USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1004 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 13 LYS NZ :NH3+ 137:sc= 0.497 (180deg=-4.29!) USER MOD Set 1.2: B 81 ASN : amide:sc= -0.337! C(o=2.2!,f=-6.2!) USER MOD Set 1.3: B 83 SER OG : rot -32:sc= 0.713 USER MOD Set 1.4: B 84 THR OG1 : rot 35:sc= 1.29 USER MOD Set 2.1: B 56 SER OG : rot 160:sc= -0.649 USER MOD Set 2.2: B 64 GLN :FLIP amide:sc= -0.233 F(o=-2.3!,f=-0.88) USER MOD Set 3.1: B 54 LYS NZ :NH3+ 137:sc= 1.96 (180deg=-1.47) USER MOD Set 3.2: B 66 GLN : amide:sc= -1.11 K(o=-2.3,f=-12!) USER MOD Set 3.3: B 76 ASN : amide:sc= -3.18! C(o=-2.3!,f=-4.7!) USER MOD Set 4.1: B 45 HIS : no HE2:sc= -3.43! C(o=-3.4!,f=-6.4!) USER MOD Set 4.2: B 75 THR OG1 : rot 170:sc= 0 USER MOD Set 5.1: B 1 MET N :NH3+ 140:sc= -0.413 (180deg=-1.19!) USER MOD Set 5.2: B 4 SER OG : rot 180:sc= 0.5 USER MOD Single : A 392 TYR OH : rot 180:sc= -0.331 USER MOD Single : A 404 ASN : amide:sc= -0.0327 X(o=-0.033,f=0) USER MOD Single : A 406 ASN : amide:sc= 0.748 K(o=0.75,f=-1.6) USER MOD Single : B 1 MET CE :methyl -122:sc= 0 (180deg=-0.759) USER MOD Single : B 3 THR OG1 : rot 180:sc= -0.0057 USER MOD Single : B 5 SER OG : rot 170:sc= -0.363 USER MOD Single : B 14 LYS NZ :NH3+ -156:sc= 1.21 (180deg=-1.68!) USER MOD Single : B 17 GLN : amide:sc= 1.14 K(o=1.1,f=-2.2) USER MOD Single : B 18 LYS NZ :NH3+ 154:sc= 1.83 (180deg=-1.14) USER MOD Single : B 19 LYS NZ :NH3+ -161:sc= 0.16 (180deg=-0.0863) USER MOD Single : B 20 GLN : amide:sc= 0.866 K(o=0.87,f=0) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 MET CE :methyl -131:sc= -0.242 (180deg=-3.98!) USER MOD Single : B 38 LYS NZ :NH3+ -158:sc= 1.99 (180deg=1.27) USER MOD Single : B 42 THR OG1 : rot 85:sc= -1.22! USER MOD Single : B 44 SER OG : rot 180:sc=-0.00718 USER MOD Single : B 46 MET CE :methyl -164:sc= -0.282 (180deg=-0.721) USER MOD Single : B 47 TYR OH : rot 165:sc= 1.09 USER MOD Single : B 51 LYS NZ :NH3+ 176:sc= 2.31 (180deg=2.19) USER MOD Single : B 52 CYS SG : rot 119:sc= -1.95! USER MOD Single : B 53 GLN : amide:sc= -6.78! C(o=-6.8!,f=-8.3!) USER MOD Single : B 60 LYS NZ :NH3+ 169:sc= 2.21 (180deg=1.43) USER MOD Single : B 62 LYS NZ :NH3+ -175:sc= -3.49! (180deg=-3.81!) USER MOD Single : B 70 HIS : no HE2:sc= -5.5! C(o=-5.5!,f=-9.8!) USER MOD Single : B 74 THR OG1 : rot 31:sc= 0.0549 USER MOD Single : B 78 HIS : no HE2:sc= -4.23! C(o=-4.2!,f=-9.7!) USER MOD Single : B 80 SER OG : rot 44:sc= 1.04 USER MOD Single : B 87 LYS NZ :NH3+ 174:sc= 1.25 (180deg=1.15) USER MOD Single : B 93 LYS NZ :NH3+ 160:sc= 1.79 (180deg=0.623) USER MOD Single : B 97 GLN :FLIP amide:sc=-0.00347 F(o=-1.2,f=-0.0035) USER MOD Single : B 98 GLN : amide:sc= -0.159 K(o=-0.16,f=-0.77) USER MOD Single : B 102 LYS NZ :NH3+ 157:sc= 1.22 (180deg=1.08) USER MOD Single : B 104 LYS NZ :NH3+ -135:sc= 0.84 (180deg=-1.58!) USER MOD Single : B 106 LYS NZ :NH3+ -163:sc= 0.752 (180deg=0.343!) USER MOD Single : B 108 ASN : amide:sc= 1.07 K(o=1.1,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 392 10.179 9.050 16.223 1.00 0.00 N ATOM 2 CA TYR A 392 9.774 8.453 17.514 1.00 0.00 C ATOM 3 C TYR A 392 9.672 6.938 17.392 1.00 0.00 C ATOM 4 O TYR A 392 10.489 6.217 17.959 1.00 0.00 O ATOM 5 CB TYR A 392 8.446 9.048 18.018 1.00 0.00 C ATOM 6 CG TYR A 392 7.579 9.677 16.944 1.00 0.00 C ATOM 7 CD1 TYR A 392 6.511 8.981 16.391 1.00 0.00 C ATOM 8 CD2 TYR A 392 7.827 10.968 16.490 1.00 0.00 C ATOM 9 CE1 TYR A 392 5.717 9.553 15.414 1.00 0.00 C ATOM 10 CE2 TYR A 392 7.038 11.545 15.514 1.00 0.00 C ATOM 11 CZ TYR A 392 5.986 10.834 14.979 1.00 0.00 C ATOM 12 OH TYR A 392 5.201 11.407 14.005 1.00 0.00 O ATOM 0 HA TYR A 392 10.543 8.693 18.248 1.00 0.00 H new ATOM 0 HB2 TYR A 392 7.875 8.260 18.510 1.00 0.00 H new ATOM 0 HB3 TYR A 392 8.666 9.802 18.774 1.00 0.00 H new ATOM 0 HD1 TYR A 392 6.298 7.978 16.729 1.00 0.00 H new ATOM 0 HD2 TYR A 392 8.650 11.529 16.908 1.00 0.00 H new ATOM 0 HE1 TYR A 392 4.890 8.999 14.994 1.00 0.00 H new ATOM 0 HE2 TYR A 392 7.245 12.548 15.172 1.00 0.00 H new ATOM 0 HH TYR A 392 5.525 12.312 13.814 1.00 0.00 H new ATOM 24 N VAL A 393 8.688 6.459 16.639 1.00 0.00 N ATOM 25 CA VAL A 393 8.497 5.029 16.454 1.00 0.00 C ATOM 26 C VAL A 393 7.460 4.771 15.364 1.00 0.00 C ATOM 27 O VAL A 393 6.479 5.504 15.248 1.00 0.00 O ATOM 28 CB VAL A 393 8.070 4.333 17.774 1.00 0.00 C ATOM 29 CG1 VAL A 393 6.711 4.831 18.252 1.00 0.00 C ATOM 30 CG2 VAL A 393 8.068 2.819 17.615 1.00 0.00 C ATOM 0 H VAL A 393 8.011 7.042 16.147 1.00 0.00 H new ATOM 0 HA VAL A 393 9.453 4.604 16.148 1.00 0.00 H new ATOM 0 HB VAL A 393 8.804 4.594 18.536 1.00 0.00 H new ATOM 0 HG11 VAL A 393 6.443 4.323 19.178 1.00 0.00 H new ATOM 0 HG12 VAL A 393 6.759 5.906 18.428 1.00 0.00 H new ATOM 0 HG13 VAL A 393 5.959 4.621 17.492 1.00 0.00 H new ATOM 0 HG21 VAL A 393 7.765 2.355 18.554 1.00 0.00 H new ATOM 0 HG22 VAL A 393 7.368 2.537 16.828 1.00 0.00 H new ATOM 0 HG23 VAL A 393 9.069 2.480 17.349 1.00 0.00 H new ATOM 40 N GLY A 394 7.692 3.738 14.560 1.00 0.00 N ATOM 41 CA GLY A 394 6.777 3.417 13.484 1.00 0.00 C ATOM 42 C GLY A 394 6.843 4.453 12.386 1.00 0.00 C ATOM 43 O GLY A 394 7.867 4.589 11.711 1.00 0.00 O ATOM 0 H GLY A 394 8.498 3.118 14.636 1.00 0.00 H new ATOM 0 HA2 GLY A 394 7.020 2.435 13.077 1.00 0.00 H new ATOM 0 HA3 GLY A 394 5.760 3.359 13.872 1.00 0.00 H new ATOM 47 N GLU A 395 5.762 5.193 12.210 1.00 0.00 N ATOM 48 CA GLU A 395 5.730 6.232 11.205 1.00 0.00 C ATOM 49 C GLU A 395 5.956 7.577 11.868 1.00 0.00 C ATOM 50 O GLU A 395 5.506 7.808 12.986 1.00 0.00 O ATOM 51 CB GLU A 395 4.414 6.237 10.434 1.00 0.00 C ATOM 52 CG GLU A 395 4.482 7.089 9.179 1.00 0.00 C ATOM 53 CD GLU A 395 5.649 6.711 8.297 1.00 0.00 C ATOM 54 OE1 GLU A 395 6.766 7.200 8.558 1.00 0.00 O ATOM 55 OE2 GLU A 395 5.460 5.916 7.358 1.00 0.00 O ATOM 0 H GLU A 395 4.901 5.092 12.748 1.00 0.00 H new ATOM 0 HA GLU A 395 6.524 6.035 10.485 1.00 0.00 H new ATOM 0 HB2 GLU A 395 4.151 5.215 10.162 1.00 0.00 H new ATOM 0 HB3 GLU A 395 3.619 6.609 11.080 1.00 0.00 H new ATOM 0 HG2 GLU A 395 3.554 6.981 8.617 1.00 0.00 H new ATOM 0 HG3 GLU A 395 4.565 8.139 9.459 1.00 0.00 H new ATOM 62 N ASP A 396 6.650 8.458 11.170 1.00 0.00 N ATOM 63 CA ASP A 396 6.967 9.774 11.704 1.00 0.00 C ATOM 64 C ASP A 396 6.719 10.838 10.652 1.00 0.00 C ATOM 65 O ASP A 396 7.389 11.871 10.639 1.00 0.00 O ATOM 66 CB ASP A 396 8.437 9.848 12.152 1.00 0.00 C ATOM 67 CG ASP A 396 8.909 8.616 12.902 1.00 0.00 C ATOM 68 OD1 ASP A 396 8.816 8.597 14.146 1.00 0.00 O ATOM 69 OD2 ASP A 396 9.400 7.671 12.247 1.00 0.00 O ATOM 0 H ASP A 396 7.006 8.287 10.230 1.00 0.00 H new ATOM 0 HA ASP A 396 6.323 9.947 12.566 1.00 0.00 H new ATOM 0 HB2 ASP A 396 9.068 9.993 11.275 1.00 0.00 H new ATOM 0 HB3 ASP A 396 8.570 10.723 12.788 1.00 0.00 H new ATOM 74 N ASP A 397 5.765 10.585 9.758 1.00 0.00 N ATOM 75 CA ASP A 397 5.466 11.532 8.688 1.00 0.00 C ATOM 76 C ASP A 397 4.991 12.866 9.243 1.00 0.00 C ATOM 77 O ASP A 397 5.276 13.910 8.656 1.00 0.00 O ATOM 78 CB ASP A 397 4.439 10.982 7.702 1.00 0.00 C ATOM 79 CG ASP A 397 4.533 11.689 6.361 1.00 0.00 C ATOM 80 OD1 ASP A 397 5.272 11.194 5.481 1.00 0.00 O ATOM 81 OD2 ASP A 397 3.897 12.753 6.193 1.00 0.00 O ATOM 0 H ASP A 397 5.192 9.741 9.753 1.00 0.00 H new ATOM 0 HA ASP A 397 6.399 11.690 8.148 1.00 0.00 H new ATOM 0 HB2 ASP A 397 4.599 9.913 7.564 1.00 0.00 H new ATOM 0 HB3 ASP A 397 3.436 11.104 8.111 1.00 0.00 H new ATOM 86 N GLU A 398 4.270 12.833 10.367 1.00 0.00 N ATOM 87 CA GLU A 398 3.789 14.054 11.016 1.00 0.00 C ATOM 88 C GLU A 398 2.787 13.736 12.131 1.00 0.00 C ATOM 89 O GLU A 398 3.085 13.915 13.310 1.00 0.00 O ATOM 90 CB GLU A 398 3.154 15.004 9.999 1.00 0.00 C ATOM 91 CG GLU A 398 3.760 16.399 10.007 1.00 0.00 C ATOM 92 CD GLU A 398 3.672 17.078 8.654 1.00 0.00 C ATOM 93 OE1 GLU A 398 4.718 17.208 7.984 1.00 0.00 O ATOM 94 OE2 GLU A 398 2.556 17.478 8.258 1.00 0.00 O ATOM 0 H GLU A 398 4.007 11.972 10.847 1.00 0.00 H new ATOM 0 HA GLU A 398 4.654 14.545 11.461 1.00 0.00 H new ATOM 0 HB2 GLU A 398 3.259 14.577 9.001 1.00 0.00 H new ATOM 0 HB3 GLU A 398 2.086 15.080 10.203 1.00 0.00 H new ATOM 0 HG2 GLU A 398 3.248 17.010 10.750 1.00 0.00 H new ATOM 0 HG3 GLU A 398 4.805 16.336 10.311 1.00 0.00 H new ATOM 101 N GLU A 399 1.604 13.268 11.749 1.00 0.00 N ATOM 102 CA GLU A 399 0.552 12.924 12.705 1.00 0.00 C ATOM 103 C GLU A 399 -0.272 11.781 12.169 1.00 0.00 C ATOM 104 O GLU A 399 -0.957 11.918 11.160 1.00 0.00 O ATOM 105 CB GLU A 399 -0.368 14.110 12.990 1.00 0.00 C ATOM 106 CG GLU A 399 -0.485 15.072 11.830 1.00 0.00 C ATOM 107 CD GLU A 399 -1.660 16.022 11.943 1.00 0.00 C ATOM 108 OE1 GLU A 399 -1.706 16.991 11.151 1.00 0.00 O ATOM 109 OE2 GLU A 399 -2.537 15.793 12.800 1.00 0.00 O ATOM 0 H GLU A 399 1.346 13.116 10.774 1.00 0.00 H new ATOM 0 HA GLU A 399 1.039 12.637 13.637 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -1.360 13.737 13.245 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.004 14.648 13.862 1.00 0.00 H new ATOM 0 HG2 GLU A 399 0.435 15.653 11.757 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.577 14.503 10.905 1.00 0.00 H new ATOM 116 N ASP A 400 -0.212 10.656 12.841 1.00 0.00 N ATOM 117 CA ASP A 400 -0.945 9.491 12.403 1.00 0.00 C ATOM 118 C ASP A 400 -1.541 8.774 13.604 1.00 0.00 C ATOM 119 O ASP A 400 -0.929 7.862 14.159 1.00 0.00 O ATOM 120 CB ASP A 400 -0.016 8.544 11.653 1.00 0.00 C ATOM 121 CG ASP A 400 0.779 9.220 10.550 1.00 0.00 C ATOM 122 OD1 ASP A 400 0.399 9.065 9.372 1.00 0.00 O ATOM 123 OD2 ASP A 400 1.792 9.884 10.859 1.00 0.00 O ATOM 0 H ASP A 400 0.335 10.522 13.691 1.00 0.00 H new ATOM 0 HA ASP A 400 -1.748 9.808 11.738 1.00 0.00 H new ATOM 0 HB2 ASP A 400 0.676 8.090 12.362 1.00 0.00 H new ATOM 0 HB3 ASP A 400 -0.606 7.736 11.221 1.00 0.00 H new ATOM 128 N ASP A 401 -2.732 9.184 14.006 1.00 0.00 N ATOM 129 CA ASP A 401 -3.378 8.594 15.182 1.00 0.00 C ATOM 130 C ASP A 401 -4.868 8.350 14.982 1.00 0.00 C ATOM 131 O ASP A 401 -5.355 7.258 15.271 1.00 0.00 O ATOM 132 CB ASP A 401 -3.150 9.476 16.417 1.00 0.00 C ATOM 133 CG ASP A 401 -3.169 10.963 16.097 1.00 0.00 C ATOM 134 OD1 ASP A 401 -3.986 11.390 15.249 1.00 0.00 O ATOM 135 OD2 ASP A 401 -2.359 11.707 16.680 1.00 0.00 O ATOM 0 H ASP A 401 -3.273 9.916 13.545 1.00 0.00 H new ATOM 0 HA ASP A 401 -2.914 7.620 15.336 1.00 0.00 H new ATOM 0 HB2 ASP A 401 -3.919 9.260 17.158 1.00 0.00 H new ATOM 0 HB3 ASP A 401 -2.192 9.219 16.868 1.00 0.00 H new ATOM 140 N ASP A 402 -5.593 9.353 14.488 1.00 0.00 N ATOM 141 CA ASP A 402 -7.037 9.222 14.239 1.00 0.00 C ATOM 142 C ASP A 402 -7.299 8.246 13.098 1.00 0.00 C ATOM 143 O ASP A 402 -8.428 8.075 12.642 1.00 0.00 O ATOM 144 CB ASP A 402 -7.672 10.581 13.920 1.00 0.00 C ATOM 145 CG ASP A 402 -6.889 11.382 12.897 1.00 0.00 C ATOM 146 OD1 ASP A 402 -6.452 10.806 11.876 1.00 0.00 O ATOM 147 OD2 ASP A 402 -6.701 12.594 13.124 1.00 0.00 O ATOM 0 H ASP A 402 -5.208 10.267 14.251 1.00 0.00 H new ATOM 0 HA ASP A 402 -7.494 8.835 15.149 1.00 0.00 H new ATOM 0 HB2 ASP A 402 -8.685 10.423 13.550 1.00 0.00 H new ATOM 0 HB3 ASP A 402 -7.755 11.161 14.839 1.00 0.00 H new ATOM 152 N PHE A 403 -6.228 7.614 12.663 1.00 0.00 N ATOM 153 CA PHE A 403 -6.237 6.640 11.614 1.00 0.00 C ATOM 154 C PHE A 403 -7.202 5.500 11.941 1.00 0.00 C ATOM 155 O PHE A 403 -7.031 4.797 12.935 1.00 0.00 O ATOM 156 CB PHE A 403 -4.824 6.115 11.504 1.00 0.00 C ATOM 157 CG PHE A 403 -4.094 6.504 10.277 1.00 0.00 C ATOM 158 CD1 PHE A 403 -4.659 6.306 9.042 1.00 0.00 C ATOM 159 CD2 PHE A 403 -2.819 7.018 10.359 1.00 0.00 C ATOM 160 CE1 PHE A 403 -3.968 6.609 7.900 1.00 0.00 C ATOM 161 CE2 PHE A 403 -2.123 7.335 9.220 1.00 0.00 C ATOM 162 CZ PHE A 403 -2.696 7.126 7.989 1.00 0.00 C ATOM 0 H PHE A 403 -5.299 7.777 13.051 1.00 0.00 H new ATOM 0 HA PHE A 403 -6.570 7.083 10.675 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -4.258 6.462 12.368 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -4.854 5.027 11.559 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -5.660 5.907 8.970 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -2.364 7.173 11.326 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -4.419 6.443 6.933 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -1.127 7.748 9.291 1.00 0.00 H new ATOM 0 HZ PHE A 403 -2.148 7.368 7.090 1.00 0.00 H new ATOM 172 N ASN A 404 -8.188 5.306 11.085 1.00 0.00 N ATOM 173 CA ASN A 404 -9.197 4.270 11.291 1.00 0.00 C ATOM 174 C ASN A 404 -8.957 3.092 10.363 1.00 0.00 C ATOM 175 O ASN A 404 -8.749 3.276 9.167 1.00 0.00 O ATOM 176 CB ASN A 404 -10.600 4.833 11.041 1.00 0.00 C ATOM 177 CG ASN A 404 -11.209 5.482 12.269 1.00 0.00 C ATOM 178 OD1 ASN A 404 -11.916 4.838 13.041 1.00 0.00 O ATOM 179 ND2 ASN A 404 -10.941 6.765 12.459 1.00 0.00 N ATOM 0 H ASN A 404 -8.316 5.853 10.234 1.00 0.00 H new ATOM 0 HA ASN A 404 -9.122 3.930 12.324 1.00 0.00 H new ATOM 0 HB2 ASN A 404 -10.552 5.566 10.236 1.00 0.00 H new ATOM 0 HB3 ASN A 404 -11.252 4.029 10.701 1.00 0.00 H new ATOM 0 HD21 ASN A 404 -11.326 7.252 13.268 1.00 0.00 H new ATOM 0 HD22 ASN A 404 -10.350 7.266 11.796 1.00 0.00 H new ATOM 186 N GLU A 405 -8.979 1.887 10.911 1.00 0.00 N ATOM 187 CA GLU A 405 -8.770 0.688 10.111 1.00 0.00 C ATOM 188 C GLU A 405 -9.746 -0.412 10.496 1.00 0.00 C ATOM 189 O GLU A 405 -10.726 -0.177 11.204 1.00 0.00 O ATOM 190 CB GLU A 405 -7.342 0.167 10.256 1.00 0.00 C ATOM 191 CG GLU A 405 -6.955 -0.201 11.676 1.00 0.00 C ATOM 192 CD GLU A 405 -5.743 -1.109 11.724 1.00 0.00 C ATOM 193 OE1 GLU A 405 -5.604 -1.967 10.834 1.00 0.00 O ATOM 194 OE2 GLU A 405 -4.914 -0.945 12.641 1.00 0.00 O ATOM 0 H GLU A 405 -9.139 1.712 11.903 1.00 0.00 H new ATOM 0 HA GLU A 405 -8.943 0.968 9.072 1.00 0.00 H new ATOM 0 HB2 GLU A 405 -7.221 -0.710 9.620 1.00 0.00 H new ATOM 0 HB3 GLU A 405 -6.651 0.926 9.888 1.00 0.00 H new ATOM 0 HG2 GLU A 405 -6.748 0.708 12.241 1.00 0.00 H new ATOM 0 HG3 GLU A 405 -7.796 -0.695 12.163 1.00 0.00 H new ATOM 201 N ASN A 406 -9.453 -1.613 10.029 1.00 0.00 N ATOM 202 CA ASN A 406 -10.268 -2.780 10.301 1.00 0.00 C ATOM 203 C ASN A 406 -9.349 -3.961 10.584 1.00 0.00 C ATOM 204 O ASN A 406 -8.241 -4.018 10.061 1.00 0.00 O ATOM 205 CB ASN A 406 -11.179 -3.074 9.103 1.00 0.00 C ATOM 206 CG ASN A 406 -12.129 -4.232 9.342 1.00 0.00 C ATOM 207 OD1 ASN A 406 -12.539 -4.498 10.473 1.00 0.00 O ATOM 208 ND2 ASN A 406 -12.484 -4.932 8.276 1.00 0.00 N ATOM 0 H ASN A 406 -8.638 -1.805 9.447 1.00 0.00 H new ATOM 0 HA ASN A 406 -10.902 -2.600 11.169 1.00 0.00 H new ATOM 0 HB2 ASN A 406 -11.758 -2.181 8.868 1.00 0.00 H new ATOM 0 HB3 ASN A 406 -10.562 -3.293 8.231 1.00 0.00 H new ATOM 0 HD21 ASN A 406 -13.119 -5.724 8.374 1.00 0.00 H new ATOM 0 HD22 ASN A 406 -12.122 -4.679 7.356 1.00 0.00 H new ATOM 215 N ASP A 407 -9.807 -4.902 11.398 1.00 0.00 N ATOM 216 CA ASP A 407 -9.001 -6.072 11.755 1.00 0.00 C ATOM 217 C ASP A 407 -9.009 -7.118 10.640 1.00 0.00 C ATOM 218 O ASP A 407 -8.645 -8.272 10.854 1.00 0.00 O ATOM 219 CB ASP A 407 -9.489 -6.689 13.067 1.00 0.00 C ATOM 220 CG ASP A 407 -8.450 -7.604 13.697 1.00 0.00 C ATOM 221 OD1 ASP A 407 -7.254 -7.487 13.340 1.00 0.00 O ATOM 222 OD2 ASP A 407 -8.826 -8.436 14.543 1.00 0.00 O ATOM 0 H ASP A 407 -10.733 -4.882 11.826 1.00 0.00 H new ATOM 0 HA ASP A 407 -7.974 -5.733 11.890 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -9.742 -5.893 13.768 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -10.403 -7.254 12.882 1.00 0.00 H new ATOM 227 N GLU A 408 -9.460 -6.707 9.460 1.00 0.00 N ATOM 228 CA GLU A 408 -9.530 -7.581 8.293 1.00 0.00 C ATOM 229 C GLU A 408 -8.203 -8.302 8.042 1.00 0.00 C ATOM 230 O GLU A 408 -7.262 -7.732 7.499 1.00 0.00 O ATOM 231 CB GLU A 408 -9.937 -6.769 7.054 1.00 0.00 C ATOM 232 CG GLU A 408 -9.231 -5.422 6.942 1.00 0.00 C ATOM 233 CD GLU A 408 -9.891 -4.481 5.951 1.00 0.00 C ATOM 234 OE1 GLU A 408 -11.134 -4.357 5.986 1.00 0.00 O ATOM 235 OE2 GLU A 408 -9.168 -3.849 5.152 1.00 0.00 O ATOM 0 H GLU A 408 -9.788 -5.757 9.285 1.00 0.00 H new ATOM 0 HA GLU A 408 -10.284 -8.343 8.491 1.00 0.00 H new ATOM 0 HB2 GLU A 408 -9.724 -7.356 6.160 1.00 0.00 H new ATOM 0 HB3 GLU A 408 -11.014 -6.603 7.077 1.00 0.00 H new ATOM 0 HG2 GLU A 408 -9.209 -4.948 7.923 1.00 0.00 H new ATOM 0 HG3 GLU A 408 -8.196 -5.586 6.643 1.00 0.00 H new ATOM 242 N ASP A 409 -8.125 -9.547 8.493 1.00 0.00 N ATOM 243 CA ASP A 409 -6.933 -10.364 8.295 1.00 0.00 C ATOM 244 C ASP A 409 -7.123 -11.186 7.032 1.00 0.00 C ATOM 245 O ASP A 409 -6.208 -11.333 6.222 1.00 0.00 O ATOM 246 CB ASP A 409 -6.701 -11.287 9.500 1.00 0.00 C ATOM 247 CG ASP A 409 -5.240 -11.376 9.908 1.00 0.00 C ATOM 248 OD1 ASP A 409 -4.833 -10.637 10.828 1.00 0.00 O ATOM 249 OD2 ASP A 409 -4.498 -12.192 9.318 1.00 0.00 O ATOM 0 H ASP A 409 -8.876 -10.015 9.000 1.00 0.00 H new ATOM 0 HA ASP A 409 -6.059 -9.721 8.197 1.00 0.00 H new ATOM 0 HB2 ASP A 409 -7.287 -10.926 10.345 1.00 0.00 H new ATOM 0 HB3 ASP A 409 -7.067 -12.286 9.261 1.00 0.00 H new ATOM 254 N ASP A 410 -8.344 -11.699 6.891 1.00 0.00 N ATOM 255 CA ASP A 410 -8.760 -12.498 5.739 1.00 0.00 C ATOM 256 C ASP A 410 -7.855 -13.712 5.533 1.00 0.00 C ATOM 257 O ASP A 410 -7.444 -13.981 4.383 1.00 0.00 O ATOM 258 CB ASP A 410 -8.801 -11.622 4.482 1.00 0.00 C ATOM 259 CG ASP A 410 -9.928 -12.007 3.546 1.00 0.00 C ATOM 260 OD1 ASP A 410 -10.986 -12.450 4.033 1.00 0.00 O ATOM 261 OD2 ASP A 410 -9.748 -11.890 2.314 1.00 0.00 O ATOM 262 OXT ASP A 410 -7.556 -14.400 6.530 1.00 0.00 O ATOM 0 H ASP A 410 -9.082 -11.570 7.583 1.00 0.00 H new ATOM 0 HA ASP A 410 -9.762 -12.879 5.936 1.00 0.00 H new ATOM 0 HB2 ASP A 410 -8.915 -10.578 4.774 1.00 0.00 H new ATOM 0 HB3 ASP A 410 -7.851 -11.703 3.955 1.00 0.00 H new TER 267 ASP A 410 ATOM 268 N MET B 1 7.966 -4.221 -10.301 1.00 0.00 N ATOM 269 CA MET B 1 9.161 -3.346 -10.222 1.00 0.00 C ATOM 270 C MET B 1 9.927 -3.391 -11.537 1.00 0.00 C ATOM 271 O MET B 1 10.458 -2.384 -11.998 1.00 0.00 O ATOM 272 CB MET B 1 10.066 -3.773 -9.067 1.00 0.00 C ATOM 273 CG MET B 1 10.947 -2.650 -8.550 1.00 0.00 C ATOM 274 SD MET B 1 9.988 -1.260 -7.916 1.00 0.00 S ATOM 275 CE MET B 1 11.301 -0.175 -7.361 1.00 0.00 C ATOM 0 H1 MET B 1 7.845 -4.726 -9.400 1.00 0.00 H new ATOM 0 H2 MET B 1 7.123 -3.641 -10.489 1.00 0.00 H new ATOM 0 H3 MET B 1 8.091 -4.910 -11.070 1.00 0.00 H new ATOM 0 HA MET B 1 8.831 -2.323 -10.039 1.00 0.00 H new ATOM 0 HB2 MET B 1 9.449 -4.147 -8.250 1.00 0.00 H new ATOM 0 HB3 MET B 1 10.697 -4.599 -9.395 1.00 0.00 H new ATOM 0 HG2 MET B 1 11.593 -3.033 -7.760 1.00 0.00 H new ATOM 0 HG3 MET B 1 11.597 -2.303 -9.353 1.00 0.00 H new ATOM 0 HE1 MET B 1 11.175 0.035 -6.299 1.00 0.00 H new ATOM 0 HE2 MET B 1 12.265 -0.658 -7.523 1.00 0.00 H new ATOM 0 HE3 MET B 1 11.264 0.758 -7.923 1.00 0.00 H new ATOM 285 N ALA B 2 9.980 -4.576 -12.122 1.00 0.00 N ATOM 286 CA ALA B 2 10.644 -4.792 -13.394 1.00 0.00 C ATOM 287 C ALA B 2 9.904 -5.896 -14.123 1.00 0.00 C ATOM 288 O ALA B 2 10.226 -7.075 -13.964 1.00 0.00 O ATOM 289 CB ALA B 2 12.108 -5.159 -13.188 1.00 0.00 C ATOM 0 H ALA B 2 9.562 -5.418 -11.725 1.00 0.00 H new ATOM 0 HA ALA B 2 10.627 -3.877 -13.986 1.00 0.00 H new ATOM 0 HB1 ALA B 2 12.584 -5.316 -14.156 1.00 0.00 H new ATOM 0 HB2 ALA B 2 12.615 -4.351 -12.661 1.00 0.00 H new ATOM 0 HB3 ALA B 2 12.174 -6.074 -12.599 1.00 0.00 H new ATOM 295 N THR B 3 8.875 -5.509 -14.873 1.00 0.00 N ATOM 296 CA THR B 3 8.043 -6.463 -15.596 1.00 0.00 C ATOM 297 C THR B 3 7.313 -7.341 -14.579 1.00 0.00 C ATOM 298 O THR B 3 7.045 -8.520 -14.808 1.00 0.00 O ATOM 299 CB THR B 3 8.872 -7.336 -16.566 1.00 0.00 C ATOM 300 OG1 THR B 3 9.966 -6.574 -17.097 1.00 0.00 O ATOM 301 CG2 THR B 3 8.011 -7.846 -17.713 1.00 0.00 C ATOM 0 H THR B 3 8.598 -4.535 -14.995 1.00 0.00 H new ATOM 0 HA THR B 3 7.326 -5.911 -16.204 1.00 0.00 H new ATOM 0 HB THR B 3 9.254 -8.191 -16.008 1.00 0.00 H new ATOM 0 HG1 THR B 3 10.488 -7.134 -17.709 1.00 0.00 H new ATOM 0 HG21 THR B 3 8.619 -8.457 -18.380 1.00 0.00 H new ATOM 0 HG22 THR B 3 7.193 -8.447 -17.315 1.00 0.00 H new ATOM 0 HG23 THR B 3 7.604 -7.000 -18.266 1.00 0.00 H new ATOM 309 N SER B 4 6.991 -6.730 -13.445 1.00 0.00 N ATOM 310 CA SER B 4 6.319 -7.411 -12.353 1.00 0.00 C ATOM 311 C SER B 4 5.338 -6.461 -11.675 1.00 0.00 C ATOM 312 O SER B 4 5.714 -5.730 -10.754 1.00 0.00 O ATOM 313 CB SER B 4 7.360 -7.908 -11.347 1.00 0.00 C ATOM 314 OG SER B 4 8.549 -7.124 -11.421 1.00 0.00 O ATOM 0 H SER B 4 7.190 -5.747 -13.260 1.00 0.00 H new ATOM 0 HA SER B 4 5.764 -8.264 -12.742 1.00 0.00 H new ATOM 0 HB2 SER B 4 6.950 -7.860 -10.338 1.00 0.00 H new ATOM 0 HB3 SER B 4 7.595 -8.953 -11.546 1.00 0.00 H new ATOM 0 HG SER B 4 9.201 -7.456 -10.769 1.00 0.00 H new ATOM 320 N SER B 5 4.092 -6.474 -12.144 1.00 0.00 N ATOM 321 CA SER B 5 3.054 -5.600 -11.612 1.00 0.00 C ATOM 322 C SER B 5 3.454 -4.143 -11.827 1.00 0.00 C ATOM 323 O SER B 5 3.865 -3.444 -10.894 1.00 0.00 O ATOM 324 CB SER B 5 2.804 -5.891 -10.129 1.00 0.00 C ATOM 325 OG SER B 5 2.749 -7.288 -9.888 1.00 0.00 O ATOM 0 H SER B 5 3.777 -7.086 -12.897 1.00 0.00 H new ATOM 0 HA SER B 5 2.121 -5.790 -12.143 1.00 0.00 H new ATOM 0 HB2 SER B 5 3.597 -5.446 -9.528 1.00 0.00 H new ATOM 0 HB3 SER B 5 1.869 -5.427 -9.816 1.00 0.00 H new ATOM 0 HG SER B 5 2.751 -7.454 -8.922 1.00 0.00 H new ATOM 331 N GLU B 6 3.338 -3.703 -13.072 1.00 0.00 N ATOM 332 CA GLU B 6 3.705 -2.348 -13.458 1.00 0.00 C ATOM 333 C GLU B 6 2.497 -1.624 -14.015 1.00 0.00 C ATOM 334 O GLU B 6 2.568 -0.471 -14.444 1.00 0.00 O ATOM 335 CB GLU B 6 4.829 -2.378 -14.501 1.00 0.00 C ATOM 336 CG GLU B 6 6.193 -1.979 -13.960 1.00 0.00 C ATOM 337 CD GLU B 6 6.651 -2.852 -12.810 1.00 0.00 C ATOM 338 OE1 GLU B 6 6.548 -2.411 -11.649 1.00 0.00 O ATOM 339 OE2 GLU B 6 7.131 -3.980 -13.056 1.00 0.00 O ATOM 0 H GLU B 6 2.988 -4.274 -13.841 1.00 0.00 H new ATOM 0 HA GLU B 6 4.062 -1.816 -12.576 1.00 0.00 H new ATOM 0 HB2 GLU B 6 4.896 -3.383 -14.918 1.00 0.00 H new ATOM 0 HB3 GLU B 6 4.566 -1.710 -15.321 1.00 0.00 H new ATOM 0 HG2 GLU B 6 6.927 -2.032 -14.764 1.00 0.00 H new ATOM 0 HG3 GLU B 6 6.157 -0.941 -13.629 1.00 0.00 H new ATOM 346 N GLU B 7 1.391 -2.323 -13.990 1.00 0.00 N ATOM 347 CA GLU B 7 0.129 -1.805 -14.480 1.00 0.00 C ATOM 348 C GLU B 7 -0.523 -0.937 -13.409 1.00 0.00 C ATOM 349 O GLU B 7 -1.116 -1.431 -12.450 1.00 0.00 O ATOM 350 CB GLU B 7 -0.799 -2.954 -14.934 1.00 0.00 C ATOM 351 CG GLU B 7 -1.193 -3.963 -13.850 1.00 0.00 C ATOM 352 CD GLU B 7 -0.011 -4.622 -13.163 1.00 0.00 C ATOM 353 OE1 GLU B 7 0.906 -5.095 -13.868 1.00 0.00 O ATOM 354 OE2 GLU B 7 0.018 -4.641 -11.915 1.00 0.00 O ATOM 0 H GLU B 7 1.335 -3.275 -13.627 1.00 0.00 H new ATOM 0 HA GLU B 7 0.314 -1.182 -15.355 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -1.709 -2.519 -15.346 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -0.308 -3.493 -15.744 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -1.800 -3.457 -13.100 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -1.818 -4.736 -14.297 1.00 0.00 H new ATOM 361 N VAL B 8 -0.404 0.367 -13.578 1.00 0.00 N ATOM 362 CA VAL B 8 -0.955 1.309 -12.620 1.00 0.00 C ATOM 363 C VAL B 8 -2.431 1.538 -12.867 1.00 0.00 C ATOM 364 O VAL B 8 -2.831 2.040 -13.916 1.00 0.00 O ATOM 365 CB VAL B 8 -0.225 2.663 -12.674 1.00 0.00 C ATOM 366 CG1 VAL B 8 -0.876 3.649 -11.720 1.00 0.00 C ATOM 367 CG2 VAL B 8 1.252 2.491 -12.354 1.00 0.00 C ATOM 0 H VAL B 8 0.070 0.799 -14.371 1.00 0.00 H new ATOM 0 HA VAL B 8 -0.815 0.869 -11.633 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.304 3.061 -13.686 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -0.350 4.603 -11.768 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -1.919 3.795 -12.003 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -0.827 3.258 -10.704 1.00 0.00 H new ATOM 0 HG21 VAL B 8 1.749 3.460 -12.398 1.00 0.00 H new ATOM 0 HG22 VAL B 8 1.361 2.072 -11.354 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.706 1.817 -13.081 1.00 0.00 H new ATOM 377 N LEU B 9 -3.232 1.151 -11.893 1.00 0.00 N ATOM 378 CA LEU B 9 -4.668 1.321 -11.978 1.00 0.00 C ATOM 379 C LEU B 9 -5.076 2.657 -11.370 1.00 0.00 C ATOM 380 O LEU B 9 -6.027 3.294 -11.818 1.00 0.00 O ATOM 381 CB LEU B 9 -5.390 0.178 -11.255 1.00 0.00 C ATOM 382 CG LEU B 9 -4.912 -1.235 -11.604 1.00 0.00 C ATOM 383 CD1 LEU B 9 -5.655 -2.266 -10.769 1.00 0.00 C ATOM 384 CD2 LEU B 9 -5.099 -1.516 -13.088 1.00 0.00 C ATOM 0 H LEU B 9 -2.909 0.714 -11.029 1.00 0.00 H new ATOM 0 HA LEU B 9 -4.954 1.305 -13.030 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -5.279 0.324 -10.181 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -6.455 0.247 -11.478 1.00 0.00 H new ATOM 0 HG LEU B 9 -3.848 -1.304 -11.376 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -5.305 -3.265 -11.028 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -5.470 -2.080 -9.711 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -6.724 -2.193 -10.968 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -4.753 -2.525 -13.314 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -6.155 -1.428 -13.345 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -4.523 -0.796 -13.670 1.00 0.00 H new ATOM 396 N LEU B 10 -4.346 3.077 -10.345 1.00 0.00 N ATOM 397 CA LEU B 10 -4.638 4.330 -9.669 1.00 0.00 C ATOM 398 C LEU B 10 -3.394 5.187 -9.496 1.00 0.00 C ATOM 399 O LEU B 10 -2.379 4.722 -8.977 1.00 0.00 O ATOM 400 CB LEU B 10 -5.237 4.047 -8.300 1.00 0.00 C ATOM 401 CG LEU B 10 -5.648 5.292 -7.511 1.00 0.00 C ATOM 402 CD1 LEU B 10 -7.084 5.682 -7.796 1.00 0.00 C ATOM 403 CD2 LEU B 10 -5.459 5.069 -6.027 1.00 0.00 C ATOM 0 H LEU B 10 -3.548 2.567 -9.965 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.346 4.879 -10.290 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -6.111 3.409 -8.426 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -4.513 3.483 -7.711 1.00 0.00 H new ATOM 0 HG LEU B 10 -5.004 6.110 -7.833 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -7.341 6.570 -7.219 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -7.199 5.894 -8.859 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -7.746 4.863 -7.516 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -5.757 5.966 -5.483 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -6.073 4.228 -5.704 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -4.411 4.852 -5.822 1.00 0.00 H new ATOM 415 N ILE B 11 -3.479 6.435 -9.933 1.00 0.00 N ATOM 416 CA ILE B 11 -2.375 7.367 -9.783 1.00 0.00 C ATOM 417 C ILE B 11 -2.750 8.424 -8.761 1.00 0.00 C ATOM 418 O ILE B 11 -3.773 9.097 -8.894 1.00 0.00 O ATOM 419 CB ILE B 11 -1.987 8.070 -11.099 1.00 0.00 C ATOM 420 CG1 ILE B 11 -1.631 7.043 -12.176 1.00 0.00 C ATOM 421 CG2 ILE B 11 -0.815 9.014 -10.845 1.00 0.00 C ATOM 422 CD1 ILE B 11 -1.363 7.653 -13.535 1.00 0.00 C ATOM 0 H ILE B 11 -4.302 6.824 -10.394 1.00 0.00 H new ATOM 0 HA ILE B 11 -1.513 6.784 -9.460 1.00 0.00 H new ATOM 0 HB ILE B 11 -2.838 8.648 -11.458 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -0.750 6.487 -11.857 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -2.446 6.325 -12.264 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -0.540 9.511 -11.775 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -1.103 9.761 -10.105 1.00 0.00 H new ATOM 0 HG23 ILE B 11 0.037 8.445 -10.473 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -1.117 6.864 -14.246 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -2.251 8.186 -13.876 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -0.528 8.349 -13.463 1.00 0.00 H new ATOM 434 N VAL B 12 -1.925 8.557 -7.746 1.00 0.00 N ATOM 435 CA VAL B 12 -2.153 9.515 -6.691 1.00 0.00 C ATOM 436 C VAL B 12 -1.045 10.547 -6.703 1.00 0.00 C ATOM 437 O VAL B 12 0.085 10.251 -7.090 1.00 0.00 O ATOM 438 CB VAL B 12 -2.212 8.827 -5.320 1.00 0.00 C ATOM 439 CG1 VAL B 12 -2.812 9.748 -4.282 1.00 0.00 C ATOM 440 CG2 VAL B 12 -3.005 7.536 -5.409 1.00 0.00 C ATOM 0 H VAL B 12 -1.077 8.003 -7.630 1.00 0.00 H new ATOM 0 HA VAL B 12 -3.113 10.001 -6.865 1.00 0.00 H new ATOM 0 HB VAL B 12 -1.194 8.588 -5.013 1.00 0.00 H new ATOM 0 HG11 VAL B 12 -2.844 9.239 -3.319 1.00 0.00 H new ATOM 0 HG12 VAL B 12 -2.202 10.647 -4.197 1.00 0.00 H new ATOM 0 HG13 VAL B 12 -3.824 10.023 -4.581 1.00 0.00 H new ATOM 0 HG21 VAL B 12 -3.037 7.061 -4.429 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -4.020 7.755 -5.740 1.00 0.00 H new ATOM 0 HG23 VAL B 12 -2.528 6.864 -6.122 1.00 0.00 H new ATOM 450 N LYS B 13 -1.360 11.748 -6.282 1.00 0.00 N ATOM 451 CA LYS B 13 -0.383 12.819 -6.285 1.00 0.00 C ATOM 452 C LYS B 13 -0.073 13.283 -4.881 1.00 0.00 C ATOM 453 O LYS B 13 -0.703 12.832 -3.931 1.00 0.00 O ATOM 454 CB LYS B 13 -0.887 13.985 -7.123 1.00 0.00 C ATOM 455 CG LYS B 13 -1.012 13.639 -8.591 1.00 0.00 C ATOM 456 CD LYS B 13 -2.281 14.210 -9.196 1.00 0.00 C ATOM 457 CE LYS B 13 -3.528 13.470 -8.723 1.00 0.00 C ATOM 458 NZ LYS B 13 -4.090 14.038 -7.463 1.00 0.00 N ATOM 0 H LYS B 13 -2.282 12.012 -5.933 1.00 0.00 H new ATOM 0 HA LYS B 13 0.538 12.434 -6.723 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -1.858 14.305 -6.746 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -0.207 14.829 -7.010 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -0.147 14.024 -9.131 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -1.007 12.556 -8.711 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -2.365 15.264 -8.933 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -2.219 14.157 -10.283 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -4.287 13.508 -9.504 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -3.285 12.419 -8.566 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -5.126 14.095 -7.539 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -3.835 13.425 -6.662 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -3.702 14.990 -7.308 1.00 0.00 H new ATOM 472 N LYS B 14 0.854 14.243 -4.807 1.00 0.00 N ATOM 473 CA LYS B 14 1.348 14.836 -3.551 1.00 0.00 C ATOM 474 C LYS B 14 1.054 13.977 -2.322 1.00 0.00 C ATOM 475 O LYS B 14 0.216 14.318 -1.486 1.00 0.00 O ATOM 476 CB LYS B 14 0.750 16.233 -3.365 1.00 0.00 C ATOM 477 CG LYS B 14 1.569 17.336 -4.009 1.00 0.00 C ATOM 478 CD LYS B 14 2.267 18.190 -2.963 1.00 0.00 C ATOM 479 CE LYS B 14 3.625 18.664 -3.450 1.00 0.00 C ATOM 480 NZ LYS B 14 4.519 17.524 -3.770 1.00 0.00 N ATOM 0 H LYS B 14 1.295 14.642 -5.636 1.00 0.00 H new ATOM 0 HA LYS B 14 2.433 14.897 -3.638 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -0.256 16.247 -3.784 1.00 0.00 H new ATOM 0 HB3 LYS B 14 0.654 16.439 -2.299 1.00 0.00 H new ATOM 0 HG2 LYS B 14 2.310 16.898 -4.677 1.00 0.00 H new ATOM 0 HG3 LYS B 14 0.920 17.964 -4.620 1.00 0.00 H new ATOM 0 HD2 LYS B 14 1.645 19.052 -2.721 1.00 0.00 H new ATOM 0 HD3 LYS B 14 2.388 17.616 -2.044 1.00 0.00 H new ATOM 0 HE2 LYS B 14 3.498 19.287 -4.335 1.00 0.00 H new ATOM 0 HE3 LYS B 14 4.089 19.288 -2.686 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 5.510 17.831 -3.702 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 4.349 16.750 -3.097 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 4.325 17.191 -4.736 1.00 0.00 H new ATOM 494 N VAL B 15 1.747 12.853 -2.243 1.00 0.00 N ATOM 495 CA VAL B 15 1.611 11.924 -1.136 1.00 0.00 C ATOM 496 C VAL B 15 2.951 11.793 -0.432 1.00 0.00 C ATOM 497 O VAL B 15 3.976 11.606 -1.081 1.00 0.00 O ATOM 498 CB VAL B 15 1.135 10.529 -1.611 1.00 0.00 C ATOM 499 CG1 VAL B 15 1.397 9.464 -0.554 1.00 0.00 C ATOM 500 CG2 VAL B 15 -0.341 10.558 -1.958 1.00 0.00 C ATOM 0 H VAL B 15 2.422 12.559 -2.949 1.00 0.00 H new ATOM 0 HA VAL B 15 0.857 12.315 -0.453 1.00 0.00 H new ATOM 0 HB VAL B 15 1.706 10.274 -2.504 1.00 0.00 H new ATOM 0 HG11 VAL B 15 1.051 8.497 -0.919 1.00 0.00 H new ATOM 0 HG12 VAL B 15 2.466 9.413 -0.346 1.00 0.00 H new ATOM 0 HG13 VAL B 15 0.862 9.719 0.360 1.00 0.00 H new ATOM 0 HG21 VAL B 15 -0.656 9.569 -2.290 1.00 0.00 H new ATOM 0 HG22 VAL B 15 -0.916 10.846 -1.078 1.00 0.00 H new ATOM 0 HG23 VAL B 15 -0.513 11.280 -2.756 1.00 0.00 H new ATOM 510 N ARG B 16 2.942 11.910 0.881 1.00 0.00 N ATOM 511 CA ARG B 16 4.158 11.812 1.653 1.00 0.00 C ATOM 512 C ARG B 16 4.283 10.451 2.315 1.00 0.00 C ATOM 513 O ARG B 16 3.303 9.881 2.797 1.00 0.00 O ATOM 514 CB ARG B 16 4.217 12.921 2.698 1.00 0.00 C ATOM 515 CG ARG B 16 4.233 14.306 2.087 1.00 0.00 C ATOM 516 CD ARG B 16 4.325 15.385 3.146 1.00 0.00 C ATOM 517 NE ARG B 16 4.275 16.718 2.558 1.00 0.00 N ATOM 518 CZ ARG B 16 4.097 17.834 3.255 1.00 0.00 C ATOM 519 NH1 ARG B 16 3.968 17.784 4.580 1.00 0.00 N ATOM 520 NH2 ARG B 16 4.054 19.001 2.624 1.00 0.00 N ATOM 0 H ARG B 16 2.101 12.074 1.434 1.00 0.00 H new ATOM 0 HA ARG B 16 4.999 11.930 0.969 1.00 0.00 H new ATOM 0 HB2 ARG B 16 3.358 12.833 3.363 1.00 0.00 H new ATOM 0 HB3 ARG B 16 5.109 12.789 3.310 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.079 14.393 1.405 1.00 0.00 H new ATOM 0 HG3 ARG B 16 3.329 14.453 1.495 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.507 15.269 3.857 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.253 15.268 3.706 1.00 0.00 H new ATOM 0 HE ARG B 16 4.384 16.798 1.547 1.00 0.00 H new ATOM 0 HH11 ARG B 16 4.006 16.886 5.063 1.00 0.00 H new ATOM 0 HH12 ARG B 16 3.831 18.644 5.112 1.00 0.00 H new ATOM 0 HH21 ARG B 16 4.157 19.037 1.610 1.00 0.00 H new ATOM 0 HH22 ARG B 16 3.918 19.862 3.153 1.00 0.00 H new ATOM 534 N GLN B 17 5.496 9.931 2.295 1.00 0.00 N ATOM 535 CA GLN B 17 5.810 8.651 2.895 1.00 0.00 C ATOM 536 C GLN B 17 7.100 8.788 3.692 1.00 0.00 C ATOM 537 O GLN B 17 8.171 8.969 3.110 1.00 0.00 O ATOM 538 CB GLN B 17 5.970 7.578 1.810 1.00 0.00 C ATOM 539 CG GLN B 17 5.633 6.160 2.259 1.00 0.00 C ATOM 540 CD GLN B 17 6.309 5.760 3.556 1.00 0.00 C ATOM 541 OE1 GLN B 17 7.466 5.341 3.566 1.00 0.00 O ATOM 542 NE2 GLN B 17 5.581 5.872 4.652 1.00 0.00 N ATOM 0 H GLN B 17 6.296 10.389 1.858 1.00 0.00 H new ATOM 0 HA GLN B 17 4.998 8.348 3.556 1.00 0.00 H new ATOM 0 HB2 GLN B 17 5.332 7.838 0.965 1.00 0.00 H new ATOM 0 HB3 GLN B 17 6.999 7.595 1.450 1.00 0.00 H new ATOM 0 HG2 GLN B 17 4.553 6.072 2.379 1.00 0.00 H new ATOM 0 HG3 GLN B 17 5.924 5.460 1.476 1.00 0.00 H new ATOM 0 HE21 GLN B 17 4.626 6.225 4.596 1.00 0.00 H new ATOM 0 HE22 GLN B 17 5.974 5.606 5.555 1.00 0.00 H new ATOM 551 N LYS B 18 6.984 8.738 5.014 1.00 0.00 N ATOM 552 CA LYS B 18 8.137 8.850 5.903 1.00 0.00 C ATOM 553 C LYS B 18 8.795 10.224 5.773 1.00 0.00 C ATOM 554 O LYS B 18 10.023 10.332 5.749 1.00 0.00 O ATOM 555 CB LYS B 18 9.152 7.735 5.610 1.00 0.00 C ATOM 556 CG LYS B 18 9.473 6.852 6.808 1.00 0.00 C ATOM 557 CD LYS B 18 10.332 7.576 7.835 1.00 0.00 C ATOM 558 CE LYS B 18 9.528 7.961 9.067 1.00 0.00 C ATOM 559 NZ LYS B 18 9.043 6.769 9.813 1.00 0.00 N ATOM 0 H LYS B 18 6.094 8.619 5.499 1.00 0.00 H new ATOM 0 HA LYS B 18 7.787 8.739 6.929 1.00 0.00 H new ATOM 0 HB2 LYS B 18 8.765 7.110 4.805 1.00 0.00 H new ATOM 0 HB3 LYS B 18 10.076 8.186 5.248 1.00 0.00 H new ATOM 0 HG2 LYS B 18 8.545 6.526 7.277 1.00 0.00 H new ATOM 0 HG3 LYS B 18 9.991 5.955 6.469 1.00 0.00 H new ATOM 0 HD2 LYS B 18 11.165 6.937 8.129 1.00 0.00 H new ATOM 0 HD3 LYS B 18 10.760 8.472 7.385 1.00 0.00 H new ATOM 0 HE2 LYS B 18 10.144 8.574 9.725 1.00 0.00 H new ATOM 0 HE3 LYS B 18 8.676 8.572 8.767 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 8.904 7.018 10.813 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 8.141 6.449 9.407 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 9.745 6.005 9.741 1.00 0.00 H new ATOM 573 N LYS B 19 7.957 11.263 5.683 1.00 0.00 N ATOM 574 CA LYS B 19 8.408 12.656 5.571 1.00 0.00 C ATOM 575 C LYS B 19 8.963 12.957 4.176 1.00 0.00 C ATOM 576 O LYS B 19 9.793 13.853 4.011 1.00 0.00 O ATOM 577 CB LYS B 19 9.460 12.987 6.643 1.00 0.00 C ATOM 578 CG LYS B 19 9.153 14.241 7.450 1.00 0.00 C ATOM 579 CD LYS B 19 8.112 13.974 8.527 1.00 0.00 C ATOM 580 CE LYS B 19 7.849 15.197 9.384 1.00 0.00 C ATOM 581 NZ LYS B 19 7.076 16.229 8.642 1.00 0.00 N ATOM 0 H LYS B 19 6.942 11.161 5.686 1.00 0.00 H new ATOM 0 HA LYS B 19 7.536 13.289 5.734 1.00 0.00 H new ATOM 0 HB2 LYS B 19 9.546 12.141 7.325 1.00 0.00 H new ATOM 0 HB3 LYS B 19 10.430 13.107 6.160 1.00 0.00 H new ATOM 0 HG2 LYS B 19 10.069 14.610 7.912 1.00 0.00 H new ATOM 0 HG3 LYS B 19 8.794 15.025 6.783 1.00 0.00 H new ATOM 0 HD2 LYS B 19 7.181 13.653 8.059 1.00 0.00 H new ATOM 0 HD3 LYS B 19 8.449 13.154 9.161 1.00 0.00 H new ATOM 0 HE2 LYS B 19 7.300 14.904 10.279 1.00 0.00 H new ATOM 0 HE3 LYS B 19 8.797 15.620 9.716 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 7.186 17.150 9.112 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 7.431 16.294 7.667 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 6.070 15.966 8.628 1.00 0.00 H new ATOM 595 N GLN B 20 8.486 12.229 3.173 1.00 0.00 N ATOM 596 CA GLN B 20 8.940 12.431 1.798 1.00 0.00 C ATOM 597 C GLN B 20 7.748 12.672 0.887 1.00 0.00 C ATOM 598 O GLN B 20 6.846 11.851 0.828 1.00 0.00 O ATOM 599 CB GLN B 20 9.719 11.218 1.290 1.00 0.00 C ATOM 600 CG GLN B 20 10.862 10.789 2.190 1.00 0.00 C ATOM 601 CD GLN B 20 11.422 9.443 1.789 1.00 0.00 C ATOM 602 OE1 GLN B 20 12.395 9.356 1.042 1.00 0.00 O ATOM 603 NE2 GLN B 20 10.789 8.382 2.258 1.00 0.00 N ATOM 0 H GLN B 20 7.787 11.495 3.283 1.00 0.00 H new ATOM 0 HA GLN B 20 9.598 13.300 1.788 1.00 0.00 H new ATOM 0 HB2 GLN B 20 9.030 10.381 1.173 1.00 0.00 H new ATOM 0 HB3 GLN B 20 10.116 11.444 0.301 1.00 0.00 H new ATOM 0 HG2 GLN B 20 11.654 11.537 2.153 1.00 0.00 H new ATOM 0 HG3 GLN B 20 10.514 10.744 3.222 1.00 0.00 H new ATOM 0 HE21 GLN B 20 9.986 8.499 2.875 1.00 0.00 H new ATOM 0 HE22 GLN B 20 11.104 7.446 2.003 1.00 0.00 H new ATOM 612 N ASP B 21 7.757 13.785 0.173 1.00 0.00 N ATOM 613 CA ASP B 21 6.658 14.130 -0.728 1.00 0.00 C ATOM 614 C ASP B 21 6.856 13.482 -2.099 1.00 0.00 C ATOM 615 O ASP B 21 7.979 13.432 -2.608 1.00 0.00 O ATOM 616 CB ASP B 21 6.567 15.650 -0.876 1.00 0.00 C ATOM 617 CG ASP B 21 5.137 16.151 -0.931 1.00 0.00 C ATOM 618 OD1 ASP B 21 4.395 15.738 -1.847 1.00 0.00 O ATOM 619 OD2 ASP B 21 4.760 16.977 -0.069 1.00 0.00 O ATOM 0 H ASP B 21 8.513 14.470 0.196 1.00 0.00 H new ATOM 0 HA ASP B 21 5.729 13.752 -0.301 1.00 0.00 H new ATOM 0 HB2 ASP B 21 7.081 16.123 -0.039 1.00 0.00 H new ATOM 0 HB3 ASP B 21 7.089 15.954 -1.784 1.00 0.00 H new ATOM 624 N GLY B 22 5.776 12.975 -2.690 1.00 0.00 N ATOM 625 CA GLY B 22 5.869 12.337 -3.994 1.00 0.00 C ATOM 626 C GLY B 22 4.517 11.970 -4.588 1.00 0.00 C ATOM 627 O GLY B 22 3.501 12.582 -4.266 1.00 0.00 O ATOM 0 H GLY B 22 4.838 12.994 -2.289 1.00 0.00 H new ATOM 0 HA2 GLY B 22 6.389 13.005 -4.680 1.00 0.00 H new ATOM 0 HA3 GLY B 22 6.475 11.435 -3.906 1.00 0.00 H new ATOM 631 N ALA B 23 4.512 10.956 -5.447 1.00 0.00 N ATOM 632 CA ALA B 23 3.297 10.489 -6.111 1.00 0.00 C ATOM 633 C ALA B 23 3.137 8.987 -5.901 1.00 0.00 C ATOM 634 O ALA B 23 4.106 8.230 -5.991 1.00 0.00 O ATOM 635 CB ALA B 23 3.349 10.815 -7.597 1.00 0.00 C ATOM 0 H ALA B 23 5.350 10.434 -5.704 1.00 0.00 H new ATOM 0 HA ALA B 23 2.437 10.999 -5.677 1.00 0.00 H new ATOM 0 HB1 ALA B 23 2.438 10.461 -8.079 1.00 0.00 H new ATOM 0 HB2 ALA B 23 3.435 11.893 -7.730 1.00 0.00 H new ATOM 0 HB3 ALA B 23 4.212 10.324 -8.047 1.00 0.00 H new ATOM 641 N LEU B 24 1.916 8.567 -5.625 1.00 0.00 N ATOM 642 CA LEU B 24 1.611 7.165 -5.366 1.00 0.00 C ATOM 643 C LEU B 24 0.980 6.511 -6.598 1.00 0.00 C ATOM 644 O LEU B 24 0.209 7.139 -7.312 1.00 0.00 O ATOM 645 CB LEU B 24 0.665 7.079 -4.167 1.00 0.00 C ATOM 646 CG LEU B 24 0.208 5.672 -3.795 1.00 0.00 C ATOM 647 CD1 LEU B 24 1.139 5.032 -2.794 1.00 0.00 C ATOM 648 CD2 LEU B 24 -1.208 5.701 -3.251 1.00 0.00 C ATOM 0 H LEU B 24 1.106 9.185 -5.573 1.00 0.00 H new ATOM 0 HA LEU B 24 2.533 6.628 -5.143 1.00 0.00 H new ATOM 0 HB2 LEU B 24 1.159 7.523 -3.303 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -0.216 7.686 -4.376 1.00 0.00 H new ATOM 0 HG LEU B 24 0.228 5.068 -4.702 1.00 0.00 H new ATOM 0 HD11 LEU B 24 0.781 4.031 -2.553 1.00 0.00 H new ATOM 0 HD12 LEU B 24 2.141 4.967 -3.219 1.00 0.00 H new ATOM 0 HD13 LEU B 24 1.168 5.635 -1.887 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -1.518 4.689 -2.991 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -1.244 6.332 -2.363 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -1.881 6.103 -4.009 1.00 0.00 H new ATOM 660 N TYR B 25 1.326 5.257 -6.857 1.00 0.00 N ATOM 661 CA TYR B 25 0.784 4.526 -7.999 1.00 0.00 C ATOM 662 C TYR B 25 0.404 3.109 -7.575 1.00 0.00 C ATOM 663 O TYR B 25 1.249 2.346 -7.112 1.00 0.00 O ATOM 664 CB TYR B 25 1.806 4.450 -9.143 1.00 0.00 C ATOM 665 CG TYR B 25 2.433 5.771 -9.530 1.00 0.00 C ATOM 666 CD1 TYR B 25 1.878 6.561 -10.527 1.00 0.00 C ATOM 667 CD2 TYR B 25 3.591 6.220 -8.906 1.00 0.00 C ATOM 668 CE1 TYR B 25 2.457 7.761 -10.891 1.00 0.00 C ATOM 669 CE2 TYR B 25 4.174 7.419 -9.262 1.00 0.00 C ATOM 670 CZ TYR B 25 3.604 8.185 -10.255 1.00 0.00 C ATOM 671 OH TYR B 25 4.184 9.380 -10.616 1.00 0.00 O ATOM 0 H TYR B 25 1.983 4.721 -6.290 1.00 0.00 H new ATOM 0 HA TYR B 25 -0.098 5.060 -8.352 1.00 0.00 H new ATOM 0 HB2 TYR B 25 2.599 3.759 -8.856 1.00 0.00 H new ATOM 0 HB3 TYR B 25 1.316 4.027 -10.020 1.00 0.00 H new ATOM 0 HD1 TYR B 25 0.979 6.232 -11.026 1.00 0.00 H new ATOM 0 HD2 TYR B 25 4.042 5.620 -8.129 1.00 0.00 H new ATOM 0 HE1 TYR B 25 2.013 8.364 -11.670 1.00 0.00 H new ATOM 0 HE2 TYR B 25 5.072 7.755 -8.765 1.00 0.00 H new ATOM 0 HH TYR B 25 4.984 9.533 -10.071 1.00 0.00 H new ATOM 681 N LEU B 26 -0.859 2.753 -7.731 1.00 0.00 N ATOM 682 CA LEU B 26 -1.310 1.424 -7.338 1.00 0.00 C ATOM 683 C LEU B 26 -1.423 0.500 -8.543 1.00 0.00 C ATOM 684 O LEU B 26 -2.166 0.783 -9.483 1.00 0.00 O ATOM 685 CB LEU B 26 -2.657 1.490 -6.617 1.00 0.00 C ATOM 686 CG LEU B 26 -2.760 2.546 -5.518 1.00 0.00 C ATOM 687 CD1 LEU B 26 -4.028 2.368 -4.717 1.00 0.00 C ATOM 688 CD2 LEU B 26 -1.579 2.493 -4.586 1.00 0.00 C ATOM 0 H LEU B 26 -1.584 3.355 -8.121 1.00 0.00 H new ATOM 0 HA LEU B 26 -0.562 1.021 -6.655 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -3.436 1.681 -7.355 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -2.864 0.513 -6.180 1.00 0.00 H new ATOM 0 HG LEU B 26 -2.774 3.517 -6.013 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -4.078 3.132 -3.941 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -4.891 2.463 -5.376 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -4.031 1.381 -4.255 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -1.687 3.258 -3.818 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -1.531 1.511 -4.116 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -0.663 2.671 -5.149 1.00 0.00 H new ATOM 700 N MET B 27 -0.677 -0.594 -8.507 1.00 0.00 N ATOM 701 CA MET B 27 -0.694 -1.583 -9.575 1.00 0.00 C ATOM 702 C MET B 27 -1.644 -2.713 -9.204 1.00 0.00 C ATOM 703 O MET B 27 -2.024 -2.846 -8.044 1.00 0.00 O ATOM 704 CB MET B 27 0.701 -2.146 -9.836 1.00 0.00 C ATOM 705 CG MET B 27 1.683 -1.126 -10.384 1.00 0.00 C ATOM 706 SD MET B 27 2.570 -0.239 -9.089 1.00 0.00 S ATOM 707 CE MET B 27 3.584 0.854 -10.078 1.00 0.00 C ATOM 0 H MET B 27 -0.045 -0.821 -7.739 1.00 0.00 H new ATOM 0 HA MET B 27 -1.035 -1.094 -10.488 1.00 0.00 H new ATOM 0 HB2 MET B 27 1.097 -2.554 -8.906 1.00 0.00 H new ATOM 0 HB3 MET B 27 0.622 -2.975 -10.540 1.00 0.00 H new ATOM 0 HG2 MET B 27 2.402 -1.631 -11.029 1.00 0.00 H new ATOM 0 HG3 MET B 27 1.146 -0.410 -11.006 1.00 0.00 H new ATOM 0 HE1 MET B 27 4.617 0.802 -9.735 1.00 0.00 H new ATOM 0 HE2 MET B 27 3.533 0.551 -11.124 1.00 0.00 H new ATOM 0 HE3 MET B 27 3.220 1.877 -9.979 1.00 0.00 H new ATOM 717 N ALA B 28 -1.976 -3.551 -10.175 1.00 0.00 N ATOM 718 CA ALA B 28 -2.918 -4.652 -9.970 1.00 0.00 C ATOM 719 C ALA B 28 -2.525 -5.576 -8.819 1.00 0.00 C ATOM 720 O ALA B 28 -3.388 -6.051 -8.088 1.00 0.00 O ATOM 721 CB ALA B 28 -3.076 -5.454 -11.252 1.00 0.00 C ATOM 0 H ALA B 28 -1.605 -3.492 -11.123 1.00 0.00 H new ATOM 0 HA ALA B 28 -3.870 -4.198 -9.696 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -3.779 -6.270 -11.086 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -3.453 -4.805 -12.043 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -2.109 -5.862 -11.547 1.00 0.00 H new ATOM 727 N GLU B 29 -1.235 -5.825 -8.647 1.00 0.00 N ATOM 728 CA GLU B 29 -0.792 -6.722 -7.584 1.00 0.00 C ATOM 729 C GLU B 29 0.072 -6.030 -6.531 1.00 0.00 C ATOM 730 O GLU B 29 0.459 -6.658 -5.541 1.00 0.00 O ATOM 731 CB GLU B 29 -0.013 -7.894 -8.179 1.00 0.00 C ATOM 732 CG GLU B 29 -0.888 -9.059 -8.606 1.00 0.00 C ATOM 733 CD GLU B 29 -0.348 -10.391 -8.129 1.00 0.00 C ATOM 734 OE1 GLU B 29 0.179 -10.454 -6.996 1.00 0.00 O ATOM 735 OE2 GLU B 29 -0.453 -11.386 -8.874 1.00 0.00 O ATOM 0 H GLU B 29 -0.487 -5.428 -9.216 1.00 0.00 H new ATOM 0 HA GLU B 29 -1.694 -7.073 -7.083 1.00 0.00 H new ATOM 0 HB2 GLU B 29 0.553 -7.541 -9.042 1.00 0.00 H new ATOM 0 HB3 GLU B 29 0.712 -8.246 -7.445 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -1.895 -8.917 -8.214 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -0.968 -9.071 -9.693 1.00 0.00 H new ATOM 742 N ARG B 30 0.342 -4.740 -6.685 1.00 0.00 N ATOM 743 CA ARG B 30 1.205 -4.074 -5.716 1.00 0.00 C ATOM 744 C ARG B 30 0.991 -2.574 -5.676 1.00 0.00 C ATOM 745 O ARG B 30 0.489 -1.979 -6.617 1.00 0.00 O ATOM 746 CB ARG B 30 2.678 -4.363 -6.025 1.00 0.00 C ATOM 747 CG ARG B 30 3.201 -3.652 -7.264 1.00 0.00 C ATOM 748 CD ARG B 30 4.708 -3.802 -7.396 1.00 0.00 C ATOM 749 NE ARG B 30 5.256 -2.966 -8.469 1.00 0.00 N ATOM 750 CZ ARG B 30 6.182 -2.024 -8.279 1.00 0.00 C ATOM 751 NH1 ARG B 30 6.669 -1.798 -7.065 1.00 0.00 N ATOM 752 NH2 ARG B 30 6.637 -1.323 -9.308 1.00 0.00 N ATOM 0 H ARG B 30 -0.008 -4.152 -7.441 1.00 0.00 H new ATOM 0 HA ARG B 30 0.939 -4.475 -4.738 1.00 0.00 H new ATOM 0 HB2 ARG B 30 3.283 -4.069 -5.167 1.00 0.00 H new ATOM 0 HB3 ARG B 30 2.808 -5.438 -6.153 1.00 0.00 H new ATOM 0 HG2 ARG B 30 2.715 -4.058 -8.151 1.00 0.00 H new ATOM 0 HG3 ARG B 30 2.942 -2.594 -7.215 1.00 0.00 H new ATOM 0 HD2 ARG B 30 5.182 -3.535 -6.452 1.00 0.00 H new ATOM 0 HD3 ARG B 30 4.952 -4.846 -7.591 1.00 0.00 H new ATOM 0 HE ARG B 30 4.909 -3.113 -9.417 1.00 0.00 H new ATOM 0 HH11 ARG B 30 6.336 -2.346 -6.272 1.00 0.00 H new ATOM 0 HH12 ARG B 30 7.377 -1.077 -6.926 1.00 0.00 H new ATOM 0 HH21 ARG B 30 6.279 -1.503 -10.246 1.00 0.00 H new ATOM 0 HH22 ARG B 30 7.345 -0.603 -9.162 1.00 0.00 H new ATOM 766 N ILE B 31 1.387 -1.982 -4.568 1.00 0.00 N ATOM 767 CA ILE B 31 1.283 -0.551 -4.374 1.00 0.00 C ATOM 768 C ILE B 31 2.686 0.047 -4.378 1.00 0.00 C ATOM 769 O ILE B 31 3.548 -0.359 -3.589 1.00 0.00 O ATOM 770 CB ILE B 31 0.547 -0.205 -3.053 1.00 0.00 C ATOM 771 CG1 ILE B 31 0.933 1.195 -2.563 1.00 0.00 C ATOM 772 CG2 ILE B 31 0.830 -1.253 -1.982 1.00 0.00 C ATOM 773 CD1 ILE B 31 0.068 1.699 -1.432 1.00 0.00 C ATOM 0 H ILE B 31 1.791 -2.481 -3.775 1.00 0.00 H new ATOM 0 HA ILE B 31 0.695 -0.126 -5.187 1.00 0.00 H new ATOM 0 HB ILE B 31 -0.524 -0.209 -3.253 1.00 0.00 H new ATOM 0 HG12 ILE B 31 1.973 1.183 -2.236 1.00 0.00 H new ATOM 0 HG13 ILE B 31 0.869 1.893 -3.397 1.00 0.00 H new ATOM 0 HG21 ILE B 31 0.303 -0.988 -1.065 1.00 0.00 H new ATOM 0 HG22 ILE B 31 0.488 -2.228 -2.328 1.00 0.00 H new ATOM 0 HG23 ILE B 31 1.901 -1.293 -1.786 1.00 0.00 H new ATOM 0 HD11 ILE B 31 0.399 2.695 -1.137 1.00 0.00 H new ATOM 0 HD12 ILE B 31 -0.970 1.744 -1.760 1.00 0.00 H new ATOM 0 HD13 ILE B 31 0.151 1.022 -0.581 1.00 0.00 H new ATOM 785 N ALA B 32 2.928 0.974 -5.289 1.00 0.00 N ATOM 786 CA ALA B 32 4.227 1.610 -5.395 1.00 0.00 C ATOM 787 C ALA B 32 4.099 3.115 -5.256 1.00 0.00 C ATOM 788 O ALA B 32 3.072 3.696 -5.591 1.00 0.00 O ATOM 789 CB ALA B 32 4.887 1.254 -6.717 1.00 0.00 C ATOM 0 H ALA B 32 2.240 1.302 -5.966 1.00 0.00 H new ATOM 0 HA ALA B 32 4.855 1.242 -4.584 1.00 0.00 H new ATOM 0 HB1 ALA B 32 5.861 1.740 -6.780 1.00 0.00 H new ATOM 0 HB2 ALA B 32 5.016 0.173 -6.780 1.00 0.00 H new ATOM 0 HB3 ALA B 32 4.259 1.593 -7.540 1.00 0.00 H new ATOM 795 N TRP B 33 5.133 3.743 -4.743 1.00 0.00 N ATOM 796 CA TRP B 33 5.129 5.180 -4.567 1.00 0.00 C ATOM 797 C TRP B 33 6.539 5.721 -4.760 1.00 0.00 C ATOM 798 O TRP B 33 7.515 5.098 -4.334 1.00 0.00 O ATOM 799 CB TRP B 33 4.552 5.530 -3.187 1.00 0.00 C ATOM 800 CG TRP B 33 4.749 6.953 -2.762 1.00 0.00 C ATOM 801 CD1 TRP B 33 3.854 7.967 -2.906 1.00 0.00 C ATOM 802 CD2 TRP B 33 5.895 7.522 -2.114 1.00 0.00 C ATOM 803 NE1 TRP B 33 4.369 9.131 -2.410 1.00 0.00 N ATOM 804 CE2 TRP B 33 5.622 8.887 -1.914 1.00 0.00 C ATOM 805 CE3 TRP B 33 7.125 7.014 -1.690 1.00 0.00 C ATOM 806 CZ2 TRP B 33 6.532 9.746 -1.309 1.00 0.00 C ATOM 807 CZ3 TRP B 33 8.027 7.869 -1.087 1.00 0.00 C ATOM 808 CH2 TRP B 33 7.726 9.222 -0.902 1.00 0.00 C ATOM 0 H TRP B 33 5.990 3.281 -4.439 1.00 0.00 H new ATOM 0 HA TRP B 33 4.492 5.651 -5.315 1.00 0.00 H new ATOM 0 HB2 TRP B 33 3.484 5.312 -3.190 1.00 0.00 H new ATOM 0 HB3 TRP B 33 5.008 4.878 -2.443 1.00 0.00 H new ATOM 0 HD1 TRP B 33 2.875 7.866 -3.350 1.00 0.00 H new ATOM 0 HE1 TRP B 33 3.897 10.035 -2.409 1.00 0.00 H new ATOM 0 HE3 TRP B 33 7.367 5.971 -1.831 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 6.303 10.792 -1.166 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 8.980 7.486 -0.753 1.00 0.00 H new ATOM 0 HH2 TRP B 33 8.452 9.866 -0.428 1.00 0.00 H new ATOM 819 N ALA B 34 6.644 6.861 -5.424 1.00 0.00 N ATOM 820 CA ALA B 34 7.933 7.481 -5.680 1.00 0.00 C ATOM 821 C ALA B 34 7.899 8.954 -5.302 1.00 0.00 C ATOM 822 O ALA B 34 6.917 9.644 -5.575 1.00 0.00 O ATOM 823 CB ALA B 34 8.313 7.323 -7.146 1.00 0.00 C ATOM 0 H ALA B 34 5.847 7.377 -5.797 1.00 0.00 H new ATOM 0 HA ALA B 34 8.684 6.982 -5.067 1.00 0.00 H new ATOM 0 HB1 ALA B 34 9.281 7.792 -7.324 1.00 0.00 H new ATOM 0 HB2 ALA B 34 8.372 6.263 -7.394 1.00 0.00 H new ATOM 0 HB3 ALA B 34 7.558 7.800 -7.771 1.00 0.00 H new ATOM 829 N PRO B 35 8.960 9.450 -4.650 1.00 0.00 N ATOM 830 CA PRO B 35 9.049 10.852 -4.246 1.00 0.00 C ATOM 831 C PRO B 35 9.087 11.782 -5.456 1.00 0.00 C ATOM 832 O PRO B 35 9.395 11.358 -6.573 1.00 0.00 O ATOM 833 CB PRO B 35 10.364 10.935 -3.458 1.00 0.00 C ATOM 834 CG PRO B 35 10.719 9.522 -3.136 1.00 0.00 C ATOM 835 CD PRO B 35 10.149 8.689 -4.247 1.00 0.00 C ATOM 0 HA PRO B 35 8.184 11.164 -3.660 1.00 0.00 H new ATOM 0 HB2 PRO B 35 11.146 11.413 -4.048 1.00 0.00 H new ATOM 0 HB3 PRO B 35 10.242 11.527 -2.551 1.00 0.00 H new ATOM 0 HG2 PRO B 35 11.800 9.397 -3.069 1.00 0.00 H new ATOM 0 HG3 PRO B 35 10.304 9.225 -2.173 1.00 0.00 H new ATOM 0 HD2 PRO B 35 10.855 8.576 -5.070 1.00 0.00 H new ATOM 0 HD3 PRO B 35 9.891 7.686 -3.908 1.00 0.00 H new ATOM 843 N GLU B 36 8.777 13.047 -5.229 1.00 0.00 N ATOM 844 CA GLU B 36 8.756 14.037 -6.293 1.00 0.00 C ATOM 845 C GLU B 36 10.121 14.159 -6.966 1.00 0.00 C ATOM 846 O GLU B 36 11.159 14.254 -6.298 1.00 0.00 O ATOM 847 CB GLU B 36 8.314 15.389 -5.741 1.00 0.00 C ATOM 848 CG GLU B 36 7.464 16.191 -6.710 1.00 0.00 C ATOM 849 CD GLU B 36 6.351 16.939 -6.009 1.00 0.00 C ATOM 850 OE1 GLU B 36 5.171 16.561 -6.181 1.00 0.00 O ATOM 851 OE2 GLU B 36 6.649 17.893 -5.258 1.00 0.00 O ATOM 0 H GLU B 36 8.534 13.415 -4.309 1.00 0.00 H new ATOM 0 HA GLU B 36 8.041 13.708 -7.047 1.00 0.00 H new ATOM 0 HB2 GLU B 36 7.751 15.230 -4.822 1.00 0.00 H new ATOM 0 HB3 GLU B 36 9.197 15.971 -5.477 1.00 0.00 H new ATOM 0 HG2 GLU B 36 8.096 16.900 -7.244 1.00 0.00 H new ATOM 0 HG3 GLU B 36 7.036 15.521 -7.456 1.00 0.00 H new ATOM 858 N GLY B 37 10.113 14.119 -8.293 1.00 0.00 N ATOM 859 CA GLY B 37 11.337 14.243 -9.058 1.00 0.00 C ATOM 860 C GLY B 37 12.233 13.024 -8.948 1.00 0.00 C ATOM 861 O GLY B 37 13.458 13.149 -8.979 1.00 0.00 O ATOM 0 H GLY B 37 9.271 14.002 -8.857 1.00 0.00 H new ATOM 0 HA2 GLY B 37 11.088 14.410 -10.106 1.00 0.00 H new ATOM 0 HA3 GLY B 37 11.885 15.121 -8.716 1.00 0.00 H new ATOM 865 N LYS B 38 11.639 11.856 -8.751 1.00 0.00 N ATOM 866 CA LYS B 38 12.408 10.622 -8.652 1.00 0.00 C ATOM 867 C LYS B 38 12.103 9.709 -9.831 1.00 0.00 C ATOM 868 O LYS B 38 10.987 9.701 -10.347 1.00 0.00 O ATOM 869 CB LYS B 38 12.130 9.908 -7.329 1.00 0.00 C ATOM 870 CG LYS B 38 12.574 10.705 -6.113 1.00 0.00 C ATOM 871 CD LYS B 38 14.054 11.046 -6.170 1.00 0.00 C ATOM 872 CE LYS B 38 14.351 12.359 -5.460 1.00 0.00 C ATOM 873 NZ LYS B 38 13.801 13.529 -6.199 1.00 0.00 N ATOM 0 H LYS B 38 10.631 11.736 -8.657 1.00 0.00 H new ATOM 0 HA LYS B 38 13.467 10.878 -8.679 1.00 0.00 H new ATOM 0 HB2 LYS B 38 11.062 9.704 -7.251 1.00 0.00 H new ATOM 0 HB3 LYS B 38 12.640 8.944 -7.330 1.00 0.00 H new ATOM 0 HG2 LYS B 38 11.992 11.624 -6.049 1.00 0.00 H new ATOM 0 HG3 LYS B 38 12.368 10.133 -5.208 1.00 0.00 H new ATOM 0 HD2 LYS B 38 14.631 10.244 -5.710 1.00 0.00 H new ATOM 0 HD3 LYS B 38 14.373 11.113 -7.210 1.00 0.00 H new ATOM 0 HE2 LYS B 38 13.927 12.332 -4.456 1.00 0.00 H new ATOM 0 HE3 LYS B 38 15.429 12.475 -5.348 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 14.314 14.389 -5.919 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 13.912 13.377 -7.222 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 12.792 13.639 -5.973 1.00 0.00 H new ATOM 887 N ASP B 39 13.104 8.949 -10.246 1.00 0.00 N ATOM 888 CA ASP B 39 12.969 8.029 -11.371 1.00 0.00 C ATOM 889 C ASP B 39 12.658 6.617 -10.889 1.00 0.00 C ATOM 890 O ASP B 39 12.237 5.761 -11.666 1.00 0.00 O ATOM 891 CB ASP B 39 14.267 8.017 -12.188 1.00 0.00 C ATOM 892 CG ASP B 39 15.436 7.414 -11.423 1.00 0.00 C ATOM 893 OD1 ASP B 39 15.514 7.605 -10.185 1.00 0.00 O ATOM 894 OD2 ASP B 39 16.286 6.749 -12.050 1.00 0.00 O ATOM 0 H ASP B 39 14.029 8.950 -9.817 1.00 0.00 H new ATOM 0 HA ASP B 39 12.143 8.371 -11.994 1.00 0.00 H new ATOM 0 HB2 ASP B 39 14.108 7.452 -13.106 1.00 0.00 H new ATOM 0 HB3 ASP B 39 14.517 9.037 -12.481 1.00 0.00 H new ATOM 899 N ARG B 40 12.856 6.382 -9.603 1.00 0.00 N ATOM 900 CA ARG B 40 12.621 5.069 -9.029 1.00 0.00 C ATOM 901 C ARG B 40 11.635 5.136 -7.871 1.00 0.00 C ATOM 902 O ARG B 40 11.590 6.121 -7.131 1.00 0.00 O ATOM 903 CB ARG B 40 13.944 4.462 -8.559 1.00 0.00 C ATOM 904 CG ARG B 40 14.701 5.333 -7.566 1.00 0.00 C ATOM 905 CD ARG B 40 16.203 5.139 -7.688 1.00 0.00 C ATOM 906 NE ARG B 40 16.687 5.488 -9.023 1.00 0.00 N ATOM 907 CZ ARG B 40 17.739 4.929 -9.614 1.00 0.00 C ATOM 908 NH1 ARG B 40 18.478 4.033 -8.964 1.00 0.00 N ATOM 909 NH2 ARG B 40 18.053 5.273 -10.855 1.00 0.00 N ATOM 0 H ARG B 40 13.179 7.084 -8.937 1.00 0.00 H new ATOM 0 HA ARG B 40 12.185 4.436 -9.802 1.00 0.00 H new ATOM 0 HB2 ARG B 40 13.746 3.493 -8.101 1.00 0.00 H new ATOM 0 HB3 ARG B 40 14.578 4.281 -9.427 1.00 0.00 H new ATOM 0 HG2 ARG B 40 14.453 6.381 -7.737 1.00 0.00 H new ATOM 0 HG3 ARG B 40 14.383 5.091 -6.552 1.00 0.00 H new ATOM 0 HD2 ARG B 40 16.711 5.754 -6.945 1.00 0.00 H new ATOM 0 HD3 ARG B 40 16.455 4.101 -7.469 1.00 0.00 H new ATOM 0 HE ARG B 40 16.183 6.211 -9.537 1.00 0.00 H new ATOM 0 HH11 ARG B 40 18.239 3.772 -8.008 1.00 0.00 H new ATOM 0 HH12 ARG B 40 19.284 3.607 -9.422 1.00 0.00 H new ATOM 0 HH21 ARG B 40 17.489 5.963 -11.351 1.00 0.00 H new ATOM 0 HH22 ARG B 40 18.859 4.848 -11.314 1.00 0.00 H new ATOM 923 N PHE B 41 10.847 4.080 -7.727 1.00 0.00 N ATOM 924 CA PHE B 41 9.863 3.993 -6.658 1.00 0.00 C ATOM 925 C PHE B 41 10.529 3.498 -5.383 1.00 0.00 C ATOM 926 O PHE B 41 11.120 2.419 -5.367 1.00 0.00 O ATOM 927 CB PHE B 41 8.726 3.037 -7.040 1.00 0.00 C ATOM 928 CG PHE B 41 8.116 3.309 -8.386 1.00 0.00 C ATOM 929 CD1 PHE B 41 7.110 4.249 -8.529 1.00 0.00 C ATOM 930 CD2 PHE B 41 8.546 2.617 -9.508 1.00 0.00 C ATOM 931 CE1 PHE B 41 6.544 4.495 -9.765 1.00 0.00 C ATOM 932 CE2 PHE B 41 7.984 2.860 -10.746 1.00 0.00 C ATOM 933 CZ PHE B 41 6.981 3.801 -10.875 1.00 0.00 C ATOM 0 H PHE B 41 10.871 3.266 -8.342 1.00 0.00 H new ATOM 0 HA PHE B 41 9.446 4.987 -6.495 1.00 0.00 H new ATOM 0 HB2 PHE B 41 9.106 2.015 -7.026 1.00 0.00 H new ATOM 0 HB3 PHE B 41 7.946 3.098 -6.281 1.00 0.00 H new ATOM 0 HD1 PHE B 41 6.764 4.796 -7.665 1.00 0.00 H new ATOM 0 HD2 PHE B 41 9.329 1.880 -9.413 1.00 0.00 H new ATOM 0 HE1 PHE B 41 5.759 5.231 -9.863 1.00 0.00 H new ATOM 0 HE2 PHE B 41 8.328 2.315 -11.612 1.00 0.00 H new ATOM 0 HZ PHE B 41 6.540 3.993 -11.842 1.00 0.00 H new ATOM 943 N THR B 42 10.445 4.285 -4.324 1.00 0.00 N ATOM 944 CA THR B 42 11.039 3.909 -3.052 1.00 0.00 C ATOM 945 C THR B 42 10.095 3.003 -2.272 1.00 0.00 C ATOM 946 O THR B 42 10.510 2.266 -1.380 1.00 0.00 O ATOM 947 CB THR B 42 11.371 5.153 -2.215 1.00 0.00 C ATOM 948 OG1 THR B 42 10.383 6.165 -2.449 1.00 0.00 O ATOM 949 CG2 THR B 42 12.751 5.692 -2.567 1.00 0.00 C ATOM 0 H THR B 42 9.971 5.188 -4.320 1.00 0.00 H new ATOM 0 HA THR B 42 11.963 3.370 -3.259 1.00 0.00 H new ATOM 0 HB THR B 42 11.370 4.873 -1.162 1.00 0.00 H new ATOM 0 HG1 THR B 42 9.615 6.015 -1.859 1.00 0.00 H new ATOM 0 HG21 THR B 42 12.963 6.573 -1.961 1.00 0.00 H new ATOM 0 HG22 THR B 42 13.502 4.927 -2.370 1.00 0.00 H new ATOM 0 HG23 THR B 42 12.777 5.963 -3.622 1.00 0.00 H new ATOM 957 N ILE B 43 8.818 3.069 -2.622 1.00 0.00 N ATOM 958 CA ILE B 43 7.804 2.261 -1.971 1.00 0.00 C ATOM 959 C ILE B 43 7.352 1.133 -2.885 1.00 0.00 C ATOM 960 O ILE B 43 6.947 1.368 -4.026 1.00 0.00 O ATOM 961 CB ILE B 43 6.587 3.121 -1.553 1.00 0.00 C ATOM 962 CG1 ILE B 43 6.927 3.947 -0.311 1.00 0.00 C ATOM 963 CG2 ILE B 43 5.360 2.256 -1.301 1.00 0.00 C ATOM 964 CD1 ILE B 43 7.416 3.120 0.859 1.00 0.00 C ATOM 0 H ILE B 43 8.461 3.678 -3.358 1.00 0.00 H new ATOM 0 HA ILE B 43 8.248 1.833 -1.072 1.00 0.00 H new ATOM 0 HB ILE B 43 6.352 3.799 -2.374 1.00 0.00 H new ATOM 0 HG12 ILE B 43 7.692 4.679 -0.571 1.00 0.00 H new ATOM 0 HG13 ILE B 43 6.043 4.505 -0.004 1.00 0.00 H new ATOM 0 HG21 ILE B 43 4.522 2.889 -1.009 1.00 0.00 H new ATOM 0 HG22 ILE B 43 5.105 1.713 -2.211 1.00 0.00 H new ATOM 0 HG23 ILE B 43 5.573 1.546 -0.502 1.00 0.00 H new ATOM 0 HD11 ILE B 43 7.637 3.776 1.701 1.00 0.00 H new ATOM 0 HD12 ILE B 43 6.645 2.406 1.147 1.00 0.00 H new ATOM 0 HD13 ILE B 43 8.319 2.582 0.572 1.00 0.00 H new ATOM 976 N SER B 44 7.454 -0.087 -2.388 1.00 0.00 N ATOM 977 CA SER B 44 7.047 -1.258 -3.139 1.00 0.00 C ATOM 978 C SER B 44 6.521 -2.323 -2.189 1.00 0.00 C ATOM 979 O SER B 44 7.295 -3.018 -1.532 1.00 0.00 O ATOM 980 CB SER B 44 8.223 -1.803 -3.956 1.00 0.00 C ATOM 981 OG SER B 44 7.836 -2.936 -4.719 1.00 0.00 O ATOM 0 H SER B 44 7.819 -0.292 -1.458 1.00 0.00 H new ATOM 0 HA SER B 44 6.251 -0.977 -3.829 1.00 0.00 H new ATOM 0 HB2 SER B 44 8.599 -1.025 -4.620 1.00 0.00 H new ATOM 0 HB3 SER B 44 9.040 -2.073 -3.287 1.00 0.00 H new ATOM 0 HG SER B 44 8.604 -3.263 -5.232 1.00 0.00 H new ATOM 987 N HIS B 45 5.205 -2.438 -2.108 1.00 0.00 N ATOM 988 CA HIS B 45 4.581 -3.426 -1.239 1.00 0.00 C ATOM 989 C HIS B 45 3.549 -4.212 -2.019 1.00 0.00 C ATOM 990 O HIS B 45 2.815 -3.646 -2.830 1.00 0.00 O ATOM 991 CB HIS B 45 3.907 -2.762 -0.033 1.00 0.00 C ATOM 992 CG HIS B 45 4.788 -1.812 0.715 1.00 0.00 C ATOM 993 ND1 HIS B 45 5.703 -2.196 1.669 1.00 0.00 N ATOM 994 CD2 HIS B 45 4.892 -0.465 0.616 1.00 0.00 C ATOM 995 CE1 HIS B 45 6.325 -1.095 2.108 1.00 0.00 C ATOM 996 NE2 HIS B 45 5.870 -0.017 1.497 1.00 0.00 N ATOM 0 H HIS B 45 4.548 -1.861 -2.632 1.00 0.00 H new ATOM 0 HA HIS B 45 5.361 -4.093 -0.873 1.00 0.00 H new ATOM 0 HB2 HIS B 45 3.022 -2.226 -0.375 1.00 0.00 H new ATOM 0 HB3 HIS B 45 3.565 -3.539 0.651 1.00 0.00 H new ATOM 0 HD1 HIS B 45 5.876 -3.150 1.985 1.00 0.00 H new ATOM 0 HD2 HIS B 45 4.308 0.161 -0.042 1.00 0.00 H new ATOM 0 HE1 HIS B 45 7.097 -1.089 2.863 1.00 0.00 H new ATOM 1004 N MET B 46 3.497 -5.509 -1.792 1.00 0.00 N ATOM 1005 CA MET B 46 2.534 -6.347 -2.474 1.00 0.00 C ATOM 1006 C MET B 46 1.288 -6.455 -1.618 1.00 0.00 C ATOM 1007 O MET B 46 1.380 -6.509 -0.395 1.00 0.00 O ATOM 1008 CB MET B 46 3.107 -7.745 -2.738 1.00 0.00 C ATOM 1009 CG MET B 46 4.430 -7.743 -3.488 1.00 0.00 C ATOM 1010 SD MET B 46 4.259 -7.245 -5.216 1.00 0.00 S ATOM 1011 CE MET B 46 3.233 -8.571 -5.852 1.00 0.00 C ATOM 0 H MET B 46 4.109 -6.004 -1.143 1.00 0.00 H new ATOM 0 HA MET B 46 2.292 -5.897 -3.437 1.00 0.00 H new ATOM 0 HB2 MET B 46 3.243 -8.256 -1.785 1.00 0.00 H new ATOM 0 HB3 MET B 46 2.379 -8.322 -3.308 1.00 0.00 H new ATOM 0 HG2 MET B 46 5.124 -7.068 -2.988 1.00 0.00 H new ATOM 0 HG3 MET B 46 4.868 -8.740 -3.444 1.00 0.00 H new ATOM 0 HE1 MET B 46 3.271 -8.570 -6.941 1.00 0.00 H new ATOM 0 HE2 MET B 46 3.600 -9.527 -5.477 1.00 0.00 H new ATOM 0 HE3 MET B 46 2.204 -8.424 -5.525 1.00 0.00 H new ATOM 1021 N TYR B 47 0.125 -6.474 -2.253 1.00 0.00 N ATOM 1022 CA TYR B 47 -1.145 -6.595 -1.530 1.00 0.00 C ATOM 1023 C TYR B 47 -1.160 -7.889 -0.725 1.00 0.00 C ATOM 1024 O TYR B 47 -1.881 -8.018 0.259 1.00 0.00 O ATOM 1025 CB TYR B 47 -2.304 -6.579 -2.525 1.00 0.00 C ATOM 1026 CG TYR B 47 -2.356 -5.315 -3.347 1.00 0.00 C ATOM 1027 CD1 TYR B 47 -2.025 -4.090 -2.785 1.00 0.00 C ATOM 1028 CD2 TYR B 47 -2.727 -5.346 -4.679 1.00 0.00 C ATOM 1029 CE1 TYR B 47 -2.061 -2.931 -3.530 1.00 0.00 C ATOM 1030 CE2 TYR B 47 -2.765 -4.190 -5.431 1.00 0.00 C ATOM 1031 CZ TYR B 47 -2.432 -2.986 -4.850 1.00 0.00 C ATOM 1032 OH TYR B 47 -2.465 -1.832 -5.596 1.00 0.00 O ATOM 0 H TYR B 47 0.028 -6.408 -3.266 1.00 0.00 H new ATOM 0 HA TYR B 47 -1.253 -5.754 -0.845 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -2.215 -7.437 -3.192 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -3.243 -6.693 -1.983 1.00 0.00 H new ATOM 0 HD1 TYR B 47 -1.734 -4.044 -1.746 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -2.991 -6.288 -5.137 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -1.799 -1.986 -3.078 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -3.055 -4.229 -6.471 1.00 0.00 H new ATOM 0 HH TYR B 47 -2.507 -2.059 -6.548 1.00 0.00 H new ATOM 1042 N ALA B 48 -0.314 -8.821 -1.141 1.00 0.00 N ATOM 1043 CA ALA B 48 -0.197 -10.116 -0.497 1.00 0.00 C ATOM 1044 C ALA B 48 0.405 -10.012 0.900 1.00 0.00 C ATOM 1045 O ALA B 48 0.193 -10.899 1.726 1.00 0.00 O ATOM 1046 CB ALA B 48 0.640 -11.040 -1.363 1.00 0.00 C ATOM 0 H ALA B 48 0.311 -8.697 -1.937 1.00 0.00 H new ATOM 0 HA ALA B 48 -1.201 -10.524 -0.383 1.00 0.00 H new ATOM 0 HB1 ALA B 48 0.727 -12.013 -0.879 1.00 0.00 H new ATOM 0 HB2 ALA B 48 0.161 -11.160 -2.335 1.00 0.00 H new ATOM 0 HB3 ALA B 48 1.633 -10.611 -1.498 1.00 0.00 H new ATOM 1052 N ASP B 49 1.145 -8.933 1.157 1.00 0.00 N ATOM 1053 CA ASP B 49 1.788 -8.715 2.446 1.00 0.00 C ATOM 1054 C ASP B 49 1.013 -7.701 3.270 1.00 0.00 C ATOM 1055 O ASP B 49 1.278 -7.514 4.463 1.00 0.00 O ATOM 1056 CB ASP B 49 3.200 -8.176 2.282 1.00 0.00 C ATOM 1057 CG ASP B 49 3.889 -8.605 0.998 1.00 0.00 C ATOM 1058 OD1 ASP B 49 4.100 -9.819 0.800 1.00 0.00 O ATOM 1059 OD2 ASP B 49 4.227 -7.712 0.184 1.00 0.00 O ATOM 0 H ASP B 49 1.313 -8.190 0.478 1.00 0.00 H new ATOM 0 HA ASP B 49 1.813 -9.683 2.946 1.00 0.00 H new ATOM 0 HB2 ASP B 49 3.167 -7.087 2.316 1.00 0.00 H new ATOM 0 HB3 ASP B 49 3.802 -8.503 3.130 1.00 0.00 H new ATOM 1064 N ILE B 50 0.062 -7.033 2.645 1.00 0.00 N ATOM 1065 CA ILE B 50 -0.736 -6.049 3.351 1.00 0.00 C ATOM 1066 C ILE B 50 -1.901 -6.771 4.011 1.00 0.00 C ATOM 1067 O ILE B 50 -2.559 -7.589 3.373 1.00 0.00 O ATOM 1068 CB ILE B 50 -1.301 -4.952 2.419 1.00 0.00 C ATOM 1069 CG1 ILE B 50 -0.374 -4.689 1.223 1.00 0.00 C ATOM 1070 CG2 ILE B 50 -1.549 -3.671 3.199 1.00 0.00 C ATOM 1071 CD1 ILE B 50 0.791 -3.767 1.512 1.00 0.00 C ATOM 0 H ILE B 50 -0.175 -7.152 1.660 1.00 0.00 H new ATOM 0 HA ILE B 50 -0.091 -5.557 4.079 1.00 0.00 H new ATOM 0 HB ILE B 50 -2.251 -5.311 2.022 1.00 0.00 H new ATOM 0 HG12 ILE B 50 0.016 -5.643 0.867 1.00 0.00 H new ATOM 0 HG13 ILE B 50 -0.964 -4.263 0.411 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -1.947 -2.908 2.529 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -2.267 -3.864 3.996 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -0.612 -3.321 3.631 1.00 0.00 H new ATOM 0 HD11 ILE B 50 1.388 -3.641 0.609 1.00 0.00 H new ATOM 0 HD12 ILE B 50 0.415 -2.797 1.837 1.00 0.00 H new ATOM 0 HD13 ILE B 50 1.410 -4.198 2.299 1.00 0.00 H new ATOM 1083 N LYS B 51 -2.153 -6.498 5.278 1.00 0.00 N ATOM 1084 CA LYS B 51 -3.245 -7.159 5.971 1.00 0.00 C ATOM 1085 C LYS B 51 -4.505 -6.318 5.874 1.00 0.00 C ATOM 1086 O LYS B 51 -5.539 -6.763 5.387 1.00 0.00 O ATOM 1087 CB LYS B 51 -2.906 -7.386 7.444 1.00 0.00 C ATOM 1088 CG LYS B 51 -4.062 -7.979 8.231 1.00 0.00 C ATOM 1089 CD LYS B 51 -3.901 -7.766 9.724 1.00 0.00 C ATOM 1090 CE LYS B 51 -5.249 -7.528 10.396 1.00 0.00 C ATOM 1091 NZ LYS B 51 -5.356 -8.231 11.702 1.00 0.00 N ATOM 0 H LYS B 51 -1.625 -5.833 5.843 1.00 0.00 H new ATOM 0 HA LYS B 51 -3.406 -8.127 5.496 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -2.045 -8.051 7.515 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -2.614 -6.438 7.895 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -4.997 -7.527 7.899 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -4.133 -9.047 8.023 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -3.419 -8.637 10.168 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -3.247 -6.913 9.904 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -5.394 -6.458 10.548 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -6.047 -7.867 9.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -6.260 -7.987 12.154 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -5.312 -9.259 11.548 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -4.571 -7.940 12.319 1.00 0.00 H new ATOM 1105 N CYS B 52 -4.374 -5.082 6.310 1.00 0.00 N ATOM 1106 CA CYS B 52 -5.464 -4.144 6.335 1.00 0.00 C ATOM 1107 C CYS B 52 -4.927 -2.765 6.022 1.00 0.00 C ATOM 1108 O CYS B 52 -3.738 -2.603 5.739 1.00 0.00 O ATOM 1109 CB CYS B 52 -6.135 -4.160 7.708 1.00 0.00 C ATOM 1110 SG CYS B 52 -4.980 -4.272 9.095 1.00 0.00 S ATOM 0 H CYS B 52 -3.495 -4.702 6.660 1.00 0.00 H new ATOM 0 HA CYS B 52 -6.210 -4.420 5.589 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -6.732 -3.255 7.819 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -6.824 -5.004 7.754 1.00 0.00 H new ATOM 0 HG CYS B 52 -5.101 -3.218 9.846 1.00 0.00 H new ATOM 1116 N GLN B 53 -5.782 -1.773 6.053 1.00 0.00 N ATOM 1117 CA GLN B 53 -5.355 -0.429 5.760 1.00 0.00 C ATOM 1118 C GLN B 53 -6.064 0.574 6.671 1.00 0.00 C ATOM 1119 O GLN B 53 -7.217 0.362 7.045 1.00 0.00 O ATOM 1120 CB GLN B 53 -5.661 -0.115 4.304 1.00 0.00 C ATOM 1121 CG GLN B 53 -7.145 0.070 4.030 1.00 0.00 C ATOM 1122 CD GLN B 53 -7.507 -0.156 2.586 1.00 0.00 C ATOM 1123 OE1 GLN B 53 -7.415 0.750 1.767 1.00 0.00 O ATOM 1124 NE2 GLN B 53 -7.935 -1.366 2.265 1.00 0.00 N ATOM 0 H GLN B 53 -6.772 -1.870 6.277 1.00 0.00 H new ATOM 0 HA GLN B 53 -4.282 -0.350 5.937 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -5.129 0.791 4.015 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -5.280 -0.922 3.677 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -7.713 -0.620 4.654 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -7.440 1.079 4.320 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -7.996 -2.092 2.979 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -8.204 -1.573 1.303 1.00 0.00 H new ATOM 1133 N LYS B 54 -5.383 1.649 7.049 1.00 0.00 N ATOM 1134 CA LYS B 54 -6.013 2.670 7.870 1.00 0.00 C ATOM 1135 C LYS B 54 -6.275 3.890 7.022 1.00 0.00 C ATOM 1136 O LYS B 54 -5.511 4.186 6.107 1.00 0.00 O ATOM 1137 CB LYS B 54 -5.142 3.149 9.033 1.00 0.00 C ATOM 1138 CG LYS B 54 -4.875 2.171 10.148 1.00 0.00 C ATOM 1139 CD LYS B 54 -4.437 2.940 11.383 1.00 0.00 C ATOM 1140 CE LYS B 54 -4.246 2.057 12.600 1.00 0.00 C ATOM 1141 NZ LYS B 54 -3.249 0.976 12.363 1.00 0.00 N ATOM 0 H LYS B 54 -4.410 1.833 6.804 1.00 0.00 H new ATOM 0 HA LYS B 54 -6.918 2.212 8.270 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -4.182 3.466 8.626 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -5.613 4.032 9.465 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -5.772 1.591 10.364 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -4.102 1.463 9.851 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -3.502 3.458 11.168 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -5.180 3.704 11.610 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -3.923 2.668 13.443 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -5.202 1.612 12.877 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -2.628 0.889 13.192 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -3.744 0.075 12.205 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -2.678 1.208 11.525 1.00 0.00 H new ATOM 1155 N ILE B 55 -7.343 4.593 7.314 1.00 0.00 N ATOM 1156 CA ILE B 55 -7.635 5.817 6.612 1.00 0.00 C ATOM 1157 C ILE B 55 -7.840 6.903 7.663 1.00 0.00 C ATOM 1158 O ILE B 55 -8.623 6.733 8.601 1.00 0.00 O ATOM 1159 CB ILE B 55 -8.848 5.700 5.637 1.00 0.00 C ATOM 1160 CG1 ILE B 55 -10.184 6.063 6.288 1.00 0.00 C ATOM 1161 CG2 ILE B 55 -8.932 4.293 5.062 1.00 0.00 C ATOM 1162 CD1 ILE B 55 -11.171 6.653 5.298 1.00 0.00 C ATOM 0 H ILE B 55 -8.022 4.338 8.031 1.00 0.00 H new ATOM 0 HA ILE B 55 -6.798 6.068 5.961 1.00 0.00 H new ATOM 0 HB ILE B 55 -8.669 6.424 4.842 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -10.618 5.172 6.741 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -10.010 6.777 7.093 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -9.783 4.227 4.384 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -8.015 4.067 4.517 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -9.058 3.575 5.873 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -12.102 6.893 5.812 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -10.752 7.561 4.864 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -11.369 5.930 4.507 1.00 0.00 H new ATOM 1174 N SER B 56 -7.070 7.973 7.571 1.00 0.00 N ATOM 1175 CA SER B 56 -7.179 9.043 8.536 1.00 0.00 C ATOM 1176 C SER B 56 -8.221 10.034 8.057 1.00 0.00 C ATOM 1177 O SER B 56 -8.107 10.605 6.956 1.00 0.00 O ATOM 1178 CB SER B 56 -5.826 9.716 8.788 1.00 0.00 C ATOM 1179 OG SER B 56 -5.608 10.809 7.925 1.00 0.00 O ATOM 0 H SER B 56 -6.370 8.120 6.844 1.00 0.00 H new ATOM 0 HA SER B 56 -7.496 8.631 9.494 1.00 0.00 H new ATOM 0 HB2 SER B 56 -5.778 10.056 9.822 1.00 0.00 H new ATOM 0 HB3 SER B 56 -5.028 8.985 8.656 1.00 0.00 H new ATOM 0 HG SER B 56 -4.921 11.395 8.306 1.00 0.00 H new ATOM 1185 N PRO B 57 -9.254 10.206 8.889 1.00 0.00 N ATOM 1186 CA PRO B 57 -10.396 11.081 8.620 1.00 0.00 C ATOM 1187 C PRO B 57 -10.059 12.562 8.649 1.00 0.00 C ATOM 1188 O PRO B 57 -8.946 12.969 8.993 1.00 0.00 O ATOM 1189 CB PRO B 57 -11.360 10.752 9.765 1.00 0.00 C ATOM 1190 CG PRO B 57 -10.471 10.316 10.872 1.00 0.00 C ATOM 1191 CD PRO B 57 -9.370 9.554 10.205 1.00 0.00 C ATOM 0 HA PRO B 57 -10.789 10.910 7.618 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -11.953 11.621 10.049 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -12.061 9.966 9.483 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -10.081 11.170 11.425 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -11.007 9.691 11.586 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -8.439 9.617 10.768 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -9.614 8.496 10.109 1.00 0.00 H new ATOM 1199 N GLU B 58 -11.045 13.349 8.259 1.00 0.00 N ATOM 1200 CA GLU B 58 -10.940 14.792 8.237 1.00 0.00 C ATOM 1201 C GLU B 58 -10.713 15.326 9.650 1.00 0.00 C ATOM 1202 O GLU B 58 -10.996 14.650 10.640 1.00 0.00 O ATOM 1203 CB GLU B 58 -12.199 15.403 7.611 1.00 0.00 C ATOM 1204 CG GLU B 58 -12.289 15.215 6.097 1.00 0.00 C ATOM 1205 CD GLU B 58 -12.142 13.764 5.665 1.00 0.00 C ATOM 1206 OE1 GLU B 58 -11.245 13.469 4.846 1.00 0.00 O ATOM 1207 OE2 GLU B 58 -12.904 12.913 6.169 1.00 0.00 O ATOM 0 H GLU B 58 -11.950 12.998 7.946 1.00 0.00 H new ATOM 0 HA GLU B 58 -10.084 15.078 7.626 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -13.078 14.956 8.076 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -12.225 16.469 7.838 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -13.248 15.597 5.746 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -11.513 15.811 5.616 1.00 0.00 H new ATOM 1214 N GLY B 59 -10.226 16.548 9.731 1.00 0.00 N ATOM 1215 CA GLY B 59 -9.914 17.153 11.010 1.00 0.00 C ATOM 1216 C GLY B 59 -8.428 17.390 11.114 1.00 0.00 C ATOM 1217 O GLY B 59 -7.978 18.315 11.787 1.00 0.00 O ATOM 0 H GLY B 59 -10.037 17.143 8.924 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -10.450 18.096 11.117 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -10.246 16.504 11.820 1.00 0.00 H new ATOM 1221 N LYS B 60 -7.669 16.547 10.429 1.00 0.00 N ATOM 1222 CA LYS B 60 -6.230 16.703 10.356 1.00 0.00 C ATOM 1223 C LYS B 60 -5.943 17.668 9.230 1.00 0.00 C ATOM 1224 O LYS B 60 -6.799 17.899 8.373 1.00 0.00 O ATOM 1225 CB LYS B 60 -5.524 15.364 10.084 1.00 0.00 C ATOM 1226 CG LYS B 60 -5.132 14.593 11.335 1.00 0.00 C ATOM 1227 CD LYS B 60 -4.197 13.428 11.010 1.00 0.00 C ATOM 1228 CE LYS B 60 -3.605 12.795 12.267 1.00 0.00 C ATOM 1229 NZ LYS B 60 -4.218 13.338 13.509 1.00 0.00 N ATOM 0 H LYS B 60 -8.032 15.745 9.914 1.00 0.00 H new ATOM 0 HA LYS B 60 -5.854 17.074 11.309 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -6.179 14.739 9.477 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -4.628 15.554 9.493 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -4.644 15.266 12.040 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -6.029 14.214 11.825 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -4.744 12.671 10.448 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -3.390 13.781 10.368 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -3.752 11.716 12.233 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -2.529 12.969 12.288 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -3.928 12.758 14.322 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -3.901 14.318 13.653 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -5.254 13.318 13.422 1.00 0.00 H new ATOM 1243 N ALA B 61 -4.759 18.239 9.227 1.00 0.00 N ATOM 1244 CA ALA B 61 -4.384 19.175 8.184 1.00 0.00 C ATOM 1245 C ALA B 61 -4.246 18.464 6.861 1.00 0.00 C ATOM 1246 O ALA B 61 -4.234 19.084 5.800 1.00 0.00 O ATOM 1247 CB ALA B 61 -3.089 19.854 8.541 1.00 0.00 C ATOM 0 H ALA B 61 -4.040 18.074 9.931 1.00 0.00 H new ATOM 0 HA ALA B 61 -5.168 19.927 8.095 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -2.816 20.555 7.752 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -3.208 20.394 9.480 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -2.304 19.106 8.650 1.00 0.00 H new ATOM 1253 N LYS B 62 -4.139 17.157 6.936 1.00 0.00 N ATOM 1254 CA LYS B 62 -4.008 16.356 5.758 1.00 0.00 C ATOM 1255 C LYS B 62 -4.822 15.088 5.889 1.00 0.00 C ATOM 1256 O LYS B 62 -5.031 14.580 6.991 1.00 0.00 O ATOM 1257 CB LYS B 62 -2.552 15.981 5.503 1.00 0.00 C ATOM 1258 CG LYS B 62 -1.886 15.292 6.675 1.00 0.00 C ATOM 1259 CD LYS B 62 -1.114 16.281 7.518 1.00 0.00 C ATOM 1260 CE LYS B 62 -0.309 15.585 8.593 1.00 0.00 C ATOM 1261 NZ LYS B 62 0.418 16.568 9.431 1.00 0.00 N ATOM 0 H LYS B 62 -4.141 16.631 7.810 1.00 0.00 H new ATOM 0 HA LYS B 62 -4.375 16.948 4.919 1.00 0.00 H new ATOM 0 HB2 LYS B 62 -2.502 15.327 4.632 1.00 0.00 H new ATOM 0 HB3 LYS B 62 -1.992 16.883 5.257 1.00 0.00 H new ATOM 0 HG2 LYS B 62 -2.640 14.798 7.287 1.00 0.00 H new ATOM 0 HG3 LYS B 62 -1.213 14.516 6.311 1.00 0.00 H new ATOM 0 HD2 LYS B 62 -0.447 16.861 6.880 1.00 0.00 H new ATOM 0 HD3 LYS B 62 -1.806 16.986 7.979 1.00 0.00 H new ATOM 0 HE2 LYS B 62 -0.971 14.987 9.219 1.00 0.00 H new ATOM 0 HE3 LYS B 62 0.401 14.898 8.133 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 1.028 16.065 10.106 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 1.002 17.177 8.824 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 -0.266 17.153 9.952 1.00 0.00 H new ATOM 1275 N ILE B 63 -5.280 14.593 4.768 1.00 0.00 N ATOM 1276 CA ILE B 63 -6.029 13.360 4.731 1.00 0.00 C ATOM 1277 C ILE B 63 -5.007 12.243 4.566 1.00 0.00 C ATOM 1278 O ILE B 63 -4.087 12.381 3.768 1.00 0.00 O ATOM 1279 CB ILE B 63 -7.052 13.384 3.577 1.00 0.00 C ATOM 1280 CG1 ILE B 63 -8.154 14.407 3.869 1.00 0.00 C ATOM 1281 CG2 ILE B 63 -7.655 12.015 3.364 1.00 0.00 C ATOM 1282 CD1 ILE B 63 -7.855 15.808 3.372 1.00 0.00 C ATOM 0 H ILE B 63 -5.146 15.031 3.857 1.00 0.00 H new ATOM 0 HA ILE B 63 -6.607 13.210 5.643 1.00 0.00 H new ATOM 0 HB ILE B 63 -6.531 13.674 2.664 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -9.082 14.063 3.413 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -8.322 14.444 4.945 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -8.373 12.057 2.545 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.866 11.304 3.118 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -8.161 11.695 4.275 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -8.687 16.467 3.620 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -6.946 16.176 3.847 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -7.717 15.789 2.291 1.00 0.00 H new ATOM 1294 N GLN B 64 -5.114 11.154 5.311 1.00 0.00 N ATOM 1295 CA GLN B 64 -4.076 10.124 5.211 1.00 0.00 C ATOM 1296 C GLN B 64 -4.610 8.708 5.104 1.00 0.00 C ATOM 1297 O GLN B 64 -5.775 8.431 5.369 1.00 0.00 O ATOM 1298 CB GLN B 64 -3.127 10.193 6.408 1.00 0.00 C ATOM 1299 CG GLN B 64 -2.628 11.587 6.733 1.00 0.00 C ATOM 1300 CD GLN B 64 -1.982 11.659 8.100 1.00 0.00 C ATOM 1301 OE1 GLN B 64 -2.410 10.786 9.005 1.00 0.00 O flip ATOM 1302 NE2 GLN B 64 -1.113 12.495 8.343 1.00 0.00 N flip ATOM 0 H GLN B 64 -5.871 10.958 5.966 1.00 0.00 H new ATOM 0 HA GLN B 64 -3.552 10.345 4.281 1.00 0.00 H new ATOM 0 HB2 GLN B 64 -3.636 9.789 7.283 1.00 0.00 H new ATOM 0 HB3 GLN B 64 -2.269 9.550 6.213 1.00 0.00 H new ATOM 0 HG2 GLN B 64 -1.908 11.899 5.976 1.00 0.00 H new ATOM 0 HG3 GLN B 64 -3.461 12.289 6.689 1.00 0.00 H new ATOM 0 HE21 GLN B 64 -0.815 13.146 7.617 1.00 0.00 H new ATOM 0 HE22 GLN B 64 -0.691 12.537 9.271 1.00 0.00 H new ATOM 1311 N LEU B 65 -3.726 7.831 4.664 1.00 0.00 N ATOM 1312 CA LEU B 65 -4.002 6.418 4.524 1.00 0.00 C ATOM 1313 C LEU B 65 -2.766 5.650 4.979 1.00 0.00 C ATOM 1314 O LEU B 65 -1.680 6.200 4.943 1.00 0.00 O ATOM 1315 CB LEU B 65 -4.267 6.072 3.069 1.00 0.00 C ATOM 1316 CG LEU B 65 -5.191 4.890 2.837 1.00 0.00 C ATOM 1317 CD1 LEU B 65 -6.626 5.362 2.710 1.00 0.00 C ATOM 1318 CD2 LEU B 65 -4.752 4.116 1.614 1.00 0.00 C ATOM 0 H LEU B 65 -2.778 8.089 4.389 1.00 0.00 H new ATOM 0 HA LEU B 65 -4.877 6.158 5.120 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -4.693 6.946 2.577 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -3.313 5.866 2.583 1.00 0.00 H new ATOM 0 HG LEU B 65 -5.136 4.220 3.695 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -7.278 4.504 2.544 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -6.924 5.872 3.626 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -6.710 6.050 1.868 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -5.422 3.271 1.458 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -4.781 4.768 0.741 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -3.736 3.751 1.760 1.00 0.00 H new ATOM 1330 N GLN B 66 -2.905 4.421 5.445 1.00 0.00 N ATOM 1331 CA GLN B 66 -1.730 3.658 5.849 1.00 0.00 C ATOM 1332 C GLN B 66 -1.925 2.176 5.561 1.00 0.00 C ATOM 1333 O GLN B 66 -3.033 1.652 5.654 1.00 0.00 O ATOM 1334 CB GLN B 66 -1.385 3.875 7.331 1.00 0.00 C ATOM 1335 CG GLN B 66 -2.034 2.884 8.278 1.00 0.00 C ATOM 1336 CD GLN B 66 -1.542 3.008 9.711 1.00 0.00 C ATOM 1337 OE1 GLN B 66 -1.487 2.023 10.446 1.00 0.00 O ATOM 1338 NE2 GLN B 66 -1.206 4.216 10.128 1.00 0.00 N ATOM 0 H GLN B 66 -3.796 3.936 5.553 1.00 0.00 H new ATOM 0 HA GLN B 66 -0.890 4.024 5.259 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -0.303 3.819 7.451 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -1.686 4.883 7.617 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -3.114 3.028 8.259 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -1.841 1.872 7.922 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -1.264 5.010 9.490 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -0.889 4.354 11.087 1.00 0.00 H new ATOM 1347 N LEU B 67 -0.840 1.520 5.201 1.00 0.00 N ATOM 1348 CA LEU B 67 -0.852 0.102 4.897 1.00 0.00 C ATOM 1349 C LEU B 67 -0.468 -0.705 6.122 1.00 0.00 C ATOM 1350 O LEU B 67 0.683 -0.689 6.538 1.00 0.00 O ATOM 1351 CB LEU B 67 0.146 -0.205 3.785 1.00 0.00 C ATOM 1352 CG LEU B 67 -0.155 0.418 2.428 1.00 0.00 C ATOM 1353 CD1 LEU B 67 0.953 0.073 1.447 1.00 0.00 C ATOM 1354 CD2 LEU B 67 -1.501 -0.057 1.906 1.00 0.00 C ATOM 0 H LEU B 67 0.078 1.956 5.111 1.00 0.00 H new ATOM 0 HA LEU B 67 -1.860 -0.167 4.580 1.00 0.00 H new ATOM 0 HB2 LEU B 67 1.132 0.130 4.106 1.00 0.00 H new ATOM 0 HB3 LEU B 67 0.202 -1.287 3.662 1.00 0.00 H new ATOM 0 HG LEU B 67 -0.202 1.501 2.540 1.00 0.00 H new ATOM 0 HD11 LEU B 67 0.733 0.521 0.478 1.00 0.00 H new ATOM 0 HD12 LEU B 67 1.902 0.460 1.819 1.00 0.00 H new ATOM 0 HD13 LEU B 67 1.020 -1.010 1.340 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -1.697 0.400 0.936 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -1.488 -1.142 1.800 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -2.285 0.230 2.607 1.00 0.00 H new ATOM 1366 N VAL B 68 -1.419 -1.402 6.703 1.00 0.00 N ATOM 1367 CA VAL B 68 -1.136 -2.216 7.867 1.00 0.00 C ATOM 1368 C VAL B 68 -0.873 -3.641 7.415 1.00 0.00 C ATOM 1369 O VAL B 68 -1.776 -4.348 6.978 1.00 0.00 O ATOM 1370 CB VAL B 68 -2.288 -2.176 8.883 1.00 0.00 C ATOM 1371 CG1 VAL B 68 -1.855 -2.793 10.198 1.00 0.00 C ATOM 1372 CG2 VAL B 68 -2.749 -0.745 9.090 1.00 0.00 C ATOM 0 H VAL B 68 -2.390 -1.423 6.392 1.00 0.00 H new ATOM 0 HA VAL B 68 -0.255 -1.816 8.369 1.00 0.00 H new ATOM 0 HB VAL B 68 -3.123 -2.758 8.492 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -2.682 -2.757 10.907 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -1.562 -3.830 10.034 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -1.008 -2.236 10.600 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -3.566 -0.727 9.812 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -1.919 -0.146 9.466 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -3.094 -0.333 8.142 1.00 0.00 H new ATOM 1382 N LEU B 69 0.375 -4.054 7.502 1.00 0.00 N ATOM 1383 CA LEU B 69 0.772 -5.375 7.048 1.00 0.00 C ATOM 1384 C LEU B 69 0.639 -6.417 8.140 1.00 0.00 C ATOM 1385 O LEU B 69 0.695 -6.101 9.327 1.00 0.00 O ATOM 1386 CB LEU B 69 2.218 -5.340 6.567 1.00 0.00 C ATOM 1387 CG LEU B 69 2.633 -4.038 5.897 1.00 0.00 C ATOM 1388 CD1 LEU B 69 4.107 -4.052 5.578 1.00 0.00 C ATOM 1389 CD2 LEU B 69 1.832 -3.813 4.638 1.00 0.00 C ATOM 0 H LEU B 69 1.136 -3.493 7.884 1.00 0.00 H new ATOM 0 HA LEU B 69 0.105 -5.653 6.232 1.00 0.00 H new ATOM 0 HB2 LEU B 69 2.874 -5.520 7.418 1.00 0.00 H new ATOM 0 HB3 LEU B 69 2.373 -6.160 5.865 1.00 0.00 H new ATOM 0 HG LEU B 69 2.434 -3.220 6.589 1.00 0.00 H new ATOM 0 HD11 LEU B 69 4.385 -3.113 5.099 1.00 0.00 H new ATOM 0 HD12 LEU B 69 4.677 -4.173 6.499 1.00 0.00 H new ATOM 0 HD13 LEU B 69 4.326 -4.881 4.905 1.00 0.00 H new ATOM 0 HD21 LEU B 69 2.142 -2.878 4.172 1.00 0.00 H new ATOM 0 HD22 LEU B 69 2.003 -4.637 3.946 1.00 0.00 H new ATOM 0 HD23 LEU B 69 0.772 -3.761 4.886 1.00 0.00 H new ATOM 1401 N HIS B 70 0.489 -7.670 7.728 1.00 0.00 N ATOM 1402 CA HIS B 70 0.387 -8.771 8.677 1.00 0.00 C ATOM 1403 C HIS B 70 1.780 -9.130 9.172 1.00 0.00 C ATOM 1404 O HIS B 70 1.960 -10.013 10.005 1.00 0.00 O ATOM 1405 CB HIS B 70 -0.291 -10.006 8.062 1.00 0.00 C ATOM 1406 CG HIS B 70 -0.150 -10.120 6.576 1.00 0.00 C ATOM 1407 ND1 HIS B 70 -1.149 -9.789 5.692 1.00 0.00 N ATOM 1408 CD2 HIS B 70 0.896 -10.533 5.811 1.00 0.00 C ATOM 1409 CE1 HIS B 70 -0.687 -10.002 4.459 1.00 0.00 C ATOM 1410 NE2 HIS B 70 0.540 -10.463 4.485 1.00 0.00 N ATOM 0 H HIS B 70 0.436 -7.948 6.748 1.00 0.00 H new ATOM 0 HA HIS B 70 -0.237 -8.446 9.509 1.00 0.00 H new ATOM 0 HB2 HIS B 70 0.127 -10.901 8.523 1.00 0.00 H new ATOM 0 HB3 HIS B 70 -1.352 -9.984 8.312 1.00 0.00 H new ATOM 0 HD1 HIS B 70 -2.077 -9.443 5.935 1.00 0.00 H new ATOM 0 HD2 HIS B 70 1.854 -10.863 6.186 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -1.251 -9.818 3.556 1.00 0.00 H new ATOM 1418 N ALA B 71 2.760 -8.416 8.631 1.00 0.00 N ATOM 1419 CA ALA B 71 4.156 -8.601 8.982 1.00 0.00 C ATOM 1420 C ALA B 71 4.489 -7.853 10.268 1.00 0.00 C ATOM 1421 O ALA B 71 5.592 -7.967 10.798 1.00 0.00 O ATOM 1422 CB ALA B 71 5.032 -8.104 7.840 1.00 0.00 C ATOM 0 H ALA B 71 2.604 -7.689 7.933 1.00 0.00 H new ATOM 0 HA ALA B 71 4.345 -9.662 9.149 1.00 0.00 H new ATOM 0 HB1 ALA B 71 6.082 -8.241 8.100 1.00 0.00 H new ATOM 0 HB2 ALA B 71 4.805 -8.668 6.935 1.00 0.00 H new ATOM 0 HB3 ALA B 71 4.837 -7.046 7.666 1.00 0.00 H new ATOM 1428 N GLY B 72 3.521 -7.087 10.762 1.00 0.00 N ATOM 1429 CA GLY B 72 3.726 -6.319 11.973 1.00 0.00 C ATOM 1430 C GLY B 72 4.283 -4.944 11.672 1.00 0.00 C ATOM 1431 O GLY B 72 4.854 -4.290 12.541 1.00 0.00 O ATOM 0 H GLY B 72 2.597 -6.986 10.343 1.00 0.00 H new ATOM 0 HA2 GLY B 72 2.781 -6.221 12.507 1.00 0.00 H new ATOM 0 HA3 GLY B 72 4.410 -6.853 12.632 1.00 0.00 H new ATOM 1435 N ASP B 73 4.098 -4.509 10.433 1.00 0.00 N ATOM 1436 CA ASP B 73 4.591 -3.209 9.986 1.00 0.00 C ATOM 1437 C ASP B 73 3.455 -2.394 9.376 1.00 0.00 C ATOM 1438 O ASP B 73 2.421 -2.951 8.996 1.00 0.00 O ATOM 1439 CB ASP B 73 5.723 -3.399 8.966 1.00 0.00 C ATOM 1440 CG ASP B 73 6.230 -2.088 8.397 1.00 0.00 C ATOM 1441 OD1 ASP B 73 6.371 -1.993 7.160 1.00 0.00 O ATOM 1442 OD2 ASP B 73 6.469 -1.149 9.187 1.00 0.00 O ATOM 0 H ASP B 73 3.607 -5.040 9.714 1.00 0.00 H new ATOM 0 HA ASP B 73 4.982 -2.665 10.846 1.00 0.00 H new ATOM 0 HB2 ASP B 73 6.550 -3.927 9.442 1.00 0.00 H new ATOM 0 HB3 ASP B 73 5.369 -4.030 8.151 1.00 0.00 H new ATOM 1447 N THR B 74 3.644 -1.085 9.288 1.00 0.00 N ATOM 1448 CA THR B 74 2.639 -0.200 8.725 1.00 0.00 C ATOM 1449 C THR B 74 3.295 0.851 7.825 1.00 0.00 C ATOM 1450 O THR B 74 4.257 1.506 8.225 1.00 0.00 O ATOM 1451 CB THR B 74 1.848 0.524 9.835 1.00 0.00 C ATOM 1452 OG1 THR B 74 2.750 1.059 10.811 1.00 0.00 O ATOM 1453 CG2 THR B 74 0.866 -0.417 10.514 1.00 0.00 C ATOM 0 H THR B 74 4.491 -0.612 9.602 1.00 0.00 H new ATOM 0 HA THR B 74 1.955 -0.815 8.141 1.00 0.00 H new ATOM 0 HB THR B 74 1.285 1.334 9.372 1.00 0.00 H new ATOM 0 HG1 THR B 74 3.598 1.292 10.379 1.00 0.00 H new ATOM 0 HG21 THR B 74 0.324 0.122 11.291 1.00 0.00 H new ATOM 0 HG22 THR B 74 0.160 -0.799 9.777 1.00 0.00 H new ATOM 0 HG23 THR B 74 1.410 -1.249 10.961 1.00 0.00 H new ATOM 1461 N THR B 75 2.760 1.019 6.628 1.00 0.00 N ATOM 1462 CA THR B 75 3.279 1.990 5.675 1.00 0.00 C ATOM 1463 C THR B 75 2.284 3.136 5.505 1.00 0.00 C ATOM 1464 O THR B 75 1.279 2.990 4.813 1.00 0.00 O ATOM 1465 CB THR B 75 3.529 1.322 4.311 1.00 0.00 C ATOM 1466 OG1 THR B 75 4.170 0.054 4.503 1.00 0.00 O ATOM 1467 CG2 THR B 75 4.389 2.209 3.422 1.00 0.00 C ATOM 0 H THR B 75 1.957 0.490 6.288 1.00 0.00 H new ATOM 0 HA THR B 75 4.222 2.381 6.058 1.00 0.00 H new ATOM 0 HB THR B 75 2.568 1.172 3.818 1.00 0.00 H new ATOM 0 HG1 THR B 75 4.183 -0.438 3.655 1.00 0.00 H new ATOM 0 HG21 THR B 75 4.552 1.715 2.464 1.00 0.00 H new ATOM 0 HG22 THR B 75 3.883 3.160 3.259 1.00 0.00 H new ATOM 0 HG23 THR B 75 5.349 2.387 3.906 1.00 0.00 H new ATOM 1475 N ASN B 76 2.558 4.274 6.124 1.00 0.00 N ATOM 1476 CA ASN B 76 1.638 5.405 6.056 1.00 0.00 C ATOM 1477 C ASN B 76 1.823 6.225 4.786 1.00 0.00 C ATOM 1478 O ASN B 76 2.930 6.382 4.278 1.00 0.00 O ATOM 1479 CB ASN B 76 1.786 6.309 7.283 1.00 0.00 C ATOM 1480 CG ASN B 76 1.344 5.636 8.571 1.00 0.00 C ATOM 1481 OD1 ASN B 76 1.456 4.420 8.730 1.00 0.00 O ATOM 1482 ND2 ASN B 76 0.829 6.421 9.503 1.00 0.00 N ATOM 0 H ASN B 76 3.400 4.441 6.674 1.00 0.00 H new ATOM 0 HA ASN B 76 0.632 4.985 6.039 1.00 0.00 H new ATOM 0 HB2 ASN B 76 2.828 6.616 7.378 1.00 0.00 H new ATOM 0 HB3 ASN B 76 1.199 7.215 7.133 1.00 0.00 H new ATOM 0 HD21 ASN B 76 0.510 6.023 10.386 1.00 0.00 H new ATOM 0 HD22 ASN B 76 0.751 7.425 9.338 1.00 0.00 H new ATOM 1489 N PHE B 77 0.709 6.729 4.282 1.00 0.00 N ATOM 1490 CA PHE B 77 0.678 7.547 3.086 1.00 0.00 C ATOM 1491 C PHE B 77 -0.109 8.821 3.360 1.00 0.00 C ATOM 1492 O PHE B 77 -1.337 8.806 3.487 1.00 0.00 O ATOM 1493 CB PHE B 77 0.072 6.772 1.918 1.00 0.00 C ATOM 1494 CG PHE B 77 1.031 5.783 1.325 1.00 0.00 C ATOM 1495 CD1 PHE B 77 2.121 6.222 0.593 1.00 0.00 C ATOM 1496 CD2 PHE B 77 0.851 4.423 1.506 1.00 0.00 C ATOM 1497 CE1 PHE B 77 3.013 5.323 0.049 1.00 0.00 C ATOM 1498 CE2 PHE B 77 1.742 3.520 0.963 1.00 0.00 C ATOM 1499 CZ PHE B 77 2.823 3.971 0.233 1.00 0.00 C ATOM 0 H PHE B 77 -0.210 6.578 4.699 1.00 0.00 H new ATOM 0 HA PHE B 77 1.698 7.816 2.811 1.00 0.00 H new ATOM 0 HB2 PHE B 77 -0.821 6.248 2.258 1.00 0.00 H new ATOM 0 HB3 PHE B 77 -0.245 7.473 1.146 1.00 0.00 H new ATOM 0 HD1 PHE B 77 2.274 7.281 0.447 1.00 0.00 H new ATOM 0 HD2 PHE B 77 0.007 4.066 2.077 1.00 0.00 H new ATOM 0 HE1 PHE B 77 3.859 5.678 -0.520 1.00 0.00 H new ATOM 0 HE2 PHE B 77 1.593 2.460 1.109 1.00 0.00 H new ATOM 0 HZ PHE B 77 3.520 3.264 -0.194 1.00 0.00 H new ATOM 1509 N HIS B 78 0.618 9.911 3.457 1.00 0.00 N ATOM 1510 CA HIS B 78 0.058 11.219 3.746 1.00 0.00 C ATOM 1511 C HIS B 78 -0.388 11.912 2.456 1.00 0.00 C ATOM 1512 O HIS B 78 0.431 12.265 1.616 1.00 0.00 O ATOM 1513 CB HIS B 78 1.145 12.008 4.505 1.00 0.00 C ATOM 1514 CG HIS B 78 1.002 13.505 4.604 1.00 0.00 C ATOM 1515 ND1 HIS B 78 1.877 14.278 5.333 1.00 0.00 N ATOM 1516 CD2 HIS B 78 0.120 14.372 4.047 1.00 0.00 C ATOM 1517 CE1 HIS B 78 1.513 15.555 5.201 1.00 0.00 C ATOM 1518 NE2 HIS B 78 0.452 15.671 4.430 1.00 0.00 N ATOM 0 H HIS B 78 1.631 9.918 3.336 1.00 0.00 H new ATOM 0 HA HIS B 78 -0.838 11.148 4.363 1.00 0.00 H new ATOM 0 HB2 HIS B 78 1.197 11.611 5.519 1.00 0.00 H new ATOM 0 HB3 HIS B 78 2.103 11.796 4.030 1.00 0.00 H new ATOM 0 HD1 HIS B 78 2.667 13.934 5.879 1.00 0.00 H new ATOM 0 HD2 HIS B 78 -0.707 14.100 3.409 1.00 0.00 H new ATOM 0 HE1 HIS B 78 2.023 16.386 5.666 1.00 0.00 H new ATOM 1526 N PHE B 79 -1.695 12.089 2.302 1.00 0.00 N ATOM 1527 CA PHE B 79 -2.249 12.753 1.126 1.00 0.00 C ATOM 1528 C PHE B 79 -2.201 14.266 1.326 1.00 0.00 C ATOM 1529 O PHE B 79 -3.090 14.846 1.952 1.00 0.00 O ATOM 1530 CB PHE B 79 -3.700 12.322 0.888 1.00 0.00 C ATOM 1531 CG PHE B 79 -3.867 10.915 0.391 1.00 0.00 C ATOM 1532 CD1 PHE B 79 -3.977 9.848 1.271 1.00 0.00 C ATOM 1533 CD2 PHE B 79 -3.941 10.663 -0.963 1.00 0.00 C ATOM 1534 CE1 PHE B 79 -4.159 8.560 0.800 1.00 0.00 C ATOM 1535 CE2 PHE B 79 -4.117 9.381 -1.437 1.00 0.00 C ATOM 1536 CZ PHE B 79 -4.228 8.329 -0.560 1.00 0.00 C ATOM 0 H PHE B 79 -2.394 11.781 2.979 1.00 0.00 H new ATOM 0 HA PHE B 79 -1.654 12.470 0.258 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -4.254 12.431 1.820 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -4.153 13.003 0.167 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -3.920 10.025 2.335 1.00 0.00 H new ATOM 0 HD2 PHE B 79 -3.860 11.482 -1.662 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -4.247 7.737 1.494 1.00 0.00 H new ATOM 0 HE2 PHE B 79 -4.168 9.203 -2.501 1.00 0.00 H new ATOM 0 HZ PHE B 79 -4.369 7.325 -0.933 1.00 0.00 H new ATOM 1546 N SER B 80 -1.164 14.899 0.806 1.00 0.00 N ATOM 1547 CA SER B 80 -1.002 16.340 0.946 1.00 0.00 C ATOM 1548 C SER B 80 -1.577 17.105 -0.248 1.00 0.00 C ATOM 1549 O SER B 80 -1.434 18.324 -0.337 1.00 0.00 O ATOM 1550 CB SER B 80 0.479 16.681 1.142 1.00 0.00 C ATOM 1551 OG SER B 80 1.316 15.737 0.493 1.00 0.00 O ATOM 0 H SER B 80 -0.419 14.439 0.282 1.00 0.00 H new ATOM 0 HA SER B 80 -1.565 16.653 1.825 1.00 0.00 H new ATOM 0 HB2 SER B 80 0.680 17.678 0.750 1.00 0.00 H new ATOM 0 HB3 SER B 80 0.711 16.704 2.207 1.00 0.00 H new ATOM 0 HG SER B 80 0.956 15.538 -0.396 1.00 0.00 H new ATOM 1557 N ASN B 81 -2.226 16.397 -1.165 1.00 0.00 N ATOM 1558 CA ASN B 81 -2.818 17.045 -2.331 1.00 0.00 C ATOM 1559 C ASN B 81 -4.228 17.522 -2.003 1.00 0.00 C ATOM 1560 O ASN B 81 -5.196 16.792 -2.178 1.00 0.00 O ATOM 1561 CB ASN B 81 -2.846 16.095 -3.535 1.00 0.00 C ATOM 1562 CG ASN B 81 -3.214 16.792 -4.839 1.00 0.00 C ATOM 1563 OD1 ASN B 81 -3.598 16.142 -5.814 1.00 0.00 O ATOM 1564 ND2 ASN B 81 -3.099 18.113 -4.879 1.00 0.00 N ATOM 0 H ASN B 81 -2.355 15.386 -1.126 1.00 0.00 H new ATOM 0 HA ASN B 81 -2.202 17.905 -2.594 1.00 0.00 H new ATOM 0 HB2 ASN B 81 -1.867 15.627 -3.644 1.00 0.00 H new ATOM 0 HB3 ASN B 81 -3.562 15.296 -3.343 1.00 0.00 H new ATOM 0 HD21 ASN B 81 -3.331 18.619 -5.733 1.00 0.00 H new ATOM 0 HD22 ASN B 81 -2.779 18.622 -4.055 1.00 0.00 H new ATOM 1571 N GLU B 82 -4.318 18.764 -1.547 1.00 0.00 N ATOM 1572 CA GLU B 82 -5.586 19.394 -1.162 1.00 0.00 C ATOM 1573 C GLU B 82 -6.700 19.169 -2.189 1.00 0.00 C ATOM 1574 O GLU B 82 -7.855 18.937 -1.824 1.00 0.00 O ATOM 1575 CB GLU B 82 -5.394 20.907 -0.949 1.00 0.00 C ATOM 1576 CG GLU B 82 -4.117 21.491 -1.561 1.00 0.00 C ATOM 1577 CD GLU B 82 -3.946 21.164 -3.035 1.00 0.00 C ATOM 1578 OE1 GLU B 82 -4.790 21.591 -3.850 1.00 0.00 O ATOM 1579 OE2 GLU B 82 -2.980 20.446 -3.371 1.00 0.00 O ATOM 0 H GLU B 82 -3.508 19.373 -1.431 1.00 0.00 H new ATOM 0 HA GLU B 82 -5.893 18.918 -0.231 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -6.253 21.430 -1.371 1.00 0.00 H new ATOM 0 HB3 GLU B 82 -5.391 21.110 0.122 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -4.126 22.574 -1.436 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -3.255 21.114 -1.011 1.00 0.00 H new ATOM 1586 N SER B 83 -6.338 19.227 -3.463 1.00 0.00 N ATOM 1587 CA SER B 83 -7.279 19.061 -4.559 1.00 0.00 C ATOM 1588 C SER B 83 -8.125 17.795 -4.441 1.00 0.00 C ATOM 1589 O SER B 83 -9.360 17.864 -4.385 1.00 0.00 O ATOM 1590 CB SER B 83 -6.522 19.057 -5.889 1.00 0.00 C ATOM 1591 OG SER B 83 -5.276 19.730 -5.779 1.00 0.00 O ATOM 0 H SER B 83 -5.378 19.391 -3.766 1.00 0.00 H new ATOM 0 HA SER B 83 -7.969 19.903 -4.514 1.00 0.00 H new ATOM 0 HB2 SER B 83 -6.355 18.029 -6.211 1.00 0.00 H new ATOM 0 HB3 SER B 83 -7.130 19.537 -6.656 1.00 0.00 H new ATOM 0 HG SER B 83 -5.352 20.454 -5.123 1.00 0.00 H new ATOM 1597 N THR B 84 -7.489 16.638 -4.405 1.00 0.00 N ATOM 1598 CA THR B 84 -8.243 15.401 -4.366 1.00 0.00 C ATOM 1599 C THR B 84 -7.858 14.442 -3.238 1.00 0.00 C ATOM 1600 O THR B 84 -8.349 13.327 -3.224 1.00 0.00 O ATOM 1601 CB THR B 84 -8.119 14.707 -5.732 1.00 0.00 C ATOM 1602 OG1 THR B 84 -6.743 14.654 -6.137 1.00 0.00 O ATOM 1603 CG2 THR B 84 -8.913 15.486 -6.771 1.00 0.00 C ATOM 0 H THR B 84 -6.475 16.530 -4.402 1.00 0.00 H new ATOM 0 HA THR B 84 -9.276 15.673 -4.150 1.00 0.00 H new ATOM 0 HB THR B 84 -8.509 13.693 -5.649 1.00 0.00 H new ATOM 0 HG1 THR B 84 -6.175 14.524 -5.349 1.00 0.00 H new ATOM 0 HG21 THR B 84 -8.825 14.994 -7.740 1.00 0.00 H new ATOM 0 HG22 THR B 84 -9.962 15.522 -6.476 1.00 0.00 H new ATOM 0 HG23 THR B 84 -8.521 16.501 -6.842 1.00 0.00 H new ATOM 1611 N ALA B 85 -7.043 14.885 -2.280 1.00 0.00 N ATOM 1612 CA ALA B 85 -6.582 14.025 -1.168 1.00 0.00 C ATOM 1613 C ALA B 85 -7.698 13.191 -0.542 1.00 0.00 C ATOM 1614 O ALA B 85 -7.532 11.993 -0.337 1.00 0.00 O ATOM 1615 CB ALA B 85 -5.908 14.858 -0.088 1.00 0.00 C ATOM 0 H ALA B 85 -6.682 15.838 -2.244 1.00 0.00 H new ATOM 0 HA ALA B 85 -5.867 13.329 -1.607 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -5.577 14.206 0.720 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -5.048 15.376 -0.512 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -6.616 15.589 0.303 1.00 0.00 H new ATOM 1621 N VAL B 86 -8.819 13.824 -0.223 1.00 0.00 N ATOM 1622 CA VAL B 86 -9.953 13.121 0.376 1.00 0.00 C ATOM 1623 C VAL B 86 -10.421 11.973 -0.532 1.00 0.00 C ATOM 1624 O VAL B 86 -10.509 10.822 -0.108 1.00 0.00 O ATOM 1625 CB VAL B 86 -11.120 14.099 0.649 1.00 0.00 C ATOM 1626 CG1 VAL B 86 -12.454 13.371 0.755 1.00 0.00 C ATOM 1627 CG2 VAL B 86 -10.866 14.899 1.912 1.00 0.00 C ATOM 0 H VAL B 86 -8.970 14.822 -0.368 1.00 0.00 H new ATOM 0 HA VAL B 86 -9.626 12.699 1.326 1.00 0.00 H new ATOM 0 HB VAL B 86 -11.174 14.780 -0.200 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -13.248 14.093 0.947 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -12.658 12.847 -0.179 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -12.412 12.652 1.573 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -11.699 15.580 2.085 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -10.770 14.220 2.760 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -9.946 15.472 1.801 1.00 0.00 H new ATOM 1637 N LYS B 87 -10.669 12.298 -1.796 1.00 0.00 N ATOM 1638 CA LYS B 87 -11.124 11.319 -2.785 1.00 0.00 C ATOM 1639 C LYS B 87 -10.009 10.326 -3.097 1.00 0.00 C ATOM 1640 O LYS B 87 -10.266 9.157 -3.368 1.00 0.00 O ATOM 1641 CB LYS B 87 -11.555 12.051 -4.063 1.00 0.00 C ATOM 1642 CG LYS B 87 -12.402 13.292 -3.801 1.00 0.00 C ATOM 1643 CD LYS B 87 -11.772 14.542 -4.402 1.00 0.00 C ATOM 1644 CE LYS B 87 -12.533 15.803 -4.009 1.00 0.00 C ATOM 1645 NZ LYS B 87 -11.957 17.029 -4.635 1.00 0.00 N ATOM 0 H LYS B 87 -10.562 13.242 -2.166 1.00 0.00 H new ATOM 0 HA LYS B 87 -11.973 10.767 -2.381 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -10.666 12.340 -4.623 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -12.119 11.363 -4.693 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -13.397 13.148 -4.221 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -12.526 13.428 -2.727 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -10.737 14.623 -4.070 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -11.752 14.453 -5.488 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -13.577 15.702 -4.306 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -12.519 15.910 -2.924 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -12.565 17.846 -4.422 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -11.004 17.198 -4.254 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -11.900 16.899 -5.665 1.00 0.00 H new ATOM 1659 N GLU B 88 -8.777 10.806 -3.063 1.00 0.00 N ATOM 1660 CA GLU B 88 -7.615 9.970 -3.305 1.00 0.00 C ATOM 1661 C GLU B 88 -7.500 8.945 -2.185 1.00 0.00 C ATOM 1662 O GLU B 88 -7.270 7.766 -2.441 1.00 0.00 O ATOM 1663 CB GLU B 88 -6.357 10.836 -3.431 1.00 0.00 C ATOM 1664 CG GLU B 88 -6.078 11.264 -4.865 1.00 0.00 C ATOM 1665 CD GLU B 88 -5.036 12.360 -4.979 1.00 0.00 C ATOM 1666 OE1 GLU B 88 -4.016 12.151 -5.673 1.00 0.00 O ATOM 1667 OE2 GLU B 88 -5.250 13.450 -4.419 1.00 0.00 O ATOM 0 H GLU B 88 -8.556 11.782 -2.868 1.00 0.00 H new ATOM 0 HA GLU B 88 -7.725 9.433 -4.247 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -6.468 11.723 -2.807 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -5.500 10.282 -3.049 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -5.746 10.397 -5.436 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -7.007 11.608 -5.320 1.00 0.00 H new ATOM 1674 N ARG B 89 -7.700 9.398 -0.947 1.00 0.00 N ATOM 1675 CA ARG B 89 -7.676 8.516 0.215 1.00 0.00 C ATOM 1676 C ARG B 89 -8.717 7.439 0.012 1.00 0.00 C ATOM 1677 O ARG B 89 -8.479 6.262 0.252 1.00 0.00 O ATOM 1678 CB ARG B 89 -8.011 9.299 1.490 1.00 0.00 C ATOM 1679 CG ARG B 89 -7.642 8.603 2.784 1.00 0.00 C ATOM 1680 CD ARG B 89 -8.862 8.413 3.677 1.00 0.00 C ATOM 1681 NE ARG B 89 -9.603 9.658 3.925 1.00 0.00 N ATOM 1682 CZ ARG B 89 -10.784 9.948 3.363 1.00 0.00 C ATOM 1683 NH1 ARG B 89 -11.338 9.090 2.516 1.00 0.00 N ATOM 1684 NH2 ARG B 89 -11.413 11.083 3.646 1.00 0.00 N ATOM 0 H ARG B 89 -7.881 10.377 -0.725 1.00 0.00 H new ATOM 0 HA ARG B 89 -6.682 8.082 0.322 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -7.499 10.260 1.453 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -9.081 9.508 1.500 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -7.195 7.633 2.564 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -6.889 9.188 3.312 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -9.531 7.686 3.216 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -8.543 7.992 4.631 1.00 0.00 H new ATOM 0 HE ARG B 89 -9.194 10.341 4.562 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -10.865 8.214 2.295 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -12.237 9.307 2.086 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -10.997 11.747 4.299 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -12.312 11.290 3.210 1.00 0.00 H new ATOM 1698 N ASP B 90 -9.871 7.880 -0.454 1.00 0.00 N ATOM 1699 CA ASP B 90 -10.993 7.007 -0.724 1.00 0.00 C ATOM 1700 C ASP B 90 -10.715 6.023 -1.848 1.00 0.00 C ATOM 1701 O ASP B 90 -11.010 4.846 -1.704 1.00 0.00 O ATOM 1702 CB ASP B 90 -12.242 7.843 -1.000 1.00 0.00 C ATOM 1703 CG ASP B 90 -13.033 8.074 0.267 1.00 0.00 C ATOM 1704 OD1 ASP B 90 -13.260 9.243 0.634 1.00 0.00 O ATOM 1705 OD2 ASP B 90 -13.388 7.068 0.925 1.00 0.00 O ATOM 0 H ASP B 90 -10.055 8.863 -0.657 1.00 0.00 H new ATOM 0 HA ASP B 90 -11.164 6.398 0.164 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -11.954 8.801 -1.432 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -12.867 7.337 -1.735 1.00 0.00 H new ATOM 1710 N ALA B 91 -10.130 6.485 -2.942 1.00 0.00 N ATOM 1711 CA ALA B 91 -9.828 5.609 -4.075 1.00 0.00 C ATOM 1712 C ALA B 91 -8.738 4.597 -3.724 1.00 0.00 C ATOM 1713 O ALA B 91 -8.865 3.420 -4.053 1.00 0.00 O ATOM 1714 CB ALA B 91 -9.430 6.432 -5.288 1.00 0.00 C ATOM 0 H ALA B 91 -9.854 7.458 -3.074 1.00 0.00 H new ATOM 0 HA ALA B 91 -10.731 5.048 -4.316 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -9.208 5.767 -6.122 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -10.250 7.097 -5.562 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -8.546 7.024 -5.052 1.00 0.00 H new ATOM 1720 N VAL B 92 -7.663 5.051 -3.073 1.00 0.00 N ATOM 1721 CA VAL B 92 -6.592 4.140 -2.657 1.00 0.00 C ATOM 1722 C VAL B 92 -7.198 3.116 -1.703 1.00 0.00 C ATOM 1723 O VAL B 92 -6.945 1.918 -1.810 1.00 0.00 O ATOM 1724 CB VAL B 92 -5.432 4.883 -1.958 1.00 0.00 C ATOM 1725 CG1 VAL B 92 -4.303 3.923 -1.628 1.00 0.00 C ATOM 1726 CG2 VAL B 92 -4.908 6.008 -2.830 1.00 0.00 C ATOM 0 H VAL B 92 -7.512 6.029 -2.825 1.00 0.00 H new ATOM 0 HA VAL B 92 -6.172 3.660 -3.541 1.00 0.00 H new ATOM 0 HB VAL B 92 -5.819 5.308 -1.032 1.00 0.00 H new ATOM 0 HG11 VAL B 92 -3.496 4.466 -1.136 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -4.672 3.142 -0.964 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -3.929 3.471 -2.547 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -4.092 6.516 -2.317 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -4.545 5.599 -3.773 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -5.710 6.719 -3.028 1.00 0.00 H new ATOM 1736 N LYS B 93 -8.038 3.619 -0.796 1.00 0.00 N ATOM 1737 CA LYS B 93 -8.747 2.794 0.176 1.00 0.00 C ATOM 1738 C LYS B 93 -9.612 1.774 -0.547 1.00 0.00 C ATOM 1739 O LYS B 93 -9.510 0.573 -0.322 1.00 0.00 O ATOM 1740 CB LYS B 93 -9.641 3.684 1.049 1.00 0.00 C ATOM 1741 CG LYS B 93 -10.576 2.923 1.975 1.00 0.00 C ATOM 1742 CD LYS B 93 -11.717 3.809 2.466 1.00 0.00 C ATOM 1743 CE LYS B 93 -12.979 3.630 1.628 1.00 0.00 C ATOM 1744 NZ LYS B 93 -12.976 4.471 0.397 1.00 0.00 N ATOM 0 H LYS B 93 -8.244 4.615 -0.717 1.00 0.00 H new ATOM 0 HA LYS B 93 -8.020 2.276 0.801 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -9.007 4.336 1.650 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -10.236 4.327 0.400 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -10.984 2.058 1.452 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -10.015 2.543 2.829 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -11.937 3.574 3.507 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -11.405 4.853 2.434 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -13.078 2.582 1.347 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -13.850 3.881 2.233 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -13.654 4.084 -0.290 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -13.248 5.445 0.641 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -12.023 4.472 -0.020 1.00 0.00 H new ATOM 1758 N ASP B 94 -10.459 2.293 -1.419 1.00 0.00 N ATOM 1759 CA ASP B 94 -11.376 1.495 -2.218 1.00 0.00 C ATOM 1760 C ASP B 94 -10.644 0.409 -2.985 1.00 0.00 C ATOM 1761 O ASP B 94 -10.964 -0.768 -2.860 1.00 0.00 O ATOM 1762 CB ASP B 94 -12.123 2.413 -3.192 1.00 0.00 C ATOM 1763 CG ASP B 94 -13.424 2.941 -2.617 1.00 0.00 C ATOM 1764 OD1 ASP B 94 -13.664 2.748 -1.404 1.00 0.00 O ATOM 1765 OD2 ASP B 94 -14.197 3.559 -3.370 1.00 0.00 O ATOM 0 H ASP B 94 -10.531 3.295 -1.595 1.00 0.00 H new ATOM 0 HA ASP B 94 -12.084 1.006 -1.549 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -11.481 3.253 -3.459 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -12.332 1.867 -4.112 1.00 0.00 H new ATOM 1770 N LEU B 95 -9.643 0.810 -3.750 1.00 0.00 N ATOM 1771 CA LEU B 95 -8.869 -0.122 -4.554 1.00 0.00 C ATOM 1772 C LEU B 95 -8.157 -1.148 -3.682 1.00 0.00 C ATOM 1773 O LEU B 95 -8.141 -2.317 -4.016 1.00 0.00 O ATOM 1774 CB LEU B 95 -7.858 0.634 -5.419 1.00 0.00 C ATOM 1775 CG LEU B 95 -7.432 -0.088 -6.699 1.00 0.00 C ATOM 1776 CD1 LEU B 95 -8.621 -0.282 -7.627 1.00 0.00 C ATOM 1777 CD2 LEU B 95 -6.327 0.682 -7.404 1.00 0.00 C ATOM 0 H LEU B 95 -9.345 1.782 -3.832 1.00 0.00 H new ATOM 0 HA LEU B 95 -9.561 -0.658 -5.204 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -8.285 1.600 -5.690 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -6.969 0.835 -4.821 1.00 0.00 H new ATOM 0 HG LEU B 95 -7.047 -1.070 -6.425 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -8.297 -0.797 -8.531 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -9.382 -0.878 -7.123 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -9.038 0.690 -7.893 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -6.037 0.153 -8.312 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -6.686 1.678 -7.663 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -5.464 0.768 -6.743 1.00 0.00 H new ATOM 1789 N LEU B 96 -7.588 -0.722 -2.562 1.00 0.00 N ATOM 1790 CA LEU B 96 -6.892 -1.649 -1.667 1.00 0.00 C ATOM 1791 C LEU B 96 -7.891 -2.582 -0.995 1.00 0.00 C ATOM 1792 O LEU B 96 -7.666 -3.775 -0.921 1.00 0.00 O ATOM 1793 CB LEU B 96 -6.107 -0.893 -0.595 1.00 0.00 C ATOM 1794 CG LEU B 96 -4.780 -0.288 -1.043 1.00 0.00 C ATOM 1795 CD1 LEU B 96 -4.363 0.821 -0.092 1.00 0.00 C ATOM 1796 CD2 LEU B 96 -3.706 -1.358 -1.109 1.00 0.00 C ATOM 0 H LEU B 96 -7.592 0.249 -2.250 1.00 0.00 H new ATOM 0 HA LEU B 96 -6.194 -2.231 -2.268 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -6.737 -0.092 -0.208 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -5.912 -1.574 0.233 1.00 0.00 H new ATOM 0 HG LEU B 96 -4.908 0.135 -2.039 1.00 0.00 H new ATOM 0 HD11 LEU B 96 -3.415 1.245 -0.422 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -5.126 1.600 -0.084 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -4.249 0.415 0.913 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -2.766 -0.910 -1.430 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -3.577 -1.805 -0.123 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -4.003 -2.128 -1.821 1.00 0.00 H new ATOM 1808 N GLN B 97 -8.999 -2.032 -0.516 1.00 0.00 N ATOM 1809 CA GLN B 97 -10.042 -2.832 0.131 1.00 0.00 C ATOM 1810 C GLN B 97 -10.602 -3.834 -0.879 1.00 0.00 C ATOM 1811 O GLN B 97 -11.128 -4.888 -0.533 1.00 0.00 O ATOM 1812 CB GLN B 97 -11.141 -1.903 0.668 1.00 0.00 C ATOM 1813 CG GLN B 97 -12.408 -2.608 1.126 1.00 0.00 C ATOM 1814 CD GLN B 97 -12.200 -3.483 2.353 1.00 0.00 C ATOM 1815 OE1 GLN B 97 -11.293 -3.079 3.232 1.00 0.00 O flip ATOM 1816 NE2 GLN B 97 -12.861 -4.507 2.511 1.00 0.00 N flip ATOM 0 H GLN B 97 -9.203 -1.034 -0.561 1.00 0.00 H new ATOM 0 HA GLN B 97 -9.628 -3.387 0.973 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -10.737 -1.332 1.505 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -11.403 -1.186 -0.110 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -13.171 -1.862 1.346 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -12.789 -3.223 0.310 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -13.549 -4.783 1.811 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -12.721 -5.081 3.343 1.00 0.00 H new ATOM 1825 N GLN B 98 -10.455 -3.476 -2.137 1.00 0.00 N ATOM 1826 CA GLN B 98 -10.887 -4.287 -3.254 1.00 0.00 C ATOM 1827 C GLN B 98 -9.828 -5.315 -3.634 1.00 0.00 C ATOM 1828 O GLN B 98 -10.117 -6.477 -3.897 1.00 0.00 O ATOM 1829 CB GLN B 98 -11.119 -3.363 -4.446 1.00 0.00 C ATOM 1830 CG GLN B 98 -12.534 -2.840 -4.556 1.00 0.00 C ATOM 1831 CD GLN B 98 -13.252 -3.375 -5.777 1.00 0.00 C ATOM 1832 OE1 GLN B 98 -12.977 -4.485 -6.240 1.00 0.00 O ATOM 1833 NE2 GLN B 98 -14.170 -2.585 -6.310 1.00 0.00 N ATOM 0 H GLN B 98 -10.023 -2.595 -2.417 1.00 0.00 H new ATOM 0 HA GLN B 98 -11.797 -4.819 -2.975 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -10.435 -2.517 -4.375 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -10.869 -3.899 -5.362 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -13.091 -3.115 -3.660 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -12.514 -1.751 -4.597 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -14.364 -1.675 -5.893 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -14.684 -2.886 -7.138 1.00 0.00 H new ATOM 1842 N LEU B 99 -8.610 -4.839 -3.681 1.00 0.00 N ATOM 1843 CA LEU B 99 -7.446 -5.613 -4.082 1.00 0.00 C ATOM 1844 C LEU B 99 -6.851 -6.511 -2.989 1.00 0.00 C ATOM 1845 O LEU B 99 -6.591 -7.686 -3.238 1.00 0.00 O ATOM 1846 CB LEU B 99 -6.404 -4.612 -4.577 1.00 0.00 C ATOM 1847 CG LEU B 99 -6.594 -4.174 -6.033 1.00 0.00 C ATOM 1848 CD1 LEU B 99 -5.702 -2.991 -6.362 1.00 0.00 C ATOM 1849 CD2 LEU B 99 -6.326 -5.328 -6.983 1.00 0.00 C ATOM 0 H LEU B 99 -8.386 -3.875 -3.436 1.00 0.00 H new ATOM 0 HA LEU B 99 -7.760 -6.314 -4.855 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -6.432 -3.730 -3.938 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -5.413 -5.053 -4.469 1.00 0.00 H new ATOM 0 HG LEU B 99 -7.631 -3.863 -6.159 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -5.854 -2.698 -7.401 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -5.951 -2.155 -5.709 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -4.659 -3.269 -6.213 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -6.467 -4.993 -8.011 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -5.302 -5.677 -6.852 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -7.017 -6.143 -6.769 1.00 0.00 H new ATOM 1861 N LEU B 100 -6.664 -5.968 -1.792 1.00 0.00 N ATOM 1862 CA LEU B 100 -6.038 -6.699 -0.682 1.00 0.00 C ATOM 1863 C LEU B 100 -6.643 -8.090 -0.421 1.00 0.00 C ATOM 1864 O LEU B 100 -5.916 -9.082 -0.465 1.00 0.00 O ATOM 1865 CB LEU B 100 -6.024 -5.851 0.597 1.00 0.00 C ATOM 1866 CG LEU B 100 -5.018 -4.701 0.546 1.00 0.00 C ATOM 1867 CD1 LEU B 100 -4.945 -3.939 1.861 1.00 0.00 C ATOM 1868 CD2 LEU B 100 -3.653 -5.226 0.186 1.00 0.00 C ATOM 0 H LEU B 100 -6.938 -5.014 -1.558 1.00 0.00 H new ATOM 0 HA LEU B 100 -5.011 -6.885 -0.996 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -7.021 -5.445 0.767 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -5.791 -6.492 1.447 1.00 0.00 H new ATOM 0 HG LEU B 100 -5.362 -4.004 -0.219 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -4.217 -3.132 1.774 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -5.924 -3.521 2.094 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -4.642 -4.617 2.658 1.00 0.00 H new ATOM 0 HD21 LEU B 100 -2.943 -4.400 0.152 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -3.332 -5.950 0.935 1.00 0.00 H new ATOM 0 HD23 LEU B 100 -3.695 -5.709 -0.790 1.00 0.00 H new ATOM 1880 N PRO B 101 -7.967 -8.205 -0.166 1.00 0.00 N ATOM 1881 CA PRO B 101 -8.611 -9.507 0.106 1.00 0.00 C ATOM 1882 C PRO B 101 -8.423 -10.539 -1.003 1.00 0.00 C ATOM 1883 O PRO B 101 -8.538 -11.741 -0.772 1.00 0.00 O ATOM 1884 CB PRO B 101 -10.094 -9.153 0.251 1.00 0.00 C ATOM 1885 CG PRO B 101 -10.101 -7.717 0.636 1.00 0.00 C ATOM 1886 CD PRO B 101 -8.940 -7.100 -0.087 1.00 0.00 C ATOM 0 HA PRO B 101 -8.170 -9.977 0.985 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -10.633 -9.316 -0.682 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -10.576 -9.769 1.010 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -11.039 -7.239 0.351 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -9.998 -7.600 1.715 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -9.225 -6.743 -1.077 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -8.536 -6.245 0.456 1.00 0.00 H new ATOM 1894 N LYS B 102 -8.144 -10.081 -2.209 1.00 0.00 N ATOM 1895 CA LYS B 102 -7.965 -10.991 -3.325 1.00 0.00 C ATOM 1896 C LYS B 102 -6.521 -11.473 -3.472 1.00 0.00 C ATOM 1897 O LYS B 102 -6.252 -12.399 -4.236 1.00 0.00 O ATOM 1898 CB LYS B 102 -8.478 -10.352 -4.610 1.00 0.00 C ATOM 1899 CG LYS B 102 -9.982 -10.513 -4.759 1.00 0.00 C ATOM 1900 CD LYS B 102 -10.685 -9.194 -5.038 1.00 0.00 C ATOM 1901 CE LYS B 102 -10.223 -8.557 -6.339 1.00 0.00 C ATOM 1902 NZ LYS B 102 -10.727 -7.161 -6.469 1.00 0.00 N ATOM 0 H LYS B 102 -8.037 -9.093 -2.440 1.00 0.00 H new ATOM 0 HA LYS B 102 -8.556 -11.883 -3.117 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -8.224 -9.292 -4.616 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -7.977 -10.805 -5.466 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -10.191 -11.211 -5.570 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -10.389 -10.952 -3.848 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -11.761 -9.360 -5.080 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -10.501 -8.505 -4.213 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -9.134 -8.558 -6.380 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -10.574 -9.152 -7.182 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -10.116 -6.631 -7.122 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -11.699 -7.176 -6.839 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -10.719 -6.701 -5.536 1.00 0.00 H new ATOM 1916 N PHE B 103 -5.592 -10.859 -2.746 1.00 0.00 N ATOM 1917 CA PHE B 103 -4.189 -11.263 -2.828 1.00 0.00 C ATOM 1918 C PHE B 103 -3.608 -11.559 -1.453 1.00 0.00 C ATOM 1919 O PHE B 103 -2.408 -11.775 -1.323 1.00 0.00 O ATOM 1920 CB PHE B 103 -3.340 -10.183 -3.508 1.00 0.00 C ATOM 1921 CG PHE B 103 -3.769 -9.860 -4.910 1.00 0.00 C ATOM 1922 CD1 PHE B 103 -4.342 -8.635 -5.204 1.00 0.00 C ATOM 1923 CD2 PHE B 103 -3.598 -10.778 -5.935 1.00 0.00 C ATOM 1924 CE1 PHE B 103 -4.737 -8.330 -6.491 1.00 0.00 C ATOM 1925 CE2 PHE B 103 -3.992 -10.478 -7.226 1.00 0.00 C ATOM 1926 CZ PHE B 103 -4.563 -9.251 -7.504 1.00 0.00 C ATOM 0 H PHE B 103 -5.779 -10.090 -2.102 1.00 0.00 H new ATOM 0 HA PHE B 103 -4.161 -12.174 -3.426 1.00 0.00 H new ATOM 0 HB2 PHE B 103 -3.380 -9.274 -2.908 1.00 0.00 H new ATOM 0 HB3 PHE B 103 -2.300 -10.509 -3.524 1.00 0.00 H new ATOM 0 HD1 PHE B 103 -4.482 -7.909 -4.417 1.00 0.00 H new ATOM 0 HD2 PHE B 103 -3.152 -11.738 -5.723 1.00 0.00 H new ATOM 0 HE1 PHE B 103 -5.183 -7.370 -6.705 1.00 0.00 H new ATOM 0 HE2 PHE B 103 -3.854 -11.202 -8.016 1.00 0.00 H new ATOM 0 HZ PHE B 103 -4.872 -9.013 -8.511 1.00 0.00 H new ATOM 1936 N LYS B 104 -4.452 -11.575 -0.433 1.00 0.00 N ATOM 1937 CA LYS B 104 -3.996 -11.830 0.931 1.00 0.00 C ATOM 1938 C LYS B 104 -3.222 -13.145 1.041 1.00 0.00 C ATOM 1939 O LYS B 104 -3.675 -14.192 0.577 1.00 0.00 O ATOM 1940 CB LYS B 104 -5.175 -11.826 1.916 1.00 0.00 C ATOM 1941 CG LYS B 104 -6.465 -12.430 1.371 1.00 0.00 C ATOM 1942 CD LYS B 104 -6.436 -13.952 1.382 1.00 0.00 C ATOM 1943 CE LYS B 104 -7.796 -14.545 1.061 1.00 0.00 C ATOM 1944 NZ LYS B 104 -8.774 -14.283 2.144 1.00 0.00 N ATOM 0 H LYS B 104 -5.456 -11.415 -0.520 1.00 0.00 H new ATOM 0 HA LYS B 104 -3.315 -11.020 1.193 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -4.884 -12.374 2.812 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -5.372 -10.798 2.221 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -7.308 -12.080 1.966 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -6.627 -12.079 0.352 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -5.704 -14.307 0.656 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -6.109 -14.302 2.361 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -8.166 -14.124 0.126 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -7.699 -15.620 0.910 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -9.305 -15.153 2.350 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -8.270 -13.974 3.000 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -9.434 -13.538 1.843 1.00 0.00 H new ATOM 1958 N ARG B 105 -2.027 -13.063 1.627 1.00 0.00 N ATOM 1959 CA ARG B 105 -1.166 -14.229 1.848 1.00 0.00 C ATOM 1960 C ARG B 105 -0.810 -14.945 0.541 1.00 0.00 C ATOM 1961 O ARG B 105 -0.435 -16.119 0.552 1.00 0.00 O ATOM 1962 CB ARG B 105 -1.841 -15.215 2.812 1.00 0.00 C ATOM 1963 CG ARG B 105 -2.538 -14.549 3.990 1.00 0.00 C ATOM 1964 CD ARG B 105 -3.226 -15.570 4.881 1.00 0.00 C ATOM 1965 NE ARG B 105 -4.312 -14.980 5.665 1.00 0.00 N ATOM 1966 CZ ARG B 105 -4.141 -14.297 6.798 1.00 0.00 C ATOM 1967 NH1 ARG B 105 -2.925 -14.056 7.273 1.00 0.00 N ATOM 1968 NH2 ARG B 105 -5.192 -13.848 7.456 1.00 0.00 N ATOM 0 H ARG B 105 -1.627 -12.187 1.963 1.00 0.00 H new ATOM 0 HA ARG B 105 -0.238 -13.862 2.287 1.00 0.00 H new ATOM 0 HB2 ARG B 105 -2.570 -15.807 2.259 1.00 0.00 H new ATOM 0 HB3 ARG B 105 -1.090 -15.908 3.192 1.00 0.00 H new ATOM 0 HG2 ARG B 105 -1.810 -13.987 4.574 1.00 0.00 H new ATOM 0 HG3 ARG B 105 -3.272 -13.833 3.622 1.00 0.00 H new ATOM 0 HD2 ARG B 105 -3.622 -16.378 4.266 1.00 0.00 H new ATOM 0 HD3 ARG B 105 -2.493 -16.013 5.555 1.00 0.00 H new ATOM 0 HE ARG B 105 -5.265 -15.099 5.321 1.00 0.00 H new ATOM 0 HH11 ARG B 105 -2.105 -14.395 6.770 1.00 0.00 H new ATOM 0 HH12 ARG B 105 -2.811 -13.532 8.141 1.00 0.00 H new ATOM 0 HH21 ARG B 105 -6.131 -14.023 7.098 1.00 0.00 H new ATOM 0 HH22 ARG B 105 -5.066 -13.325 8.323 1.00 0.00 H new ATOM 1982 N LYS B 106 -0.916 -14.241 -0.579 1.00 0.00 N ATOM 1983 CA LYS B 106 -0.599 -14.826 -1.875 1.00 0.00 C ATOM 1984 C LYS B 106 0.902 -14.759 -2.128 1.00 0.00 C ATOM 1985 O LYS B 106 1.384 -13.887 -2.849 1.00 0.00 O ATOM 1986 CB LYS B 106 -1.365 -14.108 -2.994 1.00 0.00 C ATOM 1987 CG LYS B 106 -1.613 -14.964 -4.231 1.00 0.00 C ATOM 1988 CD LYS B 106 -0.540 -14.759 -5.294 1.00 0.00 C ATOM 1989 CE LYS B 106 -0.510 -13.323 -5.796 1.00 0.00 C ATOM 1990 NZ LYS B 106 0.494 -13.122 -6.876 1.00 0.00 N ATOM 0 H LYS B 106 -1.218 -13.267 -0.616 1.00 0.00 H new ATOM 0 HA LYS B 106 -0.906 -15.872 -1.868 1.00 0.00 H new ATOM 0 HB2 LYS B 106 -2.324 -13.769 -2.603 1.00 0.00 H new ATOM 0 HB3 LYS B 106 -0.808 -13.218 -3.287 1.00 0.00 H new ATOM 0 HG2 LYS B 106 -1.642 -16.015 -3.944 1.00 0.00 H new ATOM 0 HG3 LYS B 106 -2.589 -14.721 -4.650 1.00 0.00 H new ATOM 0 HD2 LYS B 106 0.435 -15.021 -4.882 1.00 0.00 H new ATOM 0 HD3 LYS B 106 -0.724 -15.433 -6.131 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -1.498 -13.049 -6.166 1.00 0.00 H new ATOM 0 HE3 LYS B 106 -0.285 -12.655 -4.965 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 0.687 -12.106 -6.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 1.375 -13.617 -6.628 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 0.123 -13.503 -7.770 1.00 0.00 H new ATOM 2004 N ALA B 107 1.636 -15.677 -1.517 1.00 0.00 N ATOM 2005 CA ALA B 107 3.085 -15.733 -1.666 1.00 0.00 C ATOM 2006 C ALA B 107 3.474 -16.437 -2.965 1.00 0.00 C ATOM 2007 O ALA B 107 4.231 -17.407 -2.955 1.00 0.00 O ATOM 2008 CB ALA B 107 3.708 -16.434 -0.468 1.00 0.00 C ATOM 0 H ALA B 107 1.250 -16.399 -0.909 1.00 0.00 H new ATOM 0 HA ALA B 107 3.466 -14.713 -1.712 1.00 0.00 H new ATOM 0 HB1 ALA B 107 4.791 -16.470 -0.590 1.00 0.00 H new ATOM 0 HB2 ALA B 107 3.463 -15.886 0.442 1.00 0.00 H new ATOM 0 HB3 ALA B 107 3.317 -17.449 -0.396 1.00 0.00 H new ATOM 2014 N ASN B 108 2.946 -15.931 -4.071 1.00 0.00 N ATOM 2015 CA ASN B 108 3.206 -16.481 -5.394 1.00 0.00 C ATOM 2016 C ASN B 108 2.575 -15.565 -6.436 1.00 0.00 C ATOM 2017 O ASN B 108 1.813 -16.054 -7.297 1.00 0.00 O ATOM 2018 CB ASN B 108 2.636 -17.903 -5.521 1.00 0.00 C ATOM 2019 CG ASN B 108 3.299 -18.708 -6.626 1.00 0.00 C ATOM 2020 OD1 ASN B 108 4.070 -19.632 -6.366 1.00 0.00 O ATOM 2021 ND2 ASN B 108 3.013 -18.356 -7.868 1.00 0.00 N ATOM 2022 OXT ASN B 108 2.796 -14.341 -6.346 1.00 0.00 O ATOM 0 H ASN B 108 2.322 -15.124 -4.076 1.00 0.00 H new ATOM 0 HA ASN B 108 4.283 -16.541 -5.553 1.00 0.00 H new ATOM 0 HB2 ASN B 108 2.761 -18.425 -4.573 1.00 0.00 H new ATOM 0 HB3 ASN B 108 1.565 -17.844 -5.714 1.00 0.00 H new ATOM 0 HD21 ASN B 108 3.436 -18.856 -8.650 1.00 0.00 H new ATOM 0 HD22 ASN B 108 2.369 -17.585 -8.044 1.00 0.00 H new TER 2029 ASN B 108