USER MOD reduce.3.24.130724 H: found=0, std=0, add=1066, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1061 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 112 MET CE :methyl -132:sc= -0.717 (180deg=-1.34!) USER MOD Set 1.2: A 134 HIS : no HE2:sc= -0.463 X(o=-1.9,f=-1.6) USER MOD Set 1.3: A 135 MET CE :methyl 139:sc= -0.702 (180deg=-2.52!) USER MOD Set 1.4: A 138 TYR OH : rot 120:sc= -0.0629 USER MOD Set 2.1: A 87 HIS : no HE2:sc= -0.292 K(o=0.76,f=0.07) USER MOD Set 2.2: A 94 SER OG : rot 116:sc= 1.06 USER MOD Set 3.1: A 85 THR OG1 : rot -142:sc= 2.04 USER MOD Set 3.2: A 98 GLN : amide:sc= -3.33! C(o=-1.3!,f=-7.3!) USER MOD Set 4.1: A 84 SER OG : rot 150:sc= -0.144 USER MOD Set 4.2: A 99 SER OG : rot 61:sc= 1.03 USER MOD Set 5.1: A 29 LYS NZ :NH3+ -173:sc= 1.09 (180deg=-0.124) USER MOD Set 5.2: A 43 TYR OH : rot -118:sc= 2.4 USER MOD Set 6.1: A 14 GLN : amide:sc= -1.41 K(o=-1.7,f=-0.46) USER MOD Set 6.2: A 28 HIS : no HD1:sc= -0.32 X(o=-1.7,f=-1.4) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 HIS : no HD1:sc= -0.0795 X(o=-0.08,f=0) USER MOD Single : A 17 LYS NZ :NH3+ -166:sc= -0.0182 (180deg=-0.194) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 180:sc= -2.2! (180deg=-2.2!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -1.49 K(o=-1.5,f=-0.51) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00488) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.06 X(o=-0.06,f=0) USER MOD Single : A 62 MET CE :methyl -134:sc= -0.822 (180deg=-0.853) USER MOD Single : A 66 SER OG : rot -116:sc= 0.331 USER MOD Single : A 69 SER OG : rot -170:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.788 K(o=-0.79,f=-9.5!) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 GLN : amide:sc= -0.66 X(o=-0.66,f=-0.33) USER MOD Single : A 110 SER OG : rot -12:sc= 0.898 USER MOD Single : A 111 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 113 GLN : amide:sc= -2.79! K(o=-2.8!,f=-3.9) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -0.016 K(o=-0.016,f=-1.2!) USER MOD Single : A 118 LYS NZ :NH3+ 149:sc= -1.13 (180deg=-2.54!) USER MOD Single : A 124 THR OG1 : rot 104:sc= 1.25 USER MOD Single : A 125 LYS NZ :NH3+ 160:sc= 1.23 (180deg=1.09) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot -43:sc= 0.436 USER MOD ----------------------------------------------------------------- ATOM 97 N GLU A 7 34.778 1.898 3.168 1.00 0.00 N ATOM 98 CA GLU A 7 34.269 0.599 3.507 1.00 0.00 C ATOM 99 C GLU A 7 32.913 0.408 2.866 1.00 0.00 C ATOM 100 O GLU A 7 32.198 1.388 2.641 1.00 0.00 O ATOM 101 CB GLU A 7 34.173 0.434 5.025 1.00 0.00 C ATOM 102 CG GLU A 7 35.516 0.296 5.708 1.00 0.00 C ATOM 103 CD GLU A 7 36.238 -0.953 5.275 1.00 0.00 C ATOM 104 OE1 GLU A 7 35.953 -2.038 5.829 1.00 0.00 O ATOM 105 OE2 GLU A 7 37.094 -0.883 4.368 1.00 0.00 O ATOM 0 HA GLU A 7 34.954 -0.161 3.131 1.00 0.00 H new ATOM 0 HB2 GLU A 7 33.650 1.294 5.443 1.00 0.00 H new ATOM 0 HB3 GLU A 7 33.570 -0.446 5.249 1.00 0.00 H new ATOM 0 HG2 GLU A 7 36.130 1.168 5.482 1.00 0.00 H new ATOM 0 HG3 GLU A 7 35.374 0.278 6.789 1.00 0.00 H new ATOM 112 N PRO A 8 32.560 -0.837 2.498 1.00 0.00 N ATOM 113 CA PRO A 8 31.265 -1.134 1.933 1.00 0.00 C ATOM 114 C PRO A 8 30.138 -0.728 2.861 1.00 0.00 C ATOM 115 O PRO A 8 30.258 -0.782 4.100 1.00 0.00 O ATOM 116 CB PRO A 8 31.256 -2.641 1.731 1.00 0.00 C ATOM 117 CG PRO A 8 32.426 -3.155 2.504 1.00 0.00 C ATOM 118 CD PRO A 8 33.413 -2.029 2.571 1.00 0.00 C ATOM 0 HA PRO A 8 31.108 -0.583 1.006 1.00 0.00 H new ATOM 0 HB2 PRO A 8 30.325 -3.079 2.091 1.00 0.00 H new ATOM 0 HB3 PRO A 8 31.341 -2.896 0.675 1.00 0.00 H new ATOM 0 HG2 PRO A 8 32.124 -3.468 3.504 1.00 0.00 H new ATOM 0 HG3 PRO A 8 32.862 -4.026 2.015 1.00 0.00 H new ATOM 0 HD2 PRO A 8 33.992 -2.055 3.494 1.00 0.00 H new ATOM 0 HD3 PRO A 8 34.125 -2.067 1.747 1.00 0.00 H new ATOM 126 N LEU A 9 29.054 -0.394 2.266 1.00 0.00 N ATOM 127 CA LEU A 9 27.945 0.161 2.964 1.00 0.00 C ATOM 128 C LEU A 9 27.026 -0.935 3.332 1.00 0.00 C ATOM 129 O LEU A 9 26.465 -1.573 2.451 1.00 0.00 O ATOM 130 CB LEU A 9 27.186 1.158 2.062 1.00 0.00 C ATOM 131 CG LEU A 9 26.695 2.463 2.740 1.00 0.00 C ATOM 132 CD1 LEU A 9 25.637 2.190 3.797 1.00 0.00 C ATOM 133 CD2 LEU A 9 27.862 3.203 3.363 1.00 0.00 C ATOM 0 H LEU A 9 28.905 -0.499 1.262 1.00 0.00 H new ATOM 0 HA LEU A 9 28.304 0.683 3.851 1.00 0.00 H new ATOM 0 HB2 LEU A 9 27.835 1.429 1.229 1.00 0.00 H new ATOM 0 HB3 LEU A 9 26.322 0.646 1.639 1.00 0.00 H new ATOM 0 HG LEU A 9 26.242 3.081 1.965 1.00 0.00 H new ATOM 0 HD11 LEU A 9 25.321 3.131 4.247 1.00 0.00 H new ATOM 0 HD12 LEU A 9 24.779 1.702 3.335 1.00 0.00 H new ATOM 0 HD13 LEU A 9 26.052 1.541 4.568 1.00 0.00 H new ATOM 0 HD21 LEU A 9 27.503 4.117 3.835 1.00 0.00 H new ATOM 0 HD22 LEU A 9 28.336 2.569 4.113 1.00 0.00 H new ATOM 0 HD23 LEU A 9 28.588 3.455 2.590 1.00 0.00 H new ATOM 145 N GLN A 10 26.905 -1.197 4.595 1.00 0.00 N ATOM 146 CA GLN A 10 25.948 -2.145 5.047 1.00 0.00 C ATOM 147 C GLN A 10 24.600 -1.479 5.085 1.00 0.00 C ATOM 148 O GLN A 10 24.275 -0.737 6.022 1.00 0.00 O ATOM 149 CB GLN A 10 26.293 -2.730 6.402 1.00 0.00 C ATOM 150 CG GLN A 10 27.449 -3.682 6.395 1.00 0.00 C ATOM 151 CD GLN A 10 27.676 -4.321 7.734 1.00 0.00 C ATOM 152 OE1 GLN A 10 28.409 -3.804 8.570 1.00 0.00 O ATOM 153 NE2 GLN A 10 27.090 -5.451 7.935 1.00 0.00 N ATOM 0 H GLN A 10 27.462 -0.763 5.331 1.00 0.00 H new ATOM 0 HA GLN A 10 25.942 -2.984 4.351 1.00 0.00 H new ATOM 0 HB2 GLN A 10 26.516 -1.914 7.089 1.00 0.00 H new ATOM 0 HB3 GLN A 10 25.417 -3.246 6.794 1.00 0.00 H new ATOM 0 HG2 GLN A 10 27.271 -4.459 5.651 1.00 0.00 H new ATOM 0 HG3 GLN A 10 28.351 -3.151 6.092 1.00 0.00 H new ATOM 0 HE21 GLN A 10 26.487 -5.848 7.214 1.00 0.00 H new ATOM 0 HE22 GLN A 10 27.229 -5.948 8.815 1.00 0.00 H new ATOM 162 N VAL A 11 23.857 -1.688 4.056 1.00 0.00 N ATOM 163 CA VAL A 11 22.583 -1.061 3.909 1.00 0.00 C ATOM 164 C VAL A 11 21.523 -2.006 4.358 1.00 0.00 C ATOM 165 O VAL A 11 21.419 -3.114 3.846 1.00 0.00 O ATOM 166 CB VAL A 11 22.245 -0.729 2.441 1.00 0.00 C ATOM 167 CG1 VAL A 11 21.111 0.270 2.362 1.00 0.00 C ATOM 168 CG2 VAL A 11 23.445 -0.295 1.632 1.00 0.00 C ATOM 0 H VAL A 11 24.115 -2.303 3.284 1.00 0.00 H new ATOM 0 HA VAL A 11 22.624 -0.143 4.494 1.00 0.00 H new ATOM 0 HB VAL A 11 21.910 -1.658 1.979 1.00 0.00 H new ATOM 0 HG11 VAL A 11 20.891 0.488 1.317 1.00 0.00 H new ATOM 0 HG12 VAL A 11 20.225 -0.147 2.840 1.00 0.00 H new ATOM 0 HG13 VAL A 11 21.400 1.189 2.872 1.00 0.00 H new ATOM 0 HG21 VAL A 11 23.135 -0.077 0.610 1.00 0.00 H new ATOM 0 HG22 VAL A 11 23.880 0.600 2.078 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.187 -1.094 1.624 1.00 0.00 H new ATOM 178 N HIS A 12 20.755 -1.594 5.288 1.00 0.00 N ATOM 179 CA HIS A 12 19.621 -2.347 5.674 1.00 0.00 C ATOM 180 C HIS A 12 18.442 -1.729 4.969 1.00 0.00 C ATOM 181 O HIS A 12 17.941 -0.687 5.355 1.00 0.00 O ATOM 182 CB HIS A 12 19.434 -2.347 7.190 1.00 0.00 C ATOM 183 CG HIS A 12 20.505 -3.079 7.972 1.00 0.00 C ATOM 184 ND1 HIS A 12 20.229 -3.939 9.003 1.00 0.00 N ATOM 185 CD2 HIS A 12 21.864 -3.035 7.883 1.00 0.00 C ATOM 186 CE1 HIS A 12 21.381 -4.384 9.501 1.00 0.00 C ATOM 187 NE2 HIS A 12 22.412 -3.868 8.858 1.00 0.00 N ATOM 0 H HIS A 12 20.890 -0.726 5.806 1.00 0.00 H new ATOM 0 HA HIS A 12 19.736 -3.394 5.394 1.00 0.00 H new ATOM 0 HB2 HIS A 12 19.397 -1.314 7.535 1.00 0.00 H new ATOM 0 HB3 HIS A 12 18.468 -2.795 7.421 1.00 0.00 H new ATOM 0 HD2 HIS A 12 22.427 -2.449 7.171 1.00 0.00 H new ATOM 0 HE1 HIS A 12 21.461 -5.078 10.325 1.00 0.00 H new ATOM 0 HE2 HIS A 12 23.401 -4.042 9.037 1.00 0.00 H new ATOM 195 N VAL A 13 18.076 -2.327 3.901 1.00 0.00 N ATOM 196 CA VAL A 13 17.061 -1.840 3.047 1.00 0.00 C ATOM 197 C VAL A 13 15.757 -2.594 3.249 1.00 0.00 C ATOM 198 O VAL A 13 15.685 -3.824 3.122 1.00 0.00 O ATOM 199 CB VAL A 13 17.527 -1.851 1.553 1.00 0.00 C ATOM 200 CG1 VAL A 13 17.960 -3.226 1.068 1.00 0.00 C ATOM 201 CG2 VAL A 13 16.477 -1.267 0.642 1.00 0.00 C ATOM 0 H VAL A 13 18.490 -3.203 3.584 1.00 0.00 H new ATOM 0 HA VAL A 13 16.867 -0.801 3.313 1.00 0.00 H new ATOM 0 HB VAL A 13 18.412 -1.215 1.514 1.00 0.00 H new ATOM 0 HG11 VAL A 13 18.271 -3.163 0.025 1.00 0.00 H new ATOM 0 HG12 VAL A 13 18.794 -3.580 1.674 1.00 0.00 H new ATOM 0 HG13 VAL A 13 17.126 -3.922 1.157 1.00 0.00 H new ATOM 0 HG21 VAL A 13 16.835 -1.291 -0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 13 15.560 -1.852 0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 13 16.276 -0.236 0.933 1.00 0.00 H new ATOM 211 N GLN A 14 14.753 -1.861 3.625 1.00 0.00 N ATOM 212 CA GLN A 14 13.447 -2.403 3.778 1.00 0.00 C ATOM 213 C GLN A 14 12.747 -2.251 2.455 1.00 0.00 C ATOM 214 O GLN A 14 12.703 -1.150 1.895 1.00 0.00 O ATOM 215 CB GLN A 14 12.670 -1.689 4.884 1.00 0.00 C ATOM 216 CG GLN A 14 11.309 -2.306 5.158 1.00 0.00 C ATOM 217 CD GLN A 14 10.547 -1.611 6.258 1.00 0.00 C ATOM 218 OE1 GLN A 14 10.694 -1.936 7.432 1.00 0.00 O ATOM 219 NE2 GLN A 14 9.689 -0.702 5.892 1.00 0.00 N ATOM 0 H GLN A 14 14.822 -0.865 3.834 1.00 0.00 H new ATOM 0 HA GLN A 14 13.508 -3.452 4.069 1.00 0.00 H new ATOM 0 HB2 GLN A 14 13.259 -1.705 5.801 1.00 0.00 H new ATOM 0 HB3 GLN A 14 12.538 -0.643 4.608 1.00 0.00 H new ATOM 0 HG2 GLN A 14 10.716 -2.281 4.244 1.00 0.00 H new ATOM 0 HG3 GLN A 14 11.441 -3.355 5.424 1.00 0.00 H new ATOM 0 HE21 GLN A 14 9.594 -0.458 4.906 1.00 0.00 H new ATOM 0 HE22 GLN A 14 9.112 -0.235 6.591 1.00 0.00 H new ATOM 228 N LEU A 15 12.262 -3.328 1.943 1.00 0.00 N ATOM 229 CA LEU A 15 11.624 -3.332 0.667 1.00 0.00 C ATOM 230 C LEU A 15 10.139 -3.557 0.862 1.00 0.00 C ATOM 231 O LEU A 15 9.723 -4.612 1.336 1.00 0.00 O ATOM 232 CB LEU A 15 12.241 -4.435 -0.202 1.00 0.00 C ATOM 233 CG LEU A 15 13.754 -4.354 -0.416 1.00 0.00 C ATOM 234 CD1 LEU A 15 14.244 -5.540 -1.203 1.00 0.00 C ATOM 235 CD2 LEU A 15 14.152 -3.062 -1.109 1.00 0.00 C ATOM 0 H LEU A 15 12.296 -4.240 2.399 1.00 0.00 H new ATOM 0 HA LEU A 15 11.769 -2.377 0.163 1.00 0.00 H new ATOM 0 HB2 LEU A 15 12.009 -5.399 0.251 1.00 0.00 H new ATOM 0 HB3 LEU A 15 11.755 -4.416 -1.177 1.00 0.00 H new ATOM 0 HG LEU A 15 14.224 -4.365 0.567 1.00 0.00 H new ATOM 0 HD11 LEU A 15 15.322 -5.463 -1.344 1.00 0.00 H new ATOM 0 HD12 LEU A 15 14.014 -6.457 -0.661 1.00 0.00 H new ATOM 0 HD13 LEU A 15 13.751 -5.560 -2.175 1.00 0.00 H new ATOM 0 HD21 LEU A 15 15.233 -3.040 -1.244 1.00 0.00 H new ATOM 0 HD22 LEU A 15 13.664 -3.005 -2.082 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.845 -2.212 -0.499 1.00 0.00 H new ATOM 247 N GLU A 16 9.360 -2.561 0.567 1.00 0.00 N ATOM 248 CA GLU A 16 7.921 -2.661 0.711 1.00 0.00 C ATOM 249 C GLU A 16 7.297 -3.055 -0.604 1.00 0.00 C ATOM 250 O GLU A 16 7.795 -2.695 -1.669 1.00 0.00 O ATOM 251 CB GLU A 16 7.307 -1.332 1.128 1.00 0.00 C ATOM 252 CG GLU A 16 7.795 -0.752 2.431 1.00 0.00 C ATOM 253 CD GLU A 16 7.137 0.581 2.712 1.00 0.00 C ATOM 254 OE1 GLU A 16 7.505 1.583 2.088 1.00 0.00 O ATOM 255 OE2 GLU A 16 6.229 0.647 3.552 1.00 0.00 O ATOM 0 H GLU A 16 9.690 -1.660 0.222 1.00 0.00 H new ATOM 0 HA GLU A 16 7.728 -3.410 1.479 1.00 0.00 H new ATOM 0 HB2 GLU A 16 7.495 -0.605 0.338 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.226 -1.460 1.193 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.581 -1.445 3.244 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.877 -0.627 2.395 1.00 0.00 H new ATOM 262 N LYS A 17 6.231 -3.790 -0.534 1.00 0.00 N ATOM 263 CA LYS A 17 5.446 -4.135 -1.691 1.00 0.00 C ATOM 264 C LYS A 17 4.073 -3.615 -1.453 1.00 0.00 C ATOM 265 O LYS A 17 3.349 -4.199 -0.671 1.00 0.00 O ATOM 266 CB LYS A 17 5.346 -5.663 -1.924 1.00 0.00 C ATOM 267 CG LYS A 17 6.573 -6.363 -2.492 1.00 0.00 C ATOM 268 CD LYS A 17 7.756 -6.408 -1.551 1.00 0.00 C ATOM 269 CE LYS A 17 8.929 -7.092 -2.227 1.00 0.00 C ATOM 270 NZ LYS A 17 8.661 -8.519 -2.549 1.00 0.00 N ATOM 0 H LYS A 17 5.872 -4.176 0.339 1.00 0.00 H new ATOM 0 HA LYS A 17 5.925 -3.705 -2.571 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.099 -6.134 -0.973 1.00 0.00 H new ATOM 0 HB3 LYS A 17 4.510 -5.848 -2.598 1.00 0.00 H new ATOM 0 HG2 LYS A 17 6.301 -7.383 -2.764 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.873 -5.857 -3.410 1.00 0.00 H new ATOM 0 HD2 LYS A 17 8.035 -5.397 -1.255 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.487 -6.944 -0.641 1.00 0.00 H new ATOM 0 HE2 LYS A 17 9.175 -6.558 -3.145 1.00 0.00 H new ATOM 0 HE3 LYS A 17 9.803 -7.029 -1.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 9.555 -8.995 -2.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 8.227 -8.985 -1.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 8.013 -8.576 -3.361 1.00 0.00 H new ATOM 284 N VAL A 18 3.713 -2.518 -2.063 1.00 0.00 N ATOM 285 CA VAL A 18 2.402 -1.979 -1.837 1.00 0.00 C ATOM 286 C VAL A 18 1.518 -2.579 -2.880 1.00 0.00 C ATOM 287 O VAL A 18 1.809 -2.489 -4.079 1.00 0.00 O ATOM 288 CB VAL A 18 2.339 -0.426 -1.934 1.00 0.00 C ATOM 289 CG1 VAL A 18 1.031 0.111 -1.368 1.00 0.00 C ATOM 290 CG2 VAL A 18 3.548 0.238 -1.281 1.00 0.00 C ATOM 0 H VAL A 18 4.298 -1.989 -2.709 1.00 0.00 H new ATOM 0 HA VAL A 18 2.091 -2.222 -0.821 1.00 0.00 H new ATOM 0 HB VAL A 18 2.371 -0.169 -2.993 1.00 0.00 H new ATOM 0 HG11 VAL A 18 1.018 1.198 -1.450 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.194 -0.305 -1.928 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.944 -0.175 -0.320 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.462 1.321 -1.372 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.588 -0.035 -0.227 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.459 -0.097 -1.777 1.00 0.00 H new ATOM 300 N TYR A 19 0.520 -3.244 -2.451 1.00 0.00 N ATOM 301 CA TYR A 19 -0.376 -3.890 -3.353 1.00 0.00 C ATOM 302 C TYR A 19 -1.506 -2.963 -3.702 1.00 0.00 C ATOM 303 O TYR A 19 -1.611 -1.859 -3.133 1.00 0.00 O ATOM 304 CB TYR A 19 -0.902 -5.167 -2.728 1.00 0.00 C ATOM 305 CG TYR A 19 0.168 -6.193 -2.448 1.00 0.00 C ATOM 306 CD1 TYR A 19 0.975 -6.105 -1.327 1.00 0.00 C ATOM 307 CD2 TYR A 19 0.356 -7.251 -3.300 1.00 0.00 C ATOM 308 CE1 TYR A 19 1.936 -7.045 -1.066 1.00 0.00 C ATOM 309 CE2 TYR A 19 1.314 -8.209 -3.045 1.00 0.00 C ATOM 310 CZ TYR A 19 2.101 -8.098 -1.920 1.00 0.00 C ATOM 311 OH TYR A 19 3.057 -9.043 -1.647 1.00 0.00 O ATOM 0 H TYR A 19 0.291 -3.363 -1.464 1.00 0.00 H new ATOM 0 HA TYR A 19 0.155 -4.147 -4.270 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -1.410 -4.922 -1.795 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.648 -5.605 -3.392 1.00 0.00 H new ATOM 0 HD1 TYR A 19 0.844 -5.278 -0.644 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.257 -7.335 -4.185 1.00 0.00 H new ATOM 0 HE1 TYR A 19 2.560 -6.954 -0.189 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.446 -9.040 -3.722 1.00 0.00 H new ATOM 0 HH TYR A 19 3.050 -9.728 -2.348 1.00 0.00 H new ATOM 321 N LEU A 20 -2.351 -3.388 -4.626 1.00 0.00 N ATOM 322 CA LEU A 20 -3.494 -2.590 -5.030 1.00 0.00 C ATOM 323 C LEU A 20 -4.430 -2.412 -3.859 1.00 0.00 C ATOM 324 O LEU A 20 -4.876 -1.312 -3.574 1.00 0.00 O ATOM 325 CB LEU A 20 -4.268 -3.268 -6.161 1.00 0.00 C ATOM 326 CG LEU A 20 -3.505 -3.580 -7.440 1.00 0.00 C ATOM 327 CD1 LEU A 20 -4.423 -4.253 -8.437 1.00 0.00 C ATOM 328 CD2 LEU A 20 -2.890 -2.325 -8.025 1.00 0.00 C ATOM 0 H LEU A 20 -2.266 -4.282 -5.110 1.00 0.00 H new ATOM 0 HA LEU A 20 -3.121 -1.626 -5.376 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -4.678 -4.202 -5.777 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -5.114 -2.631 -6.420 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.690 -4.263 -7.203 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -3.870 -4.473 -9.350 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -4.805 -5.181 -8.011 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.257 -3.590 -8.669 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -2.350 -2.576 -8.938 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -3.677 -1.607 -8.254 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.199 -1.888 -7.304 1.00 0.00 H new ATOM 340 N ASP A 21 -4.660 -3.511 -3.163 1.00 0.00 N ATOM 341 CA ASP A 21 -5.615 -3.577 -2.043 1.00 0.00 C ATOM 342 C ASP A 21 -5.204 -2.746 -0.847 1.00 0.00 C ATOM 343 O ASP A 21 -6.054 -2.330 -0.051 1.00 0.00 O ATOM 344 CB ASP A 21 -5.847 -5.016 -1.618 1.00 0.00 C ATOM 345 CG ASP A 21 -4.562 -5.727 -1.312 1.00 0.00 C ATOM 346 OD1 ASP A 21 -3.992 -6.308 -2.235 1.00 0.00 O ATOM 347 OD2 ASP A 21 -4.104 -5.710 -0.176 1.00 0.00 O ATOM 0 H ASP A 21 -4.191 -4.397 -3.352 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.544 -3.148 -2.419 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.490 -5.035 -0.738 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.375 -5.547 -2.410 1.00 0.00 H new ATOM 352 N GLY A 22 -3.928 -2.517 -0.691 1.00 0.00 N ATOM 353 CA GLY A 22 -3.497 -1.692 0.380 1.00 0.00 C ATOM 354 C GLY A 22 -2.655 -2.415 1.377 1.00 0.00 C ATOM 355 O GLY A 22 -2.053 -1.775 2.254 1.00 0.00 O ATOM 0 H GLY A 22 -3.187 -2.888 -1.286 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.931 -0.852 -0.022 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.370 -1.277 0.884 1.00 0.00 H new ATOM 359 N ASP A 23 -2.631 -3.736 1.303 1.00 0.00 N ATOM 360 CA ASP A 23 -1.733 -4.484 2.147 1.00 0.00 C ATOM 361 C ASP A 23 -0.346 -4.320 1.572 1.00 0.00 C ATOM 362 O ASP A 23 -0.186 -3.982 0.382 1.00 0.00 O ATOM 363 CB ASP A 23 -2.133 -5.974 2.268 1.00 0.00 C ATOM 364 CG ASP A 23 -1.234 -6.768 3.215 1.00 0.00 C ATOM 365 OD1 ASP A 23 -1.455 -6.732 4.463 1.00 0.00 O ATOM 366 OD2 ASP A 23 -0.283 -7.435 2.738 1.00 0.00 O ATOM 0 H ASP A 23 -3.212 -4.297 0.680 1.00 0.00 H new ATOM 0 HA ASP A 23 -1.775 -4.099 3.166 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.163 -6.039 2.617 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -2.102 -6.432 1.280 1.00 0.00 H new ATOM 371 N VAL A 24 0.634 -4.480 2.379 1.00 0.00 N ATOM 372 CA VAL A 24 1.976 -4.274 1.970 1.00 0.00 C ATOM 373 C VAL A 24 2.898 -5.236 2.662 1.00 0.00 C ATOM 374 O VAL A 24 2.904 -5.353 3.888 1.00 0.00 O ATOM 375 CB VAL A 24 2.406 -2.780 2.144 1.00 0.00 C ATOM 376 CG1 VAL A 24 1.881 -2.220 3.439 1.00 0.00 C ATOM 377 CG2 VAL A 24 3.917 -2.607 2.065 1.00 0.00 C ATOM 0 H VAL A 24 0.529 -4.761 3.354 1.00 0.00 H new ATOM 0 HA VAL A 24 2.047 -4.484 0.903 1.00 0.00 H new ATOM 0 HB VAL A 24 1.968 -2.222 1.316 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.192 -1.180 3.539 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.792 -2.275 3.444 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.278 -2.799 4.273 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.170 -1.554 2.191 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.392 -3.191 2.853 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.272 -2.952 1.094 1.00 0.00 H new ATOM 387 N SER A 25 3.623 -5.957 1.868 1.00 0.00 N ATOM 388 CA SER A 25 4.558 -6.909 2.352 1.00 0.00 C ATOM 389 C SER A 25 5.843 -6.185 2.671 1.00 0.00 C ATOM 390 O SER A 25 6.332 -5.375 1.863 1.00 0.00 O ATOM 391 CB SER A 25 4.767 -8.010 1.306 1.00 0.00 C ATOM 392 OG SER A 25 5.665 -9.006 1.742 1.00 0.00 O ATOM 0 H SER A 25 3.578 -5.897 0.851 1.00 0.00 H new ATOM 0 HA SER A 25 4.191 -7.391 3.258 1.00 0.00 H new ATOM 0 HB2 SER A 25 3.807 -8.469 1.070 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.143 -7.565 0.385 1.00 0.00 H new ATOM 0 HG SER A 25 5.764 -9.686 1.043 1.00 0.00 H new ATOM 398 N ILE A 26 6.340 -6.415 3.848 1.00 0.00 N ATOM 399 CA ILE A 26 7.539 -5.787 4.305 1.00 0.00 C ATOM 400 C ILE A 26 8.675 -6.783 4.240 1.00 0.00 C ATOM 401 O ILE A 26 8.617 -7.858 4.859 1.00 0.00 O ATOM 402 CB ILE A 26 7.376 -5.266 5.758 1.00 0.00 C ATOM 403 CG1 ILE A 26 6.217 -4.254 5.860 1.00 0.00 C ATOM 404 CG2 ILE A 26 8.666 -4.660 6.279 1.00 0.00 C ATOM 405 CD1 ILE A 26 6.362 -3.037 4.970 1.00 0.00 C ATOM 0 H ILE A 26 5.919 -7.051 4.525 1.00 0.00 H new ATOM 0 HA ILE A 26 7.755 -4.933 3.663 1.00 0.00 H new ATOM 0 HB ILE A 26 7.134 -6.124 6.385 1.00 0.00 H new ATOM 0 HG12 ILE A 26 5.286 -4.762 5.610 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.131 -3.923 6.895 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.516 -4.306 7.299 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.452 -5.415 6.269 1.00 0.00 H new ATOM 0 HG23 ILE A 26 8.958 -3.824 5.644 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.502 -2.381 5.108 1.00 0.00 H new ATOM 0 HD12 ILE A 26 7.274 -2.500 5.233 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.415 -3.352 3.928 1.00 0.00 H new ATOM 417 N GLU A 27 9.668 -6.454 3.482 1.00 0.00 N ATOM 418 CA GLU A 27 10.816 -7.285 3.321 1.00 0.00 C ATOM 419 C GLU A 27 12.026 -6.576 3.925 1.00 0.00 C ATOM 420 O GLU A 27 12.110 -5.346 3.881 1.00 0.00 O ATOM 421 CB GLU A 27 11.030 -7.537 1.835 1.00 0.00 C ATOM 422 CG GLU A 27 12.180 -8.450 1.518 1.00 0.00 C ATOM 423 CD GLU A 27 11.948 -9.820 2.062 1.00 0.00 C ATOM 424 OE1 GLU A 27 11.253 -10.630 1.396 1.00 0.00 O ATOM 425 OE2 GLU A 27 12.427 -10.108 3.174 1.00 0.00 O ATOM 0 H GLU A 27 9.706 -5.586 2.948 1.00 0.00 H new ATOM 0 HA GLU A 27 10.677 -8.240 3.828 1.00 0.00 H new ATOM 0 HB2 GLU A 27 10.118 -7.963 1.416 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.193 -6.581 1.337 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.318 -8.503 0.438 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.099 -8.040 1.937 1.00 0.00 H new ATOM 432 N HIS A 28 12.950 -7.338 4.458 1.00 0.00 N ATOM 433 CA HIS A 28 14.135 -6.789 5.113 1.00 0.00 C ATOM 434 C HIS A 28 15.381 -7.364 4.497 1.00 0.00 C ATOM 435 O HIS A 28 15.620 -8.579 4.552 1.00 0.00 O ATOM 436 CB HIS A 28 14.155 -7.082 6.620 1.00 0.00 C ATOM 437 CG HIS A 28 13.055 -6.442 7.413 1.00 0.00 C ATOM 438 ND1 HIS A 28 12.524 -6.978 8.562 1.00 0.00 N ATOM 439 CD2 HIS A 28 12.437 -5.266 7.232 1.00 0.00 C ATOM 440 CE1 HIS A 28 11.617 -6.127 9.037 1.00 0.00 C ATOM 441 NE2 HIS A 28 11.523 -5.060 8.265 1.00 0.00 N ATOM 0 H HIS A 28 12.911 -8.357 4.455 1.00 0.00 H new ATOM 0 HA HIS A 28 14.100 -5.709 4.972 1.00 0.00 H new ATOM 0 HB2 HIS A 28 14.104 -8.161 6.764 1.00 0.00 H new ATOM 0 HB3 HIS A 28 15.112 -6.752 7.025 1.00 0.00 H new ATOM 0 HD2 HIS A 28 12.619 -4.585 6.414 1.00 0.00 H new ATOM 0 HE1 HIS A 28 11.036 -6.288 9.933 1.00 0.00 H new ATOM 0 HE2 HIS A 28 10.911 -4.255 8.396 1.00 0.00 H new ATOM 449 N LYS A 29 16.159 -6.525 3.908 1.00 0.00 N ATOM 450 CA LYS A 29 17.384 -6.924 3.308 1.00 0.00 C ATOM 451 C LYS A 29 18.541 -6.155 3.868 1.00 0.00 C ATOM 452 O LYS A 29 18.419 -5.001 4.171 1.00 0.00 O ATOM 453 CB LYS A 29 17.338 -6.728 1.814 1.00 0.00 C ATOM 454 CG LYS A 29 16.621 -7.814 1.055 1.00 0.00 C ATOM 455 CD LYS A 29 17.414 -8.151 -0.177 1.00 0.00 C ATOM 456 CE LYS A 29 17.459 -6.988 -1.143 1.00 0.00 C ATOM 457 NZ LYS A 29 18.460 -7.165 -2.192 1.00 0.00 N ATOM 0 H LYS A 29 15.960 -5.528 3.828 1.00 0.00 H new ATOM 0 HA LYS A 29 17.521 -7.982 3.531 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.853 -5.775 1.602 1.00 0.00 H new ATOM 0 HB3 LYS A 29 18.359 -6.656 1.440 1.00 0.00 H new ATOM 0 HG2 LYS A 29 16.504 -8.698 1.682 1.00 0.00 H new ATOM 0 HG3 LYS A 29 15.619 -7.484 0.780 1.00 0.00 H new ATOM 0 HD2 LYS A 29 18.429 -8.429 0.107 1.00 0.00 H new ATOM 0 HD3 LYS A 29 16.972 -9.017 -0.669 1.00 0.00 H new ATOM 0 HE2 LYS A 29 16.478 -6.863 -1.600 1.00 0.00 H new ATOM 0 HE3 LYS A 29 17.673 -6.072 -0.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 18.532 -6.293 -2.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 19.382 -7.376 -1.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 18.179 -7.953 -2.810 1.00 0.00 H new ATOM 471 N HIS A 30 19.627 -6.809 4.057 1.00 0.00 N ATOM 472 CA HIS A 30 20.846 -6.148 4.440 1.00 0.00 C ATOM 473 C HIS A 30 21.897 -6.473 3.401 1.00 0.00 C ATOM 474 O HIS A 30 22.139 -7.656 3.123 1.00 0.00 O ATOM 475 CB HIS A 30 21.295 -6.487 5.897 1.00 0.00 C ATOM 476 CG HIS A 30 21.625 -7.933 6.198 1.00 0.00 C ATOM 477 ND1 HIS A 30 20.721 -8.849 6.697 1.00 0.00 N ATOM 478 CD2 HIS A 30 22.806 -8.595 6.108 1.00 0.00 C ATOM 479 CE1 HIS A 30 21.362 -10.004 6.889 1.00 0.00 C ATOM 480 NE2 HIS A 30 22.633 -9.904 6.549 1.00 0.00 N ATOM 0 H HIS A 30 19.709 -7.820 3.954 1.00 0.00 H new ATOM 0 HA HIS A 30 20.683 -5.071 4.464 1.00 0.00 H new ATOM 0 HB2 HIS A 30 22.173 -5.884 6.129 1.00 0.00 H new ATOM 0 HB3 HIS A 30 20.503 -6.172 6.577 1.00 0.00 H new ATOM 0 HD2 HIS A 30 23.734 -8.173 5.751 1.00 0.00 H new ATOM 0 HE1 HIS A 30 20.901 -10.902 7.272 1.00 0.00 H new ATOM 0 HE2 HIS A 30 23.342 -10.635 6.599 1.00 0.00 H new ATOM 488 N GLU A 31 22.451 -5.471 2.766 1.00 0.00 N ATOM 489 CA GLU A 31 23.439 -5.730 1.741 1.00 0.00 C ATOM 490 C GLU A 31 24.563 -4.719 1.759 1.00 0.00 C ATOM 491 O GLU A 31 24.353 -3.558 2.082 1.00 0.00 O ATOM 492 CB GLU A 31 22.764 -5.787 0.371 1.00 0.00 C ATOM 493 CG GLU A 31 22.091 -4.510 -0.101 1.00 0.00 C ATOM 494 CD GLU A 31 21.274 -4.767 -1.337 1.00 0.00 C ATOM 495 OE1 GLU A 31 21.825 -4.760 -2.465 1.00 0.00 O ATOM 496 OE2 GLU A 31 20.074 -5.042 -1.215 1.00 0.00 O ATOM 0 H GLU A 31 22.243 -4.487 2.933 1.00 0.00 H new ATOM 0 HA GLU A 31 23.894 -6.698 1.951 1.00 0.00 H new ATOM 0 HB2 GLU A 31 23.513 -6.072 -0.368 1.00 0.00 H new ATOM 0 HB3 GLU A 31 22.017 -6.580 0.390 1.00 0.00 H new ATOM 0 HG2 GLU A 31 21.451 -4.117 0.689 1.00 0.00 H new ATOM 0 HG3 GLU A 31 22.845 -3.751 -0.308 1.00 0.00 H new ATOM 503 N LYS A 32 25.768 -5.170 1.455 1.00 0.00 N ATOM 504 CA LYS A 32 26.890 -4.287 1.379 1.00 0.00 C ATOM 505 C LYS A 32 27.111 -3.807 -0.015 1.00 0.00 C ATOM 506 O LYS A 32 27.263 -4.602 -0.951 1.00 0.00 O ATOM 507 CB LYS A 32 28.170 -4.891 1.892 1.00 0.00 C ATOM 508 CG LYS A 32 28.256 -5.049 3.393 1.00 0.00 C ATOM 509 CD LYS A 32 29.692 -5.317 3.850 1.00 0.00 C ATOM 510 CE LYS A 32 30.386 -6.407 3.036 1.00 0.00 C ATOM 511 NZ LYS A 32 29.738 -7.727 3.170 1.00 0.00 N ATOM 0 H LYS A 32 25.982 -6.148 1.258 1.00 0.00 H new ATOM 0 HA LYS A 32 26.633 -3.450 2.029 1.00 0.00 H new ATOM 0 HB2 LYS A 32 28.299 -5.871 1.432 1.00 0.00 H new ATOM 0 HB3 LYS A 32 29.003 -4.271 1.561 1.00 0.00 H new ATOM 0 HG2 LYS A 32 27.882 -4.146 3.876 1.00 0.00 H new ATOM 0 HG3 LYS A 32 27.613 -5.870 3.710 1.00 0.00 H new ATOM 0 HD2 LYS A 32 30.268 -4.395 3.777 1.00 0.00 H new ATOM 0 HD3 LYS A 32 29.685 -5.606 4.901 1.00 0.00 H new ATOM 0 HE2 LYS A 32 30.395 -6.118 1.985 1.00 0.00 H new ATOM 0 HE3 LYS A 32 31.426 -6.485 3.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 30.252 -8.426 2.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 29.752 -8.021 4.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 28.753 -7.665 2.841 1.00 0.00 H new ATOM 525 N VAL A 33 27.163 -2.528 -0.147 1.00 0.00 N ATOM 526 CA VAL A 33 27.362 -1.895 -1.421 1.00 0.00 C ATOM 527 C VAL A 33 28.655 -1.089 -1.345 1.00 0.00 C ATOM 528 O VAL A 33 28.895 -0.453 -0.353 1.00 0.00 O ATOM 529 CB VAL A 33 26.186 -0.952 -1.747 1.00 0.00 C ATOM 530 CG1 VAL A 33 26.262 -0.517 -3.143 1.00 0.00 C ATOM 531 CG2 VAL A 33 24.866 -1.596 -1.443 1.00 0.00 C ATOM 0 H VAL A 33 27.068 -1.876 0.632 1.00 0.00 H new ATOM 0 HA VAL A 33 27.420 -2.650 -2.205 1.00 0.00 H new ATOM 0 HB VAL A 33 26.264 -0.072 -1.109 1.00 0.00 H new ATOM 0 HG11 VAL A 33 25.427 0.148 -3.363 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.201 0.012 -3.309 1.00 0.00 H new ATOM 0 HG13 VAL A 33 26.215 -1.387 -3.798 1.00 0.00 H new ATOM 0 HG21 VAL A 33 24.059 -0.904 -1.684 1.00 0.00 H new ATOM 0 HG22 VAL A 33 24.757 -2.502 -2.039 1.00 0.00 H new ATOM 0 HG23 VAL A 33 24.821 -1.851 -0.384 1.00 0.00 H new ATOM 541 N PHE A 34 29.483 -1.123 -2.361 1.00 0.00 N ATOM 542 CA PHE A 34 30.770 -0.429 -2.300 1.00 0.00 C ATOM 543 C PHE A 34 30.648 1.058 -2.593 1.00 0.00 C ATOM 544 O PHE A 34 31.546 1.854 -2.276 1.00 0.00 O ATOM 545 CB PHE A 34 31.770 -1.086 -3.223 1.00 0.00 C ATOM 546 CG PHE A 34 32.069 -2.495 -2.838 1.00 0.00 C ATOM 547 CD1 PHE A 34 32.692 -2.770 -1.636 1.00 0.00 C ATOM 548 CD2 PHE A 34 31.744 -3.540 -3.677 1.00 0.00 C ATOM 549 CE1 PHE A 34 32.987 -4.065 -1.275 1.00 0.00 C ATOM 550 CE2 PHE A 34 32.032 -4.841 -3.322 1.00 0.00 C ATOM 551 CZ PHE A 34 32.656 -5.103 -2.118 1.00 0.00 C ATOM 0 H PHE A 34 29.302 -1.615 -3.236 1.00 0.00 H new ATOM 0 HA PHE A 34 31.131 -0.513 -1.275 1.00 0.00 H new ATOM 0 HB2 PHE A 34 31.385 -1.066 -4.243 1.00 0.00 H new ATOM 0 HB3 PHE A 34 32.695 -0.509 -3.220 1.00 0.00 H new ATOM 0 HD1 PHE A 34 32.951 -1.959 -0.971 1.00 0.00 H new ATOM 0 HD2 PHE A 34 31.259 -3.338 -4.621 1.00 0.00 H new ATOM 0 HE1 PHE A 34 33.476 -4.267 -0.334 1.00 0.00 H new ATOM 0 HE2 PHE A 34 31.770 -5.653 -3.984 1.00 0.00 H new ATOM 0 HZ PHE A 34 32.884 -6.121 -1.838 1.00 0.00 H new ATOM 561 N SER A 35 29.573 1.417 -3.211 1.00 0.00 N ATOM 562 CA SER A 35 29.259 2.787 -3.488 1.00 0.00 C ATOM 563 C SER A 35 27.770 2.889 -3.417 1.00 0.00 C ATOM 564 O SER A 35 27.098 2.127 -4.092 1.00 0.00 O ATOM 565 CB SER A 35 29.714 3.146 -4.903 1.00 0.00 C ATOM 566 OG SER A 35 29.610 4.537 -5.152 1.00 0.00 O ATOM 0 H SER A 35 28.871 0.757 -3.546 1.00 0.00 H new ATOM 0 HA SER A 35 29.752 3.458 -2.785 1.00 0.00 H new ATOM 0 HB2 SER A 35 30.747 2.828 -5.044 1.00 0.00 H new ATOM 0 HB3 SER A 35 29.110 2.601 -5.628 1.00 0.00 H new ATOM 0 HG SER A 35 29.911 4.729 -6.065 1.00 0.00 H new ATOM 572 N MET A 36 27.229 3.818 -2.646 1.00 0.00 N ATOM 573 CA MET A 36 25.774 3.929 -2.522 1.00 0.00 C ATOM 574 C MET A 36 25.119 4.233 -3.830 1.00 0.00 C ATOM 575 O MET A 36 23.978 3.911 -4.035 1.00 0.00 O ATOM 576 CB MET A 36 25.358 4.922 -1.471 1.00 0.00 C ATOM 577 CG MET A 36 25.543 4.410 -0.073 1.00 0.00 C ATOM 578 SD MET A 36 24.090 4.690 0.944 1.00 0.00 S ATOM 579 CE MET A 36 22.887 3.777 -0.017 1.00 0.00 C ATOM 0 H MET A 36 27.760 4.499 -2.102 1.00 0.00 H new ATOM 0 HA MET A 36 25.427 2.948 -2.196 1.00 0.00 H new ATOM 0 HB2 MET A 36 25.936 5.838 -1.596 1.00 0.00 H new ATOM 0 HB3 MET A 36 24.310 5.183 -1.620 1.00 0.00 H new ATOM 0 HG2 MET A 36 25.764 3.343 -0.104 1.00 0.00 H new ATOM 0 HG3 MET A 36 26.404 4.900 0.382 1.00 0.00 H new ATOM 0 HE1 MET A 36 21.912 3.839 0.467 1.00 0.00 H new ATOM 0 HE2 MET A 36 22.823 4.202 -1.018 1.00 0.00 H new ATOM 0 HE3 MET A 36 23.193 2.733 -0.085 1.00 0.00 H new ATOM 589 N ASP A 37 25.886 4.781 -4.718 1.00 0.00 N ATOM 590 CA ASP A 37 25.454 5.098 -6.089 1.00 0.00 C ATOM 591 C ASP A 37 24.982 3.834 -6.792 1.00 0.00 C ATOM 592 O ASP A 37 23.985 3.841 -7.504 1.00 0.00 O ATOM 593 CB ASP A 37 26.602 5.724 -6.883 1.00 0.00 C ATOM 594 CG ASP A 37 26.219 6.067 -8.307 1.00 0.00 C ATOM 595 OD1 ASP A 37 25.607 7.127 -8.530 1.00 0.00 O ATOM 596 OD2 ASP A 37 26.577 5.310 -9.240 1.00 0.00 O ATOM 0 H ASP A 37 26.856 5.036 -4.530 1.00 0.00 H new ATOM 0 HA ASP A 37 24.632 5.812 -6.033 1.00 0.00 H new ATOM 0 HB2 ASP A 37 26.937 6.628 -6.375 1.00 0.00 H new ATOM 0 HB3 ASP A 37 27.446 5.034 -6.896 1.00 0.00 H new ATOM 601 N ASP A 38 25.669 2.731 -6.510 1.00 0.00 N ATOM 602 CA ASP A 38 25.332 1.433 -7.087 1.00 0.00 C ATOM 603 C ASP A 38 24.036 0.972 -6.513 1.00 0.00 C ATOM 604 O ASP A 38 23.180 0.451 -7.221 1.00 0.00 O ATOM 605 CB ASP A 38 26.389 0.384 -6.765 1.00 0.00 C ATOM 606 CG ASP A 38 26.019 -0.993 -7.306 1.00 0.00 C ATOM 607 OD1 ASP A 38 26.183 -1.235 -8.521 1.00 0.00 O ATOM 608 OD2 ASP A 38 25.561 -1.862 -6.530 1.00 0.00 O ATOM 0 H ASP A 38 26.470 2.711 -5.879 1.00 0.00 H new ATOM 0 HA ASP A 38 25.272 1.552 -8.169 1.00 0.00 H new ATOM 0 HB2 ASP A 38 27.345 0.693 -7.187 1.00 0.00 H new ATOM 0 HB3 ASP A 38 26.522 0.324 -5.685 1.00 0.00 H new ATOM 613 N PHE A 39 23.890 1.203 -5.223 1.00 0.00 N ATOM 614 CA PHE A 39 22.717 0.847 -4.513 1.00 0.00 C ATOM 615 C PHE A 39 21.517 1.619 -5.091 1.00 0.00 C ATOM 616 O PHE A 39 20.466 1.047 -5.379 1.00 0.00 O ATOM 617 CB PHE A 39 22.883 1.194 -3.040 1.00 0.00 C ATOM 618 CG PHE A 39 21.689 0.824 -2.220 1.00 0.00 C ATOM 619 CD1 PHE A 39 21.552 -0.452 -1.695 1.00 0.00 C ATOM 620 CD2 PHE A 39 20.704 1.742 -1.986 1.00 0.00 C ATOM 621 CE1 PHE A 39 20.451 -0.794 -0.952 1.00 0.00 C ATOM 622 CE2 PHE A 39 19.603 1.412 -1.247 1.00 0.00 C ATOM 623 CZ PHE A 39 19.470 0.147 -0.729 1.00 0.00 C ATOM 0 H PHE A 39 24.603 1.650 -4.647 1.00 0.00 H new ATOM 0 HA PHE A 39 22.545 -0.225 -4.612 1.00 0.00 H new ATOM 0 HB2 PHE A 39 23.761 0.681 -2.647 1.00 0.00 H new ATOM 0 HB3 PHE A 39 23.068 2.264 -2.942 1.00 0.00 H new ATOM 0 HD1 PHE A 39 22.323 -1.187 -1.874 1.00 0.00 H new ATOM 0 HD2 PHE A 39 20.797 2.739 -2.390 1.00 0.00 H new ATOM 0 HE1 PHE A 39 20.354 -1.790 -0.546 1.00 0.00 H new ATOM 0 HE2 PHE A 39 18.834 2.149 -1.069 1.00 0.00 H new ATOM 0 HZ PHE A 39 18.597 -0.110 -0.147 1.00 0.00 H new ATOM 633 N TRP A 40 21.711 2.927 -5.276 1.00 0.00 N ATOM 634 CA TRP A 40 20.684 3.814 -5.801 1.00 0.00 C ATOM 635 C TRP A 40 20.321 3.417 -7.212 1.00 0.00 C ATOM 636 O TRP A 40 19.176 3.467 -7.599 1.00 0.00 O ATOM 637 CB TRP A 40 21.123 5.302 -5.774 1.00 0.00 C ATOM 638 CG TRP A 40 21.494 5.840 -4.414 1.00 0.00 C ATOM 639 CD1 TRP A 40 22.616 6.555 -4.094 1.00 0.00 C ATOM 640 CD2 TRP A 40 20.759 5.702 -3.194 1.00 0.00 C ATOM 641 NE1 TRP A 40 22.637 6.833 -2.753 1.00 0.00 N ATOM 642 CE2 TRP A 40 21.506 6.335 -2.183 1.00 0.00 C ATOM 643 CE3 TRP A 40 19.545 5.105 -2.853 1.00 0.00 C ATOM 644 CZ2 TRP A 40 21.081 6.377 -0.869 1.00 0.00 C ATOM 645 CZ3 TRP A 40 19.130 5.152 -1.551 1.00 0.00 C ATOM 646 CH2 TRP A 40 19.891 5.778 -0.576 1.00 0.00 C ATOM 0 H TRP A 40 22.591 3.397 -5.063 1.00 0.00 H new ATOM 0 HA TRP A 40 19.813 3.713 -5.154 1.00 0.00 H new ATOM 0 HB2 TRP A 40 21.977 5.424 -6.440 1.00 0.00 H new ATOM 0 HB3 TRP A 40 20.314 5.910 -6.179 1.00 0.00 H new ATOM 0 HD1 TRP A 40 23.377 6.857 -4.799 1.00 0.00 H new ATOM 0 HE1 TRP A 40 23.379 7.332 -2.262 1.00 0.00 H new ATOM 0 HE3 TRP A 40 18.944 4.614 -3.604 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 21.668 6.865 -0.104 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 18.192 4.693 -1.277 1.00 0.00 H new ATOM 0 HH2 TRP A 40 19.532 5.792 0.443 1.00 0.00 H new ATOM 657 N ALA A 41 21.298 3.013 -7.966 1.00 0.00 N ATOM 658 CA ALA A 41 21.077 2.591 -9.343 1.00 0.00 C ATOM 659 C ALA A 41 20.368 1.245 -9.385 1.00 0.00 C ATOM 660 O ALA A 41 19.603 0.954 -10.309 1.00 0.00 O ATOM 661 CB ALA A 41 22.389 2.538 -10.107 1.00 0.00 C ATOM 0 H ALA A 41 22.270 2.961 -7.660 1.00 0.00 H new ATOM 0 HA ALA A 41 20.435 3.327 -9.827 1.00 0.00 H new ATOM 0 HB1 ALA A 41 22.200 2.221 -11.133 1.00 0.00 H new ATOM 0 HB2 ALA A 41 22.848 3.527 -10.112 1.00 0.00 H new ATOM 0 HB3 ALA A 41 23.062 1.828 -9.626 1.00 0.00 H new ATOM 667 N ALA A 42 20.613 0.440 -8.376 1.00 0.00 N ATOM 668 CA ALA A 42 20.004 -0.861 -8.261 1.00 0.00 C ATOM 669 C ALA A 42 18.515 -0.751 -7.927 1.00 0.00 C ATOM 670 O ALA A 42 17.700 -1.521 -8.427 1.00 0.00 O ATOM 671 CB ALA A 42 20.727 -1.680 -7.205 1.00 0.00 C ATOM 0 H ALA A 42 21.244 0.673 -7.609 1.00 0.00 H new ATOM 0 HA ALA A 42 20.090 -1.364 -9.224 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.261 -2.662 -7.124 1.00 0.00 H new ATOM 0 HB2 ALA A 42 21.773 -1.797 -7.488 1.00 0.00 H new ATOM 0 HB3 ALA A 42 20.667 -1.169 -6.244 1.00 0.00 H new ATOM 677 N TYR A 43 18.159 0.207 -7.088 1.00 0.00 N ATOM 678 CA TYR A 43 16.774 0.365 -6.676 1.00 0.00 C ATOM 679 C TYR A 43 16.171 1.652 -7.203 1.00 0.00 C ATOM 680 O TYR A 43 15.161 2.108 -6.695 1.00 0.00 O ATOM 681 CB TYR A 43 16.670 0.312 -5.152 1.00 0.00 C ATOM 682 CG TYR A 43 17.147 -0.999 -4.578 1.00 0.00 C ATOM 683 CD1 TYR A 43 16.284 -2.069 -4.461 1.00 0.00 C ATOM 684 CD2 TYR A 43 18.463 -1.178 -4.191 1.00 0.00 C ATOM 685 CE1 TYR A 43 16.712 -3.280 -3.983 1.00 0.00 C ATOM 686 CE2 TYR A 43 18.900 -2.384 -3.703 1.00 0.00 C ATOM 687 CZ TYR A 43 18.019 -3.432 -3.606 1.00 0.00 C ATOM 688 OH TYR A 43 18.451 -4.645 -3.157 1.00 0.00 O ATOM 0 H TYR A 43 18.805 0.883 -6.681 1.00 0.00 H new ATOM 0 HA TYR A 43 16.205 -0.460 -7.104 1.00 0.00 H new ATOM 0 HB2 TYR A 43 17.256 1.125 -4.724 1.00 0.00 H new ATOM 0 HB3 TYR A 43 15.634 0.477 -4.857 1.00 0.00 H new ATOM 0 HD1 TYR A 43 15.251 -1.950 -4.752 1.00 0.00 H new ATOM 0 HD2 TYR A 43 19.158 -0.355 -4.274 1.00 0.00 H new ATOM 0 HE1 TYR A 43 16.023 -4.108 -3.904 1.00 0.00 H new ATOM 0 HE2 TYR A 43 19.929 -2.507 -3.398 1.00 0.00 H new ATOM 0 HH TYR A 43 18.762 -4.559 -2.232 1.00 0.00 H new ATOM 698 N ALA A 44 16.788 2.217 -8.231 1.00 0.00 N ATOM 699 CA ALA A 44 16.305 3.439 -8.888 1.00 0.00 C ATOM 700 C ALA A 44 14.820 3.372 -9.275 1.00 0.00 C ATOM 701 O ALA A 44 14.112 4.377 -9.198 1.00 0.00 O ATOM 702 CB ALA A 44 17.147 3.756 -10.114 1.00 0.00 C ATOM 0 H ALA A 44 17.644 1.843 -8.641 1.00 0.00 H new ATOM 0 HA ALA A 44 16.406 4.239 -8.155 1.00 0.00 H new ATOM 0 HB1 ALA A 44 16.774 4.664 -10.587 1.00 0.00 H new ATOM 0 HB2 ALA A 44 18.185 3.903 -9.815 1.00 0.00 H new ATOM 0 HB3 ALA A 44 17.087 2.928 -10.821 1.00 0.00 H new ATOM 708 N GLY A 45 14.361 2.200 -9.696 1.00 0.00 N ATOM 709 CA GLY A 45 12.965 2.042 -10.064 1.00 0.00 C ATOM 710 C GLY A 45 12.025 2.140 -8.864 1.00 0.00 C ATOM 711 O GLY A 45 10.926 2.685 -8.975 1.00 0.00 O ATOM 0 H GLY A 45 14.928 1.357 -9.789 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.697 2.806 -10.794 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.828 1.076 -10.549 1.00 0.00 H new ATOM 715 N TRP A 46 12.456 1.588 -7.736 1.00 0.00 N ATOM 716 CA TRP A 46 11.727 1.608 -6.475 1.00 0.00 C ATOM 717 C TRP A 46 11.521 3.064 -6.000 1.00 0.00 C ATOM 718 O TRP A 46 12.265 3.973 -6.387 1.00 0.00 O ATOM 719 CB TRP A 46 12.552 0.871 -5.407 1.00 0.00 C ATOM 720 CG TRP A 46 12.894 -0.554 -5.708 1.00 0.00 C ATOM 721 CD1 TRP A 46 13.683 -1.023 -6.716 1.00 0.00 C ATOM 722 CD2 TRP A 46 12.498 -1.688 -4.958 1.00 0.00 C ATOM 723 NE1 TRP A 46 13.749 -2.380 -6.671 1.00 0.00 N ATOM 724 CE2 TRP A 46 13.040 -2.819 -5.597 1.00 0.00 C ATOM 725 CE3 TRP A 46 11.727 -1.862 -3.819 1.00 0.00 C ATOM 726 CZ2 TRP A 46 12.825 -4.100 -5.135 1.00 0.00 C ATOM 727 CZ3 TRP A 46 11.515 -3.134 -3.363 1.00 0.00 C ATOM 728 CH2 TRP A 46 12.064 -4.238 -4.021 1.00 0.00 C ATOM 0 H TRP A 46 13.349 1.100 -7.672 1.00 0.00 H new ATOM 0 HA TRP A 46 10.760 1.127 -6.621 1.00 0.00 H new ATOM 0 HB2 TRP A 46 13.480 1.421 -5.250 1.00 0.00 H new ATOM 0 HB3 TRP A 46 12.001 0.901 -4.467 1.00 0.00 H new ATOM 0 HD1 TRP A 46 14.184 -0.405 -7.446 1.00 0.00 H new ATOM 0 HE1 TRP A 46 14.249 -2.972 -7.334 1.00 0.00 H new ATOM 0 HE3 TRP A 46 11.303 -1.013 -3.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 13.245 -4.958 -5.639 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 10.913 -3.288 -2.480 1.00 0.00 H new ATOM 0 HH2 TRP A 46 11.877 -5.228 -3.632 1.00 0.00 H new ATOM 739 N THR A 47 10.539 3.274 -5.167 1.00 0.00 N ATOM 740 CA THR A 47 10.261 4.558 -4.630 1.00 0.00 C ATOM 741 C THR A 47 11.022 4.718 -3.308 1.00 0.00 C ATOM 742 O THR A 47 10.847 3.907 -2.384 1.00 0.00 O ATOM 743 CB THR A 47 8.756 4.662 -4.382 1.00 0.00 C ATOM 744 OG1 THR A 47 8.050 4.373 -5.606 1.00 0.00 O ATOM 745 CG2 THR A 47 8.373 6.033 -3.879 1.00 0.00 C ATOM 0 H THR A 47 9.907 2.542 -4.844 1.00 0.00 H new ATOM 0 HA THR A 47 10.574 5.341 -5.321 1.00 0.00 H new ATOM 0 HB THR A 47 8.483 3.938 -3.615 1.00 0.00 H new ATOM 0 HG1 THR A 47 7.085 4.437 -5.450 1.00 0.00 H new ATOM 0 HG21 THR A 47 7.296 6.072 -3.713 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.892 6.235 -2.942 1.00 0.00 H new ATOM 0 HG23 THR A 47 8.654 6.783 -4.618 1.00 0.00 H new ATOM 753 N LEU A 48 11.898 5.710 -3.247 1.00 0.00 N ATOM 754 CA LEU A 48 12.673 5.991 -2.051 1.00 0.00 C ATOM 755 C LEU A 48 11.764 6.663 -1.043 1.00 0.00 C ATOM 756 O LEU A 48 11.361 7.814 -1.222 1.00 0.00 O ATOM 757 CB LEU A 48 13.915 6.862 -2.421 1.00 0.00 C ATOM 758 CG LEU A 48 15.008 7.150 -1.338 1.00 0.00 C ATOM 759 CD1 LEU A 48 14.613 8.234 -0.354 1.00 0.00 C ATOM 760 CD2 LEU A 48 15.374 5.891 -0.577 1.00 0.00 C ATOM 0 H LEU A 48 12.090 6.341 -4.025 1.00 0.00 H new ATOM 0 HA LEU A 48 13.057 5.074 -1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 48 14.411 6.382 -3.265 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.545 7.824 -2.775 1.00 0.00 H new ATOM 0 HG LEU A 48 15.874 7.512 -1.892 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.417 8.381 0.367 1.00 0.00 H new ATOM 0 HD12 LEU A 48 14.433 9.165 -0.891 1.00 0.00 H new ATOM 0 HD13 LEU A 48 13.705 7.936 0.170 1.00 0.00 H new ATOM 0 HD21 LEU A 48 16.135 6.124 0.168 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.488 5.496 -0.079 1.00 0.00 H new ATOM 0 HD23 LEU A 48 15.762 5.146 -1.272 1.00 0.00 H new ATOM 772 N VAL A 49 11.425 5.933 -0.012 1.00 0.00 N ATOM 773 CA VAL A 49 10.505 6.409 0.986 1.00 0.00 C ATOM 774 C VAL A 49 11.258 7.245 1.991 1.00 0.00 C ATOM 775 O VAL A 49 10.926 8.411 2.220 1.00 0.00 O ATOM 776 CB VAL A 49 9.790 5.229 1.688 1.00 0.00 C ATOM 777 CG1 VAL A 49 8.750 5.715 2.684 1.00 0.00 C ATOM 778 CG2 VAL A 49 9.157 4.331 0.659 1.00 0.00 C ATOM 0 H VAL A 49 11.779 4.992 0.159 1.00 0.00 H new ATOM 0 HA VAL A 49 9.740 7.018 0.505 1.00 0.00 H new ATOM 0 HB VAL A 49 10.537 4.665 2.247 1.00 0.00 H new ATOM 0 HG11 VAL A 49 8.270 4.858 3.156 1.00 0.00 H new ATOM 0 HG12 VAL A 49 9.234 6.325 3.447 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.999 6.311 2.165 1.00 0.00 H new ATOM 0 HG21 VAL A 49 8.655 3.502 1.159 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.430 4.899 0.079 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.927 3.941 -0.006 1.00 0.00 H new ATOM 788 N GLU A 50 12.292 6.664 2.549 1.00 0.00 N ATOM 789 CA GLU A 50 13.136 7.343 3.495 1.00 0.00 C ATOM 790 C GLU A 50 14.470 6.657 3.526 1.00 0.00 C ATOM 791 O GLU A 50 14.577 5.491 3.168 1.00 0.00 O ATOM 792 CB GLU A 50 12.523 7.353 4.913 1.00 0.00 C ATOM 793 CG GLU A 50 12.272 5.991 5.498 1.00 0.00 C ATOM 794 CD GLU A 50 11.749 6.054 6.911 1.00 0.00 C ATOM 795 OE1 GLU A 50 10.524 6.124 7.107 1.00 0.00 O ATOM 796 OE2 GLU A 50 12.559 6.034 7.853 1.00 0.00 O ATOM 0 H GLU A 50 12.571 5.702 2.357 1.00 0.00 H new ATOM 0 HA GLU A 50 13.242 8.381 3.179 1.00 0.00 H new ATOM 0 HB2 GLU A 50 13.189 7.902 5.578 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.581 7.900 4.883 1.00 0.00 H new ATOM 0 HG2 GLU A 50 11.556 5.458 4.873 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.198 5.417 5.483 1.00 0.00 H new ATOM 803 N GLN A 51 15.471 7.376 3.879 1.00 0.00 N ATOM 804 CA GLN A 51 16.765 6.826 4.072 1.00 0.00 C ATOM 805 C GLN A 51 17.432 7.473 5.247 1.00 0.00 C ATOM 806 O GLN A 51 17.169 8.638 5.572 1.00 0.00 O ATOM 807 CB GLN A 51 17.633 6.977 2.837 1.00 0.00 C ATOM 808 CG GLN A 51 17.841 8.403 2.364 1.00 0.00 C ATOM 809 CD GLN A 51 18.843 8.453 1.256 1.00 0.00 C ATOM 810 OE1 GLN A 51 20.039 8.637 1.485 1.00 0.00 O ATOM 811 NE2 GLN A 51 18.378 8.223 0.061 1.00 0.00 N ATOM 0 H GLN A 51 15.415 8.381 4.045 1.00 0.00 H new ATOM 0 HA GLN A 51 16.642 5.760 4.264 1.00 0.00 H new ATOM 0 HB2 GLN A 51 18.607 6.533 3.041 1.00 0.00 H new ATOM 0 HB3 GLN A 51 17.185 6.404 2.025 1.00 0.00 H new ATOM 0 HG2 GLN A 51 16.893 8.820 2.023 1.00 0.00 H new ATOM 0 HG3 GLN A 51 18.180 9.021 3.195 1.00 0.00 H new ATOM 0 HE21 GLN A 51 17.378 8.077 -0.078 1.00 0.00 H new ATOM 0 HE22 GLN A 51 19.014 8.189 -0.736 1.00 0.00 H new ATOM 820 N LYS A 52 18.210 6.706 5.904 1.00 0.00 N ATOM 821 CA LYS A 52 19.053 7.133 6.978 1.00 0.00 C ATOM 822 C LYS A 52 20.338 6.357 6.804 1.00 0.00 C ATOM 823 O LYS A 52 20.310 5.291 6.191 1.00 0.00 O ATOM 824 CB LYS A 52 18.344 6.882 8.328 1.00 0.00 C ATOM 825 CG LYS A 52 17.693 5.508 8.433 1.00 0.00 C ATOM 826 CD LYS A 52 16.798 5.351 9.649 1.00 0.00 C ATOM 827 CE LYS A 52 15.576 6.216 9.511 1.00 0.00 C ATOM 828 NZ LYS A 52 14.614 6.029 10.616 1.00 0.00 N ATOM 0 H LYS A 52 18.290 5.708 5.707 1.00 0.00 H new ATOM 0 HA LYS A 52 19.270 8.201 6.970 1.00 0.00 H new ATOM 0 HB2 LYS A 52 19.068 6.993 9.135 1.00 0.00 H new ATOM 0 HB3 LYS A 52 17.582 7.647 8.476 1.00 0.00 H new ATOM 0 HG2 LYS A 52 17.105 5.324 7.534 1.00 0.00 H new ATOM 0 HG3 LYS A 52 18.473 4.747 8.466 1.00 0.00 H new ATOM 0 HD2 LYS A 52 16.503 4.308 9.760 1.00 0.00 H new ATOM 0 HD3 LYS A 52 17.346 5.625 10.551 1.00 0.00 H new ATOM 0 HE2 LYS A 52 15.880 7.262 9.473 1.00 0.00 H new ATOM 0 HE3 LYS A 52 15.083 5.992 8.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 13.792 6.649 10.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 14.300 5.038 10.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 15.072 6.268 11.519 1.00 0.00 H new ATOM 842 N LYS A 53 21.450 6.857 7.256 1.00 0.00 N ATOM 843 CA LYS A 53 22.697 6.186 6.979 1.00 0.00 C ATOM 844 C LYS A 53 22.805 4.863 7.716 1.00 0.00 C ATOM 845 O LYS A 53 23.019 4.810 8.928 1.00 0.00 O ATOM 846 CB LYS A 53 23.911 7.085 7.217 1.00 0.00 C ATOM 847 CG LYS A 53 25.252 6.471 6.771 1.00 0.00 C ATOM 848 CD LYS A 53 25.248 6.032 5.300 1.00 0.00 C ATOM 849 CE LYS A 53 25.010 7.197 4.342 1.00 0.00 C ATOM 850 NZ LYS A 53 26.117 8.172 4.337 1.00 0.00 N ATOM 0 H LYS A 53 21.526 7.711 7.809 1.00 0.00 H new ATOM 0 HA LYS A 53 22.696 5.954 5.914 1.00 0.00 H new ATOM 0 HB2 LYS A 53 23.761 8.026 6.687 1.00 0.00 H new ATOM 0 HB3 LYS A 53 23.969 7.323 8.279 1.00 0.00 H new ATOM 0 HG2 LYS A 53 26.048 7.199 6.926 1.00 0.00 H new ATOM 0 HG3 LYS A 53 25.480 5.611 7.401 1.00 0.00 H new ATOM 0 HD2 LYS A 53 26.201 5.560 5.063 1.00 0.00 H new ATOM 0 HD3 LYS A 53 24.474 5.279 5.151 1.00 0.00 H new ATOM 0 HE2 LYS A 53 24.870 6.808 3.333 1.00 0.00 H new ATOM 0 HE3 LYS A 53 24.086 7.705 4.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 25.908 8.931 3.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 26.225 8.579 5.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 26.999 7.694 4.063 1.00 0.00 H new ATOM 864 N GLY A 54 22.581 3.811 6.971 1.00 0.00 N ATOM 865 CA GLY A 54 22.654 2.489 7.486 1.00 0.00 C ATOM 866 C GLY A 54 21.421 1.710 7.130 1.00 0.00 C ATOM 867 O GLY A 54 21.467 0.491 6.992 1.00 0.00 O ATOM 0 H GLY A 54 22.341 3.860 5.981 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.535 1.986 7.087 1.00 0.00 H new ATOM 0 HA3 GLY A 54 22.769 2.522 8.569 1.00 0.00 H new ATOM 871 N TYR A 55 20.320 2.409 6.950 1.00 0.00 N ATOM 872 CA TYR A 55 19.073 1.802 6.655 1.00 0.00 C ATOM 873 C TYR A 55 18.312 2.637 5.615 1.00 0.00 C ATOM 874 O TYR A 55 18.122 3.836 5.772 1.00 0.00 O ATOM 875 CB TYR A 55 18.290 1.649 7.976 1.00 0.00 C ATOM 876 CG TYR A 55 16.814 1.400 7.832 1.00 0.00 C ATOM 877 CD1 TYR A 55 15.978 2.465 7.652 1.00 0.00 C ATOM 878 CD2 TYR A 55 16.268 0.132 7.886 1.00 0.00 C ATOM 879 CE1 TYR A 55 14.632 2.313 7.519 1.00 0.00 C ATOM 880 CE2 TYR A 55 14.907 -0.053 7.753 1.00 0.00 C ATOM 881 CZ TYR A 55 14.089 1.044 7.569 1.00 0.00 C ATOM 882 OH TYR A 55 12.728 0.871 7.436 1.00 0.00 O ATOM 0 H TYR A 55 20.283 3.427 7.009 1.00 0.00 H new ATOM 0 HA TYR A 55 19.213 0.814 6.217 1.00 0.00 H new ATOM 0 HB2 TYR A 55 18.725 0.826 8.542 1.00 0.00 H new ATOM 0 HB3 TYR A 55 18.432 2.553 8.568 1.00 0.00 H new ATOM 0 HD1 TYR A 55 16.398 3.459 7.614 1.00 0.00 H new ATOM 0 HD2 TYR A 55 16.912 -0.722 8.034 1.00 0.00 H new ATOM 0 HE1 TYR A 55 13.996 3.174 7.376 1.00 0.00 H new ATOM 0 HE2 TYR A 55 14.486 -1.047 7.792 1.00 0.00 H new ATOM 0 HH TYR A 55 12.512 -0.083 7.493 1.00 0.00 H new ATOM 892 N VAL A 56 17.860 2.003 4.590 1.00 0.00 N ATOM 893 CA VAL A 56 17.133 2.669 3.542 1.00 0.00 C ATOM 894 C VAL A 56 15.788 1.981 3.362 1.00 0.00 C ATOM 895 O VAL A 56 15.689 0.769 3.483 1.00 0.00 O ATOM 896 CB VAL A 56 17.935 2.693 2.195 1.00 0.00 C ATOM 897 CG1 VAL A 56 17.106 3.292 1.083 1.00 0.00 C ATOM 898 CG2 VAL A 56 19.219 3.499 2.341 1.00 0.00 C ATOM 0 H VAL A 56 17.980 1.001 4.445 1.00 0.00 H new ATOM 0 HA VAL A 56 16.980 3.709 3.830 1.00 0.00 H new ATOM 0 HB VAL A 56 18.181 1.661 1.947 1.00 0.00 H new ATOM 0 HG11 VAL A 56 17.685 3.297 0.160 1.00 0.00 H new ATOM 0 HG12 VAL A 56 16.203 2.698 0.942 1.00 0.00 H new ATOM 0 HG13 VAL A 56 16.831 4.314 1.344 1.00 0.00 H new ATOM 0 HG21 VAL A 56 19.757 3.501 1.393 1.00 0.00 H new ATOM 0 HG22 VAL A 56 18.975 4.524 2.622 1.00 0.00 H new ATOM 0 HG23 VAL A 56 19.844 3.050 3.113 1.00 0.00 H new ATOM 908 N LEU A 57 14.769 2.746 3.130 1.00 0.00 N ATOM 909 CA LEU A 57 13.461 2.227 2.932 1.00 0.00 C ATOM 910 C LEU A 57 12.970 2.545 1.519 1.00 0.00 C ATOM 911 O LEU A 57 12.764 3.720 1.154 1.00 0.00 O ATOM 912 CB LEU A 57 12.529 2.745 4.055 1.00 0.00 C ATOM 913 CG LEU A 57 11.014 2.599 3.880 1.00 0.00 C ATOM 914 CD1 LEU A 57 10.613 1.262 3.427 1.00 0.00 C ATOM 915 CD2 LEU A 57 10.269 3.001 5.136 1.00 0.00 C ATOM 0 H LEU A 57 14.827 3.763 3.073 1.00 0.00 H new ATOM 0 HA LEU A 57 13.464 1.139 3.003 1.00 0.00 H new ATOM 0 HB2 LEU A 57 12.806 2.233 4.977 1.00 0.00 H new ATOM 0 HB3 LEU A 57 12.744 3.803 4.201 1.00 0.00 H new ATOM 0 HG LEU A 57 10.733 3.289 3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 57 9.529 1.223 3.322 1.00 0.00 H new ATOM 0 HD12 LEU A 57 11.078 1.049 2.465 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.934 0.519 4.157 1.00 0.00 H new ATOM 0 HD21 LEU A 57 9.197 2.885 4.976 1.00 0.00 H new ATOM 0 HD22 LEU A 57 10.583 2.366 5.964 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.490 4.042 5.373 1.00 0.00 H new ATOM 927 N PHE A 58 12.831 1.492 0.735 1.00 0.00 N ATOM 928 CA PHE A 58 12.352 1.547 -0.637 1.00 0.00 C ATOM 929 C PHE A 58 11.069 0.761 -0.775 1.00 0.00 C ATOM 930 O PHE A 58 10.874 -0.255 -0.112 1.00 0.00 O ATOM 931 CB PHE A 58 13.378 0.953 -1.618 1.00 0.00 C ATOM 932 CG PHE A 58 14.335 1.931 -2.238 1.00 0.00 C ATOM 933 CD1 PHE A 58 13.903 2.767 -3.241 1.00 0.00 C ATOM 934 CD2 PHE A 58 15.653 1.993 -1.855 1.00 0.00 C ATOM 935 CE1 PHE A 58 14.754 3.653 -3.850 1.00 0.00 C ATOM 936 CE2 PHE A 58 16.517 2.884 -2.469 1.00 0.00 C ATOM 937 CZ PHE A 58 16.063 3.713 -3.465 1.00 0.00 C ATOM 0 H PHE A 58 13.055 0.546 1.043 1.00 0.00 H new ATOM 0 HA PHE A 58 12.188 2.598 -0.876 1.00 0.00 H new ATOM 0 HB2 PHE A 58 13.956 0.192 -1.093 1.00 0.00 H new ATOM 0 HB3 PHE A 58 12.837 0.447 -2.418 1.00 0.00 H new ATOM 0 HD1 PHE A 58 12.871 2.725 -3.556 1.00 0.00 H new ATOM 0 HD2 PHE A 58 16.017 1.344 -1.072 1.00 0.00 H new ATOM 0 HE1 PHE A 58 14.390 4.302 -4.633 1.00 0.00 H new ATOM 0 HE2 PHE A 58 17.552 2.927 -2.163 1.00 0.00 H new ATOM 0 HZ PHE A 58 16.738 4.409 -3.942 1.00 0.00 H new ATOM 947 N ARG A 59 10.196 1.219 -1.614 1.00 0.00 N ATOM 948 CA ARG A 59 9.000 0.485 -1.881 1.00 0.00 C ATOM 949 C ARG A 59 8.855 0.243 -3.345 1.00 0.00 C ATOM 950 O ARG A 59 9.170 1.107 -4.167 1.00 0.00 O ATOM 951 CB ARG A 59 7.748 1.165 -1.327 1.00 0.00 C ATOM 952 CG ARG A 59 7.480 2.538 -1.865 1.00 0.00 C ATOM 953 CD ARG A 59 6.210 3.104 -1.287 1.00 0.00 C ATOM 954 NE ARG A 59 6.199 3.051 0.181 1.00 0.00 N ATOM 955 CZ ARG A 59 5.338 3.673 0.982 1.00 0.00 C ATOM 956 NH1 ARG A 59 4.462 4.546 0.503 1.00 0.00 N ATOM 957 NH2 ARG A 59 5.400 3.439 2.277 1.00 0.00 N ATOM 0 H ARG A 59 10.288 2.097 -2.126 1.00 0.00 H new ATOM 0 HA ARG A 59 9.095 -0.469 -1.363 1.00 0.00 H new ATOM 0 HB2 ARG A 59 6.886 0.533 -1.540 1.00 0.00 H new ATOM 0 HB3 ARG A 59 7.837 1.227 -0.242 1.00 0.00 H new ATOM 0 HG2 ARG A 59 8.317 3.195 -1.628 1.00 0.00 H new ATOM 0 HG3 ARG A 59 7.404 2.498 -2.952 1.00 0.00 H new ATOM 0 HD2 ARG A 59 6.093 4.138 -1.613 1.00 0.00 H new ATOM 0 HD3 ARG A 59 5.356 2.549 -1.676 1.00 0.00 H new ATOM 0 HE ARG A 59 6.919 2.484 0.628 1.00 0.00 H new ATOM 0 HH11 ARG A 59 4.440 4.751 -0.496 1.00 0.00 H new ATOM 0 HH12 ARG A 59 3.810 5.013 1.134 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.098 2.793 2.646 1.00 0.00 H new ATOM 0 HH22 ARG A 59 4.750 3.904 2.911 1.00 0.00 H new ATOM 971 N LYS A 60 8.441 -0.922 -3.666 1.00 0.00 N ATOM 972 CA LYS A 60 8.134 -1.288 -5.003 1.00 0.00 C ATOM 973 C LYS A 60 6.721 -1.769 -5.006 1.00 0.00 C ATOM 974 O LYS A 60 6.402 -2.839 -4.485 1.00 0.00 O ATOM 975 CB LYS A 60 9.071 -2.373 -5.510 1.00 0.00 C ATOM 976 CG LYS A 60 8.751 -2.905 -6.884 1.00 0.00 C ATOM 977 CD LYS A 60 9.138 -1.945 -7.990 1.00 0.00 C ATOM 978 CE LYS A 60 10.636 -1.759 -8.088 1.00 0.00 C ATOM 979 NZ LYS A 60 10.988 -1.074 -9.339 1.00 0.00 N ATOM 0 H LYS A 60 8.300 -1.673 -2.990 1.00 0.00 H new ATOM 0 HA LYS A 60 8.259 -0.434 -5.669 1.00 0.00 H new ATOM 0 HB2 LYS A 60 10.087 -1.979 -5.518 1.00 0.00 H new ATOM 0 HB3 LYS A 60 9.056 -3.203 -4.804 1.00 0.00 H new ATOM 0 HG2 LYS A 60 9.271 -3.851 -7.032 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.683 -3.114 -6.948 1.00 0.00 H new ATOM 0 HD2 LYS A 60 8.757 -2.317 -8.941 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.665 -0.979 -7.813 1.00 0.00 H new ATOM 0 HE2 LYS A 60 10.993 -1.180 -7.236 1.00 0.00 H new ATOM 0 HE3 LYS A 60 11.132 -2.728 -8.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.020 -0.954 -9.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 10.664 -1.641 -10.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 10.529 -0.141 -9.365 1.00 0.00 H new ATOM 993 N GLN A 61 5.878 -0.965 -5.509 1.00 0.00 N ATOM 994 CA GLN A 61 4.504 -1.292 -5.569 1.00 0.00 C ATOM 995 C GLN A 61 4.166 -1.810 -6.929 1.00 0.00 C ATOM 996 O GLN A 61 4.497 -1.202 -7.951 1.00 0.00 O ATOM 997 CB GLN A 61 3.647 -0.140 -5.074 1.00 0.00 C ATOM 998 CG GLN A 61 3.952 1.190 -5.677 1.00 0.00 C ATOM 999 CD GLN A 61 3.268 2.307 -4.940 1.00 0.00 C ATOM 1000 OE1 GLN A 61 2.148 2.705 -5.258 1.00 0.00 O ATOM 1001 NE2 GLN A 61 3.935 2.811 -3.934 1.00 0.00 N ATOM 0 H GLN A 61 6.116 -0.052 -5.896 1.00 0.00 H new ATOM 0 HA GLN A 61 4.274 -2.107 -4.882 1.00 0.00 H new ATOM 0 HB2 GLN A 61 2.601 -0.377 -5.269 1.00 0.00 H new ATOM 0 HB3 GLN A 61 3.760 -0.064 -3.993 1.00 0.00 H new ATOM 0 HG2 GLN A 61 5.029 1.355 -5.668 1.00 0.00 H new ATOM 0 HG3 GLN A 61 3.637 1.197 -6.721 1.00 0.00 H new ATOM 0 HE21 GLN A 61 4.861 2.451 -3.705 1.00 0.00 H new ATOM 0 HE22 GLN A 61 3.529 3.564 -3.379 1.00 0.00 H new ATOM 1010 N MET A 62 3.575 -2.956 -6.937 1.00 0.00 N ATOM 1011 CA MET A 62 3.340 -3.704 -8.134 1.00 0.00 C ATOM 1012 C MET A 62 1.864 -3.915 -8.329 1.00 0.00 C ATOM 1013 O MET A 62 1.103 -3.930 -7.362 1.00 0.00 O ATOM 1014 CB MET A 62 4.142 -5.015 -8.064 1.00 0.00 C ATOM 1015 CG MET A 62 5.648 -4.776 -8.235 1.00 0.00 C ATOM 1016 SD MET A 62 6.704 -6.170 -7.762 1.00 0.00 S ATOM 1017 CE MET A 62 6.615 -6.062 -5.972 1.00 0.00 C ATOM 0 H MET A 62 3.232 -3.414 -6.093 1.00 0.00 H new ATOM 0 HA MET A 62 3.685 -3.156 -9.011 1.00 0.00 H new ATOM 0 HB2 MET A 62 3.958 -5.502 -7.106 1.00 0.00 H new ATOM 0 HB3 MET A 62 3.792 -5.696 -8.840 1.00 0.00 H new ATOM 0 HG2 MET A 62 5.845 -4.528 -9.278 1.00 0.00 H new ATOM 0 HG3 MET A 62 5.932 -3.907 -7.642 1.00 0.00 H new ATOM 0 HE1 MET A 62 7.616 -6.160 -5.551 1.00 0.00 H new ATOM 0 HE2 MET A 62 6.194 -5.098 -5.686 1.00 0.00 H new ATOM 0 HE3 MET A 62 5.981 -6.862 -5.590 1.00 0.00 H new ATOM 1027 N ASP A 63 1.454 -4.058 -9.562 1.00 0.00 N ATOM 1028 CA ASP A 63 0.037 -4.112 -9.880 1.00 0.00 C ATOM 1029 C ASP A 63 -0.519 -5.498 -9.745 1.00 0.00 C ATOM 1030 O ASP A 63 -0.415 -6.313 -10.679 1.00 0.00 O ATOM 1031 CB ASP A 63 -0.275 -3.575 -11.283 1.00 0.00 C ATOM 1032 CG ASP A 63 0.148 -2.151 -11.499 1.00 0.00 C ATOM 1033 OD1 ASP A 63 -0.562 -1.225 -11.048 1.00 0.00 O ATOM 1034 OD2 ASP A 63 1.213 -1.928 -12.126 1.00 0.00 O ATOM 0 H ASP A 63 2.075 -4.140 -10.367 1.00 0.00 H new ATOM 0 HA ASP A 63 -0.447 -3.464 -9.149 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.220 -4.206 -12.021 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.347 -3.656 -11.462 1.00 0.00 H new ATOM 1039 N ASP A 64 -1.022 -5.786 -8.565 1.00 0.00 N ATOM 1040 CA ASP A 64 -1.750 -7.011 -8.251 1.00 0.00 C ATOM 1041 C ASP A 64 -2.178 -6.885 -6.801 1.00 0.00 C ATOM 1042 O ASP A 64 -1.850 -5.870 -6.154 1.00 0.00 O ATOM 1043 CB ASP A 64 -0.896 -8.282 -8.443 1.00 0.00 C ATOM 1044 CG ASP A 64 -1.754 -9.504 -8.720 1.00 0.00 C ATOM 1045 OD1 ASP A 64 -2.385 -10.039 -7.798 1.00 0.00 O ATOM 1046 OD2 ASP A 64 -1.846 -9.912 -9.885 1.00 0.00 O ATOM 0 H ASP A 64 -0.937 -5.158 -7.766 1.00 0.00 H new ATOM 0 HA ASP A 64 -2.597 -7.120 -8.929 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -0.201 -8.131 -9.269 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.296 -8.455 -7.550 1.00 0.00 H new ATOM 1051 N ILE A 65 -2.877 -7.849 -6.276 1.00 0.00 N ATOM 1052 CA ILE A 65 -3.328 -7.766 -4.909 1.00 0.00 C ATOM 1053 C ILE A 65 -2.538 -8.712 -4.046 1.00 0.00 C ATOM 1054 O ILE A 65 -1.822 -9.588 -4.547 1.00 0.00 O ATOM 1055 CB ILE A 65 -4.848 -8.040 -4.728 1.00 0.00 C ATOM 1056 CG1 ILE A 65 -5.212 -9.460 -5.183 1.00 0.00 C ATOM 1057 CG2 ILE A 65 -5.679 -6.980 -5.442 1.00 0.00 C ATOM 1058 CD1 ILE A 65 -6.682 -9.823 -5.014 1.00 0.00 C ATOM 0 H ILE A 65 -3.149 -8.700 -6.768 1.00 0.00 H new ATOM 0 HA ILE A 65 -3.161 -6.734 -4.600 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.083 -7.975 -3.666 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -4.942 -9.571 -6.233 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.608 -10.173 -4.622 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.739 -7.193 -5.301 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.448 -5.998 -5.029 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.445 -6.990 -6.507 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.847 -10.843 -5.361 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.956 -9.749 -3.962 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -7.296 -9.137 -5.598 1.00 0.00 H new ATOM 1070 N SER A 66 -2.654 -8.539 -2.784 1.00 0.00 N ATOM 1071 CA SER A 66 -1.947 -9.334 -1.829 1.00 0.00 C ATOM 1072 C SER A 66 -2.582 -10.718 -1.720 1.00 0.00 C ATOM 1073 O SER A 66 -3.768 -10.896 -2.051 1.00 0.00 O ATOM 1074 CB SER A 66 -1.950 -8.612 -0.470 1.00 0.00 C ATOM 1075 OG SER A 66 -3.274 -8.343 -0.037 1.00 0.00 O ATOM 0 H SER A 66 -3.254 -7.827 -2.367 1.00 0.00 H new ATOM 0 HA SER A 66 -0.915 -9.468 -2.153 1.00 0.00 H new ATOM 0 HB2 SER A 66 -1.439 -9.225 0.272 1.00 0.00 H new ATOM 0 HB3 SER A 66 -1.393 -7.678 -0.550 1.00 0.00 H new ATOM 0 HG SER A 66 -3.413 -7.374 0.009 1.00 0.00 H new ATOM 1081 N PRO A 67 -1.821 -11.738 -1.286 1.00 0.00 N ATOM 1082 CA PRO A 67 -2.380 -13.064 -1.046 1.00 0.00 C ATOM 1083 C PRO A 67 -3.443 -12.995 0.055 1.00 0.00 C ATOM 1084 O PRO A 67 -4.413 -13.745 0.053 1.00 0.00 O ATOM 1085 CB PRO A 67 -1.172 -13.897 -0.586 1.00 0.00 C ATOM 1086 CG PRO A 67 -0.134 -12.902 -0.185 1.00 0.00 C ATOM 1087 CD PRO A 67 -0.364 -11.695 -1.038 1.00 0.00 C ATOM 0 HA PRO A 67 -2.868 -13.488 -1.923 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -1.437 -14.546 0.249 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -0.810 -14.541 -1.388 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -0.220 -12.654 0.873 1.00 0.00 H new ATOM 0 HG3 PRO A 67 0.868 -13.302 -0.338 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -0.068 -10.778 -0.529 1.00 0.00 H new ATOM 0 HD3 PRO A 67 0.205 -11.742 -1.966 1.00 0.00 H new ATOM 1095 N LEU A 68 -3.269 -12.026 0.946 1.00 0.00 N ATOM 1096 CA LEU A 68 -4.172 -11.796 2.041 1.00 0.00 C ATOM 1097 C LEU A 68 -5.469 -11.197 1.489 1.00 0.00 C ATOM 1098 O LEU A 68 -6.535 -11.522 1.951 1.00 0.00 O ATOM 1099 CB LEU A 68 -3.516 -10.852 3.081 1.00 0.00 C ATOM 1100 CG LEU A 68 -4.003 -10.946 4.562 1.00 0.00 C ATOM 1101 CD1 LEU A 68 -5.477 -10.618 4.733 1.00 0.00 C ATOM 1102 CD2 LEU A 68 -3.715 -12.323 5.113 1.00 0.00 C ATOM 0 H LEU A 68 -2.484 -11.376 0.918 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.400 -12.735 2.545 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.442 -11.037 3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -3.667 -9.826 2.744 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.448 -10.192 5.121 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -5.749 -10.703 5.785 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.666 -9.601 4.390 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -6.075 -11.315 4.147 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.058 -12.380 6.146 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.237 -13.070 4.516 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.642 -12.513 5.075 1.00 0.00 H new ATOM 1114 N SER A 69 -5.374 -10.360 0.473 1.00 0.00 N ATOM 1115 CA SER A 69 -6.557 -9.769 -0.150 1.00 0.00 C ATOM 1116 C SER A 69 -7.482 -10.877 -0.685 1.00 0.00 C ATOM 1117 O SER A 69 -8.698 -10.759 -0.641 1.00 0.00 O ATOM 1118 CB SER A 69 -6.141 -8.824 -1.280 1.00 0.00 C ATOM 1119 OG SER A 69 -7.240 -8.106 -1.808 1.00 0.00 O ATOM 0 H SER A 69 -4.490 -10.070 0.056 1.00 0.00 H new ATOM 0 HA SER A 69 -7.102 -9.194 0.599 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.395 -8.122 -0.908 1.00 0.00 H new ATOM 0 HB3 SER A 69 -5.668 -9.399 -2.076 1.00 0.00 H new ATOM 0 HG SER A 69 -6.963 -7.637 -2.623 1.00 0.00 H new ATOM 1125 N LYS A 70 -6.888 -11.977 -1.108 1.00 0.00 N ATOM 1126 CA LYS A 70 -7.633 -13.113 -1.635 1.00 0.00 C ATOM 1127 C LYS A 70 -8.322 -13.911 -0.512 1.00 0.00 C ATOM 1128 O LYS A 70 -9.228 -14.695 -0.769 1.00 0.00 O ATOM 1129 CB LYS A 70 -6.684 -14.000 -2.425 1.00 0.00 C ATOM 1130 CG LYS A 70 -5.891 -13.210 -3.438 1.00 0.00 C ATOM 1131 CD LYS A 70 -4.923 -14.056 -4.210 1.00 0.00 C ATOM 1132 CE LYS A 70 -4.061 -13.168 -5.079 1.00 0.00 C ATOM 1133 NZ LYS A 70 -3.223 -13.932 -6.032 1.00 0.00 N ATOM 0 H LYS A 70 -5.877 -12.112 -1.098 1.00 0.00 H new ATOM 0 HA LYS A 70 -8.422 -12.744 -2.290 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.001 -14.502 -1.740 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -7.253 -14.778 -2.935 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.578 -12.727 -4.133 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.345 -12.417 -2.926 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.299 -14.630 -3.525 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.463 -14.774 -4.827 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.700 -12.481 -5.634 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.417 -12.561 -4.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -2.654 -13.272 -6.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -2.591 -14.569 -5.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.834 -14.492 -6.660 1.00 0.00 H new ATOM 1147 N VAL A 71 -7.872 -13.725 0.719 1.00 0.00 N ATOM 1148 CA VAL A 71 -8.489 -14.404 1.870 1.00 0.00 C ATOM 1149 C VAL A 71 -9.449 -13.436 2.567 1.00 0.00 C ATOM 1150 O VAL A 71 -10.393 -13.830 3.260 1.00 0.00 O ATOM 1151 CB VAL A 71 -7.410 -14.912 2.910 1.00 0.00 C ATOM 1152 CG1 VAL A 71 -6.226 -15.512 2.211 1.00 0.00 C ATOM 1153 CG2 VAL A 71 -6.951 -13.840 3.883 1.00 0.00 C ATOM 0 H VAL A 71 -7.088 -13.116 0.956 1.00 0.00 H new ATOM 0 HA VAL A 71 -9.025 -15.277 1.497 1.00 0.00 H new ATOM 0 HB VAL A 71 -7.911 -15.679 3.500 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -5.501 -15.852 2.950 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.551 -16.358 1.605 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.764 -14.762 1.569 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -6.212 -14.260 4.565 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.505 -13.013 3.330 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -7.806 -13.476 4.453 1.00 0.00 H new ATOM 1163 N ASN A 72 -9.184 -12.179 2.373 1.00 0.00 N ATOM 1164 CA ASN A 72 -9.920 -11.114 3.019 1.00 0.00 C ATOM 1165 C ASN A 72 -11.011 -10.572 2.102 1.00 0.00 C ATOM 1166 O ASN A 72 -12.172 -10.939 2.230 1.00 0.00 O ATOM 1167 CB ASN A 72 -8.949 -9.995 3.423 1.00 0.00 C ATOM 1168 CG ASN A 72 -9.610 -8.858 4.162 1.00 0.00 C ATOM 1169 OD1 ASN A 72 -10.546 -9.057 4.909 1.00 0.00 O ATOM 1170 ND2 ASN A 72 -9.138 -7.660 3.939 1.00 0.00 N ATOM 0 H ASN A 72 -8.442 -11.851 1.755 1.00 0.00 H new ATOM 0 HA ASN A 72 -10.404 -11.510 3.912 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -8.163 -10.416 4.050 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -8.467 -9.603 2.527 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -9.558 -6.853 4.400 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -8.350 -7.532 3.304 1.00 0.00 H new ATOM 1177 N GLY A 73 -10.607 -9.746 1.144 1.00 0.00 N ATOM 1178 CA GLY A 73 -11.532 -9.137 0.214 1.00 0.00 C ATOM 1179 C GLY A 73 -12.419 -8.078 0.838 1.00 0.00 C ATOM 1180 O GLY A 73 -13.437 -7.712 0.263 1.00 0.00 O ATOM 0 H GLY A 73 -9.632 -9.485 0.996 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -10.968 -8.689 -0.604 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.161 -9.914 -0.220 1.00 0.00 H new ATOM 1184 N TYR A 74 -11.987 -7.536 1.950 1.00 0.00 N ATOM 1185 CA TYR A 74 -12.750 -6.600 2.705 1.00 0.00 C ATOM 1186 C TYR A 74 -12.266 -5.219 2.490 1.00 0.00 C ATOM 1187 O TYR A 74 -11.096 -4.883 2.712 1.00 0.00 O ATOM 1188 CB TYR A 74 -12.775 -6.927 4.196 1.00 0.00 C ATOM 1189 CG TYR A 74 -13.873 -7.868 4.606 1.00 0.00 C ATOM 1190 CD1 TYR A 74 -13.832 -9.212 4.299 1.00 0.00 C ATOM 1191 CD2 TYR A 74 -14.970 -7.391 5.296 1.00 0.00 C ATOM 1192 CE1 TYR A 74 -14.856 -10.050 4.669 1.00 0.00 C ATOM 1193 CE2 TYR A 74 -15.991 -8.219 5.675 1.00 0.00 C ATOM 1194 CZ TYR A 74 -15.933 -9.547 5.356 1.00 0.00 C ATOM 1195 OH TYR A 74 -16.964 -10.380 5.719 1.00 0.00 O ATOM 0 H TYR A 74 -11.075 -7.744 2.356 1.00 0.00 H new ATOM 0 HA TYR A 74 -13.774 -6.675 2.341 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -11.816 -7.363 4.476 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -12.880 -5.999 4.758 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -12.985 -9.611 3.761 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -15.023 -6.341 5.542 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -14.814 -11.100 4.420 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -16.836 -7.827 6.222 1.00 0.00 H new ATOM 0 HH TYR A 74 -17.646 -9.866 6.199 1.00 0.00 H new ATOM 1205 N ILE A 75 -13.151 -4.452 2.038 1.00 0.00 N ATOM 1206 CA ILE A 75 -12.964 -3.079 1.793 1.00 0.00 C ATOM 1207 C ILE A 75 -13.934 -2.376 2.674 1.00 0.00 C ATOM 1208 O ILE A 75 -15.122 -2.744 2.697 1.00 0.00 O ATOM 1209 CB ILE A 75 -13.263 -2.793 0.323 1.00 0.00 C ATOM 1210 CG1 ILE A 75 -12.149 -3.334 -0.548 1.00 0.00 C ATOM 1211 CG2 ILE A 75 -13.512 -1.302 0.045 1.00 0.00 C ATOM 1212 CD1 ILE A 75 -12.464 -3.324 -2.022 1.00 0.00 C ATOM 0 H ILE A 75 -14.091 -4.774 1.810 1.00 0.00 H new ATOM 0 HA ILE A 75 -11.945 -2.751 1.997 1.00 0.00 H new ATOM 0 HB ILE A 75 -14.192 -3.306 0.074 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -11.248 -2.745 -0.375 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -11.926 -4.356 -0.241 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -13.719 -1.159 -1.016 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -14.365 -0.960 0.631 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -12.628 -0.728 0.323 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -11.617 -3.726 -2.578 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -13.346 -3.937 -2.210 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -12.657 -2.301 -2.346 1.00 0.00 H new ATOM 1224 N GLY A 76 -13.458 -1.445 3.435 1.00 0.00 N ATOM 1225 CA GLY A 76 -14.337 -0.764 4.318 1.00 0.00 C ATOM 1226 C GLY A 76 -14.237 0.731 4.250 1.00 0.00 C ATOM 1227 O GLY A 76 -13.275 1.313 3.708 1.00 0.00 O ATOM 0 H GLY A 76 -12.483 -1.145 3.462 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -15.362 -1.059 4.093 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.130 -1.085 5.339 1.00 0.00 H new ATOM 1231 N VAL A 77 -15.234 1.365 4.745 1.00 0.00 N ATOM 1232 CA VAL A 77 -15.172 2.762 4.880 1.00 0.00 C ATOM 1233 C VAL A 77 -15.408 3.157 6.278 1.00 0.00 C ATOM 1234 O VAL A 77 -16.086 2.453 7.047 1.00 0.00 O ATOM 1235 CB VAL A 77 -16.107 3.577 3.951 1.00 0.00 C ATOM 1236 CG1 VAL A 77 -15.816 3.329 2.495 1.00 0.00 C ATOM 1237 CG2 VAL A 77 -17.555 3.355 4.289 1.00 0.00 C ATOM 0 H VAL A 77 -16.102 0.934 5.062 1.00 0.00 H new ATOM 0 HA VAL A 77 -14.160 3.013 4.561 1.00 0.00 H new ATOM 0 HB VAL A 77 -15.898 4.631 4.131 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -16.496 3.921 1.882 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -14.787 3.615 2.276 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -15.954 2.271 2.271 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -18.180 3.943 3.617 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -17.797 2.298 4.178 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -17.740 3.663 5.318 1.00 0.00 H new ATOM 1247 N SER A 78 -14.823 4.230 6.629 1.00 0.00 N ATOM 1248 CA SER A 78 -15.089 4.829 7.874 1.00 0.00 C ATOM 1249 C SER A 78 -16.243 5.801 7.643 1.00 0.00 C ATOM 1250 O SER A 78 -16.555 6.092 6.484 1.00 0.00 O ATOM 1251 CB SER A 78 -13.843 5.513 8.391 1.00 0.00 C ATOM 1252 OG SER A 78 -12.773 4.587 8.495 1.00 0.00 O ATOM 0 H SER A 78 -14.139 4.724 6.056 1.00 0.00 H new ATOM 0 HA SER A 78 -15.371 4.102 8.635 1.00 0.00 H new ATOM 0 HB2 SER A 78 -13.564 6.327 7.722 1.00 0.00 H new ATOM 0 HB3 SER A 78 -14.043 5.957 9.366 1.00 0.00 H new ATOM 0 HG SER A 78 -11.974 5.046 8.829 1.00 0.00 H new ATOM 1258 N ASP A 79 -16.831 6.311 8.708 1.00 0.00 N ATOM 1259 CA ASP A 79 -18.061 7.131 8.694 1.00 0.00 C ATOM 1260 C ASP A 79 -18.042 8.297 7.712 1.00 0.00 C ATOM 1261 O ASP A 79 -19.091 8.693 7.189 1.00 0.00 O ATOM 1262 CB ASP A 79 -18.340 7.655 10.096 1.00 0.00 C ATOM 1263 CG ASP A 79 -18.520 6.564 11.119 1.00 0.00 C ATOM 1264 OD1 ASP A 79 -17.500 5.958 11.544 1.00 0.00 O ATOM 1265 OD2 ASP A 79 -19.663 6.305 11.540 1.00 0.00 O ATOM 0 H ASP A 79 -16.464 6.169 9.649 1.00 0.00 H new ATOM 0 HA ASP A 79 -18.854 6.466 8.351 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -17.517 8.300 10.405 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -19.238 8.273 10.073 1.00 0.00 H new ATOM 1270 N ASN A 80 -16.884 8.823 7.441 1.00 0.00 N ATOM 1271 CA ASN A 80 -16.764 9.960 6.545 1.00 0.00 C ATOM 1272 C ASN A 80 -16.609 9.528 5.086 1.00 0.00 C ATOM 1273 O ASN A 80 -16.479 10.362 4.228 1.00 0.00 O ATOM 1274 CB ASN A 80 -15.600 10.882 6.957 1.00 0.00 C ATOM 1275 CG ASN A 80 -15.857 11.694 8.226 1.00 0.00 C ATOM 1276 OD1 ASN A 80 -16.379 12.801 8.174 1.00 0.00 O ATOM 1277 ND2 ASN A 80 -15.468 11.178 9.358 1.00 0.00 N ATOM 0 H ASN A 80 -16.000 8.489 7.824 1.00 0.00 H new ATOM 0 HA ASN A 80 -17.695 10.521 6.629 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -14.706 10.275 7.103 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -15.389 11.569 6.137 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -15.596 11.698 10.226 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -15.036 10.254 9.376 1.00 0.00 H new ATOM 1284 N GLY A 81 -16.682 8.218 4.837 1.00 0.00 N ATOM 1285 CA GLY A 81 -16.488 7.641 3.529 1.00 0.00 C ATOM 1286 C GLY A 81 -15.037 7.332 3.247 1.00 0.00 C ATOM 1287 O GLY A 81 -14.580 7.450 2.134 1.00 0.00 O ATOM 0 H GLY A 81 -16.882 7.527 5.560 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.074 6.726 3.448 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -16.864 8.329 2.772 1.00 0.00 H new ATOM 1291 N VAL A 82 -14.319 6.923 4.253 1.00 0.00 N ATOM 1292 CA VAL A 82 -12.886 6.657 4.091 1.00 0.00 C ATOM 1293 C VAL A 82 -12.666 5.268 3.460 1.00 0.00 C ATOM 1294 O VAL A 82 -13.001 4.287 4.044 1.00 0.00 O ATOM 1295 CB VAL A 82 -12.134 6.777 5.437 1.00 0.00 C ATOM 1296 CG1 VAL A 82 -10.637 6.725 5.228 1.00 0.00 C ATOM 1297 CG2 VAL A 82 -12.527 8.057 6.157 1.00 0.00 C ATOM 0 H VAL A 82 -14.681 6.762 5.193 1.00 0.00 H new ATOM 0 HA VAL A 82 -12.477 7.412 3.419 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.419 5.928 6.059 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.132 6.811 6.190 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -10.368 5.778 4.761 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -10.331 7.548 4.582 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.987 8.123 7.102 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.276 8.916 5.535 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.600 8.051 6.351 1.00 0.00 H new ATOM 1307 N ILE A 83 -11.965 5.251 2.355 1.00 0.00 N ATOM 1308 CA ILE A 83 -11.784 4.102 1.397 1.00 0.00 C ATOM 1309 C ILE A 83 -10.715 3.084 1.863 1.00 0.00 C ATOM 1310 O ILE A 83 -9.937 2.546 1.081 1.00 0.00 O ATOM 1311 CB ILE A 83 -11.531 4.644 -0.069 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -12.648 5.621 -0.426 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.513 3.518 -1.126 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -14.028 5.021 -0.255 1.00 0.00 C ATOM 0 H ILE A 83 -11.456 6.079 2.046 1.00 0.00 H new ATOM 0 HA ILE A 83 -12.713 3.533 1.383 1.00 0.00 H new ATOM 0 HB ILE A 83 -10.552 5.124 -0.077 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -12.562 6.509 0.201 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.524 5.947 -1.459 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.336 3.947 -2.112 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -10.718 2.810 -0.890 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -12.472 3.000 -1.123 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -14.782 5.761 -0.523 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -14.129 4.149 -0.902 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -14.168 4.720 0.783 1.00 0.00 H new ATOM 1326 N SER A 84 -10.655 2.864 3.125 1.00 0.00 N ATOM 1327 CA SER A 84 -9.537 2.107 3.672 1.00 0.00 C ATOM 1328 C SER A 84 -9.912 0.633 3.792 1.00 0.00 C ATOM 1329 O SER A 84 -10.980 0.293 4.262 1.00 0.00 O ATOM 1330 CB SER A 84 -9.182 2.643 5.047 1.00 0.00 C ATOM 1331 OG SER A 84 -8.984 4.053 5.030 1.00 0.00 O ATOM 0 H SER A 84 -11.343 3.182 3.807 1.00 0.00 H new ATOM 0 HA SER A 84 -8.682 2.209 3.004 1.00 0.00 H new ATOM 0 HB2 SER A 84 -9.978 2.396 5.750 1.00 0.00 H new ATOM 0 HB3 SER A 84 -8.277 2.153 5.405 1.00 0.00 H new ATOM 0 HG SER A 84 -9.231 4.429 5.901 1.00 0.00 H new ATOM 1337 N THR A 85 -9.042 -0.247 3.415 1.00 0.00 N ATOM 1338 CA THR A 85 -9.391 -1.619 3.507 1.00 0.00 C ATOM 1339 C THR A 85 -9.025 -2.144 4.879 1.00 0.00 C ATOM 1340 O THR A 85 -8.091 -1.629 5.543 1.00 0.00 O ATOM 1341 CB THR A 85 -8.759 -2.474 2.378 1.00 0.00 C ATOM 1342 OG1 THR A 85 -7.337 -2.420 2.438 1.00 0.00 O ATOM 1343 CG2 THR A 85 -9.203 -1.956 1.027 1.00 0.00 C ATOM 0 H THR A 85 -8.111 -0.045 3.051 1.00 0.00 H new ATOM 0 HA THR A 85 -10.469 -1.702 3.370 1.00 0.00 H new ATOM 0 HB THR A 85 -9.088 -3.504 2.514 1.00 0.00 H new ATOM 0 HG1 THR A 85 -6.972 -2.392 1.529 1.00 0.00 H new ATOM 0 HG21 THR A 85 -8.755 -2.562 0.240 1.00 0.00 H new ATOM 0 HG22 THR A 85 -10.289 -2.013 0.955 1.00 0.00 H new ATOM 0 HG23 THR A 85 -8.885 -0.920 0.912 1.00 0.00 H new ATOM 1351 N PHE A 86 -9.804 -3.089 5.339 1.00 0.00 N ATOM 1352 CA PHE A 86 -9.640 -3.661 6.644 1.00 0.00 C ATOM 1353 C PHE A 86 -9.574 -5.142 6.508 1.00 0.00 C ATOM 1354 O PHE A 86 -10.126 -5.692 5.559 1.00 0.00 O ATOM 1355 CB PHE A 86 -10.819 -3.322 7.564 1.00 0.00 C ATOM 1356 CG PHE A 86 -10.906 -1.898 8.030 1.00 0.00 C ATOM 1357 CD1 PHE A 86 -11.174 -0.881 7.150 1.00 0.00 C ATOM 1358 CD2 PHE A 86 -10.768 -1.600 9.367 1.00 0.00 C ATOM 1359 CE1 PHE A 86 -11.300 0.425 7.586 1.00 0.00 C ATOM 1360 CE2 PHE A 86 -10.882 -0.301 9.820 1.00 0.00 C ATOM 1361 CZ PHE A 86 -11.152 0.715 8.927 1.00 0.00 C ATOM 0 H PHE A 86 -10.579 -3.486 4.808 1.00 0.00 H new ATOM 0 HA PHE A 86 -8.728 -3.253 7.080 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -11.743 -3.569 7.042 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -10.766 -3.967 8.441 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -11.288 -1.104 6.099 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -10.568 -2.394 10.071 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -11.513 1.214 6.880 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -10.760 -0.081 10.870 1.00 0.00 H new ATOM 0 HZ PHE A 86 -11.247 1.733 9.276 1.00 0.00 H new ATOM 1371 N HIS A 87 -8.886 -5.787 7.394 1.00 0.00 N ATOM 1372 CA HIS A 87 -8.888 -7.224 7.403 1.00 0.00 C ATOM 1373 C HIS A 87 -10.058 -7.723 8.226 1.00 0.00 C ATOM 1374 O HIS A 87 -10.080 -7.616 9.461 1.00 0.00 O ATOM 1375 CB HIS A 87 -7.514 -7.856 7.790 1.00 0.00 C ATOM 1376 CG HIS A 87 -6.760 -7.200 8.924 1.00 0.00 C ATOM 1377 ND1 HIS A 87 -5.493 -6.669 8.781 1.00 0.00 N ATOM 1378 CD2 HIS A 87 -7.091 -7.022 10.227 1.00 0.00 C ATOM 1379 CE1 HIS A 87 -5.107 -6.197 9.965 1.00 0.00 C ATOM 1380 NE2 HIS A 87 -6.042 -6.386 10.882 1.00 0.00 N ATOM 0 H HIS A 87 -8.317 -5.350 8.119 1.00 0.00 H new ATOM 0 HA HIS A 87 -9.030 -7.571 6.379 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -7.682 -8.901 8.052 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -6.875 -7.848 6.907 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -4.948 -6.643 7.919 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -8.021 -7.326 10.683 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -4.155 -5.722 10.152 1.00 0.00 H new ATOM 1388 N GLY A 88 -11.057 -8.195 7.526 1.00 0.00 N ATOM 1389 CA GLY A 88 -12.277 -8.600 8.143 1.00 0.00 C ATOM 1390 C GLY A 88 -13.231 -7.431 8.229 1.00 0.00 C ATOM 1391 O GLY A 88 -12.998 -6.401 7.582 1.00 0.00 O ATOM 0 H GLY A 88 -11.040 -8.306 6.512 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.732 -9.409 7.571 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -12.077 -8.990 9.141 1.00 0.00 H new ATOM 1395 N ARG A 89 -14.307 -7.595 8.991 1.00 0.00 N ATOM 1396 CA ARG A 89 -15.302 -6.541 9.214 1.00 0.00 C ATOM 1397 C ARG A 89 -14.618 -5.242 9.650 1.00 0.00 C ATOM 1398 O ARG A 89 -13.814 -5.252 10.593 1.00 0.00 O ATOM 1399 CB ARG A 89 -16.289 -6.965 10.308 1.00 0.00 C ATOM 1400 CG ARG A 89 -17.203 -8.106 9.964 1.00 0.00 C ATOM 1401 CD ARG A 89 -18.354 -7.635 9.097 1.00 0.00 C ATOM 1402 NE ARG A 89 -19.188 -6.598 9.769 1.00 0.00 N ATOM 1403 CZ ARG A 89 -20.537 -6.584 9.805 1.00 0.00 C ATOM 1404 NH1 ARG A 89 -21.237 -7.587 9.267 1.00 0.00 N ATOM 1405 NH2 ARG A 89 -21.179 -5.564 10.388 1.00 0.00 N ATOM 0 H ARG A 89 -14.519 -8.467 9.476 1.00 0.00 H new ATOM 0 HA ARG A 89 -15.835 -6.378 8.277 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -15.720 -7.237 11.197 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -16.901 -6.102 10.572 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -16.643 -8.881 9.442 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -17.591 -8.555 10.878 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -17.960 -7.232 8.164 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -18.981 -8.488 8.836 1.00 0.00 H new ATOM 0 HE ARG A 89 -18.699 -5.837 10.240 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -20.752 -8.369 8.826 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -22.256 -7.571 9.297 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -20.649 -4.799 10.804 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -22.199 -5.552 10.416 1.00 0.00 H new ATOM 1419 N PRO A 90 -14.889 -4.135 8.946 1.00 0.00 N ATOM 1420 CA PRO A 90 -14.337 -2.838 9.281 1.00 0.00 C ATOM 1421 C PRO A 90 -14.930 -2.319 10.583 1.00 0.00 C ATOM 1422 O PRO A 90 -16.027 -1.751 10.614 1.00 0.00 O ATOM 1423 CB PRO A 90 -14.694 -1.931 8.096 1.00 0.00 C ATOM 1424 CG PRO A 90 -15.735 -2.658 7.308 1.00 0.00 C ATOM 1425 CD PRO A 90 -15.735 -4.097 7.755 1.00 0.00 C ATOM 0 HA PRO A 90 -13.259 -2.878 9.440 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -15.071 -0.969 8.443 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.815 -1.727 7.484 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -16.716 -2.209 7.467 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.522 -2.590 6.241 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -16.745 -4.438 7.980 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -15.344 -4.750 6.975 1.00 0.00 H new ATOM 1433 N GLU A 91 -14.264 -2.635 11.646 1.00 0.00 N ATOM 1434 CA GLU A 91 -14.666 -2.282 12.971 1.00 0.00 C ATOM 1435 C GLU A 91 -13.388 -1.914 13.751 1.00 0.00 C ATOM 1436 O GLU A 91 -12.302 -2.136 13.227 1.00 0.00 O ATOM 1437 CB GLU A 91 -15.408 -3.495 13.578 1.00 0.00 C ATOM 1438 CG GLU A 91 -14.567 -4.750 13.713 1.00 0.00 C ATOM 1439 CD GLU A 91 -15.364 -5.909 14.236 1.00 0.00 C ATOM 1440 OE1 GLU A 91 -15.644 -5.952 15.442 1.00 0.00 O ATOM 1441 OE2 GLU A 91 -15.743 -6.792 13.447 1.00 0.00 O ATOM 0 H GLU A 91 -13.393 -3.165 11.615 1.00 0.00 H new ATOM 0 HA GLU A 91 -15.344 -1.429 13.002 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -15.784 -3.218 14.563 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -16.276 -3.720 12.958 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -14.145 -5.009 12.742 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -13.730 -4.555 14.383 1.00 0.00 H new ATOM 1448 N PRO A 92 -13.476 -1.370 14.996 1.00 0.00 N ATOM 1449 CA PRO A 92 -12.285 -1.009 15.793 1.00 0.00 C ATOM 1450 C PRO A 92 -11.462 -2.227 16.202 1.00 0.00 C ATOM 1451 O PRO A 92 -10.313 -2.109 16.619 1.00 0.00 O ATOM 1452 CB PRO A 92 -12.847 -0.333 17.037 1.00 0.00 C ATOM 1453 CG PRO A 92 -14.280 -0.718 17.096 1.00 0.00 C ATOM 1454 CD PRO A 92 -14.713 -1.030 15.697 1.00 0.00 C ATOM 0 HA PRO A 92 -11.612 -0.375 15.216 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.318 -0.659 17.932 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -12.735 0.750 16.978 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -14.419 -1.583 17.744 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -14.879 0.092 17.513 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -15.421 -1.859 15.676 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -15.208 -0.176 15.235 1.00 0.00 H new ATOM 1462 N ALA A 93 -12.061 -3.395 16.086 1.00 0.00 N ATOM 1463 CA ALA A 93 -11.382 -4.638 16.382 1.00 0.00 C ATOM 1464 C ALA A 93 -10.560 -5.075 15.172 1.00 0.00 C ATOM 1465 O ALA A 93 -9.869 -6.090 15.188 1.00 0.00 O ATOM 1466 CB ALA A 93 -12.380 -5.694 16.798 1.00 0.00 C ATOM 0 H ALA A 93 -13.029 -3.508 15.785 1.00 0.00 H new ATOM 0 HA ALA A 93 -10.698 -4.492 17.218 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -11.855 -6.624 17.018 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -12.914 -5.360 17.688 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -13.091 -5.861 15.989 1.00 0.00 H new ATOM 1472 N SER A 94 -10.677 -4.309 14.121 1.00 0.00 N ATOM 1473 CA SER A 94 -9.871 -4.469 12.950 1.00 0.00 C ATOM 1474 C SER A 94 -9.117 -3.150 12.779 1.00 0.00 C ATOM 1475 O SER A 94 -9.359 -2.197 13.546 1.00 0.00 O ATOM 1476 CB SER A 94 -10.753 -4.791 11.726 1.00 0.00 C ATOM 1477 OG SER A 94 -9.973 -5.060 10.568 1.00 0.00 O ATOM 0 H SER A 94 -11.348 -3.544 14.058 1.00 0.00 H new ATOM 0 HA SER A 94 -9.173 -5.301 13.044 1.00 0.00 H new ATOM 0 HB2 SER A 94 -11.382 -5.653 11.948 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.420 -3.952 11.528 1.00 0.00 H new ATOM 0 HG SER A 94 -10.119 -5.986 10.283 1.00 0.00 H new ATOM 1483 N GLU A 95 -8.220 -3.070 11.856 1.00 0.00 N ATOM 1484 CA GLU A 95 -7.461 -1.868 11.675 1.00 0.00 C ATOM 1485 C GLU A 95 -7.369 -1.544 10.200 1.00 0.00 C ATOM 1486 O GLU A 95 -7.444 -2.453 9.359 1.00 0.00 O ATOM 1487 CB GLU A 95 -6.057 -1.993 12.297 1.00 0.00 C ATOM 1488 CG GLU A 95 -5.203 -3.097 11.711 1.00 0.00 C ATOM 1489 CD GLU A 95 -3.815 -3.125 12.289 1.00 0.00 C ATOM 1490 OE1 GLU A 95 -2.931 -2.413 11.770 1.00 0.00 O ATOM 1491 OE2 GLU A 95 -3.568 -3.859 13.270 1.00 0.00 O ATOM 0 H GLU A 95 -7.989 -3.824 11.209 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.972 -1.053 12.189 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.534 -1.044 12.175 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.163 -2.163 13.368 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.686 -4.058 11.889 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -5.140 -2.967 10.631 1.00 0.00 H new ATOM 1498 N PRO A 96 -7.265 -0.255 9.843 1.00 0.00 N ATOM 1499 CA PRO A 96 -7.087 0.139 8.474 1.00 0.00 C ATOM 1500 C PRO A 96 -5.719 -0.281 8.023 1.00 0.00 C ATOM 1501 O PRO A 96 -4.700 0.086 8.633 1.00 0.00 O ATOM 1502 CB PRO A 96 -7.207 1.665 8.481 1.00 0.00 C ATOM 1503 CG PRO A 96 -7.731 2.012 9.824 1.00 0.00 C ATOM 1504 CD PRO A 96 -7.317 0.901 10.741 1.00 0.00 C ATOM 0 HA PRO A 96 -7.814 -0.314 7.800 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -6.240 2.136 8.303 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -7.879 2.010 7.696 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -7.328 2.966 10.163 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -8.816 2.114 9.803 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.350 1.098 11.205 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -8.034 0.754 11.549 1.00 0.00 H new ATOM 1512 N ILE A 97 -5.696 -1.061 7.002 1.00 0.00 N ATOM 1513 CA ILE A 97 -4.469 -1.622 6.468 1.00 0.00 C ATOM 1514 C ILE A 97 -3.633 -0.503 5.832 1.00 0.00 C ATOM 1515 O ILE A 97 -2.407 -0.501 5.879 1.00 0.00 O ATOM 1516 CB ILE A 97 -4.819 -2.708 5.429 1.00 0.00 C ATOM 1517 CG1 ILE A 97 -5.755 -3.745 6.071 1.00 0.00 C ATOM 1518 CG2 ILE A 97 -3.553 -3.383 4.914 1.00 0.00 C ATOM 1519 CD1 ILE A 97 -6.399 -4.688 5.086 1.00 0.00 C ATOM 0 H ILE A 97 -6.534 -1.343 6.493 1.00 0.00 H new ATOM 0 HA ILE A 97 -3.884 -2.079 7.266 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.323 -2.243 4.582 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -5.190 -4.327 6.798 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.537 -3.221 6.621 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.819 -4.146 4.182 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -2.909 -2.639 4.445 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.024 -3.847 5.746 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -7.043 -5.387 5.619 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -6.994 -4.118 4.372 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.626 -5.241 4.553 1.00 0.00 H new ATOM 1531 N GLN A 98 -4.334 0.454 5.297 1.00 0.00 N ATOM 1532 CA GLN A 98 -3.790 1.625 4.669 1.00 0.00 C ATOM 1533 C GLN A 98 -4.953 2.588 4.640 1.00 0.00 C ATOM 1534 O GLN A 98 -6.021 2.249 5.176 1.00 0.00 O ATOM 1535 CB GLN A 98 -3.329 1.314 3.200 1.00 0.00 C ATOM 1536 CG GLN A 98 -4.451 1.343 2.132 1.00 0.00 C ATOM 1537 CD GLN A 98 -5.588 0.364 2.373 1.00 0.00 C ATOM 1538 OE1 GLN A 98 -6.732 0.643 2.070 1.00 0.00 O ATOM 1539 NE2 GLN A 98 -5.282 -0.780 2.862 1.00 0.00 N ATOM 0 H GLN A 98 -5.354 0.439 5.286 1.00 0.00 H new ATOM 0 HA GLN A 98 -2.917 2.009 5.197 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.563 2.036 2.917 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -2.861 0.330 3.185 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -4.863 2.351 2.086 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -4.011 1.133 1.157 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -4.314 -0.987 3.107 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -6.006 -1.483 3.006 1.00 0.00 H new ATOM 1548 N SER A 99 -4.792 3.725 4.052 1.00 0.00 N ATOM 1549 CA SER A 99 -5.893 4.581 3.824 1.00 0.00 C ATOM 1550 C SER A 99 -5.650 5.313 2.507 1.00 0.00 C ATOM 1551 O SER A 99 -4.522 5.742 2.230 1.00 0.00 O ATOM 1552 CB SER A 99 -6.079 5.551 4.997 1.00 0.00 C ATOM 1553 OG SER A 99 -7.298 6.263 4.886 1.00 0.00 O ATOM 0 H SER A 99 -3.896 4.081 3.719 1.00 0.00 H new ATOM 0 HA SER A 99 -6.817 4.008 3.752 1.00 0.00 H new ATOM 0 HB2 SER A 99 -6.063 4.997 5.936 1.00 0.00 H new ATOM 0 HB3 SER A 99 -5.246 6.254 5.027 1.00 0.00 H new ATOM 0 HG SER A 99 -8.048 5.632 4.899 1.00 0.00 H new ATOM 1559 N PHE A 100 -6.669 5.396 1.669 1.00 0.00 N ATOM 1560 CA PHE A 100 -6.525 6.067 0.397 1.00 0.00 C ATOM 1561 C PHE A 100 -7.130 7.467 0.445 1.00 0.00 C ATOM 1562 O PHE A 100 -6.425 8.452 0.661 1.00 0.00 O ATOM 1563 CB PHE A 100 -7.141 5.254 -0.760 1.00 0.00 C ATOM 1564 CG PHE A 100 -6.488 3.925 -1.029 1.00 0.00 C ATOM 1565 CD1 PHE A 100 -5.288 3.861 -1.714 1.00 0.00 C ATOM 1566 CD2 PHE A 100 -7.082 2.744 -0.620 1.00 0.00 C ATOM 1567 CE1 PHE A 100 -4.691 2.645 -1.983 1.00 0.00 C ATOM 1568 CE2 PHE A 100 -6.486 1.525 -0.884 1.00 0.00 C ATOM 1569 CZ PHE A 100 -5.290 1.476 -1.565 1.00 0.00 C ATOM 0 H PHE A 100 -7.596 5.010 1.848 1.00 0.00 H new ATOM 0 HA PHE A 100 -5.456 6.155 0.204 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -8.196 5.085 -0.543 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.095 5.854 -1.669 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -4.812 4.773 -2.043 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.022 2.775 -0.089 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -3.755 2.610 -2.521 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -6.958 0.611 -0.556 1.00 0.00 H new ATOM 0 HZ PHE A 100 -4.823 0.524 -1.771 1.00 0.00 H new ATOM 1579 N PHE A 101 -8.438 7.545 0.311 1.00 0.00 N ATOM 1580 CA PHE A 101 -9.128 8.821 0.257 1.00 0.00 C ATOM 1581 C PHE A 101 -10.494 8.717 0.920 1.00 0.00 C ATOM 1582 O PHE A 101 -10.831 7.662 1.475 1.00 0.00 O ATOM 1583 CB PHE A 101 -9.229 9.331 -1.203 1.00 0.00 C ATOM 1584 CG PHE A 101 -9.918 8.399 -2.176 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -9.218 7.368 -2.781 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -11.250 8.561 -2.491 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -9.833 6.519 -3.673 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -11.869 7.714 -3.386 1.00 0.00 C ATOM 1589 CZ PHE A 101 -11.159 6.692 -3.975 1.00 0.00 C ATOM 0 H PHE A 101 -9.051 6.733 0.237 1.00 0.00 H new ATOM 0 HA PHE A 101 -8.548 9.556 0.815 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -9.761 10.282 -1.200 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.222 9.530 -1.570 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -8.173 7.228 -2.549 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.815 9.359 -2.032 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -9.273 5.719 -4.134 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -12.913 7.853 -3.625 1.00 0.00 H new ATOM 0 HZ PHE A 101 -11.646 6.028 -4.674 1.00 0.00 H new ATOM 1599 N GLN A 102 -11.263 9.785 0.867 1.00 0.00 N ATOM 1600 CA GLN A 102 -12.528 9.864 1.497 1.00 0.00 C ATOM 1601 C GLN A 102 -13.590 10.273 0.463 1.00 0.00 C ATOM 1602 O GLN A 102 -13.322 11.120 -0.395 1.00 0.00 O ATOM 1603 CB GLN A 102 -12.443 10.945 2.551 1.00 0.00 C ATOM 1604 CG GLN A 102 -13.662 11.036 3.365 1.00 0.00 C ATOM 1605 CD GLN A 102 -13.773 12.333 4.115 1.00 0.00 C ATOM 1606 OE1 GLN A 102 -14.355 13.288 3.634 1.00 0.00 O ATOM 1607 NE2 GLN A 102 -13.191 12.394 5.264 1.00 0.00 N ATOM 0 H GLN A 102 -11.002 10.635 0.367 1.00 0.00 H new ATOM 0 HA GLN A 102 -12.797 8.903 1.934 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -11.590 10.748 3.201 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -12.260 11.905 2.068 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -14.533 10.921 2.719 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -13.680 10.209 4.075 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -12.712 11.574 5.637 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -13.209 13.262 5.800 1.00 0.00 H new ATOM 1616 N ILE A 103 -14.756 9.664 0.537 1.00 0.00 N ATOM 1617 CA ILE A 103 -15.884 9.993 -0.312 1.00 0.00 C ATOM 1618 C ILE A 103 -17.123 10.201 0.554 1.00 0.00 C ATOM 1619 O ILE A 103 -17.196 9.719 1.705 1.00 0.00 O ATOM 1620 CB ILE A 103 -16.192 8.896 -1.374 1.00 0.00 C ATOM 1621 CG1 ILE A 103 -16.676 7.605 -0.704 1.00 0.00 C ATOM 1622 CG2 ILE A 103 -14.971 8.642 -2.231 1.00 0.00 C ATOM 1623 CD1 ILE A 103 -17.036 6.516 -1.677 1.00 0.00 C ATOM 0 H ILE A 103 -14.950 8.914 1.200 1.00 0.00 H new ATOM 0 HA ILE A 103 -15.619 10.902 -0.851 1.00 0.00 H new ATOM 0 HB ILE A 103 -16.995 9.253 -2.018 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -15.897 7.239 -0.035 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -17.546 7.831 -0.087 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -15.198 7.873 -2.970 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -14.687 9.562 -2.741 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -14.147 8.307 -1.601 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -17.369 5.634 -1.129 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -17.837 6.862 -2.330 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -16.163 6.261 -2.278 1.00 0.00 H new ATOM 1635 N ASP A 104 -18.074 10.897 0.014 1.00 0.00 N ATOM 1636 CA ASP A 104 -19.291 11.215 0.710 1.00 0.00 C ATOM 1637 C ASP A 104 -20.243 10.048 0.625 1.00 0.00 C ATOM 1638 O ASP A 104 -20.755 9.719 -0.472 1.00 0.00 O ATOM 1639 CB ASP A 104 -19.950 12.380 0.046 1.00 0.00 C ATOM 1640 CG ASP A 104 -20.910 13.098 0.918 1.00 0.00 C ATOM 1641 OD1 ASP A 104 -20.547 13.424 2.077 1.00 0.00 O ATOM 1642 OD2 ASP A 104 -22.012 13.423 0.453 1.00 0.00 O ATOM 0 H ASP A 104 -18.031 11.267 -0.935 1.00 0.00 H new ATOM 0 HA ASP A 104 -19.053 11.442 1.749 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -19.183 13.079 -0.287 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.472 12.031 -0.845 1.00 0.00 H new ATOM 1647 N LEU A 105 -20.527 9.432 1.740 1.00 0.00 N ATOM 1648 CA LEU A 105 -21.400 8.292 1.721 1.00 0.00 C ATOM 1649 C LEU A 105 -22.790 8.662 1.343 1.00 0.00 C ATOM 1650 O LEU A 105 -23.471 7.904 0.667 1.00 0.00 O ATOM 1651 CB LEU A 105 -21.436 7.502 3.005 1.00 0.00 C ATOM 1652 CG LEU A 105 -20.223 6.688 3.396 1.00 0.00 C ATOM 1653 CD1 LEU A 105 -20.707 5.545 4.252 1.00 0.00 C ATOM 1654 CD2 LEU A 105 -19.460 6.166 2.186 1.00 0.00 C ATOM 0 H LEU A 105 -20.173 9.695 2.660 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.963 7.645 0.960 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -21.640 8.201 3.816 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -22.286 6.822 2.950 1.00 0.00 H new ATOM 0 HG LEU A 105 -19.523 7.321 3.942 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -19.858 4.932 4.555 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -21.205 5.939 5.138 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -21.409 4.936 3.683 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -18.598 5.588 2.521 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -20.114 5.530 1.590 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -19.120 7.006 1.580 1.00 0.00 H new ATOM 1666 N GLU A 106 -23.209 9.820 1.748 1.00 0.00 N ATOM 1667 CA GLU A 106 -24.521 10.268 1.430 1.00 0.00 C ATOM 1668 C GLU A 106 -24.657 10.634 -0.042 1.00 0.00 C ATOM 1669 O GLU A 106 -25.774 10.705 -0.565 1.00 0.00 O ATOM 1670 CB GLU A 106 -24.955 11.383 2.362 1.00 0.00 C ATOM 1671 CG GLU A 106 -23.945 12.481 2.548 1.00 0.00 C ATOM 1672 CD GLU A 106 -24.475 13.613 3.367 1.00 0.00 C ATOM 1673 OE1 GLU A 106 -24.808 13.399 4.545 1.00 0.00 O ATOM 1674 OE2 GLU A 106 -24.596 14.734 2.856 1.00 0.00 O ATOM 0 H GLU A 106 -22.655 10.473 2.302 1.00 0.00 H new ATOM 0 HA GLU A 106 -25.208 9.438 1.592 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -25.878 11.819 1.979 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -25.186 10.953 3.337 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -23.055 12.074 3.029 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -23.637 12.856 1.572 1.00 0.00 H new ATOM 1681 N ARG A 107 -23.524 10.829 -0.724 1.00 0.00 N ATOM 1682 CA ARG A 107 -23.564 11.112 -2.136 1.00 0.00 C ATOM 1683 C ARG A 107 -23.576 9.812 -2.929 1.00 0.00 C ATOM 1684 O ARG A 107 -23.855 9.810 -4.135 1.00 0.00 O ATOM 1685 CB ARG A 107 -22.424 12.028 -2.571 1.00 0.00 C ATOM 1686 CG ARG A 107 -21.192 11.345 -3.115 1.00 0.00 C ATOM 1687 CD ARG A 107 -20.132 12.354 -3.524 1.00 0.00 C ATOM 1688 NE ARG A 107 -20.691 13.402 -4.360 1.00 0.00 N ATOM 1689 CZ ARG A 107 -20.071 14.012 -5.358 1.00 0.00 C ATOM 1690 NH1 ARG A 107 -18.764 13.835 -5.548 1.00 0.00 N ATOM 1691 NH2 ARG A 107 -20.757 14.834 -6.145 1.00 0.00 N ATOM 0 H ARG A 107 -22.589 10.794 -0.317 1.00 0.00 H new ATOM 0 HA ARG A 107 -24.487 11.653 -2.346 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.803 12.709 -3.333 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -22.129 12.638 -1.717 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -20.784 10.673 -2.360 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -21.464 10.732 -3.975 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -19.686 12.796 -2.633 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -19.332 11.845 -4.062 1.00 0.00 H new ATOM 0 HE ARG A 107 -21.648 13.694 -4.160 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -18.236 13.227 -4.923 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -18.292 14.308 -6.319 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -21.751 14.990 -5.977 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -20.290 15.309 -6.917 1.00 0.00 H new ATOM 1705 N LEU A 108 -23.217 8.699 -2.259 1.00 0.00 N ATOM 1706 CA LEU A 108 -23.373 7.370 -2.864 1.00 0.00 C ATOM 1707 C LEU A 108 -24.803 7.099 -3.282 1.00 0.00 C ATOM 1708 O LEU A 108 -25.732 7.814 -2.880 1.00 0.00 O ATOM 1709 CB LEU A 108 -22.881 6.215 -1.968 1.00 0.00 C ATOM 1710 CG LEU A 108 -21.428 5.868 -2.096 1.00 0.00 C ATOM 1711 CD1 LEU A 108 -20.538 6.599 -1.172 1.00 0.00 C ATOM 1712 CD2 LEU A 108 -21.153 4.391 -2.149 1.00 0.00 C ATOM 0 H LEU A 108 -22.825 8.696 -1.317 1.00 0.00 H new ATOM 0 HA LEU A 108 -22.734 7.398 -3.747 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -23.084 6.474 -0.929 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -23.470 5.326 -2.196 1.00 0.00 H new ATOM 0 HG LEU A 108 -21.160 6.242 -3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -19.507 6.285 -1.335 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -20.624 7.670 -1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -20.825 6.382 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -20.080 4.224 -2.242 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -21.516 3.920 -1.235 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -21.663 3.956 -3.008 1.00 0.00 H new ATOM 1724 N GLU A 109 -24.972 6.077 -4.097 1.00 0.00 N ATOM 1725 CA GLU A 109 -26.286 5.684 -4.576 1.00 0.00 C ATOM 1726 C GLU A 109 -27.157 5.229 -3.390 1.00 0.00 C ATOM 1727 O GLU A 109 -27.974 5.993 -2.869 1.00 0.00 O ATOM 1728 CB GLU A 109 -26.165 4.535 -5.543 1.00 0.00 C ATOM 1729 CG GLU A 109 -25.187 4.699 -6.667 1.00 0.00 C ATOM 1730 CD GLU A 109 -25.074 3.412 -7.429 1.00 0.00 C ATOM 1731 OE1 GLU A 109 -24.867 2.350 -6.788 1.00 0.00 O ATOM 1732 OE2 GLU A 109 -25.263 3.414 -8.662 1.00 0.00 O ATOM 0 H GLU A 109 -24.208 5.497 -4.445 1.00 0.00 H new ATOM 0 HA GLU A 109 -26.742 6.540 -5.074 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -25.889 3.644 -4.979 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -27.149 4.348 -5.973 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -25.513 5.499 -7.332 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -24.212 4.988 -6.275 1.00 0.00 H new ATOM 1739 N SER A 110 -26.963 3.988 -2.953 1.00 0.00 N ATOM 1740 CA SER A 110 -27.693 3.437 -1.835 1.00 0.00 C ATOM 1741 C SER A 110 -26.924 2.287 -1.134 1.00 0.00 C ATOM 1742 O SER A 110 -26.129 2.539 -0.222 1.00 0.00 O ATOM 1743 CB SER A 110 -29.107 2.994 -2.257 1.00 0.00 C ATOM 1744 OG SER A 110 -29.895 4.105 -2.711 1.00 0.00 O ATOM 0 H SER A 110 -26.293 3.342 -3.370 1.00 0.00 H new ATOM 0 HA SER A 110 -27.796 4.236 -1.100 1.00 0.00 H new ATOM 0 HB2 SER A 110 -29.034 2.250 -3.051 1.00 0.00 H new ATOM 0 HB3 SER A 110 -29.605 2.514 -1.415 1.00 0.00 H new ATOM 0 HG SER A 110 -29.445 4.943 -2.475 1.00 0.00 H new ATOM 1750 N HIS A 111 -27.064 1.045 -1.635 1.00 0.00 N ATOM 1751 CA HIS A 111 -26.514 -0.132 -0.926 1.00 0.00 C ATOM 1752 C HIS A 111 -25.000 -0.229 -1.046 1.00 0.00 C ATOM 1753 O HIS A 111 -24.362 -0.938 -0.279 1.00 0.00 O ATOM 1754 CB HIS A 111 -27.197 -1.466 -1.352 1.00 0.00 C ATOM 1755 CG HIS A 111 -26.820 -2.001 -2.717 1.00 0.00 C ATOM 1756 ND1 HIS A 111 -26.126 -3.178 -2.910 1.00 0.00 N ATOM 1757 CD2 HIS A 111 -27.060 -1.509 -3.954 1.00 0.00 C ATOM 1758 CE1 HIS A 111 -25.962 -3.355 -4.219 1.00 0.00 C ATOM 1759 NE2 HIS A 111 -26.511 -2.368 -4.908 1.00 0.00 N ATOM 0 H HIS A 111 -27.543 0.830 -2.510 1.00 0.00 H new ATOM 0 HA HIS A 111 -26.748 0.026 0.127 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -26.959 -2.226 -0.608 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -28.277 -1.322 -1.326 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -27.593 -0.595 -4.170 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -25.448 -4.195 -4.661 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -26.529 -2.258 -5.922 1.00 0.00 H new ATOM 1767 N MET A 112 -24.452 0.480 -2.014 1.00 0.00 N ATOM 1768 CA MET A 112 -23.009 0.548 -2.245 1.00 0.00 C ATOM 1769 C MET A 112 -22.230 0.882 -0.971 1.00 0.00 C ATOM 1770 O MET A 112 -21.355 0.129 -0.553 1.00 0.00 O ATOM 1771 CB MET A 112 -22.707 1.578 -3.327 1.00 0.00 C ATOM 1772 CG MET A 112 -22.809 1.065 -4.748 1.00 0.00 C ATOM 1773 SD MET A 112 -21.425 0.006 -5.187 1.00 0.00 S ATOM 1774 CE MET A 112 -20.076 1.179 -5.036 1.00 0.00 C ATOM 0 H MET A 112 -24.997 1.034 -2.674 1.00 0.00 H new ATOM 0 HA MET A 112 -22.684 -0.440 -2.572 1.00 0.00 H new ATOM 0 HB2 MET A 112 -23.393 2.417 -3.210 1.00 0.00 H new ATOM 0 HB3 MET A 112 -21.700 1.965 -3.168 1.00 0.00 H new ATOM 0 HG2 MET A 112 -23.740 0.511 -4.867 1.00 0.00 H new ATOM 0 HG3 MET A 112 -22.851 1.910 -5.436 1.00 0.00 H new ATOM 0 HE1 MET A 112 -19.441 1.119 -5.920 1.00 0.00 H new ATOM 0 HE2 MET A 112 -20.479 2.188 -4.946 1.00 0.00 H new ATOM 0 HE3 MET A 112 -19.487 0.944 -4.150 1.00 0.00 H new ATOM 1784 N GLN A 113 -22.586 1.980 -0.334 1.00 0.00 N ATOM 1785 CA GLN A 113 -21.886 2.410 0.864 1.00 0.00 C ATOM 1786 C GLN A 113 -22.237 1.546 2.041 1.00 0.00 C ATOM 1787 O GLN A 113 -21.410 1.302 2.894 1.00 0.00 O ATOM 1788 CB GLN A 113 -22.067 3.901 1.142 1.00 0.00 C ATOM 1789 CG GLN A 113 -23.473 4.364 1.003 1.00 0.00 C ATOM 1790 CD GLN A 113 -24.156 4.733 2.284 1.00 0.00 C ATOM 1791 OE1 GLN A 113 -24.694 3.895 2.976 1.00 0.00 O ATOM 1792 NE2 GLN A 113 -24.243 5.997 2.521 1.00 0.00 N ATOM 0 H GLN A 113 -23.352 2.589 -0.623 1.00 0.00 H new ATOM 0 HA GLN A 113 -20.819 2.276 0.684 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -21.719 4.119 2.152 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -21.436 4.469 0.458 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -23.489 5.229 0.340 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -24.050 3.578 0.516 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -23.772 6.664 1.910 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -24.783 6.330 3.320 1.00 0.00 H new ATOM 1801 N LYS A 114 -23.462 1.069 2.067 1.00 0.00 N ATOM 1802 CA LYS A 114 -23.892 0.088 3.067 1.00 0.00 C ATOM 1803 C LYS A 114 -23.002 -1.173 3.009 1.00 0.00 C ATOM 1804 O LYS A 114 -22.670 -1.772 4.050 1.00 0.00 O ATOM 1805 CB LYS A 114 -25.352 -0.276 2.831 1.00 0.00 C ATOM 1806 CG LYS A 114 -26.296 0.908 2.902 1.00 0.00 C ATOM 1807 CD LYS A 114 -26.338 1.517 4.295 1.00 0.00 C ATOM 1808 CE LYS A 114 -27.245 2.727 4.334 1.00 0.00 C ATOM 1809 NZ LYS A 114 -27.138 3.465 5.614 1.00 0.00 N ATOM 0 H LYS A 114 -24.190 1.340 1.406 1.00 0.00 H new ATOM 0 HA LYS A 114 -23.791 0.526 4.060 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -25.446 -0.746 1.852 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -25.656 -1.017 3.571 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -25.983 1.666 2.184 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -27.298 0.591 2.614 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -26.689 0.773 5.010 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -25.332 1.803 4.601 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -26.993 3.394 3.510 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -28.277 2.410 4.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -27.777 4.286 5.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -27.403 2.837 6.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -26.159 3.791 5.746 1.00 0.00 H new ATOM 1823 N ASN A 115 -22.592 -1.553 1.797 1.00 0.00 N ATOM 1824 CA ASN A 115 -21.691 -2.687 1.602 1.00 0.00 C ATOM 1825 C ASN A 115 -20.340 -2.370 2.169 1.00 0.00 C ATOM 1826 O ASN A 115 -19.691 -3.213 2.759 1.00 0.00 O ATOM 1827 CB ASN A 115 -21.541 -3.084 0.122 1.00 0.00 C ATOM 1828 CG ASN A 115 -22.751 -3.783 -0.453 1.00 0.00 C ATOM 1829 OD1 ASN A 115 -23.505 -4.430 0.270 1.00 0.00 O ATOM 1830 ND2 ASN A 115 -22.912 -3.720 -1.748 1.00 0.00 N ATOM 0 H ASN A 115 -22.872 -1.088 0.933 1.00 0.00 H new ATOM 0 HA ASN A 115 -22.135 -3.535 2.124 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -21.339 -2.188 -0.465 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -20.674 -3.736 0.018 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -23.684 -4.218 -2.191 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -22.266 -3.173 -2.316 1.00 0.00 H new ATOM 1837 N LEU A 116 -19.949 -1.135 2.023 1.00 0.00 N ATOM 1838 CA LEU A 116 -18.673 -0.652 2.518 1.00 0.00 C ATOM 1839 C LEU A 116 -18.691 -0.567 4.053 1.00 0.00 C ATOM 1840 O LEU A 116 -17.643 -0.623 4.702 1.00 0.00 O ATOM 1841 CB LEU A 116 -18.390 0.721 1.926 1.00 0.00 C ATOM 1842 CG LEU A 116 -18.436 0.825 0.398 1.00 0.00 C ATOM 1843 CD1 LEU A 116 -18.273 2.264 -0.043 1.00 0.00 C ATOM 1844 CD2 LEU A 116 -17.368 -0.052 -0.237 1.00 0.00 C ATOM 0 H LEU A 116 -20.507 -0.422 1.553 1.00 0.00 H new ATOM 0 HA LEU A 116 -17.888 -1.347 2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -19.111 1.427 2.339 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -17.403 1.041 2.261 1.00 0.00 H new ATOM 0 HG LEU A 116 -19.411 0.470 0.063 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -18.308 2.317 -1.131 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -19.079 2.867 0.376 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -17.314 2.646 0.308 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -17.421 0.039 -1.322 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.384 0.267 0.107 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.533 -1.091 0.049 1.00 0.00 H new ATOM 1856 N LEU A 117 -19.892 -0.409 4.617 1.00 0.00 N ATOM 1857 CA LEU A 117 -20.079 -0.358 6.059 1.00 0.00 C ATOM 1858 C LEU A 117 -19.789 -1.701 6.687 1.00 0.00 C ATOM 1859 O LEU A 117 -19.047 -1.783 7.663 1.00 0.00 O ATOM 1860 CB LEU A 117 -21.500 0.073 6.442 1.00 0.00 C ATOM 1861 CG LEU A 117 -21.989 1.413 5.909 1.00 0.00 C ATOM 1862 CD1 LEU A 117 -23.351 1.750 6.472 1.00 0.00 C ATOM 1863 CD2 LEU A 117 -21.007 2.509 6.207 1.00 0.00 C ATOM 0 H LEU A 117 -20.756 -0.314 4.083 1.00 0.00 H new ATOM 0 HA LEU A 117 -19.377 0.386 6.436 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -22.190 -0.698 6.101 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -21.563 0.099 7.530 1.00 0.00 H new ATOM 0 HG LEU A 117 -22.076 1.327 4.826 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -23.680 2.711 6.077 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -24.064 0.977 6.186 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -23.292 1.805 7.559 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -21.385 3.453 5.814 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -20.872 2.593 7.285 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -20.050 2.278 5.738 1.00 0.00 H new ATOM 1875 N LYS A 118 -20.367 -2.767 6.137 1.00 0.00 N ATOM 1876 CA LYS A 118 -20.116 -4.075 6.727 1.00 0.00 C ATOM 1877 C LYS A 118 -18.846 -4.671 6.182 1.00 0.00 C ATOM 1878 O LYS A 118 -18.271 -5.573 6.779 1.00 0.00 O ATOM 1879 CB LYS A 118 -21.284 -5.086 6.605 1.00 0.00 C ATOM 1880 CG LYS A 118 -21.469 -5.757 5.255 1.00 0.00 C ATOM 1881 CD LYS A 118 -22.173 -4.921 4.190 1.00 0.00 C ATOM 1882 CE LYS A 118 -23.696 -4.784 4.402 1.00 0.00 C ATOM 1883 NZ LYS A 118 -24.070 -3.934 5.555 1.00 0.00 N ATOM 0 H LYS A 118 -20.983 -2.755 5.324 1.00 0.00 H new ATOM 0 HA LYS A 118 -20.012 -3.885 7.795 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -21.140 -5.864 7.355 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -22.210 -4.568 6.857 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -20.488 -6.044 4.875 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -22.036 -6.676 5.402 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -21.728 -3.926 4.172 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -21.992 -5.369 3.213 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -24.142 -4.369 3.498 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -24.124 -5.777 4.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -24.976 -3.463 5.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -24.164 -4.525 6.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -23.333 -3.217 5.711 1.00 0.00 H new ATOM 1897 N GLY A 119 -18.406 -4.171 5.049 1.00 0.00 N ATOM 1898 CA GLY A 119 -17.218 -4.658 4.470 1.00 0.00 C ATOM 1899 C GLY A 119 -17.538 -5.659 3.428 1.00 0.00 C ATOM 1900 O GLY A 119 -18.356 -6.566 3.658 1.00 0.00 O ATOM 0 H GLY A 119 -18.868 -3.427 4.526 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -16.652 -3.835 4.034 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -16.587 -5.108 5.237 1.00 0.00 H new ATOM 1904 N ILE A 120 -16.951 -5.486 2.283 1.00 0.00 N ATOM 1905 CA ILE A 120 -17.160 -6.381 1.170 1.00 0.00 C ATOM 1906 C ILE A 120 -16.680 -7.772 1.577 1.00 0.00 C ATOM 1907 O ILE A 120 -15.570 -7.916 2.018 1.00 0.00 O ATOM 1908 CB ILE A 120 -16.389 -5.897 -0.089 1.00 0.00 C ATOM 1909 CG1 ILE A 120 -16.655 -4.397 -0.342 1.00 0.00 C ATOM 1910 CG2 ILE A 120 -16.788 -6.715 -1.311 1.00 0.00 C ATOM 1911 CD1 ILE A 120 -18.120 -4.026 -0.385 1.00 0.00 C ATOM 0 H ILE A 120 -16.309 -4.718 2.087 1.00 0.00 H new ATOM 0 HA ILE A 120 -18.220 -6.404 0.918 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.323 -6.038 0.089 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -16.167 -3.816 0.441 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -16.192 -4.112 -1.286 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -16.237 -6.360 -2.182 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -16.555 -7.766 -1.137 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -17.858 -6.605 -1.489 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -18.219 -2.956 -0.567 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -18.612 -4.577 -1.187 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -18.587 -4.277 0.567 1.00 0.00 H new ATOM 1923 N PRO A 121 -17.529 -8.799 1.462 1.00 0.00 N ATOM 1924 CA PRO A 121 -17.215 -10.150 1.955 1.00 0.00 C ATOM 1925 C PRO A 121 -16.108 -10.877 1.193 1.00 0.00 C ATOM 1926 O PRO A 121 -15.591 -11.894 1.672 1.00 0.00 O ATOM 1927 CB PRO A 121 -18.543 -10.898 1.826 1.00 0.00 C ATOM 1928 CG PRO A 121 -19.281 -10.172 0.753 1.00 0.00 C ATOM 1929 CD PRO A 121 -18.885 -8.731 0.882 1.00 0.00 C ATOM 0 HA PRO A 121 -16.820 -10.098 2.970 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -18.385 -11.943 1.561 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -19.097 -10.887 2.765 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -19.021 -10.561 -0.231 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -20.358 -10.293 0.870 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -18.884 -8.227 -0.084 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -19.571 -8.182 1.527 1.00 0.00 H new ATOM 1937 N PHE A 122 -15.737 -10.353 0.040 1.00 0.00 N ATOM 1938 CA PHE A 122 -14.733 -10.986 -0.812 1.00 0.00 C ATOM 1939 C PHE A 122 -14.443 -10.093 -2.026 1.00 0.00 C ATOM 1940 O PHE A 122 -15.343 -9.394 -2.515 1.00 0.00 O ATOM 1941 CB PHE A 122 -15.242 -12.370 -1.280 1.00 0.00 C ATOM 1942 CG PHE A 122 -14.208 -13.221 -1.949 1.00 0.00 C ATOM 1943 CD1 PHE A 122 -13.230 -13.852 -1.201 1.00 0.00 C ATOM 1944 CD2 PHE A 122 -14.219 -13.400 -3.315 1.00 0.00 C ATOM 1945 CE1 PHE A 122 -12.283 -14.642 -1.807 1.00 0.00 C ATOM 1946 CE2 PHE A 122 -13.275 -14.189 -3.927 1.00 0.00 C ATOM 1947 CZ PHE A 122 -12.305 -14.810 -3.172 1.00 0.00 C ATOM 0 H PHE A 122 -16.116 -9.484 -0.335 1.00 0.00 H new ATOM 0 HA PHE A 122 -13.812 -11.120 -0.244 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -15.634 -12.909 -0.418 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -16.074 -12.223 -1.969 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -13.211 -13.722 -0.129 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -14.978 -12.915 -3.911 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -11.524 -15.129 -1.213 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -13.294 -14.322 -4.999 1.00 0.00 H new ATOM 0 HZ PHE A 122 -11.561 -15.429 -3.652 1.00 0.00 H new ATOM 1957 N ARG A 123 -13.211 -10.110 -2.511 1.00 0.00 N ATOM 1958 CA ARG A 123 -12.802 -9.328 -3.675 1.00 0.00 C ATOM 1959 C ARG A 123 -11.775 -10.095 -4.473 1.00 0.00 C ATOM 1960 O ARG A 123 -11.249 -11.112 -4.013 1.00 0.00 O ATOM 1961 CB ARG A 123 -12.176 -7.968 -3.278 1.00 0.00 C ATOM 1962 CG ARG A 123 -13.119 -6.882 -2.753 1.00 0.00 C ATOM 1963 CD ARG A 123 -14.017 -6.288 -3.845 1.00 0.00 C ATOM 1964 NE ARG A 123 -15.060 -7.207 -4.312 1.00 0.00 N ATOM 1965 CZ ARG A 123 -15.895 -6.969 -5.342 1.00 0.00 C ATOM 1966 NH1 ARG A 123 -15.765 -5.865 -6.080 1.00 0.00 N ATOM 1967 NH2 ARG A 123 -16.843 -7.835 -5.629 1.00 0.00 N ATOM 0 H ARG A 123 -12.459 -10.669 -2.108 1.00 0.00 H new ATOM 0 HA ARG A 123 -13.702 -9.143 -4.262 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -11.421 -8.155 -2.515 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -11.656 -7.570 -4.149 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -13.744 -7.302 -1.965 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -12.529 -6.084 -2.301 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -14.487 -5.382 -3.464 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -13.398 -5.994 -4.692 1.00 0.00 H new ATOM 0 HE ARG A 123 -15.161 -8.094 -3.819 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -15.028 -5.192 -5.866 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -16.402 -5.694 -6.858 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -16.944 -8.684 -5.072 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -17.477 -7.658 -6.408 1.00 0.00 H new ATOM 1981 N THR A 124 -11.500 -9.589 -5.645 1.00 0.00 N ATOM 1982 CA THR A 124 -10.490 -10.095 -6.528 1.00 0.00 C ATOM 1983 C THR A 124 -9.794 -8.835 -7.083 1.00 0.00 C ATOM 1984 O THR A 124 -10.330 -7.731 -6.885 1.00 0.00 O ATOM 1985 CB THR A 124 -11.138 -10.925 -7.662 1.00 0.00 C ATOM 1986 OG1 THR A 124 -12.131 -11.812 -7.109 1.00 0.00 O ATOM 1987 CG2 THR A 124 -10.108 -11.760 -8.383 1.00 0.00 C ATOM 0 H THR A 124 -11.994 -8.781 -6.023 1.00 0.00 H new ATOM 0 HA THR A 124 -9.785 -10.759 -6.028 1.00 0.00 H new ATOM 0 HB THR A 124 -11.593 -10.228 -8.366 1.00 0.00 H new ATOM 0 HG1 THR A 124 -13.026 -11.455 -7.289 1.00 0.00 H new ATOM 0 HG21 THR A 124 -10.593 -12.332 -9.174 1.00 0.00 H new ATOM 0 HG22 THR A 124 -9.351 -11.108 -8.818 1.00 0.00 H new ATOM 0 HG23 THR A 124 -9.636 -12.444 -7.678 1.00 0.00 H new ATOM 1995 N LYS A 125 -8.674 -8.968 -7.782 1.00 0.00 N ATOM 1996 CA LYS A 125 -7.867 -7.812 -8.188 1.00 0.00 C ATOM 1997 C LYS A 125 -8.613 -6.817 -9.069 1.00 0.00 C ATOM 1998 O LYS A 125 -8.615 -5.616 -8.789 1.00 0.00 O ATOM 1999 CB LYS A 125 -6.547 -8.250 -8.837 1.00 0.00 C ATOM 2000 CG LYS A 125 -6.704 -9.141 -10.065 1.00 0.00 C ATOM 2001 CD LYS A 125 -5.364 -9.552 -10.637 1.00 0.00 C ATOM 2002 CE LYS A 125 -4.587 -8.360 -11.160 1.00 0.00 C ATOM 2003 NZ LYS A 125 -3.303 -8.753 -11.752 1.00 0.00 N ATOM 0 H LYS A 125 -8.298 -9.867 -8.083 1.00 0.00 H new ATOM 0 HA LYS A 125 -7.639 -7.277 -7.266 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -5.985 -7.360 -9.120 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -5.951 -8.780 -8.094 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -7.273 -10.031 -9.798 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -7.278 -8.613 -10.827 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -4.780 -10.058 -9.868 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -5.517 -10.269 -11.444 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -5.185 -7.838 -11.907 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -4.410 -7.658 -10.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -2.966 -7.998 -12.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.606 -8.910 -10.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -3.426 -9.630 -12.297 1.00 0.00 H new ATOM 2017 N ALA A 126 -9.320 -7.312 -10.057 1.00 0.00 N ATOM 2018 CA ALA A 126 -9.971 -6.447 -11.006 1.00 0.00 C ATOM 2019 C ALA A 126 -11.247 -5.918 -10.420 1.00 0.00 C ATOM 2020 O ALA A 126 -11.772 -4.895 -10.840 1.00 0.00 O ATOM 2021 CB ALA A 126 -10.229 -7.201 -12.283 1.00 0.00 C ATOM 0 H ALA A 126 -9.458 -8.309 -10.223 1.00 0.00 H new ATOM 0 HA ALA A 126 -9.326 -5.599 -11.234 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -10.722 -6.544 -13.000 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -9.283 -7.547 -12.699 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -10.870 -8.058 -12.076 1.00 0.00 H new ATOM 2027 N GLU A 127 -11.735 -6.615 -9.428 1.00 0.00 N ATOM 2028 CA GLU A 127 -12.950 -6.241 -8.777 1.00 0.00 C ATOM 2029 C GLU A 127 -12.665 -5.196 -7.716 1.00 0.00 C ATOM 2030 O GLU A 127 -13.549 -4.438 -7.322 1.00 0.00 O ATOM 2031 CB GLU A 127 -13.610 -7.448 -8.171 1.00 0.00 C ATOM 2032 CG GLU A 127 -13.695 -8.612 -9.121 1.00 0.00 C ATOM 2033 CD GLU A 127 -14.641 -9.662 -8.624 1.00 0.00 C ATOM 2034 OE1 GLU A 127 -14.278 -10.411 -7.708 1.00 0.00 O ATOM 2035 OE2 GLU A 127 -15.780 -9.729 -9.128 1.00 0.00 O ATOM 0 H GLU A 127 -11.297 -7.457 -9.053 1.00 0.00 H new ATOM 0 HA GLU A 127 -13.632 -5.814 -9.513 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -13.055 -7.751 -7.283 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -14.614 -7.180 -7.843 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -14.022 -8.261 -10.100 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -12.704 -9.047 -9.253 1.00 0.00 H new ATOM 2042 N PHE A 128 -11.429 -5.169 -7.247 1.00 0.00 N ATOM 2043 CA PHE A 128 -10.983 -4.169 -6.315 1.00 0.00 C ATOM 2044 C PHE A 128 -10.962 -2.835 -7.021 1.00 0.00 C ATOM 2045 O PHE A 128 -11.533 -1.869 -6.555 1.00 0.00 O ATOM 2046 CB PHE A 128 -9.581 -4.513 -5.774 1.00 0.00 C ATOM 2047 CG PHE A 128 -8.982 -3.411 -4.953 1.00 0.00 C ATOM 2048 CD1 PHE A 128 -9.189 -3.351 -3.596 1.00 0.00 C ATOM 2049 CD2 PHE A 128 -8.244 -2.411 -5.564 1.00 0.00 C ATOM 2050 CE1 PHE A 128 -8.673 -2.314 -2.851 1.00 0.00 C ATOM 2051 CE2 PHE A 128 -7.722 -1.376 -4.833 1.00 0.00 C ATOM 2052 CZ PHE A 128 -7.939 -1.324 -3.469 1.00 0.00 C ATOM 0 H PHE A 128 -10.711 -5.845 -7.508 1.00 0.00 H new ATOM 0 HA PHE A 128 -11.664 -4.130 -5.465 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -9.643 -5.417 -5.168 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -8.919 -4.735 -6.611 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -9.763 -4.125 -3.108 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -8.078 -2.447 -6.630 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -8.843 -2.276 -1.785 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -7.144 -0.605 -5.320 1.00 0.00 H new ATOM 0 HZ PHE A 128 -7.534 -0.509 -2.888 1.00 0.00 H new ATOM 2062 N GLU A 129 -10.319 -2.793 -8.151 1.00 0.00 N ATOM 2063 CA GLU A 129 -10.271 -1.582 -8.904 1.00 0.00 C ATOM 2064 C GLU A 129 -11.626 -1.223 -9.496 1.00 0.00 C ATOM 2065 O GLU A 129 -11.884 -0.079 -9.773 1.00 0.00 O ATOM 2066 CB GLU A 129 -9.138 -1.580 -9.920 1.00 0.00 C ATOM 2067 CG GLU A 129 -9.006 -2.832 -10.743 1.00 0.00 C ATOM 2068 CD GLU A 129 -7.932 -2.698 -11.781 1.00 0.00 C ATOM 2069 OE1 GLU A 129 -6.740 -2.860 -11.446 1.00 0.00 O ATOM 2070 OE2 GLU A 129 -8.253 -2.394 -12.955 1.00 0.00 O ATOM 0 H GLU A 129 -9.824 -3.582 -8.567 1.00 0.00 H new ATOM 0 HA GLU A 129 -10.035 -0.777 -8.208 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -9.279 -0.736 -10.595 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -8.199 -1.412 -9.392 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -8.779 -3.675 -10.090 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -9.957 -3.051 -11.228 1.00 0.00 H new ATOM 2077 N ASP A 130 -12.499 -2.218 -9.630 1.00 0.00 N ATOM 2078 CA ASP A 130 -13.883 -2.003 -10.113 1.00 0.00 C ATOM 2079 C ASP A 130 -14.683 -1.238 -9.072 1.00 0.00 C ATOM 2080 O ASP A 130 -15.452 -0.337 -9.382 1.00 0.00 O ATOM 2081 CB ASP A 130 -14.573 -3.339 -10.368 1.00 0.00 C ATOM 2082 CG ASP A 130 -15.975 -3.192 -10.934 1.00 0.00 C ATOM 2083 OD1 ASP A 130 -16.120 -3.052 -12.166 1.00 0.00 O ATOM 2084 OD2 ASP A 130 -16.949 -3.233 -10.163 1.00 0.00 O ATOM 0 H ASP A 130 -12.282 -3.191 -9.413 1.00 0.00 H new ATOM 0 HA ASP A 130 -13.834 -1.434 -11.041 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -13.969 -3.926 -11.060 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -14.622 -3.899 -9.434 1.00 0.00 H new ATOM 2089 N VAL A 131 -14.511 -1.615 -7.841 1.00 0.00 N ATOM 2090 CA VAL A 131 -15.176 -0.922 -6.758 1.00 0.00 C ATOM 2091 C VAL A 131 -14.456 0.410 -6.455 1.00 0.00 C ATOM 2092 O VAL A 131 -15.092 1.432 -6.199 1.00 0.00 O ATOM 2093 CB VAL A 131 -15.346 -1.827 -5.480 1.00 0.00 C ATOM 2094 CG1 VAL A 131 -14.036 -2.345 -4.971 1.00 0.00 C ATOM 2095 CG2 VAL A 131 -16.079 -1.104 -4.376 1.00 0.00 C ATOM 0 H VAL A 131 -13.920 -2.395 -7.553 1.00 0.00 H new ATOM 0 HA VAL A 131 -16.190 -0.686 -7.080 1.00 0.00 H new ATOM 0 HB VAL A 131 -15.946 -2.681 -5.794 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -14.207 -2.963 -4.090 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -13.555 -2.943 -5.746 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -13.391 -1.507 -4.707 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -16.176 -1.762 -3.512 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -15.521 -0.212 -4.092 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -17.070 -0.816 -4.726 1.00 0.00 H new ATOM 2105 N ILE A 132 -13.136 0.404 -6.559 1.00 0.00 N ATOM 2106 CA ILE A 132 -12.332 1.597 -6.326 1.00 0.00 C ATOM 2107 C ILE A 132 -12.568 2.682 -7.376 1.00 0.00 C ATOM 2108 O ILE A 132 -12.604 3.872 -7.039 1.00 0.00 O ATOM 2109 CB ILE A 132 -10.814 1.266 -6.118 1.00 0.00 C ATOM 2110 CG1 ILE A 132 -10.484 1.174 -4.616 1.00 0.00 C ATOM 2111 CG2 ILE A 132 -9.884 2.250 -6.822 1.00 0.00 C ATOM 2112 CD1 ILE A 132 -11.299 0.151 -3.852 1.00 0.00 C ATOM 0 H ILE A 132 -12.593 -0.423 -6.806 1.00 0.00 H new ATOM 0 HA ILE A 132 -12.678 2.019 -5.383 1.00 0.00 H new ATOM 0 HB ILE A 132 -10.638 0.296 -6.582 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -9.427 0.934 -4.504 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -10.638 2.153 -4.163 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -8.848 1.966 -6.639 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.081 2.234 -7.894 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -10.058 3.255 -6.436 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -10.999 0.156 -2.804 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -12.358 0.399 -3.928 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -11.127 -0.839 -4.274 1.00 0.00 H new ATOM 2124 N GLU A 133 -12.777 2.286 -8.624 1.00 0.00 N ATOM 2125 CA GLU A 133 -13.070 3.248 -9.672 1.00 0.00 C ATOM 2126 C GLU A 133 -14.415 3.918 -9.402 1.00 0.00 C ATOM 2127 O GLU A 133 -14.646 5.062 -9.774 1.00 0.00 O ATOM 2128 CB GLU A 133 -13.038 2.618 -11.066 1.00 0.00 C ATOM 2129 CG GLU A 133 -14.089 1.571 -11.299 1.00 0.00 C ATOM 2130 CD GLU A 133 -14.097 1.045 -12.699 1.00 0.00 C ATOM 2131 OE1 GLU A 133 -13.208 0.267 -13.068 1.00 0.00 O ATOM 2132 OE2 GLU A 133 -15.020 1.383 -13.463 1.00 0.00 O ATOM 0 H GLU A 133 -12.749 1.314 -8.932 1.00 0.00 H new ATOM 0 HA GLU A 133 -12.286 4.005 -9.657 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -13.156 3.406 -11.810 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.057 2.172 -11.227 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.928 0.744 -10.608 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -15.068 1.991 -11.070 1.00 0.00 H new ATOM 2139 N HIS A 134 -15.278 3.210 -8.691 1.00 0.00 N ATOM 2140 CA HIS A 134 -16.564 3.745 -8.339 1.00 0.00 C ATOM 2141 C HIS A 134 -16.384 4.684 -7.139 1.00 0.00 C ATOM 2142 O HIS A 134 -17.029 5.693 -7.035 1.00 0.00 O ATOM 2143 CB HIS A 134 -17.542 2.614 -8.009 1.00 0.00 C ATOM 2144 CG HIS A 134 -18.984 2.971 -8.244 1.00 0.00 C ATOM 2145 ND1 HIS A 134 -19.794 2.310 -9.138 1.00 0.00 N ATOM 2146 CD2 HIS A 134 -19.756 3.935 -7.687 1.00 0.00 C ATOM 2147 CE1 HIS A 134 -21.002 2.879 -9.103 1.00 0.00 C ATOM 2148 NE2 HIS A 134 -21.034 3.875 -8.233 1.00 0.00 N ATOM 0 H HIS A 134 -15.102 2.265 -8.351 1.00 0.00 H new ATOM 0 HA HIS A 134 -16.981 4.302 -9.178 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -17.291 1.741 -8.612 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -17.414 2.328 -6.965 1.00 0.00 H new ATOM 0 HD1 HIS A 134 -19.520 1.522 -9.725 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -19.430 4.640 -6.936 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -21.842 2.567 -9.706 1.00 0.00 H new ATOM 2156 N MET A 135 -15.469 4.342 -6.253 1.00 0.00 N ATOM 2157 CA MET A 135 -15.145 5.179 -5.098 1.00 0.00 C ATOM 2158 C MET A 135 -14.580 6.512 -5.577 1.00 0.00 C ATOM 2159 O MET A 135 -15.039 7.579 -5.170 1.00 0.00 O ATOM 2160 CB MET A 135 -14.127 4.493 -4.172 1.00 0.00 C ATOM 2161 CG MET A 135 -14.501 3.106 -3.616 1.00 0.00 C ATOM 2162 SD MET A 135 -15.962 3.053 -2.544 1.00 0.00 S ATOM 2163 CE MET A 135 -17.321 3.071 -3.709 1.00 0.00 C ATOM 0 H MET A 135 -14.927 3.480 -6.307 1.00 0.00 H new ATOM 0 HA MET A 135 -16.062 5.342 -4.531 1.00 0.00 H new ATOM 0 HB2 MET A 135 -13.188 4.396 -4.716 1.00 0.00 H new ATOM 0 HB3 MET A 135 -13.939 5.156 -3.327 1.00 0.00 H new ATOM 0 HG2 MET A 135 -14.665 2.431 -4.456 1.00 0.00 H new ATOM 0 HG3 MET A 135 -13.649 2.718 -3.057 1.00 0.00 H new ATOM 0 HE1 MET A 135 -18.093 2.376 -3.378 1.00 0.00 H new ATOM 0 HE2 MET A 135 -17.738 4.076 -3.766 1.00 0.00 H new ATOM 0 HE3 MET A 135 -16.961 2.772 -4.693 1.00 0.00 H new ATOM 2173 N LYS A 136 -13.628 6.449 -6.497 1.00 0.00 N ATOM 2174 CA LYS A 136 -13.008 7.654 -7.040 1.00 0.00 C ATOM 2175 C LYS A 136 -13.968 8.417 -7.926 1.00 0.00 C ATOM 2176 O LYS A 136 -13.754 9.587 -8.207 1.00 0.00 O ATOM 2177 CB LYS A 136 -11.688 7.384 -7.756 1.00 0.00 C ATOM 2178 CG LYS A 136 -11.787 6.418 -8.903 1.00 0.00 C ATOM 2179 CD LYS A 136 -10.453 6.216 -9.601 1.00 0.00 C ATOM 2180 CE LYS A 136 -9.376 5.742 -8.638 1.00 0.00 C ATOM 2181 NZ LYS A 136 -8.116 5.429 -9.331 1.00 0.00 N ATOM 0 H LYS A 136 -13.267 5.577 -6.884 1.00 0.00 H new ATOM 0 HA LYS A 136 -12.764 8.280 -6.182 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -11.290 8.329 -8.127 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.970 6.998 -7.033 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -12.152 5.459 -8.537 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -12.519 6.785 -9.622 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -10.569 5.487 -10.403 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -10.140 7.152 -10.064 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -9.196 6.512 -7.888 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -9.728 4.857 -8.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -7.409 5.110 -8.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -8.281 4.676 -10.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -7.766 6.280 -9.816 1.00 0.00 H new ATOM 2195 N THR A 137 -15.028 7.744 -8.380 1.00 0.00 N ATOM 2196 CA THR A 137 -16.045 8.394 -9.164 1.00 0.00 C ATOM 2197 C THR A 137 -16.725 9.480 -8.287 1.00 0.00 C ATOM 2198 O THR A 137 -17.220 10.479 -8.791 1.00 0.00 O ATOM 2199 CB THR A 137 -17.074 7.352 -9.759 1.00 0.00 C ATOM 2200 OG1 THR A 137 -17.269 7.575 -11.166 1.00 0.00 O ATOM 2201 CG2 THR A 137 -18.434 7.395 -9.058 1.00 0.00 C ATOM 0 H THR A 137 -15.192 6.751 -8.211 1.00 0.00 H new ATOM 0 HA THR A 137 -15.594 8.880 -10.029 1.00 0.00 H new ATOM 0 HB THR A 137 -16.638 6.367 -9.591 1.00 0.00 H new ATOM 0 HG1 THR A 137 -17.908 6.919 -11.516 1.00 0.00 H new ATOM 0 HG21 THR A 137 -19.099 6.658 -9.509 1.00 0.00 H new ATOM 0 HG22 THR A 137 -18.305 7.168 -8.000 1.00 0.00 H new ATOM 0 HG23 THR A 137 -18.868 8.389 -9.166 1.00 0.00 H new ATOM 2209 N TYR A 138 -16.696 9.278 -6.964 1.00 0.00 N ATOM 2210 CA TYR A 138 -17.183 10.255 -6.035 1.00 0.00 C ATOM 2211 C TYR A 138 -16.001 11.115 -5.614 1.00 0.00 C ATOM 2212 O TYR A 138 -15.982 12.335 -5.835 1.00 0.00 O ATOM 2213 CB TYR A 138 -17.756 9.569 -4.795 1.00 0.00 C ATOM 2214 CG TYR A 138 -18.876 8.594 -5.050 1.00 0.00 C ATOM 2215 CD1 TYR A 138 -20.134 9.038 -5.406 1.00 0.00 C ATOM 2216 CD2 TYR A 138 -18.677 7.231 -4.906 1.00 0.00 C ATOM 2217 CE1 TYR A 138 -21.170 8.156 -5.613 1.00 0.00 C ATOM 2218 CE2 TYR A 138 -19.706 6.342 -5.101 1.00 0.00 C ATOM 2219 CZ TYR A 138 -20.954 6.810 -5.456 1.00 0.00 C ATOM 2220 OH TYR A 138 -21.999 5.926 -5.628 1.00 0.00 O ATOM 0 H TYR A 138 -16.332 8.431 -6.528 1.00 0.00 H new ATOM 0 HA TYR A 138 -17.967 10.852 -6.500 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -16.948 9.042 -4.287 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -18.116 10.337 -4.110 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -20.308 10.097 -5.524 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -17.699 6.862 -4.636 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -22.146 8.521 -5.897 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -19.539 5.282 -4.977 1.00 0.00 H new ATOM 0 HH TYR A 138 -21.782 5.300 -6.350 1.00 0.00 H new ATOM 2230 N SER A 139 -15.021 10.437 -4.993 1.00 0.00 N ATOM 2231 CA SER A 139 -13.751 11.001 -4.511 1.00 0.00 C ATOM 2232 C SER A 139 -13.962 12.209 -3.569 1.00 0.00 C ATOM 2233 O SER A 139 -13.056 13.026 -3.373 1.00 0.00 O ATOM 2234 CB SER A 139 -12.853 11.360 -5.702 1.00 0.00 C ATOM 2235 OG SER A 139 -11.522 11.671 -5.295 1.00 0.00 O ATOM 0 H SER A 139 -15.097 9.437 -4.806 1.00 0.00 H new ATOM 0 HA SER A 139 -13.251 10.239 -3.914 1.00 0.00 H new ATOM 0 HB2 SER A 139 -12.832 10.526 -6.404 1.00 0.00 H new ATOM 0 HB3 SER A 139 -13.278 12.212 -6.232 1.00 0.00 H new ATOM 0 HG SER A 139 -11.548 12.243 -4.499 1.00 0.00 H new ATOM 2241 N GLY A 140 -15.120 12.291 -2.971 1.00 0.00 N ATOM 2242 CA GLY A 140 -15.440 13.333 -2.092 1.00 0.00 C ATOM 2243 C GLY A 140 -16.896 13.324 -2.000 1.00 0.00 C ATOM 2244 O GLY A 140 -17.452 12.235 -2.226 1.00 0.00 O ATOM 2245 OXT GLY A 140 -17.512 14.370 -1.740 1.00 0.00 O ATOM 0 H GLY A 140 -15.869 11.610 -3.098 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -14.983 13.178 -1.115 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -15.075 14.290 -2.466 1.00 0.00 H new