOM 838 CD PRO A 58 9.939 -13.216 5.492 1.00 0.00 C ATOM 0 HA PRO A 58 9.134 -10.405 6.931 1.00 0.00 H new ATOM 0 HB2 PRO A 58 11.872 -10.845 6.786 1.00 0.00 H new ATOM 0 HB3 PRO A 58 10.863 -11.823 7.833 1.00 0.00 H new ATOM 0 HG2 PRO A 58 11.908 -12.456 5.079 1.00 0.00 H new ATOM 0 HG3 PRO A 58 11.823 -13.493 6.490 1.00 0.00 H new ATOM 0 HD2 PRO A 58 9.979 -13.649 4.493 1.00 0.00 H new ATOM 0 HD3 PRO A 58 9.554 -13.987 6.159 1.00 0.00 H new ATOM 846 N VAL A 59 10.680 -10.169 4.060 1.00 0.00 N ATOM 847 CA VAL A 59 11.090 -9.208 3.043 1.00 0.00 C ATOM 848 C VAL A 59 9.924 -8.319 2.625 1.00 0.00 C ATOM 849 O VAL A 59 10.115 -7.159 2.261 1.00 0.00 O ATOM 850 CB VAL A 59 11.655 -9.916 1.798 1.00 0.00 C ATOM 851 CG1 VAL A 59 12.196 -8.899 0.805 1.00 0.00 C ATOM 852 CG2 VAL A 59 12.734 -10.912 2.195 1.00 0.00 C ATOM 0 H VAL A 59 10.823 -11.145 3.800 1.00 0.00 H new ATOM 0 HA VAL A 59 11.872 -8.591 3.487 1.00 0.00 H new ATOM 0 HB VAL A 59 10.846 -10.465 1.315 1.00 0.00 H new ATOM 0 HG11 VAL A 59 12.591 -9.418 -0.068 1.00 0.00 H new ATOM 0 HG12 VAL A 59 11.393 -8.229 0.497 1.00 0.00 H new ATOM 0 HG13 VAL A 59 12.992 -8.320 1.274 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.122 -11.403 1.303 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.544 -10.388 2.702 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.310 -11.660 2.865 1.00 0.00 H new ATOM 862 N ILE A 60 8.717 -8.872 2.679 1.00 0.00 N ATOM 863 CA ILE A 60 7.520 -8.129 2.307 1.00 0.00 C ATOM 864 C ILE A 60 6.958 -7.359 3.498 1.00 0.00 C ATOM 865 O ILE A 60 6.403 -6.272 3.341 1.00 0.00 O ATOM 866 CB ILE A 60 6.427 -9.062 1.752 1.00 0.00 C ATOM 867 CG1 ILE A 60 6.980 -9.898 0.596 1.00 0.00 C ATOM 868 CG2 ILE A 60 5.220 -8.254 1.299 1.00 0.00 C ATOM 869 CD1 ILE A 60 5.940 -10.773 -0.068 1.00 0.00 C ATOM 0 H ILE A 60 8.542 -9.832 2.977 1.00 0.00 H new ATOM 0 HA ILE A 60 7.815 -7.425 1.529 1.00 0.00 H new ATOM 0 HB ILE A 60 6.109 -9.738 2.546 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.412 -9.231 -0.150 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.789 -10.527 0.968 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.457 -8.928 0.909 1.00 0.00 H new ATOM 0 HG22 ILE A 60 4.816 -7.698 2.145 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.522 -7.557 0.517 1.00 0.00 H new ATOM 0 HD11 ILE A 60 6.402 -11.337 -0.878 1.00 0.00 H new ATOM 0 HD12 ILE A 60 5.525 -11.465 0.665 1.00 0.00 H new ATOM 0 HD13 ILE A 60 5.142 -10.149 -0.470 1.00 0.00 H new ATOM 881 N ARG A 61 7.107 -7.931 4.688 1.00 0.00 N ATOM 882 CA ARG A 61 6.616 -7.299 5.907 1.00 0.00 C ATOM 883 C ARG A 61 7.437 -6.058 6.245 1.00 0.00 C ATOM 884 O ARG A 61 6.907 -5.071 6.754 1.00 0.00 O ATOM 885 CB ARG A 61 6.660 -8.287 7.073 1.00 0.00 C ATOM 886 CG ARG A 61 5.378 -9.085 7.246 1.00 0.00 C ATOM 887 CD ARG A 61 4.284 -8.247 7.889 1.00 0.00 C ATOM 888 NE ARG A 61 4.305 -8.345 9.346 1.00 0.00 N ATOM 889 CZ ARG A 61 4.973 -7.506 10.129 1.00 0.00 C ATOM 890 NH1 ARG A 61 5.671 -6.512 9.598 1.00 0.00 N ATOM 891 NH2 ARG A 61 4.944 -7.661 11.447 1.00 0.00 N ATOM 0 H ARG A 61 7.564 -8.831 4.834 1.00 0.00 H new ATOM 0 HA ARG A 61 5.583 -6.995 5.738 1.00 0.00 H new ATOM 0 HB2 ARG A 61 7.490 -8.977 6.922 1.00 0.00 H new ATOM 0 HB3 ARG A 61 6.864 -7.740 7.994 1.00 0.00 H new ATOM 0 HG2 ARG A 61 5.039 -9.446 6.275 1.00 0.00 H new ATOM 0 HG3 ARG A 61 5.575 -9.963 7.861 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.405 -7.205 7.594 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.312 -8.573 7.518 1.00 0.00 H new ATOM 0 HE ARG A 61 3.778 -9.099 9.786 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.696 -6.390 8.586 1.00 0.00 H new ATOM 0 HH12 ARG A 61 6.183 -5.869 10.202 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.408 -8.425 11.859 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.457 -7.016 12.048 1.00 0.00 H new ATOM 905 N GLU A 62 8.734 -6.117 5.959 1.00 0.00 N ATOM 906 CA GLU A 62 9.628 -4.999 6.235 1.00 0.00 C ATOM 907 C GLU A 62 9.442 -3.887 5.206 1.00 0.00 C ATOM 908 O GLU A 62 9.361 -2.710 5.556 1.00 0.00 O ATOM 909 CB GLU A 62 11.084 -5.469 6.236 1.00 0.00 C ATOM 910 CG GLU A 62 11.452 -6.309 7.447 1.00 0.00 C ATOM 911 CD GLU A 62 12.921 -6.683 7.474 1.00 0.00 C ATOM 912 OE1 GLU A 62 13.471 -7.004 6.399 1.00 0.00 O ATOM 913 OE2 GLU A 62 13.521 -6.656 8.568 1.00 0.00 O ATOM 0 H GLU A 62 9.188 -6.927 5.537 1.00 0.00 H new ATOM 0 HA GLU A 62 9.381 -4.604 7.220 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.270 -6.049 5.332 1.00 0.00 H new ATOM 0 HB3 GLU A 62 11.738 -4.598 6.196 1.00 0.00 H new ATOM 0 HG2 GLU A 62 11.204 -5.759 8.355 1.00 0.00 H new ATOM 0 HG3 GLU A 62 10.850 -7.217 7.451 1.00 0.00 H new ATOM 920 N GLY A 63 9.375 -4.270 3.935 1.00 0.00 N ATOM 921 CA GLY A 63 9.200 -3.295 2.874 1.00 0.00 C ATOM 922 C GLY A 63 7.921 -2.497 3.026 1.00 0.00 C ATOM 923 O GLY A 63 7.828 -1.362 2.556 1.00 0.00 O ATOM 0 H GLY A 63 9.439 -5.238 3.621 1.00 0.00 H new ATOM 0 HA2 GLY A 63 10.051 -2.614 2.867 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.193 -3.807 1.912 1.00 0.00 H new ATOM 927 N LEU A 64 6.930 -3.090 3.683 1.00 0.00 N ATOM 928 CA LEU A 64 5.648 -2.427 3.895 1.00 0.00 C ATOM 929 C LEU A 64 5.826 -1.138 4.692 1.00 0.00 C ATOM 930 O LEU A 64 4.999 -0.230 4.617 1.00 0.00 O ATOM 931 CB LEU A 64 4.682 -3.362 4.625 1.00 0.00 C ATOM 932 CG LEU A 64 3.915 -4.352 3.748 1.00 0.00 C ATOM 933 CD1 LEU A 64 3.312 -5.461 4.596 1.00 0.00 C ATOM 934 CD2 LEU A 64 2.832 -3.635 2.956 1.00 0.00 C ATOM 0 H LEU A 64 6.990 -4.029 4.078 1.00 0.00 H new ATOM 0 HA LEU A 64 5.232 -2.175 2.919 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.246 -3.926 5.368 1.00 0.00 H new ATOM 0 HB3 LEU A 64 3.959 -2.753 5.168 1.00 0.00 H new ATOM 0 HG LEU A 64 4.615 -4.801 3.044 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.770 -6.156 3.954 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.107 -5.994 5.117 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.626 -5.030 5.325 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.296 -4.355 2.337 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.134 -3.157 3.644 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.288 -2.878 2.318 1.00 0.00 H new ATOM 946 N LYS A 65 6.912 -1.066 5.454 1.00 0.00 N ATOM 947 CA LYS A 65 7.202 0.112 6.263 1.00 0.00 C ATOM 948 C LYS A 65 7.624 1.285 5.385 1.00 0.00 C ATOM 949 O LYS A 65 7.272 2.434 5.655 1.00 0.00 O ATOM 950 CB LYS A 65 8.303 -0.200 7.279 1.00 0.00 C ATOM 951 CG LYS A 65 7.781 -0.761 8.590 1.00 0.00 C ATOM 952 CD LYS A 65 7.505 0.343 9.598 1.00 0.00 C ATOM 953 CE LYS A 65 6.267 1.143 9.223 1.00 0.00 C ATOM 954 NZ LYS A 65 5.870 2.088 10.303 1.00 0.00 N ATOM 0 H LYS A 65 7.606 -1.810 5.528 1.00 0.00 H new ATOM 0 HA LYS A 65 6.292 0.389 6.796 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.999 -0.914 6.840 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.867 0.711 7.482 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.866 -1.325 8.407 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.509 -1.459 9.004 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.372 -0.092 10.589 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.366 1.009 9.655 1.00 0.00 H new ATOM 0 HE2 LYS A 65 6.458 1.700 8.306 1.00 0.00 H new ATOM 0 HE3 LYS A 65 5.442 0.461 9.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 5.023 2.614 10.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 5.663 1.555 11.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 6.647 2.755 10.483 1.00 0.00 H new ATOM 968 N HIS A 66 8.378 0.989 4.331 1.00 0.00 N ATOM 969 CA HIS A 66 8.846 2.019 3.411 1.00 0.00 C ATOM 970 C HIS A 66 7.677 2.645 2.657 1.00 0.00 C ATOM 971 O HIS A 66 7.771 3.772 2.169 1.00 0.00 O ATOM 972 CB HIS A 66 9.851 1.431 2.420 1.00 0.00 C ATOM 973 CG HIS A 66 11.080 0.877 3.072 1.00 0.00 C ATOM 974 ND1 HIS A 66 12.329 1.445 2.928 1.00 0.00 N ATOM 975 CD2 HIS A 66 11.249 -0.198 3.876 1.00 0.00 C ATOM 976 CE1 HIS A 66 13.212 0.742 3.614 1.00 0.00 C ATOM 977 NE2 HIS A 66 12.582 -0.261 4.199 1.00 0.00 N ATOM 0 H HIS A 66 8.678 0.044 4.093 1.00 0.00 H new ATOM 0 HA HIS A 66 9.337 2.797 3.996 1.00 0.00 H new ATOM 0 HB2 HIS A 66 9.365 0.640 1.848 1.00 0.00 H new ATOM 0 HB3 HIS A 66 10.144 2.204 1.710 1.00 0.00 H new ATOM 0 HD2 HIS A 66 10.478 -0.880 4.203 1.00 0.00 H new ATOM 0 HE1 HIS A 66 14.269 0.951 3.685 1.00 0.00 H new ATOM 0 HE2 HIS A 66 13.015 -0.967 4.794 1.00 0.00 H new ATOM 986 N VAL A 67 6.575 1.907 2.564 1.00 0.00 N ATOM 987 CA VAL A 67 5.387 2.390 1.870 1.00 0.00 C ATOM 988 C VAL A 67 5.114 3.853 2.201 1.00 0.00 C ATOM 989 O VAL A 67 5.361 4.305 3.319 1.00 0.00 O ATOM 990 CB VAL A 67 4.147 1.553 2.231 1.00 0.00 C ATOM 991 CG1 VAL A 67 3.592 1.976 3.583 1.00 0.00 C ATOM 992 CG2 VAL A 67 3.086 1.678 1.148 1.00 0.00 C ATOM 0 H VAL A 67 6.480 0.972 2.961 1.00 0.00 H new ATOM 0 HA VAL A 67 5.583 2.293 0.802 1.00 0.00 H new ATOM 0 HB VAL A 67 4.444 0.506 2.298 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.716 1.373 3.821 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.352 1.830 4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 67 3.310 3.028 3.547 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.216 1.080 1.420 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.791 2.722 1.047 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.490 1.322 0.200 1.00 0.00 H new ATOM 1002 N THR A 68 4.601 4.590 1.220 1.00 0.00 N ATOM 1003 CA THR A 68 4.294 6.003 1.406 1.00 0.00 C ATOM 1004 C THR A 68 2.820 6.284 1.143 1.00 0.00 C ATOM 1005 O THR A 68 2.447 7.397 0.774 1.00 0.00 O ATOM 1006 CB THR A 68 5.148 6.890 0.480 1.00 0.00 C ATOM 1007 OG1 THR A 68 5.097 8.251 0.922 1.00 0.00 O ATOM 1008 CG2 THR A 68 4.658 6.799 -0.958 1.00 0.00 C ATOM 0 H THR A 68 4.390 4.232 0.289 1.00 0.00 H new ATOM 0 HA THR A 68 4.527 6.244 2.443 1.00 0.00 H new ATOM 0 HB THR A 68 6.178 6.534 0.520 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.162 8.533 1.006 1.00 0.00 H new ATOM 0 HG21 THR A 68 5.276 7.433 -1.594 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.725 5.766 -1.301 1.00 0.00 H new ATOM 0 HG23 THR A 68 3.621 7.132 -1.011 1.00 0.00 H new ATOM 1016 N GLU A 69 1.984 5.268 1.336 1.00 0.00 N ATOM 1017 CA GLU A 69 0.549 5.408 1.119 1.00 0.00 C ATOM 1018 C GLU A 69 -0.236 4.524 2.084 1.00 0.00 C ATOM 1019 O GLU A 69 -0.072 3.304 2.098 1.00 0.00 O ATOM 1020 CB GLU A 69 0.192 5.048 -0.325 1.00 0.00 C ATOM 1021 CG GLU A 69 0.439 3.588 -0.667 1.00 0.00 C ATOM 1022 CD GLU A 69 0.557 3.352 -2.160 1.00 0.00 C ATOM 1023 OE1 GLU A 69 1.076 4.245 -2.863 1.00 0.00 O ATOM 1024 OE2 GLU A 69 0.132 2.274 -2.627 1.00 0.00 O ATOM 0 H GLU A 69 2.276 4.340 1.642 1.00 0.00 H new ATOM 0 HA GLU A 69 0.279 6.448 1.304 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.858 5.281 -0.500 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.774 5.674 -1.001 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.353 3.253 -0.176 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.376 2.983 -0.270 1.00 0.00 H new ATOM 1031 N ASP A 70 -1.088 5.149 2.889 1.00 0.00 N ATOM 1032 CA ASP A 70 -1.899 4.420 3.857 1.00 0.00 C ATOM 1033 C ASP A 70 -2.567 3.212 3.208 1.00 0.00 C ATOM 1034 O ASP A 70 -3.623 3.334 2.586 1.00 0.00 O ATOM 1035 CB ASP A 70 -2.960 5.341 4.462 1.00 0.00 C ATOM 1036 CG ASP A 70 -2.481 6.774 4.584 1.00 0.00 C ATOM 1037 OD1 ASP A 70 -1.313 6.977 4.977 1.00 0.00 O ATOM 1038 OD2 ASP A 70 -3.274 7.693 4.289 1.00 0.00 O ATOM 0 H ASP A 70 -1.235 6.158 2.890 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.241 4.065 4.650 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.857 5.312 3.844 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -3.240 4.969 5.448 1.00 0.00 H new ATOM 1043 N CYS A 71 -1.944 2.048 3.355 1.00 0.00 N ATOM 1044 CA CYS A 71 -2.477 0.818 2.781 1.00 0.00 C ATOM 1045 C CYS A 71 -2.799 -0.197 3.873 1.00 0.00 C ATOM 1046 O CYS A 71 -2.487 0.016 5.045 1.00 0.00 O ATOM 1047 CB CYS A 71 -1.478 0.218 1.790 1.00 0.00 C ATOM 1048 SG CYS A 71 0.051 -0.376 2.552 1.00 0.00 S ATOM 0 H CYS A 71 -1.070 1.930 3.867 1.00 0.00 H new ATOM 0 HA CYS A 71 -3.399 1.063 2.254 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -1.955 -0.610 1.265 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -1.230 0.970 1.041 1.00 0.00 H new ATOM 0 HG CYS A 71 0.514 -1.381 1.870 1.00 0.00 H new ATOM 1054 N VAL A 72 -3.429 -1.300 3.482 1.00 0.00 N ATOM 1055 CA VAL A 72 -3.795 -2.348 4.427 1.00 0.00 C ATOM 1056 C VAL A 72 -3.380 -3.722 3.913 1.00 0.00 C ATOM 1057 O VAL A 72 -4.096 -4.345 3.129 1.00 0.00 O ATOM 1058 CB VAL A 72 -5.311 -2.351 4.702 1.00 0.00 C ATOM 1059 CG1 VAL A 72 -5.694 -3.543 5.566 1.00 0.00 C ATOM 1060 CG2 VAL A 72 -5.735 -1.047 5.360 1.00 0.00 C ATOM 0 H VAL A 72 -3.697 -1.491 2.516 1.00 0.00 H new ATOM 0 HA VAL A 72 -3.265 -2.136 5.355 1.00 0.00 H new ATOM 0 HB VAL A 72 -5.836 -2.439 3.751 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.768 -3.529 5.750 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.426 -4.466 5.052 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -5.162 -3.489 6.516 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.809 -1.066 5.547 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -5.204 -0.927 6.304 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.496 -0.212 4.701 1.00 0.00 H new ATOM 1070 N PHE A 73 -2.219 -4.188 4.360 1.00 0.00 N ATOM 1071 CA PHE A 73 -1.707 -5.489 3.945 1.00 0.00 C ATOM 1072 C PHE A 73 -2.654 -6.608 4.371 1.00 0.00 C ATOM 1073 O PHE A 73 -3.370 -6.484 5.366 1.00 0.00 O ATOM 1074 CB PHE A 73 -0.318 -5.728 4.539 1.00 0.00 C ATOM 1075 CG PHE A 73 0.403 -6.895 3.928 1.00 0.00 C ATOM 1076 CD1 PHE A 73 0.412 -7.079 2.555 1.00 0.00 C ATOM 1077 CD2 PHE A 73 1.072 -7.809 4.727 1.00 0.00 C ATOM 1078 CE1 PHE A 73 1.074 -8.153 1.990 1.00 0.00 C ATOM 1079 CE2 PHE A 73 1.737 -8.884 4.168 1.00 0.00 C ATOM 1080 CZ PHE A 73 1.738 -9.056 2.797 1.00 0.00 C ATOM 0 H PHE A 73 -1.615 -3.684 5.009 1.00 0.00 H new ATOM 0 HA PHE A 73 -1.635 -5.492 2.857 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.284 -4.829 4.407 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.414 -5.892 5.612 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.104 -6.375 1.919 1.00 0.00 H new ATOM 0 HD2 PHE A 73 1.074 -7.680 5.799 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.072 -8.286 0.918 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.255 -9.588 4.802 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.257 -9.895 2.357 1.00 0.00 H new ATOM 1090 N ILE A 74 -2.653 -7.698 3.611 1.00 0.00 N ATOM 1091 CA ILE A 74 -3.510 -8.838 3.910 1.00 0.00 C ATOM 1092 C ILE A 74 -2.799 -10.153 3.613 1.00 0.00 C ATOM 1093 O ILE A 74 -2.457 -10.441 2.466 1.00 0.00 O ATOM 1094 CB ILE A 74 -4.821 -8.782 3.104 1.00 0.00 C ATOM 1095 CG1 ILE A 74 -5.552 -7.464 3.367 1.00 0.00 C ATOM 1096 CG2 ILE A 74 -5.710 -9.966 3.456 1.00 0.00 C ATOM 1097 CD1 ILE A 74 -6.763 -7.257 2.484 1.00 0.00 C ATOM 0 H ILE A 74 -2.068 -7.815 2.784 1.00 0.00 H new ATOM 0 HA ILE A 74 -3.744 -8.787 4.973 1.00 0.00 H new ATOM 0 HB ILE A 74 -4.580 -8.836 2.042 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -5.864 -7.433 4.411 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -4.858 -6.637 3.217 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.633 -9.913 2.878 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.189 -10.894 3.222 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.946 -9.940 4.520 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.231 -6.303 2.726 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.455 -7.255 1.438 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.477 -8.064 2.650 1.00 0.00 H new ATOM 1109 N TYR A 75 -2.581 -10.950 4.654 1.00 0.00 N ATOM 1110 CA TYR A 75 -1.910 -12.236 4.505 1.00 0.00 C ATOM 1111 C TYR A 75 -2.911 -13.336 4.166 1.00 0.00 C ATOM 1112 O TYR A 75 -3.453 -13.993 5.056 1.00 0.00 O ATOM 1113 CB TYR A 75 -1.157 -12.593 5.787 1.00 0.00 C ATOM 1114 CG TYR A 75 -0.145 -13.702 5.606 1.00 0.00 C ATOM 1115 CD1 TYR A 75 -0.536 -14.958 5.159 1.00 0.00 C ATOM 1116 CD2 TYR A 75 1.200 -13.494 5.883 1.00 0.00 C ATOM 1117 CE1 TYR A 75 0.385 -15.975 4.992 1.00 0.00 C ATOM 1118 CE2 TYR A 75 2.128 -14.505 5.719 1.00 0.00 C ATOM 1119 CZ TYR A 75 1.715 -15.743 5.273 1.00 0.00 C ATOM 1120 OH TYR A 75 2.636 -16.753 5.109 1.00 0.00 O ATOM 0 H TYR A 75 -2.859 -10.728 5.610 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.197 -12.153 3.684 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.647 -11.704 6.158 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -1.876 -12.890 6.550 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -1.577 -15.143 4.938 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.526 -12.526 6.233 1.00 0.00 H new ATOM 0 HE1 TYR A 75 0.065 -16.946 4.643 1.00 0.00 H new ATOM 0 HE2 TYR A 75 3.170 -14.327 5.939 1.00 0.00 H new ATOM 0 HH TYR A 75 3.528 -16.425 5.349 1.00 0.00 H new ATOM 1130 N CYS A 76 -3.150 -13.532 2.874 1.00 0.00 N ATOM 1131 CA CYS A 76 -4.086 -14.553 2.416 1.00 0.00 C ATOM 1132 C CYS A 76 -3.367 -15.873 2.157 1.00 0.00 C ATOM 1133 O CYS A 76 -2.380 -15.918 1.423 1.00 0.00 O ATOM 1134 CB CYS A 76 -4.798 -14.088 1.145 1.00 0.00 C ATOM 1135 SG CYS A 76 -6.049 -15.242 0.535 1.00 0.00 S ATOM 0 H CYS A 76 -2.709 -12.998 2.125 1.00 0.00 H new ATOM 0 HA CYS A 76 -4.826 -14.711 3.201 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -5.271 -13.125 1.338 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -4.055 -13.928 0.363 1.00 0.00 H new ATOM 0 HG CYS A 76 -6.596 -14.760 -0.541 1.00 0.00 H new ATOM 1141 N GLN A 77 -3.867 -16.943 2.767 1.00 0.00 N ATOM 1142 CA GLN A 77 -3.270 -18.263 2.604 1.00 0.00 C ATOM 1143 C GLN A 77 -4.099 -19.121 1.654 1.00 0.00 C ATOM 1144 O GLN A 77 -5.269 -19.400 1.914 1.00 0.00 O ATOM 1145 CB GLN A 77 -3.142 -18.959 3.960 1.00 0.00 C ATOM 1146 CG GLN A 77 -2.445 -18.115 5.014 1.00 0.00 C ATOM 1147 CD GLN A 77 -2.923 -18.423 6.419 1.00 0.00 C ATOM 1148 OE1 GLN A 77 -3.394 -17.539 7.135 1.00 0.00 O ATOM 1149 NE2 GLN A 77 -2.804 -19.683 6.822 1.00 0.00 N ATOM 0 H GLN A 77 -4.683 -16.921 3.378 1.00 0.00 H new ATOM 0 HA GLN A 77 -2.276 -18.135 2.175 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.137 -19.224 4.318 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -2.591 -19.891 3.830 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -1.370 -18.283 4.955 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.615 -17.060 4.800 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -2.408 -20.384 6.195 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -3.109 -19.950 7.758 1.00 0.00 H new ATOM 1158 N VAL A 78 -3.483 -19.539 0.552 1.00 0.00 N ATOM 1159 CA VAL A 78 -4.164 -20.366 -0.437 1.00 0.00 C ATOM 1160 C VAL A 78 -4.889 -21.531 0.228 1.00 0.00 C ATOM 1161 O VAL A 78 -6.061 -21.786 -0.049 1.00 0.00 O ATOM 1162 CB VAL A 78 -3.176 -20.919 -1.481 1.00 0.00 C ATOM 1163 CG1 VAL A 78 -2.715 -19.813 -2.418 1.00 0.00 C ATOM 1164 CG2 VAL A 78 -1.989 -21.577 -0.795 1.00 0.00 C ATOM 0 H VAL A 78 -2.514 -19.318 0.322 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.891 -19.727 -0.938 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.688 -21.676 -2.075 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.017 -20.222 -3.149 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.577 -19.392 -2.935 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.220 -19.031 -1.842 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -1.301 -21.962 -1.548 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.474 -20.843 -0.175 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.339 -22.398 -0.170 1.00 0.00 H new ATOM 1174 N GLY A 79 -4.183 -22.237 1.106 1.00 0.00 N ATOM 1175 CA GLY A 79 -4.776 -23.367 1.797 1.00 0.00 C ATOM 1176 C GLY A 79 -3.744 -24.389 2.230 1.00 0.00 C ATOM 1177 O GLY A 79 -3.501 -24.570 3.423 1.00 0.00 O ATOM 0 H GLY A 79 -3.211 -22.047 1.351 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.318 -23.010 2.672 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.505 -23.846 1.144 1.00 0.00 H new ATOM 1181 N ASP A 80 -3.135 -25.060 1.258 1.00 0.00 N ATOM 1182 CA ASP A 80 -2.122 -26.070 1.545 1.00 0.00 C ATOM 1183 C ASP A 80 -1.139 -26.198 0.385 1.00 0.00 C ATOM 1184 O ASP A 80 -1.360 -25.648 -0.694 1.00 0.00 O ATOM 1185 CB ASP A 80 -2.784 -27.421 1.821 1.00 0.00 C ATOM 1186 CG ASP A 80 -4.074 -27.285 2.606 1.00 0.00 C ATOM 1187 OD1 ASP A 80 -5.110 -26.953 1.992 1.00 0.00 O ATOM 1188 OD2 ASP A 80 -4.048 -27.511 3.833 1.00 0.00 O ATOM 0 H ASP A 80 -3.325 -24.923 0.265 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.571 -25.756 2.431 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -2.989 -27.922 0.875 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.091 -28.056 2.374 1.00 0.00 H new ATOM 1193 N LYS A 81 -0.053 -26.928 0.616 1.00 0.00 N ATOM 1194 CA LYS A 81 0.965 -27.130 -0.409 1.00 0.00 C ATOM 1195 C LYS A 81 0.367 -27.790 -1.647 1.00 0.00 C ATOM 1196 O LYS A 81 0.412 -27.248 -2.752 1.00 0.00 O ATOM 1197 CB LYS A 81 2.106 -27.989 0.140 1.00 0.00 C ATOM 1198 CG LYS A 81 2.767 -28.865 -0.911 1.00 0.00 C ATOM 1199 CD LYS A 81 4.021 -29.532 -0.372 1.00 0.00 C ATOM 1200 CE LYS A 81 5.009 -29.845 -1.485 1.00 0.00 C ATOM 1201 NZ LYS A 81 5.853 -31.028 -1.161 1.00 0.00 N ATOM 0 H LYS A 81 0.145 -27.390 1.504 1.00 0.00 H new ATOM 0 HA LYS A 81 1.358 -26.154 -0.694 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.859 -27.338 0.584 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.721 -28.622 0.939 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.063 -29.627 -1.246 1.00 0.00 H new ATOM 0 HG3 LYS A 81 3.021 -28.261 -1.782 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.494 -28.880 0.363 1.00 0.00 H new ATOM 0 HD3 LYS A 81 3.751 -30.453 0.145 1.00 0.00 H new ATOM 0 HE2 LYS A 81 4.466 -30.029 -2.412 1.00 0.00 H new ATOM 0 HE3 LYS A 81 5.648 -28.979 -1.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 6.513 -31.209 -1.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 6.391 -30.843 -0.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 5.245 -31.860 -1.022 1.00 0.00 H new ATOM 1215 N PRO A 82 -0.208 -28.987 -1.461 1.00 0.00 N ATOM 1216 CA PRO A 82 -0.827 -29.746 -2.552 1.00 0.00 C ATOM 1217 C PRO A 82 -2.113 -29.097 -3.052 1.00 0.00 C ATOM 1218 O PRO A 82 -2.635 -29.461 -4.106 1.00 0.00 O ATOM 1219 CB PRO A 82 -1.127 -31.105 -1.914 1.00 0.00 C ATOM 1220 CG PRO A 82 -1.252 -30.819 -0.457 1.00 0.00 C ATOM 1221 CD PRO A 82 -0.298 -29.693 -0.172 1.00 0.00 C ATOM 0 HA PRO A 82 -0.179 -29.804 -3.427 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -2.045 -31.536 -2.313 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.328 -31.820 -2.110 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.274 -30.539 -0.201 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.005 -31.699 0.136 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.671 -29.041 0.618 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.675 -30.063 0.152 1.00 0.00 H new ATOM 1229 N TYR A 83 -2.619 -28.134 -2.290 1.00 0.00 N ATOM 1230 CA TYR A 83 -3.846 -27.435 -2.655 1.00 0.00 C ATOM 1231 C TYR A 83 -3.563 -26.334 -3.672 1.00 0.00 C ATOM 1232 O TYR A 83 -4.351 -26.105 -4.590 1.00 0.00 O ATOM 1233 CB TYR A 83 -4.508 -26.839 -1.411 1.00 0.00 C ATOM 1234 CG TYR A 83 -5.527 -25.767 -1.723 1.00 0.00 C ATOM 1235 CD1 TYR A 83 -5.139 -24.447 -1.915 1.00 0.00 C ATOM 1236 CD2 TYR A 83 -6.878 -26.074 -1.826 1.00 0.00 C ATOM 1237 CE1 TYR A 83 -6.067 -23.464 -2.200 1.00 0.00 C ATOM 1238 CE2 TYR A 83 -7.813 -25.098 -2.111 1.00 0.00 C ATOM 1239 CZ TYR A 83 -7.403 -23.794 -2.297 1.00 0.00 C ATOM 1240 OH TYR A 83 -8.330 -22.818 -2.581 1.00 0.00 O ATOM 0 H TYR A 83 -2.199 -27.819 -1.416 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.525 -28.157 -3.108 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -4.993 -27.638 -0.850 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -3.737 -26.419 -0.765 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.094 -24.185 -1.840 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.203 -27.094 -1.681 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -5.748 -22.443 -2.346 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -8.859 -25.354 -2.188 1.00 0.00 H new ATOM 0 HH TYR A 83 -9.225 -23.217 -2.615 1.00 0.00 H new ATOM 1250 N TRP A 84 -2.434 -25.656 -3.501 1.00 0.00 N ATOM 1251 CA TRP A 84 -2.046 -24.578 -4.404 1.00 0.00 C ATOM 1252 C TRP A 84 -2.017 -25.063 -5.849 1.00 0.00 C ATOM 1253 O TRP A 84 -2.440 -24.352 -6.762 1.00 0.00 O ATOM 1254 CB TRP A 84 -0.675 -24.025 -4.011 1.00 0.00 C ATOM 1255 CG TRP A 84 -0.024 -23.224 -5.098 1.00 0.00 C ATOM 1256 CD1 TRP A 84 1.246 -23.373 -5.577 1.00 0.00 C ATOM 1257 CD2 TRP A 84 -0.611 -22.149 -5.839 1.00 0.00 C ATOM 1258 NE1 TRP A 84 1.484 -22.456 -6.571 1.00 0.00 N ATOM 1259 CE2 TRP A 84 0.361 -21.693 -6.752 1.00 0.00 C ATOM 1260 CE3 TRP A 84 -1.863 -21.529 -5.822 1.00 0.00 C ATOM 1261 CZ2 TRP A 84 0.117 -20.646 -7.636 1.00 0.00 C ATOM 1262 CZ3 TRP A 84 -2.103 -20.489 -6.701 1.00 0.00 C ATOM 1263 CH2 TRP A 84 -1.117 -20.056 -7.598 1.00 0.00 C ATOM 0 H TRP A 84 -1.771 -25.833 -2.746 1.00 0.00 H new ATOM 0 HA TRP A 84 -2.788 -23.783 -4.322 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -0.784 -23.400 -3.124 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -0.021 -24.854 -3.739 1.00 0.00 H new ATOM 0 HD1 TRP A 84 1.959 -24.105 -5.226 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.356 -22.359 -7.091 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -2.629 -21.856 -5.135 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.875 -20.311 -8.328 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -3.067 -20.002 -6.696 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.335 -19.241 -8.272 1.00 0.00 H new ATOM 1274 N LYS A 85 -1.516 -26.276 -6.052 1.00 0.00 N ATOM 1275 CA LYS A 85 -1.433 -26.857 -7.387 1.00 0.00 C ATOM 1276 C LYS A 85 -2.808 -26.900 -8.048 1.00 0.00 C ATOM 1277 O LYS A 85 -2.927 -26.747 -9.264 1.00 0.00 O ATOM 1278 CB LYS A 85 -0.846 -28.269 -7.316 1.00 0.00 C ATOM 1279 CG LYS A 85 0.671 -28.293 -7.253 1.00 0.00 C ATOM 1280 CD LYS A 85 1.200 -29.709 -7.093 1.00 0.00 C ATOM 1281 CE LYS A 85 1.206 -30.141 -5.635 1.00 0.00 C ATOM 1282 NZ LYS A 85 2.107 -31.303 -5.404 1.00 0.00 N ATOM 0 H LYS A 85 -1.161 -26.877 -5.308 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.778 -26.228 -7.990 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -1.246 -28.776 -6.438 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -1.174 -28.834 -8.188 1.00 0.00 H new ATOM 0 HG2 LYS A 85 1.081 -27.851 -8.161 1.00 0.00 H new ATOM 0 HG3 LYS A 85 1.011 -27.680 -6.418 1.00 0.00 H new ATOM 0 HD2 LYS A 85 0.585 -30.396 -7.674 1.00 0.00 H new ATOM 0 HD3 LYS A 85 2.211 -29.768 -7.495 1.00 0.00 H new ATOM 0 HE2 LYS A 85 1.523 -29.306 -5.010 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.193 -30.401 -5.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 2.083 -31.567 -4.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 1.790 -32.108 -5.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 3.079 -31.047 -5.671 1.00 0.00 H new ATOM 1296 N ASP A 86 -3.841 -27.107 -7.240 1.00 0.00 N ATOM 1297 CA ASP A 86 -5.208 -27.167 -7.746 1.00 0.00 C ATOM 1298 C ASP A 86 -5.444 -26.089 -8.800 1.00 0.00 C ATOM 1299 O ASP A 86 -5.638 -24.914 -8.488 1.00 0.00 O ATOM 1300 CB ASP A 86 -6.207 -27.005 -6.600 1.00 0.00 C ATOM 1301 CG ASP A 86 -6.004 -28.034 -5.505 1.00 0.00 C ATOM 1302 OD1 ASP A 86 -4.920 -28.652 -5.466 1.00 0.00 O ATOM 1303 OD2 ASP A 86 -6.929 -28.222 -4.688 1.00 0.00 O ATOM 0 H ASP A 86 -3.759 -27.236 -6.232 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.355 -28.142 -8.210 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.111 -26.005 -6.177 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.221 -27.090 -6.991 1.00 0.00 H new ATOM 1308 N PRO A 87 -5.427 -26.496 -10.078 1.00 0.00 N ATOM 1309 CA PRO A 87 -5.638 -25.581 -11.203 1.00 0.00 C ATOM 1310 C PRO A 87 -7.075 -25.078 -11.280 1.00 0.00 C ATOM 1311 O PRO A 87 -7.399 -24.218 -12.098 1.00 0.00 O ATOM 1312 CB PRO A 87 -5.306 -26.440 -12.426 1.00 0.00 C ATOM 1313 CG PRO A 87 -5.554 -27.841 -11.983 1.00 0.00 C ATOM 1314 CD PRO A 87 -5.202 -27.882 -10.522 1.00 0.00 C ATOM 0 HA PRO A 87 -5.027 -24.682 -11.117 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.934 -26.177 -13.277 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -4.271 -26.301 -12.739 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.595 -28.122 -12.142 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.944 -28.544 -12.551 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.831 -28.586 -9.977 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -4.168 -28.191 -10.366 1.00 0.00 H new ATOM 1322 N ASN A 88 -7.934 -25.620 -10.422 1.00 0.00 N ATOM 1323 CA ASN A 88 -9.337 -25.225 -10.394 1.00 0.00 C ATOM 1324 C ASN A 88 -9.632 -24.350 -9.179 1.00 0.00 C ATOM 1325 O ASN A 88 -10.767 -24.284 -8.710 1.00 0.00 O ATOM 1326 CB ASN A 88 -10.236 -26.463 -10.374 1.00 0.00 C ATOM 1327 CG ASN A 88 -9.772 -27.530 -11.347 1.00 0.00 C ATOM 1328 OD1 ASN A 88 -8.954 -27.268 -12.228 1.00 0.00 O ATOM 1329 ND2 ASN A 88 -10.295 -28.741 -11.191 1.00 0.00 N ATOM 0 H ASN A 88 -7.683 -26.333 -9.738 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.544 -24.647 -11.295 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -10.256 -26.878 -9.366 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -11.257 -26.171 -10.619 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -10.021 -29.499 -11.816 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -10.970 -28.913 -10.446 1.00 0.00 H new ATOM 1336 N ASN A 89 -8.601 -23.679 -8.676 1.00 0.00 N ATOM 1337 CA ASN A 89 -8.749 -22.808 -7.516 1.00 0.00 C ATOM 1338 C ASN A 89 -9.235 -21.423 -7.934 1.00 0.00 C ATOM 1339 O ASN A 89 -8.931 -20.952 -9.030 1.00 0.00 O ATOM 1340 CB ASN A 89 -7.419 -22.689 -6.768 1.00 0.00 C ATOM 1341 CG ASN A 89 -7.222 -23.804 -5.759 1.00 0.00 C ATOM 1342 OD1 ASN A 89 -8.160 -24.531 -5.430 1.00 0.00 O ATOM 1343 ND2 ASN A 89 -5.998 -23.942 -5.262 1.00 0.00 N ATOM 0 H ASN A 89 -7.654 -23.722 -9.053 1.00 0.00 H new ATOM 0 HA ASN A 89 -9.493 -23.251 -6.853 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -6.599 -22.703 -7.486 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.378 -21.728 -6.256 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -5.805 -24.674 -4.578 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -5.251 -23.316 -5.564 1.00 0.00 H new ATOM 1350 N ASP A 90 -9.991 -20.777 -7.054 1.00 0.00 N ATOM 1351 CA ASP A 90 -10.518 -19.446 -7.330 1.00 0.00 C ATOM 1352 C ASP A 90 -9.386 -18.436 -7.493 1.00 0.00 C ATOM 1353 O ASP A 90 -9.589 -17.338 -8.012 1.00 0.00 O ATOM 1354 CB ASP A 90 -11.456 -19.002 -6.207 1.00 0.00 C ATOM 1355 CG ASP A 90 -12.847 -19.589 -6.348 1.00 0.00 C ATOM 1356 OD1 ASP A 90 -12.995 -20.596 -7.072 1.00 0.00 O ATOM 1357 OD2 ASP A 90 -13.787 -19.041 -5.735 1.00 0.00 O ATOM 0 H ASP A 90 -10.253 -21.154 -6.143 1.00 0.00 H new ATOM 0 HA ASP A 90 -11.078 -19.491 -8.264 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -11.035 -19.300 -5.247 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.523 -17.914 -6.202 1.00 0.00 H new ATOM 1362 N PHE A 91 -8.194 -18.814 -7.044 1.00 0.00 N ATOM 1363 CA PHE A 91 -7.029 -17.941 -7.138 1.00 0.00 C ATOM 1364 C PHE A 91 -6.492 -17.903 -8.565 1.00 0.00 C ATOM 1365 O PHE A 91 -6.038 -16.862 -9.041 1.00 0.00 O ATOM 1366 CB PHE A 91 -5.933 -18.413 -6.180 1.00 0.00 C ATOM 1367 CG PHE A 91 -6.353 -18.407 -4.738 1.00 0.00 C ATOM 1368 CD1 PHE A 91 -6.405 -17.221 -4.023 1.00 0.00 C ATOM 1369 CD2 PHE A 91 -6.697 -19.586 -4.098 1.00 0.00 C ATOM 1370 CE1 PHE A 91 -6.791 -17.213 -2.696 1.00 0.00 C ATOM 1371 CE2 PHE A 91 -7.084 -19.584 -2.771 1.00 0.00 C ATOM 1372 CZ PHE A 91 -7.132 -18.396 -2.069 1.00 0.00 C ATOM 0 H PHE A 91 -8.009 -19.719 -6.611 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.337 -16.934 -6.858 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.629 -19.422 -6.457 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -5.058 -17.773 -6.298 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -6.141 -16.293 -4.508 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -6.662 -20.518 -4.642 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.826 -16.282 -2.149 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.349 -20.511 -2.284 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.435 -18.392 -1.032 1.00 0.00 H new ATOM 1382 N ARG A 92 -6.546 -19.045 -9.242 1.00 0.00 N ATOM 1383 CA ARG A 92 -6.063 -19.144 -10.614 1.00 0.00 C ATOM 1384 C ARG A 92 -7.206 -18.955 -11.608 1.00 0.00 C ATOM 1385 O ARG A 92 -6.979 -18.816 -12.809 1.00 0.00 O ATOM 1386 CB ARG A 92 -5.391 -20.499 -10.845 1.00 0.00 C ATOM 1387 CG ARG A 92 -4.399 -20.880 -9.758 1.00 0.00 C ATOM 1388 CD ARG A 92 -4.203 -22.386 -9.686 1.00 0.00 C ATOM 1389 NE ARG A 92 -2.909 -22.742 -9.111 1.00 0.00 N ATOM 1390 CZ ARG A 92 -1.753 -22.582 -9.746 1.00 0.00 C ATOM 1391 NH1 ARG A 92 -1.730 -22.073 -10.970 1.00 0.00 N ATOM 1392 NH2 ARG A 92 -0.616 -22.930 -9.156 1.00 0.00 N ATOM 0 H ARG A 92 -6.920 -19.915 -8.863 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.331 -18.352 -10.773 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.159 -21.270 -10.910 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -4.876 -20.480 -11.805 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.442 -20.396 -9.952 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.753 -20.512 -8.795 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -5.000 -22.827 -9.087 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -4.284 -22.810 -10.687 1.00 0.00 H new ATOM 0 HE ARG A 92 -2.892 -23.135 -8.170 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -2.601 -21.803 -11.427 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.841 -21.951 -11.455 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -0.629 -23.321 -8.214 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.271 -22.807 -9.645 1.00 0.00 H new ATOM 1406 N GLN A 93 -8.433 -18.952 -11.097 1.00 0.00 N ATOM 1407 CA GLN A 93 -9.610 -18.781 -11.940 1.00 0.00 C ATOM 1408 C GLN A 93 -10.128 -17.349 -11.868 1.00 0.00 C ATOM 1409 O GLN A 93 -10.550 -16.778 -12.874 1.00 0.00 O ATOM 1410 CB GLN A 93 -10.711 -19.756 -11.518 1.00 0.00 C ATOM 1411 CG GLN A 93 -10.281 -21.214 -11.559 1.00 0.00 C ATOM 1412 CD GLN A 93 -10.519 -21.854 -12.913 1.00 0.00 C ATOM 1413 OE1 GLN A 93 -11.591 -21.707 -13.502 1.00 0.00 O ATOM 1414 NE2 GLN A 93 -9.519 -22.570 -13.413 1.00 0.00 N ATOM 0 H GLN A 93 -8.638 -19.066 -10.104 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.322 -18.992 -12.970 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.035 -19.510 -10.507 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.574 -19.622 -12.171 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -9.222 -21.284 -11.309 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.826 -21.771 -10.797 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.648 -22.665 -12.890 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.621 -23.025 -14.320 1.00 0.00 H new ATOM 1423 N LYS A 94 -10.094 -16.772 -10.671 1.00 0.00 N ATOM 1424 CA LYS A 94 -10.559 -15.405 -10.467 1.00 0.00 C ATOM 1425 C LYS A 94 -9.384 -14.434 -10.406 1.00 0.00 C ATOM 1426 O LYS A 94 -9.334 -13.457 -11.155 1.00 0.00 O ATOM 1427 CB LYS A 94 -11.379 -15.311 -9.178 1.00 0.00 C ATOM 1428 CG LYS A 94 -12.500 -16.333 -9.094 1.00 0.00 C ATOM 1429 CD LYS A 94 -13.646 -15.834 -8.232 1.00 0.00 C ATOM 1430 CE LYS A 94 -14.633 -16.948 -7.917 1.00 0.00 C ATOM 1431 NZ LYS A 94 -15.443 -16.646 -6.704 1.00 0.00 N ATOM 0 H LYS A 94 -9.749 -17.230 -9.827 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.190 -15.132 -11.313 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.714 -15.442 -8.324 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.804 -14.310 -9.100 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -12.867 -16.555 -10.096 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.113 -17.265 -8.683 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.251 -15.423 -7.303 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -14.163 -15.023 -8.746 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -15.297 -17.097 -8.769 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -14.091 -17.882 -7.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -15.195 -17.313 -5.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -15.246 -15.675 -6.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -16.454 -16.739 -6.930 1.00 0.00 H new ATOM 1445 N LEU A 95 -8.441 -14.709 -9.512 1.00 0.00 N ATOM 1446 CA LEU A 95 -7.265 -13.860 -9.355 1.00 0.00 C ATOM 1447 C LEU A 95 -6.210 -14.191 -10.406 1.00 0.00 C ATOM 1448 O LEU A 95 -5.246 -13.447 -10.590 1.00 0.00 O ATOM 1449 CB LEU A 95 -6.675 -14.027 -7.954 1.00 0.00 C ATOM 1450 CG LEU A 95 -7.530 -13.506 -6.799 1.00 0.00 C ATOM 1451 CD1 LEU A 95 -6.928 -13.912 -5.463 1.00 0.00 C ATOM 1452 CD2 LEU A 95 -7.676 -11.994 -6.883 1.00 0.00 C ATOM 0 H LEU A 95 -8.467 -15.513 -8.885 1.00 0.00 H new ATOM 0 HA LEU A 95 -7.575 -12.824 -9.491 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -6.481 -15.087 -7.787 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -5.711 -13.518 -7.924 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.522 -13.951 -6.877 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.551 -13.532 -4.653 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.877 -14.999 -5.402 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.924 -13.496 -5.375 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.288 -11.641 -6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -6.691 -11.530 -6.831 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -8.154 -11.726 -7.825 1.00 0.00 H new ATOM 1464 N LYS A 96 -6.401 -15.310 -11.096 1.00 0.00 N ATOM 1465 CA LYS A 96 -5.469 -15.739 -12.132 1.00 0.00 C ATOM 1466 C LYS A 96 -4.027 -15.625 -11.648 1.00 0.00 C ATOM 1467 O LYS A 96 -3.174 -15.063 -12.336 1.00 0.00 O ATOM 1468 CB LYS A 96 -5.661 -14.901 -13.398 1.00 0.00 C ATOM 1469 CG LYS A 96 -7.004 -15.117 -14.073 1.00 0.00 C ATOM 1470 CD LYS A 96 -6.963 -16.291 -15.036 1.00 0.00 C ATOM 1471 CE LYS A 96 -6.568 -15.849 -16.437 1.00 0.00 C ATOM 1472 NZ LYS A 96 -5.091 -15.723 -16.583 1.00 0.00 N ATOM 0 H LYS A 96 -7.193 -15.937 -10.956 1.00 0.00 H new ATOM 0 HA LYS A 96 -5.675 -16.785 -12.361 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.557 -13.846 -13.144 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -4.866 -15.139 -14.105 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -7.768 -15.293 -13.316 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -7.291 -14.214 -14.611 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -6.253 -17.035 -14.674 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.941 -16.772 -15.067 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -6.945 -16.568 -17.164 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -7.038 -14.892 -16.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -4.808 -16.039 -17.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -4.813 -14.730 -16.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -4.620 -16.312 -15.867 1.00 0.00 H new ATOM 1486 N ILE A 97 -3.761 -16.162 -10.462 1.00 0.00 N ATOM 1487 CA ILE A 97 -2.422 -16.122 -9.888 1.00 0.00 C ATOM 1488 C ILE A 97 -1.419 -16.843 -10.783 1.00 0.00 C ATOM 1489 O ILE A 97 -1.772 -17.777 -11.504 1.00 0.00 O ATOM 1490 CB ILE A 97 -2.391 -16.758 -8.486 1.00 0.00 C ATOM 1491 CG1 ILE A 97 -3.343 -16.016 -7.545 1.00 0.00 C ATOM 1492 CG2 ILE A 97 -0.975 -16.749 -7.931 1.00 0.00 C ATOM 1493 CD1 ILE A 97 -2.887 -14.614 -7.208 1.00 0.00 C ATOM 0 H ILE A 97 -4.456 -16.630 -9.880 1.00 0.00 H new ATOM 0 HA ILE A 97 -2.144 -15.071 -9.807 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.722 -17.794 -8.565 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.331 -15.968 -8.004 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.448 -16.587 -6.623 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -0.970 -17.202 -6.940 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.321 -17.317 -8.593 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.618 -15.722 -7.862 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -3.609 -14.148 -6.538 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -1.913 -14.656 -6.720 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -2.810 -14.027 -8.123 1.00 0.00 H new ATOM 1505 N THR A 98 -0.165 -16.404 -10.730 1.00 0.00 N ATOM 1506 CA THR A 98 0.890 -17.007 -11.535 1.00 0.00 C ATOM 1507 C THR A 98 1.682 -18.028 -10.727 1.00 0.00 C ATOM 1508 O THR A 98 1.681 -19.218 -11.040 1.00 0.00 O ATOM 1509 CB THR A 98 1.857 -15.941 -12.083 1.00 0.00 C ATOM 1510 OG1 THR A 98 1.137 -14.985 -12.870 1.00 0.00 O ATOM 1511 CG2 THR A 98 2.947 -16.583 -12.928 1.00 0.00 C ATOM 0 H THR A 98 0.144 -15.633 -10.138 1.00 0.00 H new ATOM 0 HA THR A 98 0.402 -17.509 -12.371 1.00 0.00 H new ATOM 0 HB THR A 98 2.324 -15.437 -11.237 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.758 -14.310 -13.213 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.618 -15.811 -13.304 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.511 -17.289 -12.319 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.494 -17.110 -13.767 1.00 0.00 H new ATOM 1519 N ALA A 99 2.358 -17.555 -9.684 1.00 0.00 N ATOM 1520 CA ALA A 99 3.152 -18.428 -8.829 1.00 0.00 C ATOM 1521 C ALA A 99 3.322 -17.827 -7.438 1.00 0.00 C ATOM 1522 O ALA A 99 3.769 -16.690 -7.292 1.00 0.00 O ATOM 1523 CB ALA A 99 4.511 -18.692 -9.461 1.00 0.00 C ATOM 0 H ALA A 99 2.371 -16.572 -9.412 1.00 0.00 H new ATOM 0 HA ALA A 99 2.621 -19.374 -8.725 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.094 -19.345 -8.812 1.00 0.00 H new ATOM 0 HB2 ALA A 99 4.375 -19.172 -10.430 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.040 -17.748 -9.594 1.00 0.00 H new ATOM 1529 N VAL A 100 2.961 -18.599 -6.417 1.00 0.00 N ATOM 1530 CA VAL A 100 3.073 -18.143 -5.037 1.00 0.00 C ATOM 1531 C VAL A 100 4.505 -18.274 -4.530 1.00 0.00 C ATOM 1532 O VAL A 100 5.256 -19.161 -4.938 1.00 0.00 O ATOM 1533 CB VAL A 100 2.136 -18.934 -4.106 1.00 0.00 C ATOM 1534 CG1 VAL A 100 0.697 -18.837 -4.589 1.00 0.00 C ATOM 1535 CG2 VAL A 100 2.579 -20.386 -4.014 1.00 0.00 C ATOM 0 H VAL A 100 2.589 -19.543 -6.520 1.00 0.00 H new ATOM 0 HA VAL A 100 2.781 -17.093 -5.026 1.00 0.00 H new ATOM 0 HB VAL A 100 2.189 -18.497 -3.109 1.00 0.00 H new ATOM 0 HG11 VAL A 100 0.049 -19.402 -3.919 1.00 0.00 H new ATOM 0 HG12 VAL A 100 0.386 -17.792 -4.599 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.623 -19.247 -5.596 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.906 -20.931 -3.352 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.556 -20.837 -5.006 1.00 0.00 H new ATOM 0 HG23 VAL A 100 3.593 -20.433 -3.618 1.00 0.00 H new ATOM 1545 N PRO A 101 4.895 -17.372 -3.617 1.00 0.00 N ATOM 1546 CA PRO A 101 4.010 -16.312 -3.124 1.00 0.00 C ATOM 1547 C PRO A 101 3.721 -15.257 -4.186 1.00 0.00 C ATOM 1548 O PRO A 101 4.611 -14.856 -4.937 1.00 0.00 O ATOM 1549 CB PRO A 101 4.801 -15.700 -1.965 1.00 0.00 C ATOM 1550 CG PRO A 101 6.227 -15.992 -2.284 1.00 0.00 C ATOM 1551 CD PRO A 101 6.229 -17.316 -2.996 1.00 0.00 C ATOM 0 HA PRO A 101 3.033 -16.699 -2.835 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.624 -14.627 -1.888 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.510 -16.140 -1.011 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.654 -15.210 -2.912 1.00 0.00 H new ATOM 0 HG3 PRO A 101 6.829 -16.036 -1.376 1.00 0.00 H new ATOM 0 HD2 PRO A 101 7.022 -17.370 -3.742 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.385 -18.144 -2.304 1.00 0.00 H new ATOM 1559 N THR A 102 2.470 -14.811 -4.246 1.00 0.00 N ATOM 1560 CA THR A 102 2.063 -13.803 -5.217 1.00 0.00 C ATOM 1561 C THR A 102 1.558 -12.543 -4.523 1.00 0.00 C ATOM 1562 O THR A 102 0.502 -12.551 -3.890 1.00 0.00 O ATOM 1563 CB THR A 102 0.962 -14.337 -6.152 1.00 0.00 C ATOM 1564 OG1 THR A 102 1.444 -15.474 -6.877 1.00 0.00 O ATOM 1565 CG2 THR A 102 0.513 -13.260 -7.128 1.00 0.00 C ATOM 0 H THR A 102 1.721 -15.132 -3.633 1.00 0.00 H new ATOM 0 HA THR A 102 2.945 -13.559 -5.809 1.00 0.00 H new ATOM 0 HB THR A 102 0.108 -14.631 -5.542 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.421 -15.513 -6.813 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.265 -13.660 -7.778 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.120 -12.408 -6.574 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.362 -12.940 -7.732 1.00 0.00 H new ATOM 1573 N LEU A 103 2.319 -11.461 -4.646 1.00 0.00 N ATOM 1574 CA LEU A 103 1.948 -10.191 -4.031 1.00 0.00 C ATOM 1575 C LEU A 103 1.240 -9.286 -5.034 1.00 0.00 C ATOM 1576 O LEU A 103 1.883 -8.610 -5.838 1.00 0.00 O ATOM 1577 CB LEU A 103 3.188 -9.487 -3.479 1.00 0.00 C ATOM 1578 CG LEU A 103 2.950 -8.134 -2.807 1.00 0.00 C ATOM 1579 CD1 LEU A 103 2.078 -8.298 -1.572 1.00 0.00 C ATOM 1580 CD2 LEU A 103 4.274 -7.478 -2.445 1.00 0.00 C ATOM 0 H LEU A 103 3.196 -11.438 -5.166 1.00 0.00 H new ATOM 0 HA LEU A 103 1.261 -10.400 -3.211 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.666 -10.149 -2.757 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.894 -9.344 -4.297 1.00 0.00 H new ATOM 0 HG LEU A 103 2.428 -7.486 -3.511 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.919 -7.325 -1.107 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.117 -8.724 -1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.572 -8.963 -0.863 1.00 0.00 H new ATOM 0 HD21 LEU A 103 4.085 -6.516 -1.968 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.823 -8.122 -1.758 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.863 -7.325 -3.349 1.00 0.00 H new ATOM 1592 N LEU A 104 -0.087 -9.277 -4.981 1.00 0.00 N ATOM 1593 CA LEU A 104 -0.884 -8.453 -5.884 1.00 0.00 C ATOM 1594 C LEU A 104 -1.336 -7.170 -5.195 1.00 0.00 C ATOM 1595 O LEU A 104 -1.845 -7.201 -4.074 1.00 0.00 O ATOM 1596 CB LEU A 104 -2.101 -9.235 -6.380 1.00 0.00 C ATOM 1597 CG LEU A 104 -3.302 -8.398 -6.822 1.00 0.00 C ATOM 1598 CD1 LEU A 104 -3.003 -7.686 -8.132 1.00 0.00 C ATOM 1599 CD2 LEU A 104 -4.540 -9.272 -6.959 1.00 0.00 C ATOM 0 H LEU A 104 -0.634 -9.831 -4.322 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.260 -8.185 -6.737 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.790 -9.859 -7.218 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.425 -9.907 -5.585 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.496 -7.645 -6.058 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.869 -7.095 -8.431 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.143 -7.029 -8.001 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.782 -8.423 -8.904 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.385 -8.659 -7.274 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.357 -10.048 -7.702 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.766 -9.735 -5.999 1.00 0.00 H new ATOM 1611 N LYS A 105 -1.148 -6.042 -5.872 1.00 0.00 N ATOM 1612 CA LYS A 105 -1.539 -4.748 -5.327 1.00 0.00 C ATOM 1613 C LYS A 105 -2.942 -4.365 -5.788 1.00 0.00 C ATOM 1614 O LYS A 105 -3.120 -3.813 -6.875 1.00 0.00 O ATOM 1615 CB LYS A 105 -0.539 -3.670 -5.752 1.00 0.00 C ATOM 1616 CG LYS A 105 -0.897 -2.279 -5.256 1.00 0.00 C ATOM 1617 CD LYS A 105 0.248 -1.302 -5.461 1.00 0.00 C ATOM 1618 CE LYS A 105 -0.038 0.038 -4.801 1.00 0.00 C ATOM 1619 NZ LYS A 105 -0.733 0.975 -5.726 1.00 0.00 N ATOM 0 H LYS A 105 -0.727 -5.998 -6.800 1.00 0.00 H new ATOM 0 HA LYS A 105 -1.541 -4.825 -4.240 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.450 -3.936 -5.379 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.476 -3.654 -6.840 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.781 -1.920 -5.783 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -1.153 -2.324 -4.197 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.165 -1.723 -5.049 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.416 -1.155 -6.528 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.651 -0.118 -3.914 1.00 0.00 H new ATOM 0 HE3 LYS A 105 0.898 0.485 -4.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -0.910 1.877 -5.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.137 1.144 -6.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -1.638 0.560 -6.025 1.00 0.00 H new ATOM 1633 N TYR A 106 -3.934 -4.659 -4.955 1.00 0.00 N ATOM 1634 CA TYR A 106 -5.321 -4.347 -5.278 1.00 0.00 C ATOM 1635 C TYR A 106 -5.452 -2.915 -5.789 1.00 0.00 C ATOM 1636 O TYR A 106 -5.315 -1.957 -5.029 1.00 0.00 O ATOM 1637 CB TYR A 106 -6.210 -4.545 -4.049 1.00 0.00 C ATOM 1638 CG TYR A 106 -7.637 -4.915 -4.387 1.00 0.00 C ATOM 1639 CD1 TYR A 106 -7.918 -5.989 -5.222 1.00 0.00 C ATOM 1640 CD2 TYR A 106 -8.704 -4.190 -3.870 1.00 0.00 C ATOM 1641 CE1 TYR A 106 -9.220 -6.329 -5.534 1.00 0.00 C ATOM 1642 CE2 TYR A 106 -10.009 -4.524 -4.176 1.00 0.00 C ATOM 1643 CZ TYR A 106 -10.262 -5.594 -5.008 1.00 0.00 C ATOM 1644 OH TYR A 106 -11.560 -5.931 -5.315 1.00 0.00 O ATOM 0 H TYR A 106 -3.803 -5.113 -4.051 1.00 0.00 H new ATOM 0 HA TYR A 106 -5.646 -5.026 -6.066 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.780 -5.326 -3.422 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -6.211 -3.628 -3.460 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.105 -6.568 -5.634 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.510 -3.351 -3.218 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -9.421 -7.166 -6.186 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.827 -3.950 -3.766 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.174 -5.315 -4.863 1.00 0.00 H new ATOM 1654 N GLY A 107 -5.720 -2.778 -7.084 1.00 0.00 N ATOM 1655 CA GLY A 107 -5.866 -1.461 -7.676 1.00 0.00 C ATOM 1656 C GLY A 107 -4.966 -1.263 -8.879 1.00 0.00 C ATOM 1657 O GLY A 107 -5.323 -0.556 -9.823 1.00 0.00 O ATOM 0 H GLY A 107 -5.839 -3.555 -7.734 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.904 -1.313 -7.974 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.639 -0.702 -6.927 1.00 0.00 H new ATOM 1661 N THR A 108 -3.792 -1.886 -8.848 1.00 0.00 N ATOM 1662 CA THR A 108 -2.837 -1.773 -9.942 1.00 0.00 C ATOM 1663 C THR A 108 -2.354 -3.146 -10.395 1.00 0.00 C ATOM 1664 O THR A 108 -2.282 -4.094 -9.613 1.00 0.00 O ATOM 1665 CB THR A 108 -1.619 -0.920 -9.539 1.00 0.00 C ATOM 1666 OG1 THR A 108 -1.018 -1.455 -8.355 1.00 0.00 O ATOM 1667 CG2 THR A 108 -2.026 0.525 -9.299 1.00 0.00 C ATOM 0 H THR A 108 -3.480 -2.475 -8.076 1.00 0.00 H new ATOM 0 HA THR A 108 -3.357 -1.284 -10.766 1.00 0.00 H new ATOM 0 HB THR A 108 -0.898 -0.946 -10.356 1.00 0.00 H new ATOM 0 HG1 THR A 108 -0.559 -2.294 -8.571 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.149 1.108 -9.016 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.457 0.938 -10.211 1.00 0.00 H new ATOM 0 HG23 THR A 108 -2.764 0.567 -8.498 1.00 0.00 H new ATOM 1675 N PRO A 109 -2.014 -3.258 -11.688 1.00 0.00 N ATOM 1676 CA PRO A 109 -1.531 -4.512 -12.273 1.00 0.00 C ATOM 1677 C PRO A 109 -0.140 -4.887 -11.774 1.00 0.00 C ATOM 1678 O PRO A 109 0.409 -5.920 -12.157 1.00 0.00 O ATOM 1679 CB PRO A 109 -1.498 -4.213 -13.774 1.00 0.00 C ATOM 1680 CG PRO A 109 -1.342 -2.734 -13.863 1.00 0.00 C ATOM 1681 CD PRO A 109 -2.075 -2.169 -12.677 1.00 0.00 C ATOM 0 HA PRO A 109 -2.166 -5.357 -12.006 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -0.671 -4.728 -14.262 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -2.414 -4.545 -14.264 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -0.290 -2.451 -13.843 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -1.757 -2.353 -14.796 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -1.599 -1.262 -12.305 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -3.104 -1.910 -12.927 1.00 0.00 H new ATOM 1689 N GLN A 110 0.424 -4.041 -10.918 1.00 0.00 N ATOM 1690 CA GLN A 110 1.752 -4.285 -10.367 1.00 0.00 C ATOM 1691 C GLN A 110 1.714 -5.402 -9.329 1.00 0.00 C ATOM 1692 O GLN A 110 1.077 -5.272 -8.284 1.00 0.00 O ATOM 1693 CB GLN A 110 2.308 -3.007 -9.737 1.00 0.00 C ATOM 1694 CG GLN A 110 2.963 -2.070 -10.739 1.00 0.00 C ATOM 1695 CD GLN A 110 3.040 -0.641 -10.239 1.00 0.00 C ATOM 1696 OE1 GLN A 110 2.772 0.304 -10.981 1.00 0.00 O ATOM 1697 NE2 GLN A 110 3.407 -0.476 -8.973 1.00 0.00 N ATOM 0 H GLN A 110 -0.017 -3.181 -10.591 1.00 0.00 H new ATOM 0 HA GLN A 110 2.405 -4.594 -11.183 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.499 -2.478 -9.233 1.00 0.00 H new ATOM 0 HB3 GLN A 110 3.037 -3.276 -8.973 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.968 -2.428 -10.961 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.402 -2.094 -11.673 1.00 0.00 H new ATOM 0 HE21 GLN A 110 3.620 -1.288 -8.394 1.00 0.00 H new ATOM 0 HE22 GLN A 110 3.476 0.463 -8.580 1.00 0.00 H new ATOM 1706 N LYS A 111 2.400 -6.501 -9.625 1.00 0.00 N ATOM 1707 CA LYS A 111 2.446 -7.642 -8.718 1.00 0.00 C ATOM 1708 C LYS A 111 3.858 -8.214 -8.635 1.00 0.00 C ATOM 1709 O LYS A 111 4.607 -8.190 -9.612 1.00 0.00 O ATOM 1710 CB LYS A 111 1.472 -8.727 -9.181 1.00 0.00 C ATOM 1711 CG LYS A 111 1.798 -9.293 -10.552 1.00 0.00 C ATOM 1712 CD LYS A 111 2.736 -10.485 -10.455 1.00 0.00 C ATOM 1713 CE LYS A 111 1.971 -11.780 -10.231 1.00 0.00 C ATOM 1714 NZ LYS A 111 1.005 -12.051 -11.332 1.00 0.00 N ATOM 0 H LYS A 111 2.932 -6.626 -10.486 1.00 0.00 H new ATOM 0 HA LYS A 111 2.153 -7.298 -7.726 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.472 -9.538 -8.453 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.463 -8.314 -9.198 1.00 0.00 H new ATOM 0 HG2 LYS A 111 0.877 -9.594 -11.051 1.00 0.00 H new ATOM 0 HG3 LYS A 111 2.255 -8.518 -11.167 1.00 0.00 H new ATOM 0 HD2 LYS A 111 3.324 -10.562 -11.370 1.00 0.00 H new ATOM 0 HD3 LYS A 111 3.439 -10.330 -9.636 1.00 0.00 H new ATOM 0 HE2 LYS A 111 2.675 -12.609 -10.153 1.00 0.00 H new ATOM 0 HE3 LYS A 111 1.436 -11.726 -9.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 1.122 -13.030 -11.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 0.034 -11.917 -10.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 1.183 -11.396 -12.120 1.00 0.00 H new ATOM 1728 N LEU A 112 4.215 -8.728 -7.463 1.00 0.00 N ATOM 1729 CA LEU A 112 5.537 -9.307 -7.252 1.00 0.00 C ATOM 1730 C LEU A 112 5.443 -10.816 -7.046 1.00 0.00 C ATOM 1731 O LEU A 112 4.790 -11.287 -6.115 1.00 0.00 O ATOM 1732 CB LEU A 112 6.214 -8.657 -6.045 1.00 0.00 C ATOM 1733 CG LEU A 112 6.198 -7.128 -6.009 1.00 0.00 C ATOM 1734 CD1 LEU A 112 6.954 -6.615 -4.793 1.00 0.00 C ATOM 1735 CD2 LEU A 112 6.793 -6.559 -7.289 1.00 0.00 C ATOM 0 H LEU A 112 3.607 -8.756 -6.644 1.00 0.00 H new ATOM 0 HA LEU A 112 6.137 -9.117 -8.142 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.732 -9.027 -5.140 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.251 -8.990 -6.012 1.00 0.00 H new ATOM 0 HG LEU A 112 5.163 -6.796 -5.934 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.932 -5.525 -4.784 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.484 -6.995 -3.886 1.00 0.00 H new ATOM 0 HD13 LEU A 112 7.988 -6.957 -4.837 1.00 0.00 H new ATOM 0 HD21 LEU A 112 6.774 -5.470 -7.246 1.00 0.00 H new ATOM 0 HD22 LEU A 112 7.823 -6.900 -7.394 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.209 -6.899 -8.144 1.00 0.00 H new ATOM 1747 N VAL A 113 6.103 -11.570 -7.920 1.00 0.00 N ATOM 1748 CA VAL A 113 6.097 -13.025 -7.832 1.00 0.00 C ATOM 1749 C VAL A 113 7.163 -13.521 -6.861 1.00 0.00 C ATOM 1750 O VAL A 113 7.947 -12.735 -6.331 1.00 0.00 O ATOM 1751 CB VAL A 113 6.333 -13.671 -9.210 1.00 0.00 C ATOM 1752 CG1 VAL A 113 5.607 -15.005 -9.305 1.00 0.00 C ATOM 1753 CG2 VAL A 113 5.889 -12.733 -10.321 1.00 0.00 C ATOM 0 H VAL A 113 6.648 -11.197 -8.697 1.00 0.00 H new ATOM 0 HA VAL A 113 5.112 -13.316 -7.466 1.00 0.00 H new ATOM 0 HB VAL A 113 7.401 -13.856 -9.328 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.785 -15.447 -10.285 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.978 -15.677 -8.531 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.537 -14.848 -9.167 1.00 0.00 H new ATOM 0 HG21 VAL A 113 6.063 -13.206 -11.288 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.827 -12.514 -10.210 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.458 -11.805 -10.263 1.00 0.00 H new ATOM 1763 N GLU A 114 7.184 -14.830 -6.633 1.00 0.00 N ATOM 1764 CA GLU A 114 8.154 -15.431 -5.725 1.00 0.00 C ATOM 1765 C GLU A 114 9.476 -14.669 -5.759 1.00 0.00 C ATOM 1766 O GLU A 114 9.934 -14.153 -4.740 1.00 0.00 O ATOM 1767 CB GLU A 114 8.389 -16.898 -6.091 1.00 0.00 C ATOM 1768 CG GLU A 114 7.113 -17.654 -6.423 1.00 0.00 C ATOM 1769 CD GLU A 114 7.315 -19.157 -6.447 1.00 0.00 C ATOM 1770 OE1 GLU A 114 8.265 -19.639 -5.796 1.00 0.00 O ATOM 1771 OE2 GLU A 114 6.521 -19.850 -7.117 1.00 0.00 O ATOM 0 H GLU A 114 6.541 -15.494 -7.064 1.00 0.00 H new ATOM 0 HA GLU A 114 7.749 -15.377 -4.715 1.00 0.00 H new ATOM 0 HB2 GLU A 114 9.063 -16.947 -6.946 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.890 -17.395 -5.261 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.347 -17.406 -5.689 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.743 -17.325 -7.394 1.00 0.00 H new ATOM 1778 N SER A 115 10.084 -14.605 -6.939 1.00 0.00 N ATOM 1779 CA SER A 115 11.356 -13.911 -7.107 1.00 0.00 C ATOM 1780 C SER A 115 11.241 -12.454 -6.668 1.00 0.00 C ATOM 1781 O SER A 115 12.131 -11.923 -6.005 1.00 0.00 O ATOM 1782 CB SER A 115 11.811 -13.982 -8.566 1.00 0.00 C ATOM 1783 OG SER A 115 12.884 -13.088 -8.809 1.00 0.00 O ATOM 0 H SER A 115 9.717 -15.025 -7.793 1.00 0.00 H new ATOM 0 HA SER A 115 12.097 -14.404 -6.479 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.120 -15.000 -8.805 1.00 0.00 H new ATOM 0 HB3 SER A 115 10.976 -13.740 -9.223 1.00 0.00 H new ATOM 0 HG SER A 115 13.158 -13.153 -9.748 1.00 0.00 H new ATOM 1789 N GLU A 116 10.139 -11.814 -7.045 1.00 0.00 N ATOM 1790 CA GLU A 116 9.908 -10.418 -6.692 1.00 0.00 C ATOM 1791 C GLU A 116 9.413 -10.296 -5.254 1.00 0.00 C ATOM 1792 O GLU A 116 9.284 -9.192 -4.722 1.00 0.00 O ATOM 1793 CB GLU A 116 8.892 -9.788 -7.648 1.00 0.00 C ATOM 1794 CG GLU A 116 9.286 -9.895 -9.111 1.00 0.00 C ATOM 1795 CD GLU A 116 8.460 -8.991 -10.005 1.00 0.00 C ATOM 1796 OE1 GLU A 116 7.259 -9.278 -10.192 1.00 0.00 O ATOM 1797 OE2 GLU A 116 9.014 -7.996 -10.518 1.00 0.00 O ATOM 0 H GLU A 116 9.392 -12.239 -7.595 1.00 0.00 H new ATOM 0 HA GLU A 116 10.856 -9.886 -6.779 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.924 -10.269 -7.505 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.767 -8.736 -7.390 1.00 0.00 H new ATOM 0 HG2 GLU A 116 10.341 -9.641 -9.219 1.00 0.00 H new ATOM 0 HG3 GLU A 116 9.171 -10.928 -9.440 1.00 0.00 H new ATOM 1804 N CYS A 117 9.137 -11.436 -4.630 1.00 0.00 N ATOM 1805 CA CYS A 117 8.654 -11.458 -3.254 1.00 0.00 C ATOM 1806 C CYS A 117 9.814 -11.602 -2.274 1.00 0.00 C ATOM 1807 O CYS A 117 9.631 -11.492 -1.061 1.00 0.00 O ATOM 1808 CB CYS A 117 7.659 -12.602 -3.058 1.00 0.00 C ATOM 1809 SG CYS A 117 5.987 -12.234 -3.638 1.00 0.00 S ATOM 0 H CYS A 117 9.240 -12.357 -5.055 1.00 0.00 H new ATOM 0 HA CYS A 117 8.150 -10.512 -3.056 1.00 0.00 H new ATOM 0 HB2 CYS A 117 8.028 -13.484 -3.582 1.00 0.00 H new ATOM 0 HB3 CYS A 117 7.617 -12.855 -1.999 1.00 0.00 H new ATOM 0 HG CYS A 117 5.989 -12.138 -4.934 1.00 0.00 H new ATOM 1815 N CYS A 118 11.005 -11.850 -2.807 1.00 0.00 N ATOM 1816 CA CYS A 118 12.195 -12.012 -1.979 1.00 0.00 C ATOM 1817 C CYS A 118 13.170 -10.859 -2.196 1.00 0.00 C ATOM 1818 O CYS A 118 14.157 -10.726 -1.474 1.00 0.00 O ATOM 1819 CB CYS A 118 12.881 -13.342 -2.291 1.00 0.00 C ATOM 1820 SG CYS A 118 14.480 -13.558 -1.475 1.00 0.00 S ATOM 0 H CYS A 118 11.173 -11.943 -3.809 1.00 0.00 H new ATOM 0 HA CYS A 118 11.884 -12.008 -0.934 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.221 -14.157 -1.994 1.00 0.00 H new ATOM 0 HB3 CYS A 118 13.022 -13.422 -3.369 1.00 0.00 H new ATOM 0 HG CYS A 118 14.975 -12.394 -1.175 1.00 0.00 H new ATOM 1826 N GLN A 119 12.886 -10.032 -3.197 1.00 0.00 N ATOM 1827 CA GLN A 119 13.739 -8.892 -3.510 1.00 0.00 C ATOM 1828 C GLN A 119 13.208 -7.619 -2.860 1.00 0.00 C ATOM 1829 O GLN A 119 12.389 -6.908 -3.442 1.00 0.00 O ATOM 1830 CB GLN A 119 13.837 -8.703 -5.025 1.00 0.00 C ATOM 1831 CG GLN A 119 14.937 -9.529 -5.672 1.00 0.00 C ATOM 1832 CD GLN A 119 15.142 -10.866 -4.986 1.00 0.00 C ATOM 1833 OE1 GLN A 119 15.786 -10.947 -3.940 1.00 0.00 O ATOM 1834 NE2 GLN A 119 14.593 -11.923 -5.573 1.00 0.00 N ATOM 0 H GLN A 119 12.073 -10.130 -3.805 1.00 0.00 H new ATOM 0 HA GLN A 119 14.733 -9.094 -3.111 1.00 0.00 H new ATOM 0 HB2 GLN A 119 12.882 -8.967 -5.478 1.00 0.00 H new ATOM 0 HB3 GLN A 119 14.011 -7.649 -5.241 1.00 0.00 H new ATOM 0 HG2 GLN A 119 14.691 -9.697 -6.721 1.00 0.00 H new ATOM 0 HG3 GLN A 119 15.870 -8.966 -5.649 1.00 0.00 H new ATOM 0 HE21 GLN A 119 14.067 -11.809 -6.440 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.697 -12.849 -5.157 1.00 0.00 H new ATOM 1843 N SER A 120 13.681 -7.337 -1.650 1.00 0.00 N ATOM 1844 CA SER A 120 13.250 -6.151 -0.918 1.00 0.00 C ATOM 1845 C SER A 120 13.197 -4.935 -1.838 1.00 0.00 C ATOM 1846 O SER A 120 12.207 -4.203 -1.860 1.00 0.00 O ATOM 1847 CB SER A 120 14.195 -5.878 0.253 1.00 0.00 C ATOM 1848 OG SER A 120 15.498 -6.364 -0.018 1.00 0.00 O ATOM 0 H SER A 120 14.362 -7.913 -1.156 1.00 0.00 H new ATOM 0 HA SER A 120 12.248 -6.336 -0.531 1.00 0.00 H new ATOM 0 HB2 SER A 120 14.237 -4.806 0.448 1.00 0.00 H new ATOM 0 HB3 SER A 120 13.807 -6.352 1.155 1.00 0.00 H new ATOM 0 HG SER A 120 16.083 -6.175 0.745 1.00 0.00 H new ATOM 1854 N SER A 121 14.268 -4.727 -2.596 1.00 0.00 N ATOM 1855 CA SER A 121 14.347 -3.598 -3.516 1.00 0.00 C ATOM 1856 C SER A 121 12.997 -3.344 -4.180 1.00 0.00 C ATOM 1857 O SER A 121 12.567 -2.199 -4.323 1.00 0.00 O ATOM 1858 CB SER A 121 15.413 -3.854 -4.582 1.00 0.00 C ATOM 1859 OG SER A 121 15.784 -2.651 -5.232 1.00 0.00 O ATOM 0 H SER A 121 15.094 -5.326 -2.592 1.00 0.00 H new ATOM 0 HA SER A 121 14.623 -2.713 -2.943 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.291 -4.308 -4.121 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.034 -4.566 -5.316 1.00 0.00 H new ATOM 0 HG SER A 121 16.468 -2.842 -5.908 1.00 0.00 H new ATOM 1865 N LEU A 122 12.333 -4.421 -4.586 1.00 0.00 N ATOM 1866 CA LEU A 122 11.031 -4.317 -5.237 1.00 0.00 C ATOM 1867 C LEU A 122 9.929 -4.068 -4.212 1.00 0.00 C ATOM 1868 O LEU A 122 9.110 -3.163 -4.373 1.00 0.00 O ATOM 1869 CB LEU A 122 10.731 -5.592 -6.027 1.00 0.00 C ATOM 1870 CG LEU A 122 11.667 -5.892 -7.198 1.00 0.00 C ATOM 1871 CD1 LEU A 122 11.631 -7.372 -7.544 1.00 0.00 C ATOM 1872 CD2 LEU A 122 11.291 -5.050 -8.409 1.00 0.00 C ATOM 0 H LEU A 122 12.674 -5.376 -4.476 1.00 0.00 H new ATOM 0 HA LEU A 122 11.061 -3.471 -5.923 1.00 0.00 H new ATOM 0 HB2 LEU A 122 10.760 -6.437 -5.339 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.712 -5.527 -6.410 1.00 0.00 H new ATOM 0 HG LEU A 122 12.684 -5.634 -6.902 1.00 0.00 H new ATOM 0 HD11 LEU A 122 12.303 -7.567 -8.380 1.00 0.00 H new ATOM 0 HD12 LEU A 122 11.948 -7.956 -6.680 1.00 0.00 H new ATOM 0 HD13 LEU A 122 10.616 -7.656 -7.821 1.00 0.00 H new ATOM 0 HD21 LEU A 122 11.967 -5.276 -9.233 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.267 -5.277 -8.707 1.00 0.00 H new ATOM 0 HD23 LEU A 122 11.369 -3.993 -8.155 1.00 0.00 H new ATOM 1884 N VAL A 123 9.915 -4.877 -3.157 1.00 0.00 N ATOM 1885 CA VAL A 123 8.916 -4.742 -2.104 1.00 0.00 C ATOM 1886 C VAL A 123 8.766 -3.288 -1.670 1.00 0.00 C ATOM 1887 O VAL A 123 7.654 -2.772 -1.569 1.00 0.00 O ATOM 1888 CB VAL A 123 9.277 -5.598 -0.875 1.00 0.00 C ATOM 1889 CG1 VAL A 123 8.293 -5.348 0.257 1.00 0.00 C ATOM 1890 CG2 VAL A 123 9.311 -7.073 -1.246 1.00 0.00 C ATOM 0 H VAL A 123 10.584 -5.632 -3.009 1.00 0.00 H new ATOM 0 HA VAL A 123 7.971 -5.093 -2.518 1.00 0.00 H new ATOM 0 HB VAL A 123 10.270 -5.309 -0.531 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.564 -5.961 1.117 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.322 -4.295 0.539 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.287 -5.608 -0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.568 -7.664 -0.367 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.332 -7.378 -1.615 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.058 -7.236 -2.023 1.00 0.00 H new ATOM 1900 N GLU A 124 9.895 -2.633 -1.416 1.00 0.00 N ATOM 1901 CA GLU A 124 9.888 -1.238 -0.993 1.00 0.00 C ATOM 1902 C GLU A 124 9.499 -0.320 -2.149 1.00 0.00 C ATOM 1903 O GLU A 124 9.152 0.842 -1.943 1.00 0.00 O ATOM 1904 CB GLU A 124 11.263 -0.839 -0.452 1.00 0.00 C ATOM 1905 CG GLU A 124 12.333 -0.736 -1.526 1.00 0.00 C ATOM 1906 CD GLU A 124 13.601 -0.073 -1.024 1.00 0.00 C ATOM 1907 OE1 GLU A 124 14.122 -0.507 0.025 1.00 0.00 O ATOM 1908 OE2 GLU A 124 14.073 0.880 -1.680 1.00 0.00 O ATOM 0 H GLU A 124 10.824 -3.046 -1.496 1.00 0.00 H new ATOM 0 HA GLU A 124 9.148 -1.130 -0.200 1.00 0.00 H new ATOM 0 HB2 GLU A 124 11.179 0.120 0.058 1.00 0.00 H new ATOM 0 HB3 GLU A 124 11.577 -1.570 0.293 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.570 -1.734 -1.894 1.00 0.00 H new ATOM 0 HG3 GLU A 124 11.941 -0.170 -2.371 1.00 0.00 H new ATOM 1915 N MET A 125 9.561 -0.852 -3.365 1.00 0.00 N ATOM 1916 CA MET A 125 9.215 -0.082 -4.554 1.00 0.00 C ATOM 1917 C MET A 125 7.708 -0.096 -4.791 1.00 0.00 C ATOM 1918 O MET A 125 7.064 0.954 -4.808 1.00 0.00 O ATOM 1919 CB MET A 125 9.940 -0.641 -5.780 1.00 0.00 C ATOM 1920 CG MET A 125 9.956 0.311 -6.964 1.00 0.00 C ATOM 1921 SD MET A 125 10.222 -0.536 -8.533 1.00 0.00 S ATOM 1922 CE MET A 125 8.690 -1.449 -8.690 1.00 0.00 C ATOM 0 H MET A 125 9.847 -1.813 -3.553 1.00 0.00 H new ATOM 0 HA MET A 125 9.531 0.949 -4.393 1.00 0.00 H new ATOM 0 HB2 MET A 125 10.967 -0.883 -5.505 1.00 0.00 H new ATOM 0 HB3 MET A 125 9.462 -1.573 -6.081 1.00 0.00 H new ATOM 0 HG2 MET A 125 9.010 0.852 -7.003 1.00 0.00 H new ATOM 0 HG3 MET A 125 10.741 1.053 -6.818 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.485 -1.638 -9.744 1.00 0.00 H new ATOM 0 HE2 MET A 125 8.776 -2.398 -8.161 1.00 0.00 H new ATOM 0 HE3 MET A 125 7.874 -0.867 -8.261 1.00 0.00 H new ATOM 1932 N ILE A 126 7.153 -1.289 -4.973 1.00 0.00 N ATOM 1933 CA ILE A 126 5.722 -1.438 -5.207 1.00 0.00 C ATOM 1934 C ILE A 126 4.912 -0.644 -4.188 1.00 0.00 C ATOM 1935 O ILE A 126 3.810 -0.180 -4.480 1.00 0.00 O ATOM 1936 CB ILE A 126 5.293 -2.916 -5.149 1.00 0.00 C ATOM 1937 CG1 ILE A 126 3.850 -3.070 -5.634 1.00 0.00 C ATOM 1938 CG2 ILE A 126 5.443 -3.456 -3.735 1.00 0.00 C ATOM 1939 CD1 ILE A 126 3.533 -4.452 -6.160 1.00 0.00 C ATOM 0 H ILE A 126 7.672 -2.167 -4.963 1.00 0.00 H new ATOM 0 HA ILE A 126 5.524 -1.050 -6.206 1.00 0.00 H new ATOM 0 HB ILE A 126 5.941 -3.494 -5.808 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.173 -2.839 -4.812 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.659 -2.339 -6.419 1.00 0.00 H new ATOM 0 HG21 ILE A 126 5.136 -4.502 -3.710 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.485 -3.376 -3.424 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.816 -2.878 -3.056 1.00 0.00 H new ATOM 0 HD11 ILE A 126 2.493 -4.488 -6.486 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.186 -4.679 -7.003 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.691 -5.187 -5.371 1.00 0.00 H new ATOM 1951 N PHE A 127 5.467 -0.490 -2.990 1.00 0.00 N ATOM 1952 CA PHE A 127 4.797 0.248 -1.926 1.00 0.00 C ATOM 1953 C PHE A 127 4.985 1.752 -2.107 1.00 0.00 C ATOM 1954 O PHE A 127 4.022 2.517 -2.068 1.00 0.00 O ATOM 1955 CB PHE A 127 5.334 -0.184 -0.560 1.00 0.00 C ATOM 1956 CG PHE A 127 4.933 -1.578 -0.172 1.00 0.00 C ATOM 1957 CD1 PHE A 127 3.625 -2.006 -0.331 1.00 0.00 C ATOM 1958 CD2 PHE A 127 5.864 -2.461 0.351 1.00 0.00 C ATOM 1959 CE1 PHE A 127 3.253 -3.288 0.027 1.00 0.00 C ATOM 1960 CE2 PHE A 127 5.498 -3.745 0.709 1.00 0.00 C ATOM 1961 CZ PHE A 127 4.191 -4.159 0.546 1.00 0.00 C ATOM 0 H PHE A 127 6.379 -0.867 -2.732 1.00 0.00 H new ATOM 0 HA PHE A 127 3.732 0.024 -1.977 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.422 -0.116 -0.568 1.00 0.00 H new ATOM 0 HB3 PHE A 127 4.977 0.513 0.199 1.00 0.00 H new ATOM 0 HD1 PHE A 127 2.888 -1.330 -0.739 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.888 -2.142 0.480 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.229 -3.609 -0.099 1.00 0.00 H new ATOM 0 HE2 PHE A 127 6.233 -4.423 1.116 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.903 -5.162 0.824 1.00 0.00 H new ATOM 1971 N SER A 128 6.232 2.167 -2.303 1.00 0.00 N ATOM 1972 CA SER A 128 6.548 3.579 -2.485 1.00 0.00 C ATOM 1973 C SER A 128 5.874 4.129 -3.738 1.00 0.00 C ATOM 1974 O SER A 128 5.094 5.078 -3.670 1.00 0.00 O ATOM 1975 CB SER A 128 8.062 3.777 -2.577 1.00 0.00 C ATOM 1976 OG SER A 128 8.412 5.137 -2.386 1.00 0.00 O ATOM 0 H SER A 128 7.040 1.546 -2.340 1.00 0.00 H new ATOM 0 HA SER A 128 6.170 4.125 -1.621 1.00 0.00 H new ATOM 0 HB2 SER A 128 8.558 3.162 -1.827 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.417 3.440 -3.551 1.00 0.00 H new ATOM 0 HG SER A 128 9.385 5.236 -2.448 1.00 0.00 H new