USER MOD reduce.3.24.130724 H: found=0, std=0, add=829, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 828 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 1 MET CE :methyl -176:sc= -0.0104 (180deg=-0.0428) USER MOD Set 1.2: B 19 SER OG : rot 180:sc= 0 USER MOD Set 2.1: B 7 THR OG1 : rot 113:sc= 1.06 USER MOD Set 2.2: B 9 THR OG1 : rot 180:sc= 0.898 USER MOD Set 3.1: A 33 SER OG : rot -75:sc= 0.189 USER MOD Set 3.2: B 55 THR OG1 : rot 119:sc= 0.605 USER MOD Set 3.3: B 57 SER OG : rot 180:sc= 0.555 USER MOD Set 4.1: A 18 THR OG1 : rot -73:sc= 1.25 USER MOD Set 4.2: A 35 CYS SG : rot 88:sc= 0.143 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 20 CYS SG : rot -171:sc= 0.194 USER MOD Single : A 23 TYR OH : rot 180:sc= -0.433 USER MOD Single : A 25 ASN : amide:sc= -2.98! C(o=-3!,f=-3!) USER MOD Single : A 28 THR OG1 : rot 161:sc= -0.423 USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 HIS : no HD1:sc= -4.07 K(o=-4.1,f=-1.8) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 GLN : amide:sc= -0.152 K(o=-0.15,f=-1.9!) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 ASN : amide:sc= -0.473 K(o=-0.47,f=-1.6!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 179:sc= 1.6 (180deg=1.6) USER MOD Single : B 2 GLN : amide:sc= -2.1 K(o=-2.1,f=-0.0054) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00451) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -77:sc= 0.0825 USER MOD Single : B 20 SER OG : rot 180:sc= 0.00454 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.227 USER MOD Single : B 25 ASN : amide:sc= -4.01! K(o=-4!,f=-0.13) USER MOD Single : B 27 LYS NZ :NH3+ -149:sc= 0.0862 (180deg=0) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 GLN : amide:sc= -0.701 X(o=-0.7,f=-1) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -1.66! K(o=-1.7!,f=-0.056) USER MOD Single : B 41 GLN : amide:sc= -2.09! K(o=-2.1!,f=-3.8) USER MOD Single : B 48 LYS NZ :NH3+ -166:sc= -0.169 (180deg=-0.41) USER MOD Single : B 49 GLN : amide:sc=-0.00251 K(o=-0.0025,f=-0.68) USER MOD Single : B 59 TYR OH : rot -67:sc= -0.286 USER MOD Single : B 60 ASN : amide:sc= -0.0834 K(o=-0.083,f=-1.4!) USER MOD Single : B 62 GLN : amide:sc= -0.96 K(o=-0.96,f=-0.0019) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 85:sc= 0.564 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 12 7.775 -12.223 -0.336 1.00 10.00 N ATOM 2 CA GLY A 12 9.115 -11.677 -0.161 1.00 10.00 C ATOM 3 C GLY A 12 9.347 -10.426 -0.999 1.00 10.00 C ATOM 4 O GLY A 12 9.435 -9.333 -0.442 1.00 10.00 O ATOM 0 HA2 GLY A 12 9.273 -11.441 0.891 1.00 10.00 H new ATOM 0 HA3 GLY A 12 9.851 -12.434 -0.432 1.00 10.00 H new ATOM 8 N PRO A 13 9.448 -10.548 -2.346 1.00 10.00 N ATOM 9 CA PRO A 13 9.672 -9.388 -3.213 1.00 10.00 C ATOM 10 C PRO A 13 8.449 -8.473 -3.274 1.00 10.00 C ATOM 11 O PRO A 13 7.690 -8.497 -4.247 1.00 10.00 O ATOM 12 CB PRO A 13 9.984 -10.004 -4.584 1.00 10.00 C ATOM 13 CG PRO A 13 9.374 -11.369 -4.556 1.00 10.00 C ATOM 14 CD PRO A 13 9.363 -11.813 -3.110 1.00 10.00 C ATOM 0 HA PRO A 13 10.476 -8.750 -2.847 1.00 10.00 H new ATOM 0 HB2 PRO A 13 9.563 -9.402 -5.390 1.00 10.00 H new ATOM 0 HB3 PRO A 13 11.059 -10.058 -4.755 1.00 10.00 H new ATOM 0 HG2 PRO A 13 8.363 -11.349 -4.962 1.00 10.00 H new ATOM 0 HG3 PRO A 13 9.950 -12.062 -5.169 1.00 10.00 H new ATOM 0 HD2 PRO A 13 8.454 -12.365 -2.869 1.00 10.00 H new ATOM 0 HD3 PRO A 13 10.203 -12.471 -2.888 1.00 10.00 H new ATOM 22 N MET A 14 8.273 -7.660 -2.228 1.00 10.00 N ATOM 23 CA MET A 14 7.144 -6.735 -2.154 1.00 10.00 C ATOM 24 C MET A 14 7.339 -5.581 -3.141 1.00 10.00 C ATOM 25 O MET A 14 7.802 -4.500 -2.769 1.00 10.00 O ATOM 26 CB MET A 14 6.990 -6.198 -0.724 1.00 10.00 C ATOM 27 CG MET A 14 6.288 -7.247 0.144 1.00 10.00 C ATOM 28 SD MET A 14 4.534 -7.323 -0.299 1.00 10.00 S ATOM 29 CE MET A 14 3.882 -7.625 1.361 1.00 10.00 C ATOM 0 H MET A 14 8.898 -7.625 -1.423 1.00 10.00 H new ATOM 0 HA MET A 14 6.234 -7.271 -2.423 1.00 10.00 H new ATOM 0 HB2 MET A 14 7.968 -5.961 -0.306 1.00 10.00 H new ATOM 0 HB3 MET A 14 6.414 -5.273 -0.732 1.00 10.00 H new ATOM 0 HG2 MET A 14 6.753 -8.223 0.001 1.00 10.00 H new ATOM 0 HG3 MET A 14 6.397 -6.994 1.199 1.00 10.00 H new ATOM 0 HE1 MET A 14 2.796 -7.706 1.316 1.00 10.00 H new ATOM 0 HE2 MET A 14 4.300 -8.552 1.753 1.00 10.00 H new ATOM 0 HE3 MET A 14 4.157 -6.798 2.016 1.00 10.00 H new ATOM 39 N LEU A 15 6.987 -5.830 -4.406 1.00 10.00 N ATOM 40 CA LEU A 15 7.128 -4.821 -5.454 1.00 10.00 C ATOM 41 C LEU A 15 6.037 -3.757 -5.318 1.00 10.00 C ATOM 42 O LEU A 15 4.914 -4.063 -4.920 1.00 10.00 O ATOM 43 CB LEU A 15 7.050 -5.502 -6.841 1.00 10.00 C ATOM 44 CG LEU A 15 8.311 -5.202 -7.671 1.00 10.00 C ATOM 45 CD1 LEU A 15 9.541 -5.828 -7.005 1.00 10.00 C ATOM 46 CD2 LEU A 15 8.140 -5.791 -9.072 1.00 10.00 C ATOM 0 H LEU A 15 6.604 -6.719 -4.726 1.00 10.00 H new ATOM 0 HA LEU A 15 8.096 -4.331 -5.352 1.00 10.00 H new ATOM 0 HB2 LEU A 15 6.940 -6.579 -6.716 1.00 10.00 H new ATOM 0 HB3 LEU A 15 6.167 -5.151 -7.374 1.00 10.00 H new ATOM 0 HG LEU A 15 8.451 -4.123 -7.734 1.00 10.00 H new ATOM 0 HD11 LEU A 15 10.428 -5.610 -7.600 1.00 10.00 H new ATOM 0 HD12 LEU A 15 9.664 -5.413 -6.005 1.00 10.00 H new ATOM 0 HD13 LEU A 15 9.407 -6.908 -6.936 1.00 10.00 H new ATOM 0 HD21 LEU A 15 9.030 -5.582 -9.666 1.00 10.00 H new ATOM 0 HD22 LEU A 15 7.998 -6.869 -8.999 1.00 10.00 H new ATOM 0 HD23 LEU A 15 7.270 -5.342 -9.552 1.00 10.00 H new ATOM 58 N CYS A 16 6.386 -2.500 -5.633 1.00 10.00 N ATOM 59 CA CYS A 16 5.449 -1.366 -5.525 1.00 10.00 C ATOM 60 C CYS A 16 4.043 -1.669 -6.075 1.00 10.00 C ATOM 61 O CYS A 16 3.889 -2.209 -7.170 1.00 10.00 O ATOM 62 CB CYS A 16 6.021 -0.152 -6.260 1.00 10.00 C ATOM 63 SG CYS A 16 5.192 1.347 -5.675 1.00 10.00 S ATOM 0 H CYS A 16 7.314 -2.240 -5.966 1.00 10.00 H new ATOM 0 HA CYS A 16 5.337 -1.165 -4.460 1.00 10.00 H new ATOM 0 HB2 CYS A 16 7.094 -0.079 -6.085 1.00 10.00 H new ATOM 0 HB3 CYS A 16 5.880 -0.264 -7.335 1.00 10.00 H new ATOM 68 N SER A 17 3.034 -1.311 -5.277 1.00 10.00 N ATOM 69 CA SER A 17 1.636 -1.538 -5.648 1.00 10.00 C ATOM 70 C SER A 17 1.240 -0.705 -6.869 1.00 10.00 C ATOM 71 O SER A 17 0.410 -1.136 -7.672 1.00 10.00 O ATOM 72 CB SER A 17 0.722 -1.190 -4.470 1.00 10.00 C ATOM 73 OG SER A 17 1.092 -1.971 -3.344 1.00 10.00 O ATOM 0 H SER A 17 3.160 -0.863 -4.370 1.00 10.00 H new ATOM 0 HA SER A 17 1.523 -2.592 -5.904 1.00 10.00 H new ATOM 0 HB2 SER A 17 0.802 -0.129 -4.234 1.00 10.00 H new ATOM 0 HB3 SER A 17 -0.318 -1.380 -4.733 1.00 10.00 H new ATOM 0 HG SER A 17 0.510 -1.750 -2.587 1.00 10.00 H new ATOM 79 N THR A 18 1.829 0.488 -6.999 1.00 10.00 N ATOM 80 CA THR A 18 1.512 1.369 -8.128 1.00 10.00 C ATOM 81 C THR A 18 2.110 0.858 -9.453 1.00 10.00 C ATOM 82 O THR A 18 1.721 1.335 -10.520 1.00 10.00 O ATOM 83 CB THR A 18 2.014 2.788 -7.848 1.00 10.00 C ATOM 84 OG1 THR A 18 3.412 2.759 -7.612 1.00 10.00 O ATOM 85 CG2 THR A 18 1.297 3.357 -6.619 1.00 10.00 C ATOM 0 H THR A 18 2.518 0.862 -6.347 1.00 10.00 H new ATOM 0 HA THR A 18 0.427 1.375 -8.236 1.00 10.00 H new ATOM 0 HB THR A 18 1.805 3.421 -8.711 1.00 10.00 H new ATOM 0 HG1 THR A 18 3.587 2.373 -6.728 1.00 10.00 H new ATOM 0 HG21 THR A 18 1.657 4.367 -6.423 1.00 10.00 H new ATOM 0 HG22 THR A 18 0.223 3.384 -6.804 1.00 10.00 H new ATOM 0 HG23 THR A 18 1.500 2.725 -5.754 1.00 10.00 H new ATOM 93 N GLY A 19 3.036 -0.113 -9.389 1.00 10.00 N ATOM 94 CA GLY A 19 3.641 -0.665 -10.605 1.00 10.00 C ATOM 95 C GLY A 19 4.662 0.291 -11.212 1.00 10.00 C ATOM 96 O GLY A 19 4.684 0.485 -12.430 1.00 10.00 O ATOM 0 H GLY A 19 3.376 -0.525 -8.520 1.00 10.00 H new ATOM 0 HA2 GLY A 19 4.125 -1.614 -10.372 1.00 10.00 H new ATOM 0 HA3 GLY A 19 2.861 -0.876 -11.336 1.00 10.00 H new ATOM 100 N CYS A 20 5.507 0.885 -10.372 1.00 10.00 N ATOM 101 CA CYS A 20 6.517 1.827 -10.851 1.00 10.00 C ATOM 102 C CYS A 20 7.697 1.107 -11.538 1.00 10.00 C ATOM 103 O CYS A 20 8.501 1.748 -12.213 1.00 10.00 O ATOM 104 CB CYS A 20 7.014 2.707 -9.689 1.00 10.00 C ATOM 105 SG CYS A 20 8.001 1.805 -8.481 1.00 10.00 S ATOM 0 H CYS A 20 5.513 0.733 -9.363 1.00 10.00 H new ATOM 0 HA CYS A 20 6.050 2.463 -11.603 1.00 10.00 H new ATOM 0 HB2 CYS A 20 7.607 3.528 -10.092 1.00 10.00 H new ATOM 0 HB3 CYS A 20 6.155 3.152 -9.186 1.00 10.00 H new ATOM 0 HG CYS A 20 8.225 2.564 -7.450 1.00 10.00 H new ATOM 110 N GLY A 21 7.797 -0.226 -11.370 1.00 10.00 N ATOM 111 CA GLY A 21 8.878 -0.993 -12.007 1.00 10.00 C ATOM 112 C GLY A 21 10.082 -1.229 -11.081 1.00 10.00 C ATOM 113 O GLY A 21 11.090 -1.783 -11.519 1.00 10.00 O ATOM 0 H GLY A 21 7.153 -0.783 -10.808 1.00 10.00 H new ATOM 0 HA2 GLY A 21 8.486 -1.956 -12.335 1.00 10.00 H new ATOM 0 HA3 GLY A 21 9.213 -0.464 -12.899 1.00 10.00 H new ATOM 117 N PHE A 22 9.976 -0.813 -9.815 1.00 10.00 N ATOM 118 CA PHE A 22 11.069 -0.985 -8.855 1.00 10.00 C ATOM 119 C PHE A 22 10.599 -1.737 -7.622 1.00 10.00 C ATOM 120 O PHE A 22 9.498 -2.281 -7.607 1.00 10.00 O ATOM 121 CB PHE A 22 11.639 0.383 -8.487 1.00 10.00 C ATOM 122 CG PHE A 22 12.416 0.965 -9.637 1.00 10.00 C ATOM 123 CD1 PHE A 22 13.724 0.554 -9.870 1.00 10.00 C ATOM 124 CD2 PHE A 22 11.834 1.877 -10.506 1.00 10.00 C ATOM 125 CE1 PHE A 22 14.441 1.048 -10.946 1.00 10.00 C ATOM 126 CE2 PHE A 22 12.550 2.380 -11.584 1.00 10.00 C ATOM 127 CZ PHE A 22 13.855 1.962 -11.806 1.00 10.00 C ATOM 0 H PHE A 22 9.148 -0.357 -9.433 1.00 10.00 H new ATOM 0 HA PHE A 22 11.856 -1.583 -9.314 1.00 10.00 H new ATOM 0 HB2 PHE A 22 10.828 1.058 -8.211 1.00 10.00 H new ATOM 0 HB3 PHE A 22 12.286 0.290 -7.615 1.00 10.00 H new ATOM 0 HD1 PHE A 22 14.186 -0.159 -9.203 1.00 10.00 H new ATOM 0 HD2 PHE A 22 10.816 2.198 -10.342 1.00 10.00 H new ATOM 0 HE1 PHE A 22 15.456 0.721 -11.115 1.00 10.00 H new ATOM 0 HE2 PHE A 22 12.092 3.096 -12.250 1.00 10.00 H new ATOM 0 HZ PHE A 22 14.412 2.348 -12.647 1.00 10.00 H new ATOM 137 N TYR A 23 11.443 -1.767 -6.592 1.00 10.00 N ATOM 138 CA TYR A 23 11.113 -2.464 -5.357 1.00 10.00 C ATOM 139 C TYR A 23 10.362 -1.553 -4.386 1.00 10.00 C ATOM 140 O TYR A 23 10.457 -0.334 -4.474 1.00 10.00 O ATOM 141 CB TYR A 23 12.381 -2.997 -4.691 1.00 10.00 C ATOM 142 CG TYR A 23 12.510 -4.494 -4.820 1.00 10.00 C ATOM 143 CD1 TYR A 23 11.929 -5.355 -3.895 1.00 10.00 C ATOM 144 CD2 TYR A 23 13.200 -5.041 -5.891 1.00 10.00 C ATOM 145 CE1 TYR A 23 12.038 -6.728 -4.040 1.00 10.00 C ATOM 146 CE2 TYR A 23 13.316 -6.409 -6.043 1.00 10.00 C ATOM 147 CZ TYR A 23 12.733 -7.251 -5.118 1.00 10.00 C ATOM 148 OH TYR A 23 12.848 -8.620 -5.261 1.00 10.00 O ATOM 0 H TYR A 23 12.358 -1.317 -6.591 1.00 10.00 H new ATOM 0 HA TYR A 23 10.462 -3.300 -5.614 1.00 10.00 H new ATOM 0 HB2 TYR A 23 13.252 -2.520 -5.139 1.00 10.00 H new ATOM 0 HB3 TYR A 23 12.376 -2.725 -3.636 1.00 10.00 H new ATOM 0 HD1 TYR A 23 11.387 -4.948 -3.054 1.00 10.00 H new ATOM 0 HD2 TYR A 23 13.655 -4.386 -6.619 1.00 10.00 H new ATOM 0 HE1 TYR A 23 11.583 -7.388 -3.316 1.00 10.00 H new ATOM 0 HE2 TYR A 23 13.860 -6.818 -6.882 1.00 10.00 H new ATOM 0 HH TYR A 23 13.364 -8.822 -6.069 1.00 10.00 H new ATOM 158 N GLY A 24 9.612 -2.164 -3.463 1.00 10.00 N ATOM 159 CA GLY A 24 8.855 -1.406 -2.476 1.00 10.00 C ATOM 160 C GLY A 24 9.498 -1.469 -1.102 1.00 10.00 C ATOM 161 O GLY A 24 10.608 -1.982 -0.957 1.00 10.00 O ATOM 0 H GLY A 24 9.517 -3.176 -3.383 1.00 10.00 H new ATOM 0 HA2 GLY A 24 8.781 -0.366 -2.795 1.00 10.00 H new ATOM 0 HA3 GLY A 24 7.839 -1.796 -2.420 1.00 10.00 H new ATOM 165 N ASN A 25 8.807 -0.946 -0.091 1.00 10.00 N ATOM 166 CA ASN A 25 9.327 -0.949 1.271 1.00 10.00 C ATOM 167 C ASN A 25 8.232 -1.328 2.269 1.00 10.00 C ATOM 168 O ASN A 25 7.236 -0.633 2.390 1.00 10.00 O ATOM 169 CB ASN A 25 9.865 0.430 1.643 1.00 10.00 C ATOM 170 CG ASN A 25 10.926 0.344 2.736 1.00 10.00 C ATOM 171 OD1 ASN A 25 11.579 -0.678 2.894 1.00 10.00 O ATOM 172 ND2 ASN A 25 11.123 1.417 3.496 1.00 10.00 N ATOM 0 H ASN A 25 7.887 -0.516 -0.191 1.00 10.00 H new ATOM 0 HA ASN A 25 10.131 -1.683 1.313 1.00 10.00 H new ATOM 0 HB2 ASN A 25 10.290 0.906 0.759 1.00 10.00 H new ATOM 0 HB3 ASN A 25 9.044 1.062 1.981 1.00 10.00 H new ATOM 0 HD21 ASN A 25 11.831 1.399 4.230 1.00 10.00 H new ATOM 0 HD22 ASN A 25 10.566 2.258 3.345 1.00 10.00 H new ATOM 179 N PRO A 26 8.372 -2.442 3.014 1.00 10.00 N ATOM 180 CA PRO A 26 7.340 -2.856 4.017 1.00 10.00 C ATOM 181 C PRO A 26 7.255 -1.880 5.195 1.00 10.00 C ATOM 182 O PRO A 26 6.238 -1.838 5.891 1.00 10.00 O ATOM 183 CB PRO A 26 7.793 -4.240 4.466 1.00 10.00 C ATOM 184 CG PRO A 26 9.262 -4.264 4.221 1.00 10.00 C ATOM 185 CD PRO A 26 9.495 -3.407 2.981 1.00 10.00 C ATOM 0 HA PRO A 26 6.336 -2.862 3.592 1.00 10.00 H new ATOM 0 HB2 PRO A 26 7.566 -4.407 5.519 1.00 10.00 H new ATOM 0 HB3 PRO A 26 7.286 -5.023 3.902 1.00 10.00 H new ATOM 0 HG2 PRO A 26 9.807 -3.867 5.078 1.00 10.00 H new ATOM 0 HG3 PRO A 26 9.615 -5.283 4.063 1.00 10.00 H new ATOM 0 HD2 PRO A 26 10.460 -2.902 3.018 1.00 10.00 H new ATOM 0 HD3 PRO A 26 9.483 -4.006 2.071 1.00 10.00 H new ATOM 193 N ARG A 27 8.302 -1.066 5.393 1.00 10.00 N ATOM 194 CA ARG A 27 8.300 -0.063 6.463 1.00 10.00 C ATOM 195 C ARG A 27 7.339 1.078 6.102 1.00 10.00 C ATOM 196 O ARG A 27 6.577 1.548 6.947 1.00 10.00 O ATOM 197 CB ARG A 27 9.706 0.510 6.656 1.00 10.00 C ATOM 198 CG ARG A 27 10.671 -0.608 7.059 1.00 10.00 C ATOM 199 CD ARG A 27 12.032 -0.004 7.428 1.00 10.00 C ATOM 200 NE ARG A 27 11.946 0.708 8.713 1.00 10.00 N ATOM 201 CZ ARG A 27 12.990 0.815 9.560 1.00 10.00 C ATOM 202 NH1 ARG A 27 14.153 0.255 9.307 1.00 10.00 N ATOM 203 NH2 ARG A 27 12.842 1.492 10.667 1.00 10.00 N ATOM 0 H ARG A 27 9.153 -1.083 4.831 1.00 10.00 H new ATOM 0 HA ARG A 27 7.976 -0.541 7.387 1.00 10.00 H new ATOM 0 HB2 ARG A 27 10.046 0.982 5.734 1.00 10.00 H new ATOM 0 HB3 ARG A 27 9.691 1.284 7.423 1.00 10.00 H new ATOM 0 HG2 ARG A 27 10.267 -1.164 7.905 1.00 10.00 H new ATOM 0 HG3 ARG A 27 10.786 -1.316 6.238 1.00 10.00 H new ATOM 0 HD2 ARG A 27 12.782 -0.793 7.491 1.00 10.00 H new ATOM 0 HD3 ARG A 27 12.357 0.682 6.646 1.00 10.00 H new ATOM 0 HE ARG A 27 11.059 1.139 8.974 1.00 10.00 H new ATOM 0 HH11 ARG A 27 14.286 -0.280 8.449 1.00 10.00 H new ATOM 0 HH12 ARG A 27 14.922 0.356 9.969 1.00 10.00 H new ATOM 0 HH21 ARG A 27 11.946 1.931 10.881 1.00 10.00 H new ATOM 0 HH22 ARG A 27 13.622 1.582 11.318 1.00 10.00 H new ATOM 217 N THR A 28 7.370 1.487 4.825 1.00 10.00 N ATOM 218 CA THR A 28 6.486 2.539 4.337 1.00 10.00 C ATOM 219 C THR A 28 5.094 1.923 4.089 1.00 10.00 C ATOM 220 O THR A 28 4.745 0.930 4.732 1.00 10.00 O ATOM 221 CB THR A 28 7.077 3.169 3.056 1.00 10.00 C ATOM 222 OG1 THR A 28 7.129 2.187 2.032 1.00 10.00 O ATOM 223 CG2 THR A 28 8.491 3.702 3.324 1.00 10.00 C ATOM 0 H THR A 28 7.998 1.103 4.119 1.00 10.00 H new ATOM 0 HA THR A 28 6.389 3.338 5.072 1.00 10.00 H new ATOM 0 HB THR A 28 6.442 3.999 2.744 1.00 10.00 H new ATOM 0 HG1 THR A 28 7.213 2.627 1.161 1.00 10.00 H new ATOM 0 HG21 THR A 28 8.893 4.142 2.412 1.00 10.00 H new ATOM 0 HG22 THR A 28 8.452 4.460 4.106 1.00 10.00 H new ATOM 0 HG23 THR A 28 9.134 2.882 3.645 1.00 10.00 H new ATOM 231 N ASN A 29 4.301 2.499 3.177 1.00 10.00 N ATOM 232 CA ASN A 29 2.964 1.978 2.882 1.00 10.00 C ATOM 233 C ASN A 29 2.988 0.929 1.758 1.00 10.00 C ATOM 234 O ASN A 29 1.992 0.760 1.048 1.00 10.00 O ATOM 235 CB ASN A 29 2.053 3.146 2.484 1.00 10.00 C ATOM 236 CG ASN A 29 1.545 3.853 3.736 1.00 10.00 C ATOM 237 OD1 ASN A 29 2.335 4.211 4.608 1.00 10.00 O ATOM 238 ND2 ASN A 29 0.271 4.076 3.878 1.00 10.00 N ATOM 0 H ASN A 29 4.562 3.322 2.634 1.00 10.00 H new ATOM 0 HA ASN A 29 2.585 1.485 3.777 1.00 10.00 H new ATOM 0 HB2 ASN A 29 2.600 3.848 1.855 1.00 10.00 H new ATOM 0 HB3 ASN A 29 1.212 2.779 1.895 1.00 10.00 H new ATOM 0 HD21 ASN A 29 -0.074 4.548 4.714 1.00 10.00 H new ATOM 0 HD22 ASN A 29 -0.383 3.778 3.154 1.00 10.00 H new ATOM 245 N GLY A 30 4.122 0.236 1.581 1.00 10.00 N ATOM 246 CA GLY A 30 4.245 -0.765 0.523 1.00 10.00 C ATOM 247 C GLY A 30 4.650 -0.119 -0.811 1.00 10.00 C ATOM 248 O GLY A 30 4.590 -0.771 -1.856 1.00 10.00 O ATOM 0 H GLY A 30 4.958 0.352 2.154 1.00 10.00 H new ATOM 0 HA2 GLY A 30 4.987 -1.510 0.809 1.00 10.00 H new ATOM 0 HA3 GLY A 30 3.297 -1.289 0.403 1.00 10.00 H new ATOM 252 N MET A 31 5.040 1.169 -0.777 1.00 10.00 N ATOM 253 CA MET A 31 5.422 1.888 -1.987 1.00 10.00 C ATOM 254 C MET A 31 6.851 2.422 -1.886 1.00 10.00 C ATOM 255 O MET A 31 7.411 2.531 -0.793 1.00 10.00 O ATOM 256 CB MET A 31 4.462 3.061 -2.197 1.00 10.00 C ATOM 257 CG MET A 31 3.214 2.593 -2.948 1.00 10.00 C ATOM 258 SD MET A 31 2.135 1.658 -1.834 1.00 10.00 S ATOM 259 CE MET A 31 0.571 2.435 -2.319 1.00 10.00 C ATOM 0 H MET A 31 5.096 1.724 0.077 1.00 10.00 H new ATOM 0 HA MET A 31 5.372 1.197 -2.828 1.00 10.00 H new ATOM 0 HB2 MET A 31 4.178 3.485 -1.234 1.00 10.00 H new ATOM 0 HB3 MET A 31 4.959 3.851 -2.760 1.00 10.00 H new ATOM 0 HG2 MET A 31 2.678 3.453 -3.350 1.00 10.00 H new ATOM 0 HG3 MET A 31 3.501 1.971 -3.796 1.00 10.00 H new ATOM 0 HE1 MET A 31 -0.246 1.999 -1.744 1.00 10.00 H new ATOM 0 HE2 MET A 31 0.621 3.506 -2.124 1.00 10.00 H new ATOM 0 HE3 MET A 31 0.396 2.268 -3.382 1.00 10.00 H new ATOM 269 N CYS A 32 7.427 2.750 -3.038 1.00 10.00 N ATOM 270 CA CYS A 32 8.782 3.281 -3.101 1.00 10.00 C ATOM 271 C CYS A 32 8.821 4.690 -2.488 1.00 10.00 C ATOM 272 O CYS A 32 7.779 5.254 -2.173 1.00 10.00 O ATOM 273 CB CYS A 32 9.268 3.269 -4.561 1.00 10.00 C ATOM 274 SG CYS A 32 8.404 4.452 -5.610 1.00 10.00 S ATOM 0 H CYS A 32 6.972 2.656 -3.946 1.00 10.00 H new ATOM 0 HA CYS A 32 9.459 2.656 -2.519 1.00 10.00 H new ATOM 0 HB2 CYS A 32 10.336 3.487 -4.583 1.00 10.00 H new ATOM 0 HB3 CYS A 32 9.138 2.268 -4.971 1.00 10.00 H new ATOM 279 N SER A 33 10.009 5.259 -2.312 1.00 10.00 N ATOM 280 CA SER A 33 10.139 6.595 -1.704 1.00 10.00 C ATOM 281 C SER A 33 9.574 7.713 -2.585 1.00 10.00 C ATOM 282 O SER A 33 9.254 8.796 -2.095 1.00 10.00 O ATOM 283 CB SER A 33 11.611 6.889 -1.401 1.00 10.00 C ATOM 284 OG SER A 33 12.363 6.875 -2.581 1.00 10.00 O ATOM 0 H SER A 33 10.894 4.827 -2.577 1.00 10.00 H new ATOM 0 HA SER A 33 9.553 6.577 -0.785 1.00 10.00 H new ATOM 0 HB2 SER A 33 11.702 7.861 -0.915 1.00 10.00 H new ATOM 0 HB3 SER A 33 12.001 6.147 -0.705 1.00 10.00 H new ATOM 0 HG SER A 33 12.490 5.949 -2.877 1.00 10.00 H new ATOM 290 N VAL A 34 9.442 7.438 -3.879 1.00 10.00 N ATOM 291 CA VAL A 34 8.949 8.428 -4.835 1.00 10.00 C ATOM 292 C VAL A 34 7.416 8.541 -4.835 1.00 10.00 C ATOM 293 O VAL A 34 6.871 9.646 -4.829 1.00 10.00 O ATOM 294 CB VAL A 34 9.437 8.102 -6.262 1.00 10.00 C ATOM 295 CG1 VAL A 34 9.093 9.245 -7.213 1.00 10.00 C ATOM 296 CG2 VAL A 34 10.944 7.845 -6.270 1.00 10.00 C ATOM 0 H VAL A 34 9.670 6.534 -4.293 1.00 10.00 H new ATOM 0 HA VAL A 34 9.354 9.388 -4.516 1.00 10.00 H new ATOM 0 HB VAL A 34 8.930 7.198 -6.600 1.00 10.00 H new ATOM 0 HG11 VAL A 34 9.443 9.002 -8.216 1.00 10.00 H new ATOM 0 HG12 VAL A 34 8.013 9.391 -7.231 1.00 10.00 H new ATOM 0 HG13 VAL A 34 9.577 10.160 -6.872 1.00 10.00 H new ATOM 0 HG21 VAL A 34 11.269 7.617 -7.285 1.00 10.00 H new ATOM 0 HG22 VAL A 34 11.466 8.732 -5.913 1.00 10.00 H new ATOM 0 HG23 VAL A 34 11.173 7.002 -5.618 1.00 10.00 H new ATOM 306 N CYS A 35 6.737 7.403 -4.828 1.00 10.00 N ATOM 307 CA CYS A 35 5.273 7.365 -4.843 1.00 10.00 C ATOM 308 C CYS A 35 4.664 7.624 -3.465 1.00 10.00 C ATOM 309 O CYS A 35 3.538 8.111 -3.368 1.00 10.00 O ATOM 310 CB CYS A 35 4.812 6.013 -5.371 1.00 10.00 C ATOM 311 SG CYS A 35 5.272 5.762 -7.095 1.00 10.00 S ATOM 0 H CYS A 35 7.177 6.483 -4.812 1.00 10.00 H new ATOM 0 HA CYS A 35 4.928 8.166 -5.497 1.00 10.00 H new ATOM 0 HB2 CYS A 35 5.246 5.220 -4.762 1.00 10.00 H new ATOM 0 HB3 CYS A 35 3.729 5.936 -5.271 1.00 10.00 H new ATOM 0 HG CYS A 35 6.464 5.247 -7.155 1.00 10.00 H new ATOM 316 N TYR A 36 5.424 7.323 -2.413 1.00 10.00 N ATOM 317 CA TYR A 36 4.951 7.515 -1.034 1.00 10.00 C ATOM 318 C TYR A 36 4.595 8.981 -0.740 1.00 10.00 C ATOM 319 O TYR A 36 3.524 9.256 -0.196 1.00 10.00 O ATOM 320 CB TYR A 36 6.022 7.001 -0.042 1.00 10.00 C ATOM 321 CG TYR A 36 5.600 7.174 1.415 1.00 10.00 C ATOM 322 CD1 TYR A 36 4.287 6.885 1.828 1.00 10.00 C ATOM 323 CD2 TYR A 36 6.540 7.614 2.352 1.00 10.00 C ATOM 324 CE1 TYR A 36 3.925 7.038 3.172 1.00 10.00 C ATOM 325 CE2 TYR A 36 6.176 7.768 3.695 1.00 10.00 C ATOM 326 CZ TYR A 36 4.870 7.481 4.106 1.00 10.00 C ATOM 327 OH TYR A 36 4.514 7.629 5.430 1.00 10.00 O ATOM 0 H TYR A 36 6.369 6.946 -2.484 1.00 10.00 H new ATOM 0 HA TYR A 36 4.034 6.939 -0.910 1.00 10.00 H new ATOM 0 HB2 TYR A 36 6.218 5.947 -0.238 1.00 10.00 H new ATOM 0 HB3 TYR A 36 6.957 7.535 -0.212 1.00 10.00 H new ATOM 0 HD1 TYR A 36 3.557 6.545 1.108 1.00 10.00 H new ATOM 0 HD2 TYR A 36 7.550 7.836 2.039 1.00 10.00 H new ATOM 0 HE1 TYR A 36 2.917 6.814 3.488 1.00 10.00 H new ATOM 0 HE2 TYR A 36 6.905 8.109 4.415 1.00 10.00 H new ATOM 0 HH TYR A 36 5.287 7.943 5.944 1.00 10.00 H new ATOM 337 N LYS A 37 5.487 9.906 -1.095 1.00 10.00 N ATOM 338 CA LYS A 37 5.236 11.325 -0.843 1.00 10.00 C ATOM 339 C LYS A 37 4.163 11.843 -1.796 1.00 10.00 C ATOM 340 O LYS A 37 3.265 12.584 -1.391 1.00 10.00 O ATOM 341 CB LYS A 37 6.529 12.153 -0.972 1.00 10.00 C ATOM 342 CG LYS A 37 7.127 12.037 -2.378 1.00 10.00 C ATOM 343 CD LYS A 37 8.420 12.845 -2.453 1.00 10.00 C ATOM 344 CE LYS A 37 8.854 12.975 -3.914 1.00 10.00 C ATOM 345 NZ LYS A 37 10.256 13.476 -3.972 1.00 10.00 N ATOM 0 H LYS A 37 6.377 9.703 -1.551 1.00 10.00 H new ATOM 0 HA LYS A 37 4.878 11.433 0.181 1.00 10.00 H new ATOM 0 HB2 LYS A 37 6.317 13.199 -0.750 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.257 11.812 -0.236 1.00 10.00 H new ATOM 0 HG2 LYS A 37 7.325 10.992 -2.615 1.00 10.00 H new ATOM 0 HG3 LYS A 37 6.415 12.402 -3.118 1.00 10.00 H new ATOM 0 HD2 LYS A 37 8.270 13.833 -2.017 1.00 10.00 H new ATOM 0 HD3 LYS A 37 9.202 12.356 -1.872 1.00 10.00 H new ATOM 0 HE2 LYS A 37 8.781 12.009 -4.414 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.190 13.659 -4.443 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 10.552 13.565 -4.965 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 10.312 14.406 -3.510 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 10.884 12.807 -3.482 1.00 10.00 H new ATOM 359 N GLU A 38 4.279 11.460 -3.070 1.00 10.00 N ATOM 360 CA GLU A 38 3.333 11.894 -4.101 1.00 10.00 C ATOM 361 C GLU A 38 1.883 11.571 -3.728 1.00 10.00 C ATOM 362 O GLU A 38 0.984 12.377 -3.988 1.00 10.00 O ATOM 363 CB GLU A 38 3.674 11.219 -5.435 1.00 10.00 C ATOM 364 CG GLU A 38 4.836 11.959 -6.103 1.00 10.00 C ATOM 365 CD GLU A 38 4.329 13.239 -6.756 1.00 10.00 C ATOM 366 OE1 GLU A 38 3.329 13.168 -7.450 1.00 10.00 O ATOM 367 OE2 GLU A 38 4.947 14.269 -6.552 1.00 10.00 O ATOM 0 H GLU A 38 5.020 10.849 -3.413 1.00 10.00 H new ATOM 0 HA GLU A 38 3.423 12.977 -4.189 1.00 10.00 H new ATOM 0 HB2 GLU A 38 3.942 10.176 -5.268 1.00 10.00 H new ATOM 0 HB3 GLU A 38 2.802 11.223 -6.090 1.00 10.00 H new ATOM 0 HG2 GLU A 38 5.601 12.196 -5.363 1.00 10.00 H new ATOM 0 HG3 GLU A 38 5.304 11.319 -6.851 1.00 10.00 H new ATOM 374 N HIS A 39 1.655 10.393 -3.132 1.00 10.00 N ATOM 375 CA HIS A 39 0.291 10.002 -2.755 1.00 10.00 C ATOM 376 C HIS A 39 -0.100 10.560 -1.377 1.00 10.00 C ATOM 377 O HIS A 39 -1.265 10.885 -1.142 1.00 10.00 O ATOM 378 CB HIS A 39 0.104 8.462 -2.852 1.00 10.00 C ATOM 379 CG HIS A 39 0.655 7.694 -1.663 1.00 10.00 C ATOM 380 ND1 HIS A 39 1.497 6.606 -1.828 1.00 10.00 N ATOM 381 CD2 HIS A 39 0.433 7.784 -0.307 1.00 10.00 C ATOM 382 CE1 HIS A 39 1.739 6.087 -0.610 1.00 10.00 C ATOM 383 NE2 HIS A 39 1.115 6.771 0.351 1.00 10.00 N ATOM 0 H HIS A 39 2.377 9.710 -2.905 1.00 10.00 H new ATOM 0 HA HIS A 39 -0.397 10.451 -3.471 1.00 10.00 H new ATOM 0 HB2 HIS A 39 -0.959 8.242 -2.952 1.00 10.00 H new ATOM 0 HB3 HIS A 39 0.591 8.104 -3.759 1.00 10.00 H new ATOM 0 HD2 HIS A 39 -0.181 8.532 0.173 1.00 10.00 H new ATOM 0 HE1 HIS A 39 2.362 5.223 -0.432 1.00 10.00 H new ATOM 0 HE2 HIS A 39 1.135 6.588 1.354 1.00 10.00 H new ATOM 392 N LEU A 40 0.882 10.664 -0.478 1.00 10.00 N ATOM 393 CA LEU A 40 0.641 11.180 0.880 1.00 10.00 C ATOM 394 C LEU A 40 0.154 12.634 0.849 1.00 10.00 C ATOM 395 O LEU A 40 -0.598 13.059 1.728 1.00 10.00 O ATOM 396 CB LEU A 40 1.931 11.089 1.703 1.00 10.00 C ATOM 397 CG LEU A 40 1.619 11.292 3.187 1.00 10.00 C ATOM 398 CD1 LEU A 40 0.963 10.025 3.747 1.00 10.00 C ATOM 399 CD2 LEU A 40 2.921 11.576 3.950 1.00 10.00 C ATOM 0 H LEU A 40 1.850 10.400 -0.661 1.00 10.00 H new ATOM 0 HA LEU A 40 -0.138 10.571 1.339 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.401 10.118 1.551 1.00 10.00 H new ATOM 0 HB3 LEU A 40 2.642 11.843 1.366 1.00 10.00 H new ATOM 0 HG LEU A 40 0.939 12.136 3.304 1.00 10.00 H new ATOM 0 HD11 LEU A 40 0.740 10.168 4.804 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.039 9.824 3.205 1.00 10.00 H new ATOM 0 HD13 LEU A 40 1.643 9.181 3.630 1.00 10.00 H new ATOM 0 HD21 LEU A 40 2.699 11.721 5.007 1.00 10.00 H new ATOM 0 HD22 LEU A 40 3.602 10.733 3.834 1.00 10.00 H new ATOM 0 HD23 LEU A 40 3.388 12.477 3.551 1.00 10.00 H new ATOM 411 N GLN A 41 0.595 13.385 -0.159 1.00 10.00 N ATOM 412 CA GLN A 41 0.212 14.794 -0.295 1.00 10.00 C ATOM 413 C GLN A 41 -1.288 14.939 -0.575 1.00 10.00 C ATOM 414 O GLN A 41 -1.936 15.848 -0.047 1.00 10.00 O ATOM 415 CB GLN A 41 1.023 15.433 -1.432 1.00 10.00 C ATOM 416 CG GLN A 41 2.332 16.006 -0.875 1.00 10.00 C ATOM 417 CD GLN A 41 3.187 16.551 -2.012 1.00 10.00 C ATOM 418 OE1 GLN A 41 3.957 15.807 -2.624 1.00 10.00 O ATOM 419 NE2 GLN A 41 3.102 17.812 -2.329 1.00 10.00 N ATOM 0 H GLN A 41 1.216 13.045 -0.893 1.00 10.00 H new ATOM 0 HA GLN A 41 0.426 15.303 0.645 1.00 10.00 H new ATOM 0 HB2 GLN A 41 1.238 14.690 -2.200 1.00 10.00 H new ATOM 0 HB3 GLN A 41 0.442 16.224 -1.907 1.00 10.00 H new ATOM 0 HG2 GLN A 41 2.116 16.799 -0.159 1.00 10.00 H new ATOM 0 HG3 GLN A 41 2.878 15.231 -0.337 1.00 10.00 H new ATOM 0 HE21 GLN A 41 2.464 18.424 -1.820 1.00 10.00 H new ATOM 0 HE22 GLN A 41 3.674 18.187 -3.086 1.00 10.00 H new ATOM 428 N ARG A 42 -1.830 14.043 -1.403 1.00 10.00 N ATOM 429 CA ARG A 42 -3.257 14.083 -1.744 1.00 10.00 C ATOM 430 C ARG A 42 -4.110 13.480 -0.629 1.00 10.00 C ATOM 431 O ARG A 42 -5.254 13.892 -0.425 1.00 10.00 O ATOM 432 CB ARG A 42 -3.502 13.314 -3.041 1.00 10.00 C ATOM 433 CG ARG A 42 -2.931 14.111 -4.214 1.00 10.00 C ATOM 434 CD ARG A 42 -2.851 13.212 -5.447 1.00 10.00 C ATOM 435 NE ARG A 42 -2.087 13.877 -6.508 1.00 10.00 N ATOM 436 CZ ARG A 42 -2.561 14.933 -7.196 1.00 10.00 C ATOM 437 NH1 ARG A 42 -3.761 15.422 -6.982 1.00 10.00 N ATOM 438 NH2 ARG A 42 -1.810 15.480 -8.112 1.00 10.00 N ATOM 0 H ARG A 42 -1.309 13.287 -1.847 1.00 10.00 H new ATOM 0 HA ARG A 42 -3.543 15.127 -1.872 1.00 10.00 H new ATOM 0 HB2 ARG A 42 -3.032 12.332 -2.990 1.00 10.00 H new ATOM 0 HB3 ARG A 42 -4.570 13.149 -3.184 1.00 10.00 H new ATOM 0 HG2 ARG A 42 -3.561 14.976 -4.421 1.00 10.00 H new ATOM 0 HG3 ARG A 42 -1.941 14.491 -3.962 1.00 10.00 H new ATOM 0 HD2 ARG A 42 -2.378 12.265 -5.186 1.00 10.00 H new ATOM 0 HD3 ARG A 42 -3.855 12.979 -5.802 1.00 10.00 H new ATOM 0 HE ARG A 42 -1.157 13.524 -6.734 1.00 10.00 H new ATOM 0 HH11 ARG A 42 -4.365 15.001 -6.276 1.00 10.00 H new ATOM 0 HH12 ARG A 42 -4.089 16.223 -7.521 1.00 10.00 H new ATOM 0 HH21 ARG A 42 -0.879 15.107 -8.298 1.00 10.00 H new ATOM 0 HH22 ARG A 42 -2.154 16.281 -8.642 1.00 10.00 H new ATOM 452 N GLN A 43 -3.545 12.507 0.089 1.00 10.00 N ATOM 453 CA GLN A 43 -4.254 11.857 1.185 1.00 10.00 C ATOM 454 C GLN A 43 -4.289 12.779 2.407 1.00 10.00 C ATOM 455 O GLN A 43 -5.287 12.832 3.126 1.00 10.00 O ATOM 456 CB GLN A 43 -3.554 10.544 1.543 1.00 10.00 C ATOM 457 CG GLN A 43 -4.542 9.589 2.219 1.00 10.00 C ATOM 458 CD GLN A 43 -5.302 8.776 1.172 1.00 10.00 C ATOM 459 OE1 GLN A 43 -4.781 8.497 0.093 1.00 10.00 O ATOM 460 NE2 GLN A 43 -6.516 8.376 1.435 1.00 10.00 N ATOM 0 H GLN A 43 -2.601 12.155 -0.071 1.00 10.00 H new ATOM 0 HA GLN A 43 -5.277 11.646 0.873 1.00 10.00 H new ATOM 0 HB2 GLN A 43 -3.148 10.082 0.643 1.00 10.00 H new ATOM 0 HB3 GLN A 43 -2.713 10.741 2.208 1.00 10.00 H new ATOM 0 HG2 GLN A 43 -4.007 8.918 2.891 1.00 10.00 H new ATOM 0 HG3 GLN A 43 -5.245 10.156 2.829 1.00 10.00 H new ATOM 0 HE21 GLN A 43 -6.947 8.608 2.330 1.00 10.00 H new ATOM 0 HE22 GLN A 43 -7.034 7.831 0.746 1.00 10.00 H new ATOM 469 N GLN A 44 -3.188 13.500 2.629 1.00 10.00 N ATOM 470 CA GLN A 44 -3.085 14.419 3.763 1.00 10.00 C ATOM 471 C GLN A 44 -3.924 15.675 3.527 1.00 10.00 C ATOM 472 O GLN A 44 -4.576 16.174 4.449 1.00 10.00 O ATOM 473 CB GLN A 44 -1.626 14.820 3.982 1.00 10.00 C ATOM 474 CG GLN A 44 -1.453 15.340 5.409 1.00 10.00 C ATOM 475 CD GLN A 44 0.027 15.482 5.739 1.00 10.00 C ATOM 476 OE1 GLN A 44 0.527 14.825 6.654 1.00 10.00 O ATOM 477 NE2 GLN A 44 0.764 16.305 5.046 1.00 10.00 N ATOM 0 H GLN A 44 -2.357 13.465 2.039 1.00 10.00 H new ATOM 0 HA GLN A 44 -3.462 13.906 4.648 1.00 10.00 H new ATOM 0 HB2 GLN A 44 -0.972 13.964 3.813 1.00 10.00 H new ATOM 0 HB3 GLN A 44 -1.337 15.588 3.265 1.00 10.00 H new ATOM 0 HG2 GLN A 44 -1.951 16.303 5.516 1.00 10.00 H new ATOM 0 HG3 GLN A 44 -1.927 14.656 6.113 1.00 10.00 H new ATOM 0 HE21 GLN A 44 0.348 16.848 4.289 1.00 10.00 H new ATOM 0 HE22 GLN A 44 1.756 16.406 5.261 1.00 10.00 H new ATOM 486 N ASN A 45 -3.898 16.182 2.292 1.00 10.00 N ATOM 487 CA ASN A 45 -4.657 17.387 1.944 1.00 10.00 C ATOM 488 C ASN A 45 -6.161 17.125 2.024 1.00 10.00 C ATOM 489 O ASN A 45 -6.918 17.959 2.523 1.00 10.00 O ATOM 490 CB ASN A 45 -4.290 17.848 0.527 1.00 10.00 C ATOM 491 CG ASN A 45 -3.003 18.670 0.557 1.00 10.00 C ATOM 492 OD1 ASN A 45 -2.757 19.407 1.512 1.00 10.00 O ATOM 493 ND2 ASN A 45 -2.163 18.590 -0.441 1.00 10.00 N ATOM 0 H ASN A 45 -3.364 15.781 1.521 1.00 10.00 H new ATOM 0 HA ASN A 45 -4.401 18.169 2.659 1.00 10.00 H new ATOM 0 HB2 ASN A 45 -4.162 16.983 -0.123 1.00 10.00 H new ATOM 0 HB3 ASN A 45 -5.101 18.444 0.109 1.00 10.00 H new ATOM 0 HD21 ASN A 45 -1.303 19.138 -0.429 1.00 10.00 H new ATOM 0 HD22 ASN A 45 -2.367 17.979 -1.232 1.00 10.00 H new ATOM 500 N SER A 46 -6.583 15.959 1.524 1.00 10.00 N ATOM 501 CA SER A 46 -7.998 15.593 1.536 1.00 10.00 C ATOM 502 C SER A 46 -8.446 15.198 2.942 1.00 10.00 C ATOM 503 O SER A 46 -9.301 15.862 3.534 1.00 10.00 O ATOM 504 CB SER A 46 -8.245 14.429 0.576 1.00 10.00 C ATOM 505 OG SER A 46 -9.611 14.426 0.182 1.00 10.00 O ATOM 0 H SER A 46 -5.968 15.259 1.109 1.00 10.00 H new ATOM 0 HA SER A 46 -8.576 16.460 1.216 1.00 10.00 H new ATOM 0 HB2 SER A 46 -7.602 14.522 -0.299 1.00 10.00 H new ATOM 0 HB3 SER A 46 -7.992 13.485 1.058 1.00 10.00 H new ATOM 0 HG SER A 46 -9.772 13.682 -0.435 1.00 10.00 H new TER 511 SER A 46 ATOM 512 N MET B 1 22.565 1.724 9.196 1.00 10.00 N ATOM 513 CA MET B 1 22.780 0.286 8.939 1.00 10.00 C ATOM 514 C MET B 1 24.053 0.085 8.093 1.00 10.00 C ATOM 515 O MET B 1 24.405 0.908 7.255 1.00 10.00 O ATOM 516 CB MET B 1 21.559 -0.299 8.211 1.00 10.00 C ATOM 517 CG MET B 1 21.371 0.231 6.782 1.00 10.00 C ATOM 518 SD MET B 1 19.927 -0.458 5.903 1.00 10.00 S ATOM 519 CE MET B 1 20.320 0.059 4.246 1.00 10.00 C ATOM 0 H1 MET B 1 21.696 1.851 9.752 1.00 10.00 H new ATOM 0 H2 MET B 1 23.374 2.107 9.726 1.00 10.00 H new ATOM 0 H3 MET B 1 22.474 2.229 8.291 1.00 10.00 H new ATOM 0 HA MET B 1 22.908 -0.233 9.889 1.00 10.00 H new ATOM 0 HB2 MET B 1 21.656 -1.384 8.175 1.00 10.00 H new ATOM 0 HB3 MET B 1 20.663 -0.078 8.791 1.00 10.00 H new ATOM 0 HG2 MET B 1 21.273 1.316 6.820 1.00 10.00 H new ATOM 0 HG3 MET B 1 22.270 0.012 6.206 1.00 10.00 H new ATOM 0 HE1 MET B 1 19.505 -0.216 3.576 1.00 10.00 H new ATOM 0 HE2 MET B 1 20.458 1.140 4.225 1.00 10.00 H new ATOM 0 HE3 MET B 1 21.238 -0.430 3.920 1.00 10.00 H new ATOM 531 N GLN B 2 24.730 -1.037 8.345 1.00 10.00 N ATOM 532 CA GLN B 2 25.895 -1.369 7.524 1.00 10.00 C ATOM 533 C GLN B 2 25.485 -2.334 6.409 1.00 10.00 C ATOM 534 O GLN B 2 24.589 -3.156 6.562 1.00 10.00 O ATOM 535 CB GLN B 2 27.008 -1.961 8.385 1.00 10.00 C ATOM 536 CG GLN B 2 26.807 -3.442 8.741 1.00 10.00 C ATOM 537 CD GLN B 2 27.964 -4.034 9.544 1.00 10.00 C ATOM 538 OE1 GLN B 2 27.834 -5.050 10.202 1.00 10.00 O ATOM 539 NE2 GLN B 2 29.126 -3.425 9.460 1.00 10.00 N ATOM 0 H GLN B 2 24.504 -1.707 9.080 1.00 10.00 H new ATOM 0 HA GLN B 2 26.281 -0.458 7.067 1.00 10.00 H new ATOM 0 HB2 GLN B 2 27.957 -1.850 7.860 1.00 10.00 H new ATOM 0 HB3 GLN B 2 27.085 -1.384 9.307 1.00 10.00 H new ATOM 0 HG2 GLN B 2 25.885 -3.549 9.313 1.00 10.00 H new ATOM 0 HG3 GLN B 2 26.681 -4.015 7.823 1.00 10.00 H new ATOM 0 HE21 GLN B 2 29.217 -2.575 8.904 1.00 10.00 H new ATOM 0 HE22 GLN B 2 29.936 -3.803 9.951 1.00 10.00 H new ATOM 548 N ILE B 3 26.162 -2.149 5.278 1.00 10.00 N ATOM 549 CA ILE B 3 26.044 -3.082 4.153 1.00 10.00 C ATOM 550 C ILE B 3 27.471 -3.328 3.631 1.00 10.00 C ATOM 551 O ILE B 3 28.365 -2.512 3.830 1.00 10.00 O ATOM 552 CB ILE B 3 25.061 -2.618 3.047 1.00 10.00 C ATOM 553 CG1 ILE B 3 25.633 -1.628 2.017 1.00 10.00 C ATOM 554 CG2 ILE B 3 23.707 -2.153 3.615 1.00 10.00 C ATOM 555 CD1 ILE B 3 26.053 -0.261 2.554 1.00 10.00 C ATOM 0 H ILE B 3 26.796 -1.367 5.114 1.00 10.00 H new ATOM 0 HA ILE B 3 25.595 -4.014 4.496 1.00 10.00 H new ATOM 0 HB ILE B 3 24.884 -3.524 2.468 1.00 10.00 H new ATOM 0 HG12 ILE B 3 26.499 -2.090 1.542 1.00 10.00 H new ATOM 0 HG13 ILE B 3 24.886 -1.475 1.238 1.00 10.00 H new ATOM 0 HG21 ILE B 3 23.058 -1.839 2.797 1.00 10.00 H new ATOM 0 HG22 ILE B 3 23.238 -2.975 4.156 1.00 10.00 H new ATOM 0 HG23 ILE B 3 23.866 -1.315 4.294 1.00 10.00 H new ATOM 0 HD11 ILE B 3 26.440 0.348 1.737 1.00 10.00 H new ATOM 0 HD12 ILE B 3 25.191 0.235 3.000 1.00 10.00 H new ATOM 0 HD13 ILE B 3 26.829 -0.389 3.309 1.00 10.00 H new ATOM 567 N PHE B 4 27.612 -4.436 2.913 1.00 10.00 N ATOM 568 CA PHE B 4 28.931 -4.844 2.406 1.00 10.00 C ATOM 569 C PHE B 4 28.958 -4.739 0.880 1.00 10.00 C ATOM 570 O PHE B 4 27.957 -4.959 0.213 1.00 10.00 O ATOM 571 CB PHE B 4 29.217 -6.280 2.850 1.00 10.00 C ATOM 572 CG PHE B 4 28.975 -6.457 4.353 1.00 10.00 C ATOM 573 CD1 PHE B 4 29.894 -5.967 5.274 1.00 10.00 C ATOM 574 CD2 PHE B 4 27.799 -7.053 4.786 1.00 10.00 C ATOM 575 CE1 PHE B 4 29.633 -6.086 6.631 1.00 10.00 C ATOM 576 CE2 PHE B 4 27.543 -7.177 6.144 1.00 10.00 C ATOM 577 CZ PHE B 4 28.461 -6.695 7.069 1.00 10.00 C ATOM 0 H PHE B 4 26.847 -5.064 2.668 1.00 10.00 H new ATOM 0 HA PHE B 4 29.700 -4.185 2.809 1.00 10.00 H new ATOM 0 HB2 PHE B 4 28.581 -6.968 2.294 1.00 10.00 H new ATOM 0 HB3 PHE B 4 30.249 -6.537 2.613 1.00 10.00 H new ATOM 0 HD1 PHE B 4 30.805 -5.497 4.935 1.00 10.00 H new ATOM 0 HD2 PHE B 4 27.083 -7.420 4.066 1.00 10.00 H new ATOM 0 HE1 PHE B 4 30.342 -5.704 7.351 1.00 10.00 H new ATOM 0 HE2 PHE B 4 26.631 -7.648 6.482 1.00 10.00 H new ATOM 0 HZ PHE B 4 28.265 -6.793 8.127 1.00 10.00 H new ATOM 587 N VAL B 5 30.084 -4.251 0.377 1.00 10.00 N ATOM 588 CA VAL B 5 30.326 -4.119 -1.070 1.00 10.00 C ATOM 589 C VAL B 5 31.582 -4.930 -1.401 1.00 10.00 C ATOM 590 O VAL B 5 32.694 -4.554 -1.066 1.00 10.00 O ATOM 591 CB VAL B 5 30.486 -2.644 -1.494 1.00 10.00 C ATOM 592 CG1 VAL B 5 30.759 -2.514 -2.996 1.00 10.00 C ATOM 593 CG2 VAL B 5 29.234 -1.828 -1.160 1.00 10.00 C ATOM 0 H VAL B 5 30.862 -3.932 0.954 1.00 10.00 H new ATOM 0 HA VAL B 5 29.468 -4.499 -1.625 1.00 10.00 H new ATOM 0 HB VAL B 5 31.338 -2.256 -0.935 1.00 10.00 H new ATOM 0 HG11 VAL B 5 30.866 -1.461 -3.257 1.00 10.00 H new ATOM 0 HG12 VAL B 5 31.678 -3.045 -3.246 1.00 10.00 H new ATOM 0 HG13 VAL B 5 29.928 -2.944 -3.555 1.00 10.00 H new ATOM 0 HG21 VAL B 5 29.380 -0.794 -1.472 1.00 10.00 H new ATOM 0 HG22 VAL B 5 28.376 -2.247 -1.685 1.00 10.00 H new ATOM 0 HG23 VAL B 5 29.054 -1.861 -0.085 1.00 10.00 H new ATOM 603 N LYS B 6 31.325 -6.119 -1.945 1.00 10.00 N ATOM 604 CA LYS B 6 32.400 -7.013 -2.378 1.00 10.00 C ATOM 605 C LYS B 6 32.972 -6.544 -3.717 1.00 10.00 C ATOM 606 O LYS B 6 32.260 -6.248 -4.668 1.00 10.00 O ATOM 607 CB LYS B 6 31.828 -8.407 -2.579 1.00 10.00 C ATOM 608 CG LYS B 6 31.369 -9.075 -1.278 1.00 10.00 C ATOM 609 CD LYS B 6 30.720 -10.426 -1.590 1.00 10.00 C ATOM 610 CE LYS B 6 31.692 -11.367 -2.311 1.00 10.00 C ATOM 611 NZ LYS B 6 30.994 -12.530 -2.869 1.00 10.00 N ATOM 0 H LYS B 6 30.385 -6.485 -2.096 1.00 10.00 H new ATOM 0 HA LYS B 6 33.184 -7.013 -1.621 1.00 10.00 H new ATOM 0 HB2 LYS B 6 30.983 -8.349 -3.265 1.00 10.00 H new ATOM 0 HB3 LYS B 6 32.582 -9.035 -3.054 1.00 10.00 H new ATOM 0 HG2 LYS B 6 32.219 -9.215 -0.611 1.00 10.00 H new ATOM 0 HG3 LYS B 6 30.659 -8.431 -0.759 1.00 10.00 H new ATOM 0 HD2 LYS B 6 30.383 -10.891 -0.663 1.00 10.00 H new ATOM 0 HD3 LYS B 6 29.836 -10.271 -2.209 1.00 10.00 H new ATOM 0 HE2 LYS B 6 32.199 -10.827 -3.110 1.00 10.00 H new ATOM 0 HE3 LYS B 6 32.461 -11.702 -1.615 1.00 10.00 H new ATOM 0 HZ1 LYS B 6 31.678 -13.148 -3.350 1.00 10.00 H new ATOM 0 HZ2 LYS B 6 30.531 -13.058 -2.102 1.00 10.00 H new ATOM 0 HZ3 LYS B 6 30.277 -12.210 -3.551 1.00 10.00 H new ATOM 625 N THR B 7 34.307 -6.526 -3.752 1.00 10.00 N ATOM 626 CA THR B 7 35.025 -6.254 -5.004 1.00 10.00 C ATOM 627 C THR B 7 35.559 -7.595 -5.525 1.00 10.00 C ATOM 628 O THR B 7 35.653 -8.585 -4.802 1.00 10.00 O ATOM 629 CB THR B 7 36.176 -5.252 -4.801 1.00 10.00 C ATOM 630 OG1 THR B 7 37.193 -5.879 -4.033 1.00 10.00 O ATOM 631 CG2 THR B 7 35.727 -3.965 -4.101 1.00 10.00 C ATOM 0 H THR B 7 34.906 -6.693 -2.944 1.00 10.00 H new ATOM 0 HA THR B 7 34.347 -5.798 -5.725 1.00 10.00 H new ATOM 0 HB THR B 7 36.545 -4.965 -5.786 1.00 10.00 H new ATOM 0 HG1 THR B 7 37.994 -5.997 -4.585 1.00 10.00 H new ATOM 0 HG21 THR B 7 36.581 -3.297 -3.985 1.00 10.00 H new ATOM 0 HG22 THR B 7 34.960 -3.474 -4.700 1.00 10.00 H new ATOM 0 HG23 THR B 7 35.320 -4.208 -3.119 1.00 10.00 H new ATOM 639 N LEU B 8 35.978 -7.584 -6.786 1.00 10.00 N ATOM 640 CA LEU B 8 36.397 -8.817 -7.476 1.00 10.00 C ATOM 641 C LEU B 8 37.803 -9.307 -7.102 1.00 10.00 C ATOM 642 O LEU B 8 38.166 -10.448 -7.371 1.00 10.00 O ATOM 643 CB LEU B 8 36.195 -8.653 -8.984 1.00 10.00 C ATOM 644 CG LEU B 8 34.753 -8.227 -9.312 1.00 10.00 C ATOM 645 CD1 LEU B 8 34.579 -8.094 -10.823 1.00 10.00 C ATOM 646 CD2 LEU B 8 33.690 -9.170 -8.728 1.00 10.00 C ATOM 0 H LEU B 8 36.039 -6.741 -7.357 1.00 10.00 H new ATOM 0 HA LEU B 8 35.753 -9.622 -7.123 1.00 10.00 H new ATOM 0 HB2 LEU B 8 36.893 -7.908 -9.368 1.00 10.00 H new ATOM 0 HB3 LEU B 8 36.422 -9.592 -9.488 1.00 10.00 H new ATOM 0 HG LEU B 8 34.595 -7.260 -8.835 1.00 10.00 H new ATOM 0 HD11 LEU B 8 33.556 -7.792 -11.046 1.00 10.00 H new ATOM 0 HD12 LEU B 8 35.270 -7.342 -11.204 1.00 10.00 H new ATOM 0 HD13 LEU B 8 34.787 -9.052 -11.299 1.00 10.00 H new ATOM 0 HD21 LEU B 8 32.697 -8.810 -8.997 1.00 10.00 H new ATOM 0 HD22 LEU B 8 33.834 -10.173 -9.129 1.00 10.00 H new ATOM 0 HD23 LEU B 8 33.784 -9.196 -7.642 1.00 10.00 H new ATOM 658 N THR B 9 38.569 -8.407 -6.494 1.00 10.00 N ATOM 659 CA THR B 9 39.840 -8.763 -5.823 1.00 10.00 C ATOM 660 C THR B 9 39.584 -9.741 -4.668 1.00 10.00 C ATOM 661 O THR B 9 40.400 -10.631 -4.420 1.00 10.00 O ATOM 662 CB THR B 9 40.565 -7.521 -5.289 1.00 10.00 C ATOM 663 OG1 THR B 9 39.678 -6.719 -4.501 1.00 10.00 O ATOM 664 CG2 THR B 9 41.172 -6.694 -6.424 1.00 10.00 C ATOM 0 H THR B 9 38.339 -7.414 -6.446 1.00 10.00 H new ATOM 0 HA THR B 9 40.477 -9.239 -6.569 1.00 10.00 H new ATOM 0 HB THR B 9 41.382 -7.863 -4.654 1.00 10.00 H new ATOM 0 HG1 THR B 9 40.158 -5.932 -4.168 1.00 10.00 H new ATOM 0 HG21 THR B 9 41.678 -5.822 -6.009 1.00 10.00 H new ATOM 0 HG22 THR B 9 41.890 -7.302 -6.974 1.00 10.00 H new ATOM 0 HG23 THR B 9 40.381 -6.367 -7.099 1.00 10.00 H new ATOM 672 N GLY B 10 38.428 -9.572 -4.016 1.00 10.00 N ATOM 673 CA GLY B 10 38.016 -10.407 -2.876 1.00 10.00 C ATOM 674 C GLY B 10 37.756 -9.562 -1.622 1.00 10.00 C ATOM 675 O GLY B 10 37.026 -9.991 -0.727 1.00 10.00 O ATOM 0 H GLY B 10 37.749 -8.852 -4.262 1.00 10.00 H new ATOM 0 HA2 GLY B 10 37.113 -10.960 -3.137 1.00 10.00 H new ATOM 0 HA3 GLY B 10 38.791 -11.144 -2.665 1.00 10.00 H new ATOM 679 N LYS B 11 38.386 -8.392 -1.562 1.00 10.00 N ATOM 680 CA LYS B 11 38.197 -7.443 -0.445 1.00 10.00 C ATOM 681 C LYS B 11 36.714 -7.027 -0.367 1.00 10.00 C ATOM 682 O LYS B 11 36.010 -6.941 -1.371 1.00 10.00 O ATOM 683 CB LYS B 11 39.079 -6.209 -0.648 1.00 10.00 C ATOM 684 CG LYS B 11 39.258 -5.443 0.672 1.00 10.00 C ATOM 685 CD LYS B 11 39.056 -3.933 0.517 1.00 10.00 C ATOM 686 CE LYS B 11 40.151 -3.234 -0.296 1.00 10.00 C ATOM 687 NZ LYS B 11 41.423 -3.167 0.439 1.00 10.00 N ATOM 0 H LYS B 11 39.039 -8.068 -2.275 1.00 10.00 H new ATOM 0 HA LYS B 11 38.484 -7.927 0.489 1.00 10.00 H new ATOM 0 HB2 LYS B 11 40.053 -6.512 -1.033 1.00 10.00 H new ATOM 0 HB3 LYS B 11 38.630 -5.555 -1.395 1.00 10.00 H new ATOM 0 HG2 LYS B 11 38.550 -5.826 1.407 1.00 10.00 H new ATOM 0 HG3 LYS B 11 40.257 -5.632 1.063 1.00 10.00 H new ATOM 0 HD2 LYS B 11 38.093 -3.754 0.039 1.00 10.00 H new ATOM 0 HD3 LYS B 11 39.009 -3.480 1.507 1.00 10.00 H new ATOM 0 HE2 LYS B 11 40.302 -3.767 -1.235 1.00 10.00 H new ATOM 0 HE3 LYS B 11 39.826 -2.225 -0.551 1.00 10.00 H new ATOM 0 HZ1 LYS B 11 42.127 -2.657 -0.132 1.00 10.00 H new ATOM 0 HZ2 LYS B 11 41.278 -2.666 1.339 1.00 10.00 H new ATOM 0 HZ3 LYS B 11 41.764 -4.131 0.630 1.00 10.00 H new ATOM 701 N THR B 12 36.290 -6.756 0.864 1.00 10.00 N ATOM 702 CA THR B 12 34.912 -6.315 1.150 1.00 10.00 C ATOM 703 C THR B 12 34.967 -4.951 1.842 1.00 10.00 C ATOM 704 O THR B 12 35.597 -4.782 2.874 1.00 10.00 O ATOM 705 CB THR B 12 34.202 -7.347 2.043 1.00 10.00 C ATOM 706 OG1 THR B 12 34.126 -8.589 1.342 1.00 10.00 O ATOM 707 CG2 THR B 12 32.788 -6.919 2.457 1.00 10.00 C ATOM 0 H THR B 12 36.881 -6.833 1.692 1.00 10.00 H new ATOM 0 HA THR B 12 34.349 -6.228 0.221 1.00 10.00 H new ATOM 0 HB THR B 12 34.788 -7.438 2.958 1.00 10.00 H new ATOM 0 HG1 THR B 12 33.676 -9.255 1.903 1.00 10.00 H new ATOM 0 HG21 THR B 12 32.343 -7.691 3.085 1.00 10.00 H new ATOM 0 HG22 THR B 12 32.839 -5.983 3.014 1.00 10.00 H new ATOM 0 HG23 THR B 12 32.175 -6.778 1.567 1.00 10.00 H new ATOM 715 N ILE B 13 34.177 -4.036 1.281 1.00 10.00 N ATOM 716 CA ILE B 13 34.019 -2.685 1.847 1.00 10.00 C ATOM 717 C ILE B 13 32.784 -2.728 2.757 1.00 10.00 C ATOM 718 O ILE B 13 31.728 -3.201 2.357 1.00 10.00 O ATOM 719 CB ILE B 13 33.770 -1.627 0.746 1.00 10.00 C ATOM 720 CG1 ILE B 13 34.480 -1.899 -0.594 1.00 10.00 C ATOM 721 CG2 ILE B 13 34.110 -0.223 1.272 1.00 10.00 C ATOM 722 CD1 ILE B 13 35.995 -2.117 -0.522 1.00 10.00 C ATOM 0 H ILE B 13 33.633 -4.200 0.434 1.00 10.00 H new ATOM 0 HA ILE B 13 34.929 -2.408 2.380 1.00 10.00 H new ATOM 0 HB ILE B 13 32.707 -1.694 0.514 1.00 10.00 H new ATOM 0 HG12 ILE B 13 34.028 -2.780 -1.049 1.00 10.00 H new ATOM 0 HG13 ILE B 13 34.285 -1.060 -1.262 1.00 10.00 H new ATOM 0 HG21 ILE B 13 33.931 0.513 0.488 1.00 10.00 H new ATOM 0 HG22 ILE B 13 33.482 0.005 2.134 1.00 10.00 H new ATOM 0 HG23 ILE B 13 35.159 -0.189 1.568 1.00 10.00 H new ATOM 0 HD11 ILE B 13 36.384 -2.299 -1.524 1.00 10.00 H new ATOM 0 HD12 ILE B 13 36.471 -1.230 -0.103 1.00 10.00 H new ATOM 0 HD13 ILE B 13 36.209 -2.977 0.112 1.00 10.00 H new ATOM 734 N THR B 14 32.953 -2.206 3.970 1.00 10.00 N ATOM 735 CA THR B 14 31.811 -2.013 4.882 1.00 10.00 C ATOM 736 C THR B 14 31.447 -0.527 4.856 1.00 10.00 C ATOM 737 O THR B 14 32.300 0.339 5.037 1.00 10.00 O ATOM 738 CB THR B 14 32.162 -2.456 6.310 1.00 10.00 C ATOM 739 OG1 THR B 14 32.516 -3.841 6.303 1.00 10.00 O ATOM 740 CG2 THR B 14 30.999 -2.240 7.279 1.00 10.00 C ATOM 0 H THR B 14 33.854 -1.910 4.347 1.00 10.00 H new ATOM 0 HA THR B 14 30.967 -2.622 4.558 1.00 10.00 H new ATOM 0 HB THR B 14 33.000 -1.847 6.650 1.00 10.00 H new ATOM 0 HG1 THR B 14 31.704 -4.386 6.234 1.00 10.00 H new ATOM 0 HG21 THR B 14 31.291 -2.567 8.277 1.00 10.00 H new ATOM 0 HG22 THR B 14 30.739 -1.182 7.305 1.00 10.00 H new ATOM 0 HG23 THR B 14 30.136 -2.817 6.946 1.00 10.00 H new ATOM 748 N LEU B 15 30.153 -0.287 4.671 1.00 10.00 N ATOM 749 CA LEU B 15 29.615 1.082 4.659 1.00 10.00 C ATOM 750 C LEU B 15 28.492 1.250 5.687 1.00 10.00 C ATOM 751 O LEU B 15 27.710 0.337 5.917 1.00 10.00 O ATOM 752 CB LEU B 15 29.077 1.419 3.266 1.00 10.00 C ATOM 753 CG LEU B 15 30.138 1.348 2.161 1.00 10.00 C ATOM 754 CD1 LEU B 15 29.456 1.488 0.801 1.00 10.00 C ATOM 755 CD2 LEU B 15 31.189 2.449 2.328 1.00 10.00 C ATOM 0 H LEU B 15 29.454 -1.016 4.527 1.00 10.00 H new ATOM 0 HA LEU B 15 30.427 1.761 4.920 1.00 10.00 H new ATOM 0 HB2 LEU B 15 28.266 0.732 3.023 1.00 10.00 H new ATOM 0 HB3 LEU B 15 28.650 2.422 3.284 1.00 10.00 H new ATOM 0 HG LEU B 15 30.645 0.386 2.229 1.00 10.00 H new ATOM 0 HD11 LEU B 15 30.206 1.438 0.011 1.00 10.00 H new ATOM 0 HD12 LEU B 15 28.737 0.680 0.670 1.00 10.00 H new ATOM 0 HD13 LEU B 15 28.939 2.446 0.750 1.00 10.00 H new ATOM 0 HD21 LEU B 15 31.927 2.372 1.529 1.00 10.00 H new ATOM 0 HD22 LEU B 15 30.705 3.424 2.281 1.00 10.00 H new ATOM 0 HD23 LEU B 15 31.685 2.336 3.292 1.00 10.00 H new ATOM 767 N GLU B 16 28.473 2.444 6.280 1.00 10.00 N ATOM 768 CA GLU B 16 27.379 2.897 7.156 1.00 10.00 C ATOM 769 C GLU B 16 26.468 3.813 6.334 1.00 10.00 C ATOM 770 O GLU B 16 26.858 4.893 5.914 1.00 10.00 O ATOM 771 CB GLU B 16 27.960 3.660 8.355 1.00 10.00 C ATOM 772 CG GLU B 16 26.877 4.212 9.291 1.00 10.00 C ATOM 773 CD GLU B 16 25.978 3.121 9.884 1.00 10.00 C ATOM 774 OE1 GLU B 16 26.511 2.053 10.255 1.00 10.00 O ATOM 775 OE2 GLU B 16 24.761 3.390 9.963 1.00 10.00 O ATOM 0 H GLU B 16 29.218 3.132 6.169 1.00 10.00 H new ATOM 0 HA GLU B 16 26.811 2.047 7.534 1.00 10.00 H new ATOM 0 HB2 GLU B 16 28.617 2.997 8.918 1.00 10.00 H new ATOM 0 HB3 GLU B 16 28.574 4.484 7.992 1.00 10.00 H new ATOM 0 HG2 GLU B 16 27.353 4.762 10.103 1.00 10.00 H new ATOM 0 HG3 GLU B 16 26.260 4.924 8.742 1.00 10.00 H new ATOM 782 N VAL B 17 25.268 3.290 6.062 1.00 10.00 N ATOM 783 CA VAL B 17 24.304 3.968 5.186 1.00 10.00 C ATOM 784 C VAL B 17 22.902 4.038 5.820 1.00 10.00 C ATOM 785 O VAL B 17 22.620 3.476 6.868 1.00 10.00 O ATOM 786 CB VAL B 17 24.240 3.268 3.811 1.00 10.00 C ATOM 787 CG1 VAL B 17 25.591 3.273 3.091 1.00 10.00 C ATOM 788 CG2 VAL B 17 23.670 1.851 3.923 1.00 10.00 C ATOM 0 H VAL B 17 24.940 2.399 6.435 1.00 10.00 H new ATOM 0 HA VAL B 17 24.652 4.992 5.047 1.00 10.00 H new ATOM 0 HB VAL B 17 23.553 3.851 3.197 1.00 10.00 H new ATOM 0 HG11 VAL B 17 25.493 2.769 2.129 1.00 10.00 H new ATOM 0 HG12 VAL B 17 25.914 4.302 2.930 1.00 10.00 H new ATOM 0 HG13 VAL B 17 26.330 2.752 3.700 1.00 10.00 H new ATOM 0 HG21 VAL B 17 23.641 1.391 2.935 1.00 10.00 H new ATOM 0 HG22 VAL B 17 24.302 1.256 4.582 1.00 10.00 H new ATOM 0 HG23 VAL B 17 22.661 1.896 4.332 1.00 10.00 H new ATOM 798 N GLU B 18 22.027 4.706 5.084 1.00 10.00 N ATOM 799 CA GLU B 18 20.578 4.738 5.329 1.00 10.00 C ATOM 800 C GLU B 18 19.872 4.221 4.073 1.00 10.00 C ATOM 801 O GLU B 18 20.338 4.460 2.964 1.00 10.00 O ATOM 802 CB GLU B 18 20.146 6.180 5.622 1.00 10.00 C ATOM 803 CG GLU B 18 20.785 6.742 6.900 1.00 10.00 C ATOM 804 CD GLU B 18 20.498 5.920 8.167 1.00 10.00 C ATOM 805 OE1 GLU B 18 19.466 5.213 8.188 1.00 10.00 O ATOM 806 OE2 GLU B 18 21.321 6.032 9.101 1.00 10.00 O ATOM 0 H GLU B 18 22.305 5.260 4.274 1.00 10.00 H new ATOM 0 HA GLU B 18 20.317 4.114 6.184 1.00 10.00 H new ATOM 0 HB2 GLU B 18 20.415 6.814 4.777 1.00 10.00 H new ATOM 0 HB3 GLU B 18 19.061 6.218 5.716 1.00 10.00 H new ATOM 0 HG2 GLU B 18 21.864 6.801 6.757 1.00 10.00 H new ATOM 0 HG3 GLU B 18 20.427 7.760 7.053 1.00 10.00 H new ATOM 813 N SER B 19 18.675 3.650 4.261 1.00 10.00 N ATOM 814 CA SER B 19 17.840 3.188 3.127 1.00 10.00 C ATOM 815 C SER B 19 17.463 4.328 2.168 1.00 10.00 C ATOM 816 O SER B 19 17.321 4.127 0.963 1.00 10.00 O ATOM 817 CB SER B 19 16.544 2.542 3.619 1.00 10.00 C ATOM 818 OG SER B 19 16.847 1.491 4.535 1.00 10.00 O ATOM 0 H SER B 19 18.259 3.494 5.179 1.00 10.00 H new ATOM 0 HA SER B 19 18.451 2.460 2.593 1.00 10.00 H new ATOM 0 HB2 SER B 19 15.915 3.289 4.103 1.00 10.00 H new ATOM 0 HB3 SER B 19 15.979 2.149 2.774 1.00 10.00 H new ATOM 0 HG SER B 19 16.014 1.081 4.849 1.00 10.00 H new ATOM 824 N SER B 20 17.382 5.533 2.735 1.00 10.00 N ATOM 825 CA SER B 20 17.106 6.780 1.997 1.00 10.00 C ATOM 826 C SER B 20 18.260 7.279 1.113 1.00 10.00 C ATOM 827 O SER B 20 18.049 8.150 0.271 1.00 10.00 O ATOM 828 CB SER B 20 16.673 7.885 2.964 1.00 10.00 C ATOM 829 OG SER B 20 17.625 8.021 4.027 1.00 10.00 O ATOM 0 H SER B 20 17.508 5.679 3.737 1.00 10.00 H new ATOM 0 HA SER B 20 16.297 6.532 1.310 1.00 10.00 H new ATOM 0 HB2 SER B 20 16.579 8.830 2.428 1.00 10.00 H new ATOM 0 HB3 SER B 20 15.690 7.653 3.375 1.00 10.00 H new ATOM 0 HG SER B 20 17.336 8.732 4.636 1.00 10.00 H new ATOM 835 N ASP B 21 19.450 6.704 1.272 1.00 10.00 N ATOM 836 CA ASP B 21 20.613 7.092 0.448 1.00 10.00 C ATOM 837 C ASP B 21 20.390 6.750 -1.022 1.00 10.00 C ATOM 838 O ASP B 21 19.970 5.651 -1.368 1.00 10.00 O ATOM 839 CB ASP B 21 21.896 6.412 0.933 1.00 10.00 C ATOM 840 CG ASP B 21 22.362 6.940 2.293 1.00 10.00 C ATOM 841 OD1 ASP B 21 21.978 8.070 2.664 1.00 10.00 O ATOM 842 OD2 ASP B 21 23.180 6.230 2.907 1.00 10.00 O ATOM 0 H ASP B 21 19.643 5.972 1.956 1.00 10.00 H new ATOM 0 HA ASP B 21 20.724 8.171 0.551 1.00 10.00 H new ATOM 0 HB2 ASP B 21 21.730 5.337 1.002 1.00 10.00 H new ATOM 0 HB3 ASP B 21 22.685 6.566 0.197 1.00 10.00 H new ATOM 847 N THR B 22 20.665 7.759 -1.852 1.00 10.00 N ATOM 848 CA THR B 22 20.647 7.589 -3.314 1.00 10.00 C ATOM 849 C THR B 22 21.841 6.704 -3.705 1.00 10.00 C ATOM 850 O THR B 22 22.861 6.675 -3.031 1.00 10.00 O ATOM 851 CB THR B 22 20.733 8.937 -4.053 1.00 10.00 C ATOM 852 OG1 THR B 22 22.011 9.541 -3.825 1.00 10.00 O ATOM 853 CG2 THR B 22 19.595 9.882 -3.651 1.00 10.00 C ATOM 0 H THR B 22 20.903 8.701 -1.542 1.00 10.00 H new ATOM 0 HA THR B 22 19.704 7.126 -3.603 1.00 10.00 H new ATOM 0 HB THR B 22 20.621 8.744 -5.120 1.00 10.00 H new ATOM 0 HG1 THR B 22 22.058 10.397 -4.300 1.00 10.00 H new ATOM 0 HG21 THR B 22 19.693 10.821 -4.195 1.00 10.00 H new ATOM 0 HG22 THR B 22 18.637 9.421 -3.892 1.00 10.00 H new ATOM 0 HG23 THR B 22 19.645 10.076 -2.580 1.00 10.00 H new ATOM 861 N ILE B 23 21.697 6.010 -4.836 1.00 10.00 N ATOM 862 CA ILE B 23 22.790 5.172 -5.379 1.00 10.00 C ATOM 863 C ILE B 23 24.047 6.008 -5.662 1.00 10.00 C ATOM 864 O ILE B 23 25.156 5.619 -5.290 1.00 10.00 O ATOM 865 CB ILE B 23 22.308 4.426 -6.639 1.00 10.00 C ATOM 866 CG1 ILE B 23 21.125 3.499 -6.314 1.00 10.00 C ATOM 867 CG2 ILE B 23 23.426 3.673 -7.375 1.00 10.00 C ATOM 868 CD1 ILE B 23 21.383 2.454 -5.220 1.00 10.00 C ATOM 0 H ILE B 23 20.845 6.005 -5.396 1.00 10.00 H new ATOM 0 HA ILE B 23 23.065 4.431 -4.628 1.00 10.00 H new ATOM 0 HB ILE B 23 21.966 5.195 -7.332 1.00 10.00 H new ATOM 0 HG12 ILE B 23 20.277 4.114 -6.012 1.00 10.00 H new ATOM 0 HG13 ILE B 23 20.832 2.979 -7.226 1.00 10.00 H new ATOM 0 HG21 ILE B 23 23.012 3.172 -8.250 1.00 10.00 H new ATOM 0 HG22 ILE B 23 24.194 4.379 -7.690 1.00 10.00 H new ATOM 0 HG23 ILE B 23 23.866 2.932 -6.708 1.00 10.00 H new ATOM 0 HD11 ILE B 23 20.485 1.854 -5.070 1.00 10.00 H new ATOM 0 HD12 ILE B 23 22.206 1.806 -5.522 1.00 10.00 H new ATOM 0 HD13 ILE B 23 21.642 2.958 -4.289 1.00 10.00 H new ATOM 880 N ASP B 24 23.816 7.208 -6.184 1.00 10.00 N ATOM 881 CA ASP B 24 24.893 8.184 -6.434 1.00 10.00 C ATOM 882 C ASP B 24 25.654 8.523 -5.140 1.00 10.00 C ATOM 883 O ASP B 24 26.882 8.577 -5.131 1.00 10.00 O ATOM 884 CB ASP B 24 24.294 9.451 -7.054 1.00 10.00 C ATOM 885 CG ASP B 24 25.371 10.505 -7.331 1.00 10.00 C ATOM 886 OD1 ASP B 24 26.262 10.201 -8.149 1.00 10.00 O ATOM 887 OD2 ASP B 24 25.271 11.570 -6.689 1.00 10.00 O ATOM 0 H ASP B 24 22.888 7.538 -6.447 1.00 10.00 H new ATOM 0 HA ASP B 24 25.610 7.743 -7.127 1.00 10.00 H new ATOM 0 HB2 ASP B 24 23.785 9.197 -7.984 1.00 10.00 H new ATOM 0 HB3 ASP B 24 23.542 9.865 -6.382 1.00 10.00 H new ATOM 892 N ASN B 25 24.895 8.669 -4.055 1.00 10.00 N ATOM 893 CA ASN B 25 25.442 8.939 -2.715 1.00 10.00 C ATOM 894 C ASN B 25 26.307 7.774 -2.200 1.00 10.00 C ATOM 895 O ASN B 25 27.375 7.996 -1.637 1.00 10.00 O ATOM 896 CB ASN B 25 24.278 9.209 -1.761 1.00 10.00 C ATOM 897 CG ASN B 25 24.729 9.424 -0.324 1.00 10.00 C ATOM 898 OD1 ASN B 25 25.579 10.243 -0.002 1.00 10.00 O ATOM 899 ND2 ASN B 25 24.156 8.645 0.552 1.00 10.00 N ATOM 0 H ASN B 25 23.877 8.604 -4.075 1.00 10.00 H new ATOM 0 HA ASN B 25 26.094 9.811 -2.770 1.00 10.00 H new ATOM 0 HB2 ASN B 25 23.733 10.089 -2.101 1.00 10.00 H new ATOM 0 HB3 ASN B 25 23.583 8.370 -1.797 1.00 10.00 H new ATOM 0 HD21 ASN B 25 24.413 8.709 1.537 1.00 10.00 H new ATOM 0 HD22 ASN B 25 23.451 7.972 0.252 1.00 10.00 H new ATOM 906 N VAL B 26 25.865 6.547 -2.475 1.00 10.00 N ATOM 907 CA VAL B 26 26.622 5.322 -2.135 1.00 10.00 C ATOM 908 C VAL B 26 27.955 5.282 -2.897 1.00 10.00 C ATOM 909 O VAL B 26 29.008 5.065 -2.304 1.00 10.00 O ATOM 910 CB VAL B 26 25.781 4.062 -2.420 1.00 10.00 C ATOM 911 CG1 VAL B 26 26.578 2.756 -2.271 1.00 10.00 C ATOM 912 CG2 VAL B 26 24.592 3.997 -1.462 1.00 10.00 C ATOM 0 H VAL B 26 24.975 6.364 -2.939 1.00 10.00 H new ATOM 0 HA VAL B 26 26.844 5.340 -1.068 1.00 10.00 H new ATOM 0 HB VAL B 26 25.455 4.147 -3.457 1.00 10.00 H new ATOM 0 HG11 VAL B 26 25.929 1.907 -2.485 1.00 10.00 H new ATOM 0 HG12 VAL B 26 27.414 2.758 -2.970 1.00 10.00 H new ATOM 0 HG13 VAL B 26 26.957 2.675 -1.252 1.00 10.00 H new ATOM 0 HG21 VAL B 26 24.004 3.103 -1.672 1.00 10.00 H new ATOM 0 HG22 VAL B 26 24.954 3.960 -0.435 1.00 10.00 H new ATOM 0 HG23 VAL B 26 23.968 4.881 -1.596 1.00 10.00 H new ATOM 922 N LYS B 27 27.889 5.509 -4.207 1.00 10.00 N ATOM 923 CA LYS B 27 29.080 5.507 -5.076 1.00 10.00 C ATOM 924 C LYS B 27 30.126 6.545 -4.635 1.00 10.00 C ATOM 925 O LYS B 27 31.323 6.260 -4.610 1.00 10.00 O ATOM 926 CB LYS B 27 28.679 5.762 -6.531 1.00 10.00 C ATOM 927 CG LYS B 27 27.861 4.598 -7.085 1.00 10.00 C ATOM 928 CD LYS B 27 27.476 4.856 -8.538 1.00 10.00 C ATOM 929 CE LYS B 27 26.712 3.654 -9.097 1.00 10.00 C ATOM 930 NZ LYS B 27 26.293 3.900 -10.481 1.00 10.00 N ATOM 0 H LYS B 27 27.017 5.699 -4.701 1.00 10.00 H new ATOM 0 HA LYS B 27 29.536 4.521 -4.989 1.00 10.00 H new ATOM 0 HB2 LYS B 27 28.099 6.682 -6.596 1.00 10.00 H new ATOM 0 HB3 LYS B 27 29.573 5.905 -7.139 1.00 10.00 H new ATOM 0 HG2 LYS B 27 28.437 3.675 -7.014 1.00 10.00 H new ATOM 0 HG3 LYS B 27 26.962 4.460 -6.484 1.00 10.00 H new ATOM 0 HD2 LYS B 27 26.860 5.753 -8.606 1.00 10.00 H new ATOM 0 HD3 LYS B 27 28.371 5.038 -9.133 1.00 10.00 H new ATOM 0 HE2 LYS B 27 27.342 2.766 -9.056 1.00 10.00 H new ATOM 0 HE3 LYS B 27 25.838 3.453 -8.478 1.00 10.00 H new ATOM 0 HZ1 LYS B 27 25.403 3.396 -10.669 1.00 10.00 H new ATOM 0 HZ2 LYS B 27 26.151 4.920 -10.625 1.00 10.00 H new ATOM 0 HZ3 LYS B 27 27.028 3.558 -11.132 1.00 10.00 H new ATOM 944 N SER B 28 29.622 7.686 -4.159 1.00 10.00 N ATOM 945 CA SER B 28 30.449 8.737 -3.533 1.00 10.00 C ATOM 946 C SER B 28 31.116 8.255 -2.230 1.00 10.00 C ATOM 947 O SER B 28 32.317 8.428 -2.035 1.00 10.00 O ATOM 948 CB SER B 28 29.601 9.977 -3.245 1.00 10.00 C ATOM 949 OG SER B 28 30.450 11.012 -2.749 1.00 10.00 O ATOM 0 H SER B 28 28.628 7.914 -4.194 1.00 10.00 H new ATOM 0 HA SER B 28 31.240 8.985 -4.241 1.00 10.00 H new ATOM 0 HB2 SER B 28 29.095 10.307 -4.152 1.00 10.00 H new ATOM 0 HB3 SER B 28 28.826 9.743 -2.515 1.00 10.00 H new ATOM 0 HG SER B 28 29.916 11.812 -2.563 1.00 10.00 H new ATOM 955 N LYS B 29 30.373 7.465 -1.452 1.00 10.00 N ATOM 956 CA LYS B 29 30.896 6.797 -0.239 1.00 10.00 C ATOM 957 C LYS B 29 31.998 5.772 -0.570 1.00 10.00 C ATOM 958 O LYS B 29 32.973 5.645 0.166 1.00 10.00 O ATOM 959 CB LYS B 29 29.787 6.082 0.540 1.00 10.00 C ATOM 960 CG LYS B 29 28.757 7.035 1.145 1.00 10.00 C ATOM 961 CD LYS B 29 27.689 6.226 1.883 1.00 10.00 C ATOM 962 CE LYS B 29 26.574 7.097 2.466 1.00 10.00 C ATOM 963 NZ LYS B 29 27.033 7.931 3.587 1.00 10.00 N ATOM 0 H LYS B 29 29.390 7.265 -1.638 1.00 10.00 H new ATOM 0 HA LYS B 29 31.319 7.592 0.375 1.00 10.00 H new ATOM 0 HB2 LYS B 29 29.278 5.384 -0.125 1.00 10.00 H new ATOM 0 HB3 LYS B 29 30.237 5.491 1.338 1.00 10.00 H new ATOM 0 HG2 LYS B 29 29.245 7.727 1.832 1.00 10.00 H new ATOM 0 HG3 LYS B 29 28.297 7.636 0.361 1.00 10.00 H new ATOM 0 HD2 LYS B 29 27.253 5.499 1.197 1.00 10.00 H new ATOM 0 HD3 LYS B 29 28.160 5.662 2.688 1.00 10.00 H new ATOM 0 HE2 LYS B 29 26.172 7.739 1.682 1.00 10.00 H new ATOM 0 HE3 LYS B 29 25.758 6.458 2.804 1.00 10.00 H new ATOM 0 HZ1 LYS B 29 26.239 8.500 3.944 1.00 10.00 H new ATOM 0 HZ2 LYS B 29 27.392 7.321 4.349 1.00 10.00 H new ATOM 0 HZ3 LYS B 29 27.793 8.562 3.262 1.00 10.00 H new ATOM 977 N ILE B 30 31.866 5.120 -1.727 1.00 10.00 N ATOM 978 CA ILE B 30 32.882 4.182 -2.260 1.00 10.00 C ATOM 979 C ILE B 30 34.153 4.951 -2.656 1.00 10.00 C ATOM 980 O ILE B 30 35.264 4.515 -2.372 1.00 10.00 O ATOM 981 CB ILE B 30 32.320 3.354 -3.434 1.00 10.00 C ATOM 982 CG1 ILE B 30 31.238 2.398 -2.906 1.00 10.00 C ATOM 983 CG2 ILE B 30 33.418 2.595 -4.209 1.00 10.00 C ATOM 984 CD1 ILE B 30 30.476 1.613 -3.981 1.00 10.00 C ATOM 0 H ILE B 30 31.050 5.222 -2.331 1.00 10.00 H new ATOM 0 HA ILE B 30 33.147 3.473 -1.476 1.00 10.00 H new ATOM 0 HB ILE B 30 31.876 4.043 -4.153 1.00 10.00 H new ATOM 0 HG12 ILE B 30 31.705 1.688 -2.224 1.00 10.00 H new ATOM 0 HG13 ILE B 30 30.520 2.975 -2.323 1.00 10.00 H new ATOM 0 HG21 ILE B 30 32.964 2.030 -5.023 1.00 10.00 H new ATOM 0 HG22 ILE B 30 34.134 3.308 -4.617 1.00 10.00 H new ATOM 0 HG23 ILE B 30 33.932 1.910 -3.535 1.00 10.00 H new ATOM 0 HD11 ILE B 30 29.737 0.969 -3.505 1.00 10.00 H new ATOM 0 HD12 ILE B 30 29.973 2.309 -4.652 1.00 10.00 H new ATOM 0 HD13 ILE B 30 31.176 1.002 -4.551 1.00 10.00 H new ATOM 996 N GLN B 31 33.956 6.077 -3.340 1.00 10.00 N ATOM 997 CA GLN B 31 35.062 6.976 -3.708 1.00 10.00 C ATOM 998 C GLN B 31 35.805 7.469 -2.457 1.00 10.00 C ATOM 999 O GLN B 31 37.034 7.473 -2.438 1.00 10.00 O ATOM 1000 CB GLN B 31 34.491 8.161 -4.486 1.00 10.00 C ATOM 1001 CG GLN B 31 35.600 9.092 -4.981 1.00 10.00 C ATOM 1002 CD GLN B 31 35.043 10.287 -5.744 1.00 10.00 C ATOM 1003 OE1 GLN B 31 33.944 10.785 -5.525 1.00 10.00 O ATOM 1004 NE2 GLN B 31 35.804 10.742 -6.709 1.00 10.00 N ATOM 0 H GLN B 31 33.039 6.394 -3.654 1.00 10.00 H new ATOM 0 HA GLN B 31 35.777 6.434 -4.327 1.00 10.00 H new ATOM 0 HB2 GLN B 31 33.914 7.796 -5.336 1.00 10.00 H new ATOM 0 HB3 GLN B 31 33.803 8.718 -3.850 1.00 10.00 H new ATOM 0 HG2 GLN B 31 36.184 9.445 -4.131 1.00 10.00 H new ATOM 0 HG3 GLN B 31 36.280 8.535 -5.626 1.00 10.00 H new ATOM 0 HE21 GLN B 31 36.716 10.319 -6.881 1.00 10.00 H new ATOM 0 HE22 GLN B 31 35.484 11.519 -7.288 1.00 10.00 H new ATOM 1013 N ASP B 32 35.044 7.693 -1.390 1.00 10.00 N ATOM 1014 CA ASP B 32 35.589 8.105 -0.085 1.00 10.00 C ATOM 1015 C ASP B 32 36.438 7.043 0.625 1.00 10.00 C ATOM 1016 O ASP B 32 37.293 7.399 1.437 1.00 10.00 O ATOM 1017 CB ASP B 32 34.472 8.623 0.825 1.00 10.00 C ATOM 1018 CG ASP B 32 33.983 10.010 0.392 1.00 10.00 C ATOM 1019 OD1 ASP B 32 34.822 10.803 -0.095 1.00 10.00 O ATOM 1020 OD2 ASP B 32 32.777 10.263 0.599 1.00 10.00 O ATOM 0 H ASP B 32 34.029 7.596 -1.398 1.00 10.00 H new ATOM 0 HA ASP B 32 36.286 8.914 -0.304 1.00 10.00 H new ATOM 0 HB2 ASP B 32 33.637 7.922 0.811 1.00 10.00 H new ATOM 0 HB3 ASP B 32 34.832 8.669 1.853 1.00 10.00 H new ATOM 1025 N LYS B 33 36.204 5.771 0.316 1.00 10.00 N ATOM 1026 CA LYS B 33 37.004 4.678 0.899 1.00 10.00 C ATOM 1027 C LYS B 33 38.076 4.105 -0.036 1.00 10.00 C ATOM 1028 O LYS B 33 39.195 3.837 0.386 1.00 10.00 O ATOM 1029 CB LYS B 33 36.119 3.532 1.391 1.00 10.00 C ATOM 1030 CG LYS B 33 35.367 3.888 2.678 1.00 10.00 C ATOM 1031 CD LYS B 33 34.929 2.631 3.441 1.00 10.00 C ATOM 1032 CE LYS B 33 36.140 1.868 3.994 1.00 10.00 C ATOM 1033 NZ LYS B 33 35.751 0.670 4.748 1.00 10.00 N ATOM 0 H LYS B 33 35.475 5.465 -0.328 1.00 10.00 H new ATOM 0 HA LYS B 33 37.521 5.146 1.736 1.00 10.00 H new ATOM 0 HB2 LYS B 33 35.401 3.271 0.614 1.00 10.00 H new ATOM 0 HB3 LYS B 33 36.735 2.650 1.565 1.00 10.00 H new ATOM 0 HG2 LYS B 33 36.006 4.498 3.317 1.00 10.00 H new ATOM 0 HG3 LYS B 33 34.492 4.490 2.434 1.00 10.00 H new ATOM 0 HD2 LYS B 33 34.267 2.912 4.261 1.00 10.00 H new ATOM 0 HD3 LYS B 33 34.358 1.981 2.779 1.00 10.00 H new ATOM 0 HE2 LYS B 33 36.791 1.579 3.169 1.00 10.00 H new ATOM 0 HE3 LYS B 33 36.718 2.529 4.640 1.00 10.00 H new ATOM 0 HZ1 LYS B 33 36.603 0.190 5.101 1.00 10.00 H new ATOM 0 HZ2 LYS B 33 35.151 0.945 5.552 1.00 10.00 H new ATOM 0 HZ3 LYS B 33 35.222 0.025 4.127 1.00 10.00 H new ATOM 1047 N GLU B 34 37.738 3.985 -1.315 1.00 10.00 N ATOM 1048 CA GLU B 34 38.609 3.313 -2.297 1.00 10.00 C ATOM 1049 C GLU B 34 39.356 4.263 -3.238 1.00 10.00 C ATOM 1050 O GLU B 34 40.429 3.918 -3.737 1.00 10.00 O ATOM 1051 CB GLU B 34 37.783 2.304 -3.096 1.00 10.00 C ATOM 1052 CG GLU B 34 37.336 1.122 -2.228 1.00 10.00 C ATOM 1053 CD GLU B 34 38.509 0.321 -1.643 1.00 10.00 C ATOM 1054 OE1 GLU B 34 39.509 0.134 -2.373 1.00 10.00 O ATOM 1055 OE2 GLU B 34 38.342 -0.158 -0.500 1.00 10.00 O ATOM 0 H GLU B 34 36.866 4.343 -1.706 1.00 10.00 H new ATOM 0 HA GLU B 34 39.389 2.808 -1.726 1.00 10.00 H new ATOM 0 HB2 GLU B 34 36.907 2.800 -3.514 1.00 10.00 H new ATOM 0 HB3 GLU B 34 38.372 1.936 -3.936 1.00 10.00 H new ATOM 0 HG2 GLU B 34 36.716 1.493 -1.412 1.00 10.00 H new ATOM 0 HG3 GLU B 34 36.713 0.457 -2.825 1.00 10.00 H new ATOM 1062 N GLY B 35 38.730 5.407 -3.527 1.00 10.00 N ATOM 1063 CA GLY B 35 39.274 6.395 -4.475 1.00 10.00 C ATOM 1064 C GLY B 35 38.732 6.202 -5.901 1.00 10.00 C ATOM 1065 O GLY B 35 39.082 6.946 -6.812 1.00 10.00 O ATOM 0 H GLY B 35 37.837 5.678 -3.116 1.00 10.00 H new ATOM 0 HA2 GLY B 35 39.029 7.399 -4.129 1.00 10.00 H new ATOM 0 HA3 GLY B 35 40.361 6.320 -4.490 1.00 10.00 H new ATOM 1069 N ILE B 36 37.833 5.230 -6.049 1.00 10.00 N ATOM 1070 CA ILE B 36 37.192 4.899 -7.339 1.00 10.00 C ATOM 1071 C ILE B 36 36.219 6.025 -7.729 1.00 10.00 C ATOM 1072 O ILE B 36 35.263 6.293 -6.999 1.00 10.00 O ATOM 1073 CB ILE B 36 36.481 3.531 -7.301 1.00 10.00 C ATOM 1074 CG1 ILE B 36 37.465 2.430 -6.866 1.00 10.00 C ATOM 1075 CG2 ILE B 36 35.888 3.200 -8.685 1.00 10.00 C ATOM 1076 CD1 ILE B 36 36.809 1.070 -6.587 1.00 10.00 C ATOM 0 H ILE B 36 37.521 4.641 -5.277 1.00 10.00 H new ATOM 0 HA ILE B 36 37.970 4.818 -8.098 1.00 10.00 H new ATOM 0 HB ILE B 36 35.669 3.580 -6.575 1.00 10.00 H new ATOM 0 HG12 ILE B 36 38.218 2.304 -7.644 1.00 10.00 H new ATOM 0 HG13 ILE B 36 37.987 2.760 -5.968 1.00 10.00 H new ATOM 0 HG21 ILE B 36 35.389 2.232 -8.645 1.00 10.00 H new ATOM 0 HG22 ILE B 36 35.168 3.968 -8.965 1.00 10.00 H new ATOM 0 HG23 ILE B 36 36.688 3.165 -9.425 1.00 10.00 H new ATOM 0 HD11 ILE B 36 37.573 0.352 -6.287 1.00 10.00 H new ATOM 0 HD12 ILE B 36 36.077 1.177 -5.787 1.00 10.00 H new ATOM 0 HD13 ILE B 36 36.312 0.714 -7.489 1.00 10.00 H new ATOM 1088 N PRO B 37 36.401 6.574 -8.942 1.00 10.00 N ATOM 1089 CA PRO B 37 35.479 7.564 -9.523 1.00 10.00 C ATOM 1090 C PRO B 37 34.065 6.967 -9.648 1.00 10.00 C ATOM 1091 O PRO B 37 33.903 5.880 -10.203 1.00 10.00 O ATOM 1092 CB PRO B 37 36.061 7.874 -10.902 1.00 10.00 C ATOM 1093 CG PRO B 37 37.556 7.655 -10.699 1.00 10.00 C ATOM 1094 CD PRO B 37 37.605 6.433 -9.781 1.00 10.00 C ATOM 0 HA PRO B 37 35.386 8.459 -8.908 1.00 10.00 H new ATOM 0 HB2 PRO B 37 35.657 7.213 -11.669 1.00 10.00 H new ATOM 0 HB3 PRO B 37 35.841 8.895 -11.213 1.00 10.00 H new ATOM 0 HG2 PRO B 37 38.068 7.471 -11.643 1.00 10.00 H new ATOM 0 HG3 PRO B 37 38.032 8.522 -10.242 1.00 10.00 H new ATOM 0 HD2 PRO B 37 37.589 5.504 -10.351 1.00 10.00 H new ATOM 0 HD3 PRO B 37 38.513 6.422 -9.178 1.00 10.00 H new ATOM 1102 N PRO B 38 33.048 7.682 -9.131 1.00 10.00 N ATOM 1103 CA PRO B 38 31.634 7.250 -9.143 1.00 10.00 C ATOM 1104 C PRO B 38 31.083 6.942 -10.539 1.00 10.00 C ATOM 1105 O PRO B 38 30.430 5.940 -10.754 1.00 10.00 O ATOM 1106 CB PRO B 38 30.863 8.422 -8.536 1.00 10.00 C ATOM 1107 CG PRO B 38 31.880 9.046 -7.587 1.00 10.00 C ATOM 1108 CD PRO B 38 33.190 8.930 -8.367 1.00 10.00 C ATOM 0 HA PRO B 38 31.533 6.315 -8.592 1.00 10.00 H new ATOM 0 HB2 PRO B 38 30.536 9.129 -9.299 1.00 10.00 H new ATOM 0 HB3 PRO B 38 29.970 8.088 -8.008 1.00 10.00 H new ATOM 0 HG2 PRO B 38 31.636 10.084 -7.359 1.00 10.00 H new ATOM 0 HG3 PRO B 38 31.927 8.513 -6.637 1.00 10.00 H new ATOM 0 HD2 PRO B 38 33.338 9.785 -9.026 1.00 10.00 H new ATOM 0 HD3 PRO B 38 34.049 8.891 -7.698 1.00 10.00 H new ATOM 1116 N ASP B 39 31.533 7.748 -11.516 1.00 10.00 N ATOM 1117 CA ASP B 39 31.146 7.607 -12.931 1.00 10.00 C ATOM 1118 C ASP B 39 31.867 6.468 -13.677 1.00 10.00 C ATOM 1119 O ASP B 39 31.925 6.450 -14.903 1.00 10.00 O ATOM 1120 CB ASP B 39 31.352 8.964 -13.637 1.00 10.00 C ATOM 1121 CG ASP B 39 32.788 9.517 -13.593 1.00 10.00 C ATOM 1122 OD1 ASP B 39 33.495 9.249 -12.593 1.00 10.00 O ATOM 1123 OD2 ASP B 39 33.121 10.286 -14.515 1.00 10.00 O ATOM 0 H ASP B 39 32.178 8.519 -11.346 1.00 10.00 H new ATOM 0 HA ASP B 39 30.095 7.320 -12.954 1.00 10.00 H new ATOM 0 HB2 ASP B 39 31.051 8.862 -14.680 1.00 10.00 H new ATOM 0 HB3 ASP B 39 30.684 9.696 -13.183 1.00 10.00 H new ATOM 1128 N GLN B 40 32.481 5.569 -12.910 1.00 10.00 N ATOM 1129 CA GLN B 40 33.097 4.341 -13.442 1.00 10.00 C ATOM 1130 C GLN B 40 32.627 3.089 -12.666 1.00 10.00 C ATOM 1131 O GLN B 40 33.106 1.975 -12.866 1.00 10.00 O ATOM 1132 CB GLN B 40 34.615 4.507 -13.356 1.00 10.00 C ATOM 1133 CG GLN B 40 35.343 3.438 -14.183 1.00 10.00 C ATOM 1134 CD GLN B 40 36.812 3.269 -13.792 1.00 10.00 C ATOM 1135 OE1 GLN B 40 37.656 2.902 -14.598 1.00 10.00 O ATOM 1136 NE2 GLN B 40 37.136 3.514 -12.540 1.00 10.00 N ATOM 0 H GLN B 40 32.569 5.666 -11.898 1.00 10.00 H new ATOM 0 HA GLN B 40 32.792 4.192 -14.478 1.00 10.00 H new ATOM 0 HB2 GLN B 40 34.895 5.498 -13.713 1.00 10.00 H new ATOM 0 HB3 GLN B 40 34.931 4.442 -12.315 1.00 10.00 H new ATOM 0 HG2 GLN B 40 34.830 2.484 -14.063 1.00 10.00 H new ATOM 0 HG3 GLN B 40 35.283 3.702 -15.239 1.00 10.00 H new ATOM 0 HE21 GLN B 40 36.422 3.819 -11.879 1.00 10.00 H new ATOM 0 HE22 GLN B 40 38.101 3.398 -12.231 1.00 10.00 H new ATOM 1145 N GLN B 41 31.668 3.298 -11.770 1.00 10.00 N ATOM 1146 CA GLN B 41 31.117 2.230 -10.927 1.00 10.00 C ATOM 1147 C GLN B 41 29.763 1.784 -11.490 1.00 10.00 C ATOM 1148 O GLN B 41 28.922 2.598 -11.851 1.00 10.00 O ATOM 1149 CB GLN B 41 30.877 2.781 -9.522 1.00 10.00 C ATOM 1150 CG GLN B 41 32.141 3.327 -8.852 1.00 10.00 C ATOM 1151 CD GLN B 41 31.816 3.876 -7.463 1.00 10.00 C ATOM 1152 OE1 GLN B 41 31.053 3.322 -6.686 1.00 10.00 O ATOM 1153 NE2 GLN B 41 32.445 4.972 -7.114 1.00 10.00 N ATOM 0 H GLN B 41 31.247 4.212 -11.604 1.00 10.00 H new ATOM 0 HA GLN B 41 31.815 1.393 -10.904 1.00 10.00 H new ATOM 0 HB2 GLN B 41 30.132 3.575 -9.575 1.00 10.00 H new ATOM 0 HB3 GLN B 41 30.458 1.992 -8.898 1.00 10.00 H new ATOM 0 HG2 GLN B 41 32.887 2.537 -8.772 1.00 10.00 H new ATOM 0 HG3 GLN B 41 32.575 4.114 -9.468 1.00 10.00 H new ATOM 0 HE21 GLN B 41 33.080 5.427 -7.770 1.00 10.00 H new ATOM 0 HE22 GLN B 41 32.300 5.370 -6.186 1.00 10.00 H new ATOM 1162 N ARG B 42 29.618 0.460 -11.568 1.00 10.00 N ATOM 1163 CA ARG B 42 28.339 -0.187 -11.907 1.00 10.00 C ATOM 1164 C ARG B 42 27.973 -1.148 -10.772 1.00 10.00 C ATOM 1165 O ARG B 42 28.679 -2.123 -10.526 1.00 10.00 O ATOM 1166 CB ARG B 42 28.447 -0.957 -13.229 1.00 10.00 C ATOM 1167 CG ARG B 42 28.662 -0.014 -14.414 1.00 10.00 C ATOM 1168 CD ARG B 42 28.980 -0.778 -15.701 1.00 10.00 C ATOM 1169 NE ARG B 42 27.820 -1.513 -16.235 1.00 10.00 N ATOM 1170 CZ ARG B 42 27.859 -2.307 -17.317 1.00 10.00 C ATOM 1171 NH1 ARG B 42 28.990 -2.508 -17.976 1.00 10.00 N ATOM 1172 NH2 ARG B 42 26.757 -2.863 -17.771 1.00 10.00 N ATOM 0 H ARG B 42 30.380 -0.197 -11.399 1.00 10.00 H new ATOM 0 HA ARG B 42 27.568 0.574 -12.027 1.00 10.00 H new ATOM 0 HB2 ARG B 42 29.274 -1.665 -13.172 1.00 10.00 H new ATOM 0 HB3 ARG B 42 27.539 -1.539 -13.387 1.00 10.00 H new ATOM 0 HG2 ARG B 42 27.768 0.592 -14.563 1.00 10.00 H new ATOM 0 HG3 ARG B 42 29.478 0.672 -14.188 1.00 10.00 H new ATOM 0 HD2 ARG B 42 29.337 -0.076 -16.455 1.00 10.00 H new ATOM 0 HD3 ARG B 42 29.791 -1.480 -15.509 1.00 10.00 H new ATOM 0 HE ARG B 42 26.928 -1.412 -15.751 1.00 10.00 H new ATOM 0 HH11 ARG B 42 29.850 -2.056 -17.663 1.00 10.00 H new ATOM 0 HH12 ARG B 42 29.002 -3.114 -18.796 1.00 10.00 H new ATOM 0 HH21 ARG B 42 25.868 -2.692 -17.301 1.00 10.00 H new ATOM 0 HH22 ARG B 42 26.791 -3.466 -18.593 1.00 10.00 H new ATOM 1186 N LEU B 43 26.953 -0.755 -10.012 1.00 10.00 N ATOM 1187 CA LEU B 43 26.513 -1.528 -8.835 1.00 10.00 C ATOM 1188 C LEU B 43 25.339 -2.450 -9.172 1.00 10.00 C ATOM 1189 O LEU B 43 24.400 -2.056 -9.849 1.00 10.00 O ATOM 1190 CB LEU B 43 26.101 -0.606 -7.685 1.00 10.00 C ATOM 1191 CG LEU B 43 27.235 0.269 -7.141 1.00 10.00 C ATOM 1192 CD1 LEU B 43 26.699 1.126 -5.996 1.00 10.00 C ATOM 1193 CD2 LEU B 43 28.413 -0.572 -6.638 1.00 10.00 C ATOM 0 H LEU B 43 26.411 0.092 -10.183 1.00 10.00 H new ATOM 0 HA LEU B 43 27.366 -2.133 -8.527 1.00 10.00 H new ATOM 0 HB2 LEU B 43 25.291 0.039 -8.025 1.00 10.00 H new ATOM 0 HB3 LEU B 43 25.705 -1.214 -6.872 1.00 10.00 H new ATOM 0 HG LEU B 43 27.598 0.898 -7.954 1.00 10.00 H new ATOM 0 HD11 LEU B 43 27.501 1.752 -5.604 1.00 10.00 H new ATOM 0 HD12 LEU B 43 25.891 1.759 -6.363 1.00 10.00 H new ATOM 0 HD13 LEU B 43 26.322 0.480 -5.203 1.00 10.00 H new ATOM 0 HD21 LEU B 43 29.195 0.087 -6.261 1.00 10.00 H new ATOM 0 HD22 LEU B 43 28.075 -1.230 -5.837 1.00 10.00 H new ATOM 0 HD23 LEU B 43 28.808 -1.172 -7.458 1.00 10.00 H new ATOM 1205 N ILE B 44 25.446 -3.673 -8.655 1.00 10.00 N ATOM 1206 CA ILE B 44 24.442 -4.727 -8.886 1.00 10.00 C ATOM 1207 C ILE B 44 23.877 -5.172 -7.533 1.00 10.00 C ATOM 1208 O ILE B 44 24.625 -5.397 -6.582 1.00 10.00 O ATOM 1209 CB ILE B 44 25.051 -5.922 -9.670 1.00 10.00 C ATOM 1210 CG1 ILE B 44 25.381 -5.565 -11.127 1.00 10.00 C ATOM 1211 CG2 ILE B 44 24.151 -7.168 -9.707 1.00 10.00 C ATOM 1212 CD1 ILE B 44 26.610 -4.671 -11.330 1.00 10.00 C ATOM 0 H ILE B 44 26.225 -3.967 -8.066 1.00 10.00 H new ATOM 0 HA ILE B 44 23.633 -4.331 -9.500 1.00 10.00 H new ATOM 0 HB ILE B 44 25.959 -6.150 -9.112 1.00 10.00 H new ATOM 0 HG12 ILE B 44 25.532 -6.490 -11.683 1.00 10.00 H new ATOM 0 HG13 ILE B 44 24.516 -5.067 -11.565 1.00 10.00 H new ATOM 0 HG21 ILE B 44 24.646 -7.958 -10.272 1.00 10.00 H new ATOM 0 HG22 ILE B 44 23.964 -7.512 -8.690 1.00 10.00 H new ATOM 0 HG23 ILE B 44 23.204 -6.919 -10.185 1.00 10.00 H new ATOM 0 HD11 ILE B 44 26.751 -4.482 -12.394 1.00 10.00 H new ATOM 0 HD12 ILE B 44 26.461 -3.725 -10.810 1.00 10.00 H new ATOM 0 HD13 ILE B 44 27.493 -5.170 -10.930 1.00 10.00 H new ATOM 1224 N PHE B 45 22.572 -5.408 -7.558 1.00 10.00 N ATOM 1225 CA PHE B 45 21.854 -6.064 -6.454 1.00 10.00 C ATOM 1226 C PHE B 45 20.579 -6.714 -6.995 1.00 10.00 C ATOM 1227 O PHE B 45 19.840 -6.095 -7.757 1.00 10.00 O ATOM 1228 CB PHE B 45 21.511 -5.044 -5.365 1.00 10.00 C ATOM 1229 CG PHE B 45 20.804 -5.717 -4.190 1.00 10.00 C ATOM 1230 CD1 PHE B 45 21.536 -6.475 -3.286 1.00 10.00 C ATOM 1231 CD2 PHE B 45 19.429 -5.585 -4.044 1.00 10.00 C ATOM 1232 CE1 PHE B 45 20.891 -7.106 -2.232 1.00 10.00 C ATOM 1233 CE2 PHE B 45 18.782 -6.207 -2.983 1.00 10.00 C ATOM 1234 CZ PHE B 45 19.515 -6.969 -2.078 1.00 10.00 C ATOM 0 H PHE B 45 21.973 -5.152 -8.343 1.00 10.00 H new ATOM 0 HA PHE B 45 22.491 -6.832 -6.015 1.00 10.00 H new ATOM 0 HB2 PHE B 45 22.422 -4.558 -5.016 1.00 10.00 H new ATOM 0 HB3 PHE B 45 20.873 -4.264 -5.780 1.00 10.00 H new ATOM 0 HD1 PHE B 45 22.605 -6.573 -3.403 1.00 10.00 H new ATOM 0 HD2 PHE B 45 18.864 -5.000 -4.754 1.00 10.00 H new ATOM 0 HE1 PHE B 45 21.456 -7.703 -1.532 1.00 10.00 H new ATOM 0 HE2 PHE B 45 17.714 -6.099 -2.861 1.00 10.00 H new ATOM 0 HZ PHE B 45 19.014 -7.455 -1.254 1.00 10.00 H new ATOM 1244 N ALA B 46 20.430 -7.999 -6.676 1.00 10.00 N ATOM 1245 CA ALA B 46 19.255 -8.813 -7.079 1.00 10.00 C ATOM 1246 C ALA B 46 19.044 -8.818 -8.608 1.00 10.00 C ATOM 1247 O ALA B 46 17.920 -8.728 -9.128 1.00 10.00 O ATOM 1248 CB ALA B 46 18.020 -8.353 -6.284 1.00 10.00 C ATOM 0 H ALA B 46 21.117 -8.518 -6.129 1.00 10.00 H new ATOM 0 HA ALA B 46 19.438 -9.858 -6.828 1.00 10.00 H new ATOM 0 HB1 ALA B 46 17.156 -8.949 -6.578 1.00 10.00 H new ATOM 0 HB2 ALA B 46 18.205 -8.483 -5.218 1.00 10.00 H new ATOM 0 HB3 ALA B 46 17.824 -7.301 -6.493 1.00 10.00 H new ATOM 1254 N GLY B 47 20.160 -8.904 -9.328 1.00 10.00 N ATOM 1255 CA GLY B 47 20.194 -8.939 -10.810 1.00 10.00 C ATOM 1256 C GLY B 47 19.694 -7.645 -11.473 1.00 10.00 C ATOM 1257 O GLY B 47 19.178 -7.667 -12.588 1.00 10.00 O ATOM 0 H GLY B 47 21.086 -8.953 -8.904 1.00 10.00 H new ATOM 0 HA2 GLY B 47 21.216 -9.132 -11.136 1.00 10.00 H new ATOM 0 HA3 GLY B 47 19.585 -9.773 -11.158 1.00 10.00 H new ATOM 1261 N LYS B 48 19.916 -6.530 -10.788 1.00 10.00 N ATOM 1262 CA LYS B 48 19.507 -5.192 -11.251 1.00 10.00 C ATOM 1263 C LYS B 48 20.691 -4.226 -11.143 1.00 10.00 C ATOM 1264 O LYS B 48 21.460 -4.279 -10.190 1.00 10.00 O ATOM 1265 CB LYS B 48 18.362 -4.676 -10.371 1.00 10.00 C ATOM 1266 CG LYS B 48 17.023 -5.339 -10.707 1.00 10.00 C ATOM 1267 CD LYS B 48 15.865 -4.704 -9.931 1.00 10.00 C ATOM 1268 CE LYS B 48 15.982 -4.876 -8.411 1.00 10.00 C ATOM 1269 NZ LYS B 48 15.950 -6.296 -8.035 1.00 10.00 N ATOM 0 H LYS B 48 20.390 -6.520 -9.885 1.00 10.00 H new ATOM 0 HA LYS B 48 19.178 -5.256 -12.288 1.00 10.00 H new ATOM 0 HB2 LYS B 48 18.602 -4.858 -9.323 1.00 10.00 H new ATOM 0 HB3 LYS B 48 18.271 -3.597 -10.494 1.00 10.00 H new ATOM 0 HG2 LYS B 48 16.834 -5.254 -11.777 1.00 10.00 H new ATOM 0 HG3 LYS B 48 17.076 -6.403 -10.476 1.00 10.00 H new ATOM 0 HD2 LYS B 48 15.820 -3.641 -10.166 1.00 10.00 H new ATOM 0 HD3 LYS B 48 14.927 -5.145 -10.268 1.00 10.00 H new ATOM 0 HE2 LYS B 48 16.911 -4.425 -8.061 1.00 10.00 H new ATOM 0 HE3 LYS B 48 15.166 -4.348 -7.918 1.00 10.00 H new ATOM 0 HZ1 LYS B 48 15.792 -6.380 -7.011 1.00 10.00 H new ATOM 0 HZ2 LYS B 48 15.179 -6.773 -8.545 1.00 10.00 H new ATOM 0 HZ3 LYS B 48 16.856 -6.741 -8.283 1.00 10.00 H new ATOM 1283 N GLN B 49 20.842 -3.411 -12.190 1.00 10.00 N ATOM 1284 CA GLN B 49 21.813 -2.303 -12.171 1.00 10.00 C ATOM 1285 C GLN B 49 21.169 -1.108 -11.463 1.00 10.00 C ATOM 1286 O GLN B 49 20.042 -0.722 -11.746 1.00 10.00 O ATOM 1287 CB GLN B 49 22.217 -1.885 -13.587 1.00 10.00 C ATOM 1288 CG GLN B 49 22.787 -3.061 -14.384 1.00 10.00 C ATOM 1289 CD GLN B 49 23.563 -2.593 -15.614 1.00 10.00 C ATOM 1290 OE1 GLN B 49 24.339 -1.647 -15.591 1.00 10.00 O ATOM 1291 NE2 GLN B 49 23.413 -3.321 -16.698 1.00 10.00 N ATOM 0 H GLN B 49 20.311 -3.492 -13.057 1.00 10.00 H new ATOM 0 HA GLN B 49 22.710 -2.635 -11.648 1.00 10.00 H new ATOM 0 HB2 GLN B 49 21.350 -1.479 -14.108 1.00 10.00 H new ATOM 0 HB3 GLN B 49 22.959 -1.088 -13.533 1.00 10.00 H new ATOM 0 HG2 GLN B 49 23.443 -3.650 -13.743 1.00 10.00 H new ATOM 0 HG3 GLN B 49 21.974 -3.717 -14.696 1.00 10.00 H new ATOM 0 HE21 GLN B 49 22.762 -4.106 -16.699 1.00 10.00 H new ATOM 0 HE22 GLN B 49 23.948 -3.101 -17.538 1.00 10.00 H new ATOM 1300 N LEU B 50 21.921 -0.559 -10.512 1.00 10.00 N ATOM 1301 CA LEU B 50 21.402 0.516 -9.658 1.00 10.00 C ATOM 1302 C LEU B 50 21.489 1.875 -10.357 1.00 10.00 C ATOM 1303 O LEU B 50 22.487 2.236 -10.962 1.00 10.00 O ATOM 1304 CB LEU B 50 22.133 0.490 -8.312 1.00 10.00 C ATOM 1305 CG LEU B 50 22.117 -0.896 -7.649 1.00 10.00 C ATOM 1306 CD1 LEU B 50 22.769 -0.816 -6.274 1.00 10.00 C ATOM 1307 CD2 LEU B 50 20.717 -1.511 -7.532 1.00 10.00 C ATOM 0 H LEU B 50 22.882 -0.834 -10.311 1.00 10.00 H new ATOM 0 HA LEU B 50 20.342 0.351 -9.467 1.00 10.00 H new ATOM 0 HB2 LEU B 50 23.166 0.805 -8.459 1.00 10.00 H new ATOM 0 HB3 LEU B 50 21.672 1.214 -7.640 1.00 10.00 H new ATOM 0 HG LEU B 50 22.685 -1.558 -8.303 1.00 10.00 H new ATOM 0 HD11 LEU B 50 22.756 -1.801 -5.807 1.00 10.00 H new ATOM 0 HD12 LEU B 50 23.800 -0.478 -6.379 1.00 10.00 H new ATOM 0 HD13 LEU B 50 22.218 -0.112 -5.651 1.00 10.00 H new ATOM 0 HD21 LEU B 50 20.788 -2.488 -7.054 1.00 10.00 H new ATOM 0 HD22 LEU B 50 20.082 -0.859 -6.932 1.00 10.00 H new ATOM 0 HD23 LEU B 50 20.285 -1.624 -8.526 1.00 10.00 H new ATOM 1319 N GLU B 51 20.387 2.614 -10.240 1.00 10.00 N ATOM 1320 CA GLU B 51 20.199 3.908 -10.900 1.00 10.00 C ATOM 1321 C GLU B 51 20.462 5.054 -9.929 1.00 10.00 C ATOM 1322 O GLU B 51 19.901 5.080 -8.840 1.00 10.00 O ATOM 1323 CB GLU B 51 18.767 3.981 -11.417 1.00 10.00 C ATOM 1324 CG GLU B 51 18.430 2.937 -12.477 1.00 10.00 C ATOM 1325 CD GLU B 51 19.352 3.016 -13.675 1.00 10.00 C ATOM 1326 OE1 GLU B 51 19.122 3.879 -14.548 1.00 10.00 O ATOM 1327 OE2 GLU B 51 20.291 2.200 -13.764 1.00 10.00 O ATOM 0 H GLU B 51 19.587 2.328 -9.676 1.00 10.00 H new ATOM 0 HA GLU B 51 20.904 4.001 -11.726 1.00 10.00 H new ATOM 0 HB2 GLU B 51 18.083 3.863 -10.577 1.00 10.00 H new ATOM 0 HB3 GLU B 51 18.593 4.974 -11.833 1.00 10.00 H new ATOM 0 HG2 GLU B 51 18.494 1.942 -12.037 1.00 10.00 H new ATOM 0 HG3 GLU B 51 17.400 3.075 -12.805 1.00 10.00 H new ATOM 1334 N ASP B 52 21.244 6.023 -10.380 1.00 10.00 N ATOM 1335 CA ASP B 52 21.712 7.135 -9.518 1.00 10.00 C ATOM 1336 C ASP B 52 20.604 7.867 -8.751 1.00 10.00 C ATOM 1337 O ASP B 52 20.730 8.046 -7.534 1.00 10.00 O ATOM 1338 CB ASP B 52 22.517 8.152 -10.338 1.00 10.00 C ATOM 1339 CG ASP B 52 23.899 7.628 -10.730 1.00 10.00 C ATOM 1340 OD1 ASP B 52 24.530 6.980 -9.866 1.00 10.00 O ATOM 1341 OD2 ASP B 52 24.259 7.845 -11.905 1.00 10.00 O ATOM 0 H ASP B 52 21.578 6.075 -11.342 1.00 10.00 H new ATOM 0 HA ASP B 52 22.340 6.658 -8.765 1.00 10.00 H new ATOM 0 HB2 ASP B 52 21.960 8.409 -11.239 1.00 10.00 H new ATOM 0 HB3 ASP B 52 22.631 9.070 -9.761 1.00 10.00 H new ATOM 1346 N GLY B 53 19.513 8.187 -9.479 1.00 10.00 N ATOM 1347 CA GLY B 53 18.360 8.905 -8.923 1.00 10.00 C ATOM 1348 C GLY B 53 17.382 8.047 -8.118 1.00 10.00 C ATOM 1349 O GLY B 53 16.293 8.519 -7.761 1.00 10.00 O ATOM 0 H GLY B 53 19.413 7.953 -10.467 1.00 10.00 H new ATOM 0 HA2 GLY B 53 18.727 9.707 -8.282 1.00 10.00 H new ATOM 0 HA3 GLY B 53 17.816 9.375 -9.742 1.00 10.00 H new ATOM 1353 N ARG B 54 17.733 6.784 -7.872 1.00 10.00 N ATOM 1354 CA ARG B 54 16.905 5.883 -7.054 1.00 10.00 C ATOM 1355 C ARG B 54 17.626 5.635 -5.733 1.00 10.00 C ATOM 1356 O ARG B 54 18.859 5.610 -5.689 1.00 10.00 O ATOM 1357 CB ARG B 54 16.643 4.546 -7.771 1.00 10.00 C ATOM 1358 CG ARG B 54 15.918 4.649 -9.127 1.00 10.00 C ATOM 1359 CD ARG B 54 14.631 5.480 -9.099 1.00 10.00 C ATOM 1360 NE ARG B 54 13.599 4.882 -8.252 1.00 10.00 N ATOM 1361 CZ ARG B 54 12.287 4.881 -8.512 1.00 10.00 C ATOM 1362 NH1 ARG B 54 11.800 5.299 -9.675 1.00 10.00 N ATOM 1363 NH2 ARG B 54 11.453 4.461 -7.581 1.00 10.00 N ATOM 0 H ARG B 54 18.588 6.356 -8.227 1.00 10.00 H new ATOM 0 HA ARG B 54 15.937 6.352 -6.880 1.00 10.00 H new ATOM 0 HB2 ARG B 54 17.598 4.045 -7.927 1.00 10.00 H new ATOM 0 HB3 ARG B 54 16.053 3.910 -7.111 1.00 10.00 H new ATOM 0 HG2 ARG B 54 16.600 5.084 -9.857 1.00 10.00 H new ATOM 0 HG3 ARG B 54 15.679 3.644 -9.474 1.00 10.00 H new ATOM 0 HD2 ARG B 54 14.857 6.483 -8.738 1.00 10.00 H new ATOM 0 HD3 ARG B 54 14.248 5.586 -10.114 1.00 10.00 H new ATOM 0 HE ARG B 54 13.905 4.428 -7.392 1.00 10.00 H new ATOM 0 HH11 ARG B 54 12.432 5.634 -10.402 1.00 10.00 H new ATOM 0 HH12 ARG B 54 10.794 5.285 -9.841 1.00 10.00 H new ATOM 0 HH21 ARG B 54 11.812 4.144 -6.680 1.00 10.00 H new ATOM 0 HH22 ARG B 54 10.449 4.453 -7.761 1.00 10.00 H new ATOM 1377 N THR B 55 16.862 5.431 -4.668 1.00 10.00 N ATOM 1378 CA THR B 55 17.429 5.215 -3.332 1.00 10.00 C ATOM 1379 C THR B 55 17.538 3.728 -3.008 1.00 10.00 C ATOM 1380 O THR B 55 17.016 2.886 -3.735 1.00 10.00 O ATOM 1381 CB THR B 55 16.565 5.868 -2.234 1.00 10.00 C ATOM 1382 OG1 THR B 55 15.247 5.318 -2.276 1.00 10.00 O ATOM 1383 CG2 THR B 55 16.502 7.393 -2.390 1.00 10.00 C ATOM 0 H THR B 55 15.843 5.410 -4.698 1.00 10.00 H new ATOM 0 HA THR B 55 18.419 5.672 -3.348 1.00 10.00 H new ATOM 0 HB THR B 55 17.026 5.656 -1.270 1.00 10.00 H new ATOM 0 HG1 THR B 55 15.047 4.882 -1.421 1.00 10.00 H new ATOM 0 HG21 THR B 55 15.884 7.815 -1.597 1.00 10.00 H new ATOM 0 HG22 THR B 55 17.508 7.807 -2.325 1.00 10.00 H new ATOM 0 HG23 THR B 55 16.069 7.642 -3.359 1.00 10.00 H new ATOM 1391 N LEU B 56 18.232 3.420 -1.912 1.00 10.00 N ATOM 1392 CA LEU B 56 18.417 2.019 -1.469 1.00 10.00 C ATOM 1393 C LEU B 56 17.092 1.303 -1.164 1.00 10.00 C ATOM 1394 O LEU B 56 16.854 0.187 -1.621 1.00 10.00 O ATOM 1395 CB LEU B 56 19.314 1.956 -0.231 1.00 10.00 C ATOM 1396 CG LEU B 56 20.743 2.430 -0.503 1.00 10.00 C ATOM 1397 CD1 LEU B 56 21.527 2.388 0.802 1.00 10.00 C ATOM 1398 CD2 LEU B 56 21.461 1.562 -1.537 1.00 10.00 C ATOM 0 H LEU B 56 18.678 4.112 -1.310 1.00 10.00 H new ATOM 0 HA LEU B 56 18.890 1.502 -2.304 1.00 10.00 H new ATOM 0 HB2 LEU B 56 18.878 2.569 0.558 1.00 10.00 H new ATOM 0 HB3 LEU B 56 19.341 0.931 0.139 1.00 10.00 H new ATOM 0 HG LEU B 56 20.687 3.442 -0.904 1.00 10.00 H new ATOM 0 HD11 LEU B 56 22.549 2.724 0.624 1.00 10.00 H new ATOM 0 HD12 LEU B 56 21.052 3.043 1.533 1.00 10.00 H new ATOM 0 HD13 LEU B 56 21.542 1.368 1.185 1.00 10.00 H new ATOM 0 HD21 LEU B 56 22.471 1.942 -1.693 1.00 10.00 H new ATOM 0 HD22 LEU B 56 21.511 0.534 -1.177 1.00 10.00 H new ATOM 0 HD23 LEU B 56 20.913 1.590 -2.479 1.00 10.00 H new ATOM 1410 N SER B 57 16.169 2.070 -0.563 1.00 10.00 N ATOM 1411 CA SER B 57 14.821 1.591 -0.229 1.00 10.00 C ATOM 1412 C SER B 57 14.044 1.193 -1.487 1.00 10.00 C ATOM 1413 O SER B 57 13.093 0.415 -1.412 1.00 10.00 O ATOM 1414 CB SER B 57 14.046 2.676 0.550 1.00 10.00 C ATOM 1415 OG SER B 57 13.872 3.846 -0.228 1.00 10.00 O ATOM 0 H SER B 57 16.337 3.040 -0.295 1.00 10.00 H new ATOM 0 HA SER B 57 14.927 0.706 0.398 1.00 10.00 H new ATOM 0 HB2 SER B 57 13.072 2.287 0.847 1.00 10.00 H new ATOM 0 HB3 SER B 57 14.584 2.923 1.465 1.00 10.00 H new ATOM 0 HG SER B 57 13.377 4.514 0.291 1.00 10.00 H new ATOM 1421 N ASP B 58 14.444 1.749 -2.637 1.00 10.00 N ATOM 1422 CA ASP B 58 13.769 1.491 -3.923 1.00 10.00 C ATOM 1423 C ASP B 58 14.297 0.231 -4.619 1.00 10.00 C ATOM 1424 O ASP B 58 13.923 -0.062 -5.758 1.00 10.00 O ATOM 1425 CB ASP B 58 13.926 2.692 -4.861 1.00 10.00 C ATOM 1426 CG ASP B 58 13.322 3.958 -4.309 1.00 10.00 C ATOM 1427 OD1 ASP B 58 12.520 3.889 -3.343 1.00 10.00 O ATOM 1428 OD2 ASP B 58 13.648 5.031 -4.848 1.00 10.00 O ATOM 0 H ASP B 58 15.238 2.386 -2.707 1.00 10.00 H new ATOM 0 HA ASP B 58 12.715 1.331 -3.696 1.00 10.00 H new ATOM 0 HB2 ASP B 58 14.986 2.857 -5.055 1.00 10.00 H new ATOM 0 HB3 ASP B 58 13.459 2.461 -5.818 1.00 10.00 H new ATOM 1433 N TYR B 59 15.176 -0.499 -3.938 1.00 10.00 N ATOM 1434 CA TYR B 59 15.763 -1.733 -4.473 1.00 10.00 C ATOM 1435 C TYR B 59 15.781 -2.846 -3.419 1.00 10.00 C ATOM 1436 O TYR B 59 16.289 -3.948 -3.665 1.00 10.00 O ATOM 1437 CB TYR B 59 17.190 -1.454 -4.935 1.00 10.00 C ATOM 1438 CG TYR B 59 17.287 -0.811 -6.289 1.00 10.00 C ATOM 1439 CD1 TYR B 59 16.892 -1.499 -7.429 1.00 10.00 C ATOM 1440 CD2 TYR B 59 17.833 0.457 -6.437 1.00 10.00 C ATOM 1441 CE1 TYR B 59 17.029 -0.938 -8.682 1.00 10.00 C ATOM 1442 CE2 TYR B 59 17.964 1.027 -7.687 1.00 10.00 C ATOM 1443 CZ TYR B 59 17.574 0.319 -8.805 1.00 10.00 C ATOM 1444 OH TYR B 59 17.733 0.872 -10.049 1.00 10.00 O ATOM 0 H TYR B 59 15.503 -0.257 -3.003 1.00 10.00 H new ATOM 0 HA TYR B 59 15.151 -2.066 -5.311 1.00 10.00 H new ATOM 0 HB2 TYR B 59 17.677 -0.809 -4.204 1.00 10.00 H new ATOM 0 HB3 TYR B 59 17.744 -2.392 -4.951 1.00 10.00 H new ATOM 0 HD1 TYR B 59 16.471 -2.489 -7.333 1.00 10.00 H new ATOM 0 HD2 TYR B 59 18.159 1.003 -5.564 1.00 10.00 H new ATOM 0 HE1 TYR B 59 16.711 -1.481 -9.559 1.00 10.00 H new ATOM 0 HE2 TYR B 59 18.370 2.023 -7.790 1.00 10.00 H new ATOM 0 HH TYR B 59 18.404 0.363 -10.550 1.00 10.00 H new ATOM 1454 N ASN B 60 15.207 -2.543 -2.250 1.00 10.00 N ATOM 1455 CA ASN B 60 15.131 -3.474 -1.112 1.00 10.00 C ATOM 1456 C ASN B 60 16.528 -3.860 -0.584 1.00 10.00 C ATOM 1457 O ASN B 60 16.749 -4.949 -0.052 1.00 10.00 O ATOM 1458 CB ASN B 60 14.282 -4.700 -1.469 1.00 10.00 C ATOM 1459 CG ASN B 60 13.762 -5.437 -0.245 1.00 10.00 C ATOM 1460 OD1 ASN B 60 13.611 -4.858 0.835 1.00 10.00 O ATOM 1461 ND2 ASN B 60 13.497 -6.718 -0.404 1.00 10.00 N ATOM 0 H ASN B 60 14.777 -1.637 -2.062 1.00 10.00 H new ATOM 0 HA ASN B 60 14.632 -2.958 -0.292 1.00 10.00 H new ATOM 0 HB2 ASN B 60 13.438 -4.385 -2.083 1.00 10.00 H new ATOM 0 HB3 ASN B 60 14.877 -5.384 -2.073 1.00 10.00 H new ATOM 0 HD21 ASN B 60 13.153 -7.269 0.382 1.00 10.00 H new ATOM 0 HD22 ASN B 60 13.635 -7.158 -1.314 1.00 10.00 H new ATOM 1468 N ILE B 61 17.466 -2.944 -0.772 1.00 10.00 N ATOM 1469 CA ILE B 61 18.842 -3.062 -0.247 1.00 10.00 C ATOM 1470 C ILE B 61 18.777 -2.801 1.260 1.00 10.00 C ATOM 1471 O ILE B 61 18.605 -1.668 1.702 1.00 10.00 O ATOM 1472 CB ILE B 61 19.797 -2.091 -0.969 1.00 10.00 C ATOM 1473 CG1 ILE B 61 19.883 -2.478 -2.454 1.00 10.00 C ATOM 1474 CG2 ILE B 61 21.186 -2.065 -0.303 1.00 10.00 C ATOM 1475 CD1 ILE B 61 20.671 -1.516 -3.349 1.00 10.00 C ATOM 0 H ILE B 61 17.304 -2.085 -1.297 1.00 10.00 H new ATOM 0 HA ILE B 61 19.243 -4.059 -0.429 1.00 10.00 H new ATOM 0 HB ILE B 61 19.401 -1.078 -0.892 1.00 10.00 H new ATOM 0 HG12 ILE B 61 20.337 -3.466 -2.527 1.00 10.00 H new ATOM 0 HG13 ILE B 61 18.870 -2.563 -2.847 1.00 10.00 H new ATOM 0 HG21 ILE B 61 21.833 -1.370 -0.838 1.00 10.00 H new ATOM 0 HG22 ILE B 61 21.086 -1.743 0.734 1.00 10.00 H new ATOM 0 HG23 ILE B 61 21.623 -3.063 -0.333 1.00 10.00 H new ATOM 0 HD11 ILE B 61 20.667 -1.887 -4.374 1.00 10.00 H new ATOM 0 HD12 ILE B 61 20.209 -0.529 -3.318 1.00 10.00 H new ATOM 0 HD13 ILE B 61 21.699 -1.447 -2.993 1.00 10.00 H new ATOM 1487 N GLN B 62 18.928 -3.870 2.027 1.00 10.00 N ATOM 1488 CA GLN B 62 18.862 -3.794 3.476 1.00 10.00 C ATOM 1489 C GLN B 62 20.195 -4.196 4.110 1.00 10.00 C ATOM 1490 O GLN B 62 21.202 -4.345 3.418 1.00 10.00 O ATOM 1491 CB GLN B 62 17.728 -4.699 3.978 1.00 10.00 C ATOM 1492 CG GLN B 62 16.337 -4.276 3.500 1.00 10.00 C ATOM 1493 CD GLN B 62 15.230 -5.207 3.983 1.00 10.00 C ATOM 1494 OE1 GLN B 62 14.099 -4.777 4.213 1.00 10.00 O ATOM 1495 NE2 GLN B 62 15.548 -6.481 4.160 1.00 10.00 N ATOM 0 H GLN B 62 19.099 -4.808 1.664 1.00 10.00 H new ATOM 0 HA GLN B 62 18.659 -2.764 3.768 1.00 10.00 H new ATOM 0 HB2 GLN B 62 17.919 -5.720 3.649 1.00 10.00 H new ATOM 0 HB3 GLN B 62 17.739 -4.708 5.068 1.00 10.00 H new ATOM 0 HG2 GLN B 62 16.131 -3.264 3.850 1.00 10.00 H new ATOM 0 HG3 GLN B 62 16.328 -4.245 2.410 1.00 10.00 H new ATOM 0 HE21 GLN B 62 16.495 -6.803 3.959 1.00 10.00 H new ATOM 0 HE22 GLN B 62 14.846 -7.140 4.497 1.00 10.00 H new ATOM 1504 N LYS B 63 20.200 -4.351 5.434 1.00 10.00 N ATOM 1505 CA LYS B 63 21.424 -4.743 6.156 1.00 10.00 C ATOM 1506 C LYS B 63 21.850 -6.145 5.699 1.00 10.00 C ATOM 1507 O LYS B 63 21.000 -6.979 5.408 1.00 10.00 O ATOM 1508 CB LYS B 63 21.197 -4.717 7.675 1.00 10.00 C ATOM 1509 CG LYS B 63 20.220 -5.779 8.192 1.00 10.00 C ATOM 1510 CD LYS B 63 20.017 -5.616 9.695 1.00 10.00 C ATOM 1511 CE LYS B 63 19.093 -6.707 10.233 1.00 10.00 C ATOM 1512 NZ LYS B 63 18.748 -6.412 11.629 1.00 10.00 N ATOM 0 H LYS B 63 19.383 -4.214 6.029 1.00 10.00 H new ATOM 0 HA LYS B 63 22.216 -4.030 5.928 1.00 10.00 H new ATOM 0 HB2 LYS B 63 22.156 -4.851 8.175 1.00 10.00 H new ATOM 0 HB3 LYS B 63 20.825 -3.732 7.957 1.00 10.00 H new ATOM 0 HG2 LYS B 63 19.264 -5.687 7.676 1.00 10.00 H new ATOM 0 HG3 LYS B 63 20.605 -6.775 7.975 1.00 10.00 H new ATOM 0 HD2 LYS B 63 20.979 -5.663 10.205 1.00 10.00 H new ATOM 0 HD3 LYS B 63 19.592 -4.635 9.906 1.00 10.00 H new ATOM 0 HE2 LYS B 63 18.188 -6.763 9.628 1.00 10.00 H new ATOM 0 HE3 LYS B 63 19.582 -7.679 10.166 1.00 10.00 H new ATOM 0 HZ1 LYS B 63 18.119 -7.155 11.996 1.00 10.00 H new ATOM 0 HZ2 LYS B 63 19.616 -6.379 12.202 1.00 10.00 H new ATOM 0 HZ3 LYS B 63 18.265 -5.493 11.680 1.00 10.00 H new ATOM 1526 N GLU B 64 23.171 -6.314 5.570 1.00 10.00 N ATOM 1527 CA GLU B 64 23.791 -7.605 5.196 1.00 10.00 C ATOM 1528 C GLU B 64 23.636 -7.972 3.708 1.00 10.00 C ATOM 1529 O GLU B 64 24.043 -9.055 3.296 1.00 10.00 O ATOM 1530 CB GLU B 64 23.216 -8.765 6.030 1.00 10.00 C ATOM 1531 CG GLU B 64 24.228 -9.418 6.968 1.00 10.00 C ATOM 1532 CD GLU B 64 24.908 -8.433 7.923 1.00 10.00 C ATOM 1533 OE1 GLU B 64 24.283 -7.413 8.297 1.00 10.00 O ATOM 1534 OE2 GLU B 64 26.076 -8.731 8.248 1.00 10.00 O ATOM 0 H GLU B 64 23.846 -5.564 5.720 1.00 10.00 H new ATOM 0 HA GLU B 64 24.852 -7.463 5.400 1.00 10.00 H new ATOM 0 HB2 GLU B 64 22.377 -8.394 6.619 1.00 10.00 H new ATOM 0 HB3 GLU B 64 22.821 -9.523 5.354 1.00 10.00 H new ATOM 0 HG2 GLU B 64 23.724 -10.188 7.553 1.00 10.00 H new ATOM 0 HG3 GLU B 64 24.991 -9.919 6.373 1.00 10.00 H new ATOM 1541 N SER B 65 23.115 -7.037 2.917 1.00 10.00 N ATOM 1542 CA SER B 65 22.997 -7.232 1.459 1.00 10.00 C ATOM 1543 C SER B 65 24.388 -7.164 0.833 1.00 10.00 C ATOM 1544 O SER B 65 25.259 -6.436 1.288 1.00 10.00 O ATOM 1545 CB SER B 65 22.151 -6.141 0.811 1.00 10.00 C ATOM 1546 OG SER B 65 20.797 -6.218 1.253 1.00 10.00 O ATOM 0 H SER B 65 22.767 -6.138 3.251 1.00 10.00 H new ATOM 0 HA SER B 65 22.524 -8.200 1.293 1.00 10.00 H new ATOM 0 HB2 SER B 65 22.563 -5.162 1.056 1.00 10.00 H new ATOM 0 HB3 SER B 65 22.190 -6.241 -0.274 1.00 10.00 H new ATOM 0 HG SER B 65 20.702 -5.737 2.102 1.00 10.00 H new ATOM 1552 N THR B 66 24.590 -8.010 -0.180 1.00 10.00 N ATOM 1553 CA THR B 66 25.852 -7.965 -0.930 1.00 10.00 C ATOM 1554 C THR B 66 25.556 -7.645 -2.402 1.00 10.00 C ATOM 1555 O THR B 66 24.601 -8.124 -2.996 1.00 10.00 O ATOM 1556 CB THR B 66 26.756 -9.214 -0.772 1.00 10.00 C ATOM 1557 OG1 THR B 66 26.681 -10.068 -1.911 1.00 10.00 O ATOM 1558 CG2 THR B 66 26.467 -10.053 0.481 1.00 10.00 C ATOM 0 H THR B 66 23.922 -8.714 -0.494 1.00 10.00 H new ATOM 0 HA THR B 66 26.448 -7.166 -0.490 1.00 10.00 H new ATOM 0 HB THR B 66 27.759 -8.801 -0.669 1.00 10.00 H new ATOM 0 HG1 THR B 66 27.264 -10.844 -1.777 1.00 10.00 H new ATOM 0 HG21 THR B 66 27.145 -10.906 0.512 1.00 10.00 H new ATOM 0 HG22 THR B 66 26.614 -9.441 1.371 1.00 10.00 H new ATOM 0 HG23 THR B 66 25.437 -10.409 0.451 1.00 10.00 H new ATOM 1566 N LEU B 67 26.331 -6.674 -2.870 1.00 10.00 N ATOM 1567 CA LEU B 67 26.286 -6.152 -4.239 1.00 10.00 C ATOM 1568 C LEU B 67 27.553 -6.632 -4.958 1.00 10.00 C ATOM 1569 O LEU B 67 28.508 -7.103 -4.351 1.00 10.00 O ATOM 1570 CB LEU B 67 26.274 -4.616 -4.187 1.00 10.00 C ATOM 1571 CG LEU B 67 24.961 -3.951 -3.735 1.00 10.00 C ATOM 1572 CD1 LEU B 67 24.495 -4.333 -2.327 1.00 10.00 C ATOM 1573 CD2 LEU B 67 25.166 -2.436 -3.755 1.00 10.00 C ATOM 0 H LEU B 67 27.032 -6.210 -2.292 1.00 10.00 H new ATOM 0 HA LEU B 67 25.395 -6.499 -4.763 1.00 10.00 H new ATOM 0 HB2 LEU B 67 27.069 -4.292 -3.515 1.00 10.00 H new ATOM 0 HB3 LEU B 67 26.522 -4.240 -5.179 1.00 10.00 H new ATOM 0 HG LEU B 67 24.192 -4.300 -4.425 1.00 10.00 H new ATOM 0 HD11 LEU B 67 23.563 -3.815 -2.099 1.00 10.00 H new ATOM 0 HD12 LEU B 67 24.333 -5.410 -2.277 1.00 10.00 H new ATOM 0 HD13 LEU B 67 25.256 -4.046 -1.601 1.00 10.00 H new ATOM 0 HD21 LEU B 67 24.248 -1.940 -3.438 1.00 10.00 H new ATOM 0 HD22 LEU B 67 25.976 -2.169 -3.076 1.00 10.00 H new ATOM 0 HD23 LEU B 67 25.420 -2.117 -4.766 1.00 10.00 H new ATOM 1585 N HIS B 68 27.509 -6.489 -6.280 1.00 10.00 N ATOM 1586 CA HIS B 68 28.671 -6.787 -7.126 1.00 10.00 C ATOM 1587 C HIS B 68 29.141 -5.525 -7.851 1.00 10.00 C ATOM 1588 O HIS B 68 28.364 -4.622 -8.135 1.00 10.00 O ATOM 1589 CB HIS B 68 28.340 -7.900 -8.119 1.00 10.00 C ATOM 1590 CG HIS B 68 28.326 -9.258 -7.416 1.00 10.00 C ATOM 1591 ND1 HIS B 68 27.300 -9.791 -6.758 1.00 10.00 N ATOM 1592 CD2 HIS B 68 29.332 -10.125 -7.394 1.00 10.00 C ATOM 1593 CE1 HIS B 68 27.677 -10.989 -6.323 1.00 10.00 C ATOM 1594 NE2 HIS B 68 28.929 -11.197 -6.722 1.00 10.00 N ATOM 0 H HIS B 68 26.686 -6.170 -6.791 1.00 10.00 H new ATOM 0 HA HIS B 68 29.485 -7.135 -6.490 1.00 10.00 H new ATOM 0 HB2 HIS B 68 27.369 -7.711 -8.576 1.00 10.00 H new ATOM 0 HB3 HIS B 68 29.075 -7.908 -8.924 1.00 10.00 H new ATOM 0 HD2 HIS B 68 30.304 -9.983 -7.843 1.00 10.00 H new ATOM 0 HE1 HIS B 68 27.073 -11.674 -5.747 1.00 10.00 H new ATOM 0 HE2 HIS B 68 29.483 -12.034 -6.543 1.00 10.00 H new ATOM 1603 N LEU B 69 30.455 -5.509 -8.065 1.00 10.00 N ATOM 1604 CA LEU B 69 31.135 -4.410 -8.757 1.00 10.00 C ATOM 1605 C LEU B 69 31.755 -4.928 -10.060 1.00 10.00 C ATOM 1606 O LEU B 69 32.496 -5.901 -10.079 1.00 10.00 O ATOM 1607 CB LEU B 69 32.224 -3.845 -7.833 1.00 10.00 C ATOM 1608 CG LEU B 69 33.087 -2.760 -8.492 1.00 10.00 C ATOM 1609 CD1 LEU B 69 32.265 -1.520 -8.845 1.00 10.00 C ATOM 1610 CD2 LEU B 69 34.252 -2.388 -7.579 1.00 10.00 C ATOM 0 H LEU B 69 31.081 -6.256 -7.765 1.00 10.00 H new ATOM 0 HA LEU B 69 30.423 -3.622 -9.002 1.00 10.00 H new ATOM 0 HB2 LEU B 69 31.753 -3.431 -6.941 1.00 10.00 H new ATOM 0 HB3 LEU B 69 32.869 -4.660 -7.504 1.00 10.00 H new ATOM 0 HG LEU B 69 33.480 -3.167 -9.424 1.00 10.00 H new ATOM 0 HD11 LEU B 69 32.911 -0.775 -9.309 1.00 10.00 H new ATOM 0 HD12 LEU B 69 31.471 -1.795 -9.539 1.00 10.00 H new ATOM 0 HD13 LEU B 69 31.826 -1.104 -7.938 1.00 10.00 H new ATOM 0 HD21 LEU B 69 34.857 -1.618 -8.057 1.00 10.00 H new ATOM 0 HD22 LEU B 69 33.866 -2.011 -6.632 1.00 10.00 H new ATOM 0 HD23 LEU B 69 34.866 -3.270 -7.395 1.00 10.00 H new ATOM 1622 N VAL B 70 31.458 -4.183 -11.149 1.00 10.00 N ATOM 1623 CA VAL B 70 32.052 -4.422 -12.446 1.00 10.00 C ATOM 1624 C VAL B 70 32.870 -3.160 -12.757 1.00 10.00 C ATOM 1625 O VAL B 70 32.408 -2.030 -12.525 1.00 10.00 O ATOM 1626 CB VAL B 70 30.940 -4.662 -13.536 1.00 10.00 C ATOM 1627 CG1 VAL B 70 31.528 -4.705 -14.953 1.00 10.00 C ATOM 1628 CG2 VAL B 70 30.125 -5.927 -13.225 1.00 10.00 C ATOM 0 H VAL B 70 30.799 -3.405 -11.134 1.00 10.00 H new ATOM 0 HA VAL B 70 32.677 -5.315 -12.449 1.00 10.00 H new ATOM 0 HB VAL B 70 30.260 -3.811 -13.501 1.00 10.00 H new ATOM 0 HG11 VAL B 70 30.728 -4.872 -15.674 1.00 10.00 H new ATOM 0 HG12 VAL B 70 32.021 -3.758 -15.171 1.00 10.00 H new ATOM 0 HG13 VAL B 70 32.253 -5.516 -15.021 1.00 10.00 H new ATOM 0 HG21 VAL B 70 29.365 -6.068 -13.993 1.00 10.00 H new ATOM 0 HG22 VAL B 70 30.788 -6.792 -13.207 1.00 10.00 H new ATOM 0 HG23 VAL B 70 29.643 -5.820 -12.253 1.00 10.00 H new ATOM 1638 N LEU B 71 34.074 -3.351 -13.281 1.00 10.00 N ATOM 1639 CA LEU B 71 34.980 -2.246 -13.536 1.00 10.00 C ATOM 1640 C LEU B 71 34.829 -1.747 -14.977 1.00 10.00 C ATOM 1641 O LEU B 71 35.123 -2.477 -15.922 1.00 10.00 O ATOM 1642 CB LEU B 71 36.430 -2.680 -13.265 1.00 10.00 C ATOM 1643 CG LEU B 71 37.269 -1.638 -12.540 1.00 10.00 C ATOM 1644 CD1 LEU B 71 37.102 -1.816 -11.020 1.00 10.00 C ATOM 1645 CD2 LEU B 71 38.776 -1.643 -13.020 1.00 10.00 C ATOM 0 H LEU B 71 34.444 -4.266 -13.538 1.00 10.00 H new ATOM 0 HA LEU B 71 34.728 -1.426 -12.864 1.00 10.00 H new ATOM 0 HB2 LEU B 71 36.419 -3.596 -12.674 1.00 10.00 H new ATOM 0 HB3 LEU B 71 36.909 -2.919 -14.214 1.00 10.00 H new ATOM 0 HG LEU B 71 36.906 -0.643 -12.797 1.00 10.00 H new ATOM 0 HD11 LEU B 71 37.702 -1.071 -10.498 1.00 10.00 H new ATOM 0 HD12 LEU B 71 36.053 -1.690 -10.752 1.00 10.00 H new ATOM 0 HD13 LEU B 71 37.432 -2.814 -10.732 1.00 10.00 H new ATOM 0 HD21 LEU B 71 39.334 -0.883 -12.474 1.00 10.00 H new ATOM 0 HD22 LEU B 71 39.215 -2.622 -12.830 1.00 10.00 H new ATOM 0 HD23 LEU B 71 38.819 -1.428 -14.088 1.00 10.00 H new TER 1657 LEU B 71 HETATM 1658 ZN ZN A 63 6.617 2.997 -6.396 1.00 10.00 ZN