USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1017 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 100 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 111 ASN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Set 1.4: A 113 MET CE :methyl -174:sc= 0 (180deg=0) USER MOD Set 2.1: A 105 ASN : amide:sc= 0.00355 X(o=0.0036,f=0) USER MOD Set 2.2: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 81 THR OG1 : rot -107:sc= 0.634 USER MOD Set 3.2: A 93 THR OG1 : rot 180:sc= 0.574 USER MOD Set 4.1: A 64 THR OG1 : rot 95:sc= 0.0846 USER MOD Set 4.2: A 69 CYS SG : rot -177:sc= 0.111 USER MOD Single : A 2 SER OG : rot 30:sc= 0.245 USER MOD Single : A 4 SER OG : rot 180:sc= 0.0133 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot -15:sc= -0.0139 USER MOD Single : A 8 GLN : amide:sc= -0.31 X(o=-0.31,f=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0.22 K(o=0.22,f=-0.41) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0.04) USER MOD Single : A 19 MET CE :methyl -165:sc= 0 (180deg=-0.0374) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0.199 X(o=0.2,f=-0.017) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 152:sc= 0.383 (180deg=0.0891) USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 150:sc= -0.0756 (180deg=-1.16) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot -70:sc= 0.47 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= -1.01 K(o=-1,f=-2.7!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.333 X(o=-0.33,f=-0.69) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.315 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 12.108 -9.636 -4.706 1.00 0.00 N ATOM 2 CA SER A 2 12.225 -10.090 -3.313 1.00 0.00 C ATOM 3 C SER A 2 11.373 -9.185 -2.385 1.00 0.00 C ATOM 4 O SER A 2 11.745 -8.040 -2.105 1.00 0.00 O ATOM 5 CB SER A 2 13.707 -10.187 -2.885 1.00 0.00 C ATOM 6 OG SER A 2 14.380 -8.932 -2.941 1.00 0.00 O ATOM 0 HA SER A 2 11.823 -11.099 -3.225 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.762 -10.579 -1.869 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.221 -10.899 -3.530 1.00 0.00 H new ATOM 0 HG SER A 2 13.740 -8.210 -2.770 1.00 0.00 H new ATOM 12 N PHE A 3 10.230 -9.714 -1.911 1.00 0.00 N ATOM 13 CA PHE A 3 9.256 -8.955 -1.074 1.00 0.00 C ATOM 14 C PHE A 3 9.647 -9.062 0.443 1.00 0.00 C ATOM 15 O PHE A 3 10.833 -9.171 0.777 1.00 0.00 O ATOM 16 CB PHE A 3 7.822 -9.440 -1.473 1.00 0.00 C ATOM 17 CG PHE A 3 7.301 -9.026 -2.863 1.00 0.00 C ATOM 18 CD1 PHE A 3 7.531 -9.831 -3.985 1.00 0.00 C ATOM 19 CD2 PHE A 3 6.538 -7.862 -3.001 1.00 0.00 C ATOM 20 CE1 PHE A 3 7.003 -9.474 -5.222 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.003 -7.516 -4.237 1.00 0.00 C ATOM 22 CZ PHE A 3 6.243 -8.316 -5.349 1.00 0.00 C ATOM 0 H PHE A 3 9.947 -10.677 -2.092 1.00 0.00 H new ATOM 0 HA PHE A 3 9.273 -7.880 -1.256 1.00 0.00 H new ATOM 0 HB2 PHE A 3 7.805 -10.528 -1.416 1.00 0.00 H new ATOM 0 HB3 PHE A 3 7.120 -9.071 -0.725 1.00 0.00 H new ATOM 0 HD1 PHE A 3 8.120 -10.731 -3.890 1.00 0.00 H new ATOM 0 HD2 PHE A 3 6.364 -7.229 -2.144 1.00 0.00 H new ATOM 0 HE1 PHE A 3 7.184 -10.097 -6.085 1.00 0.00 H new ATOM 0 HE2 PHE A 3 5.400 -6.625 -4.334 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.839 -8.038 -6.311 1.00 0.00 H new ATOM 32 N SER A 4 8.667 -8.958 1.370 1.00 0.00 N ATOM 33 CA SER A 4 8.880 -8.968 2.846 1.00 0.00 C ATOM 34 C SER A 4 9.755 -7.777 3.339 1.00 0.00 C ATOM 35 O SER A 4 10.984 -7.894 3.411 1.00 0.00 O ATOM 36 CB SER A 4 9.354 -10.338 3.393 1.00 0.00 C ATOM 37 OG SER A 4 8.411 -11.364 3.103 1.00 0.00 O ATOM 0 H SER A 4 7.684 -8.863 1.113 1.00 0.00 H new ATOM 0 HA SER A 4 7.893 -8.814 3.282 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.319 -10.593 2.955 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.502 -10.271 4.471 1.00 0.00 H new ATOM 0 HG SER A 4 8.737 -12.217 3.458 1.00 0.00 H new ATOM 43 N GLY A 5 9.117 -6.633 3.644 1.00 0.00 N ATOM 44 CA GLY A 5 9.852 -5.424 4.067 1.00 0.00 C ATOM 45 C GLY A 5 8.994 -4.152 4.203 1.00 0.00 C ATOM 46 O GLY A 5 7.860 -4.052 3.726 1.00 0.00 O ATOM 0 H GLY A 5 8.104 -6.519 3.607 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.330 -5.625 5.026 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.648 -5.231 3.348 1.00 0.00 H new ATOM 50 N LYS A 6 9.621 -3.155 4.844 1.00 0.00 N ATOM 51 CA LYS A 6 9.049 -1.795 5.028 1.00 0.00 C ATOM 52 C LYS A 6 9.573 -0.903 3.870 1.00 0.00 C ATOM 53 O LYS A 6 10.788 -0.766 3.698 1.00 0.00 O ATOM 54 CB LYS A 6 9.471 -1.206 6.401 1.00 0.00 C ATOM 55 CG LYS A 6 8.713 -1.725 7.645 1.00 0.00 C ATOM 56 CD LYS A 6 8.893 -3.205 8.055 1.00 0.00 C ATOM 57 CE LYS A 6 10.340 -3.613 8.397 1.00 0.00 C ATOM 58 NZ LYS A 6 10.430 -5.044 8.731 1.00 0.00 N ATOM 0 H LYS A 6 10.548 -3.262 5.256 1.00 0.00 H new ATOM 0 HA LYS A 6 7.960 -1.838 5.012 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.533 -1.404 6.543 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.351 -0.123 6.357 1.00 0.00 H new ATOM 0 HG2 LYS A 6 9.007 -1.108 8.494 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.649 -1.554 7.480 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.260 -3.407 8.919 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.535 -3.838 7.243 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.991 -3.394 7.551 1.00 0.00 H new ATOM 0 HE3 LYS A 6 10.698 -3.018 9.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 11.416 -5.287 8.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.827 -5.247 9.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.111 -5.611 7.919 1.00 0.00 H new ATOM 72 N TYR A 7 8.662 -0.312 3.080 1.00 0.00 N ATOM 73 CA TYR A 7 9.035 0.480 1.875 1.00 0.00 C ATOM 74 C TYR A 7 8.624 1.954 2.141 1.00 0.00 C ATOM 75 O TYR A 7 7.438 2.297 2.116 1.00 0.00 O ATOM 76 CB TYR A 7 8.399 -0.109 0.582 1.00 0.00 C ATOM 77 CG TYR A 7 8.872 -1.517 0.161 1.00 0.00 C ATOM 78 CD1 TYR A 7 8.258 -2.657 0.692 1.00 0.00 C ATOM 79 CD2 TYR A 7 9.920 -1.673 -0.756 1.00 0.00 C ATOM 80 CE1 TYR A 7 8.702 -3.928 0.343 1.00 0.00 C ATOM 81 CE2 TYR A 7 10.348 -2.948 -1.122 1.00 0.00 C ATOM 82 CZ TYR A 7 9.752 -4.073 -0.561 1.00 0.00 C ATOM 83 OH TYR A 7 10.220 -5.324 -0.862 1.00 0.00 O ATOM 0 H TYR A 7 7.657 -0.362 3.247 1.00 0.00 H new ATOM 0 HA TYR A 7 10.110 0.435 1.701 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.318 -0.139 0.717 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.599 0.578 -0.240 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.432 -2.549 1.379 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.398 -0.802 -1.181 1.00 0.00 H new ATOM 0 HE1 TYR A 7 8.233 -4.801 0.772 1.00 0.00 H new ATOM 0 HE2 TYR A 7 11.144 -3.063 -1.843 1.00 0.00 H new ATOM 0 HH TYR A 7 9.889 -5.965 -0.199 1.00 0.00 H new ATOM 93 N GLN A 8 9.624 2.814 2.412 1.00 0.00 N ATOM 94 CA GLN A 8 9.420 4.235 2.800 1.00 0.00 C ATOM 95 C GLN A 8 9.079 5.107 1.563 1.00 0.00 C ATOM 96 O GLN A 8 9.909 5.248 0.661 1.00 0.00 O ATOM 97 CB GLN A 8 10.731 4.705 3.495 1.00 0.00 C ATOM 98 CG GLN A 8 10.745 6.122 4.113 1.00 0.00 C ATOM 99 CD GLN A 8 9.853 6.287 5.355 1.00 0.00 C ATOM 100 OE1 GLN A 8 10.154 5.772 6.431 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.749 7.006 5.238 1.00 0.00 N ATOM 0 H GLN A 8 10.607 2.546 2.369 1.00 0.00 H new ATOM 0 HA GLN A 8 8.575 4.337 3.481 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.967 3.992 4.285 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.537 4.649 2.764 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.770 6.377 4.382 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.427 6.838 3.355 1.00 0.00 H new ATOM 0 HE21 GLN A 8 8.508 7.429 4.341 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.138 7.138 6.044 1.00 0.00 H new ATOM 110 N LEU A 9 7.871 5.702 1.546 1.00 0.00 N ATOM 111 CA LEU A 9 7.356 6.464 0.375 1.00 0.00 C ATOM 112 C LEU A 9 8.125 7.797 0.158 1.00 0.00 C ATOM 113 O LEU A 9 7.964 8.758 0.913 1.00 0.00 O ATOM 114 CB LEU A 9 5.824 6.652 0.545 1.00 0.00 C ATOM 115 CG LEU A 9 5.043 7.388 -0.580 1.00 0.00 C ATOM 116 CD1 LEU A 9 5.142 6.694 -1.949 1.00 0.00 C ATOM 117 CD2 LEU A 9 3.563 7.549 -0.178 1.00 0.00 C ATOM 0 H LEU A 9 7.223 5.673 2.333 1.00 0.00 H new ATOM 0 HA LEU A 9 7.533 5.899 -0.540 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.379 5.664 0.667 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.657 7.194 1.476 1.00 0.00 H new ATOM 0 HG LEU A 9 5.512 8.366 -0.692 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.574 7.261 -2.686 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.187 6.643 -2.256 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.736 5.685 -1.876 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.024 8.066 -0.972 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.120 6.566 -0.019 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.497 8.130 0.742 1.00 0.00 H new ATOM 129 N GLN A 10 8.959 7.818 -0.893 1.00 0.00 N ATOM 130 CA GLN A 10 9.831 8.976 -1.228 1.00 0.00 C ATOM 131 C GLN A 10 9.086 10.032 -2.098 1.00 0.00 C ATOM 132 O GLN A 10 9.008 11.196 -1.694 1.00 0.00 O ATOM 133 CB GLN A 10 11.154 8.527 -1.919 1.00 0.00 C ATOM 134 CG GLN A 10 12.008 7.469 -1.183 1.00 0.00 C ATOM 135 CD GLN A 10 13.394 7.287 -1.825 1.00 0.00 C ATOM 136 OE1 GLN A 10 13.517 6.836 -2.964 1.00 0.00 O ATOM 137 NE2 GLN A 10 14.459 7.625 -1.115 1.00 0.00 N ATOM 0 H GLN A 10 9.055 7.036 -1.541 1.00 0.00 H new ATOM 0 HA GLN A 10 10.094 9.449 -0.282 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.905 8.134 -2.905 1.00 0.00 H new ATOM 0 HB3 GLN A 10 11.772 9.412 -2.075 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.129 7.764 -0.141 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.481 6.515 -1.185 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.346 7.998 -0.172 1.00 0.00 H new ATOM 0 HE22 GLN A 10 15.392 7.513 -1.511 1.00 0.00 H new ATOM 146 N SER A 11 8.587 9.629 -3.286 1.00 0.00 N ATOM 147 CA SER A 11 8.047 10.559 -4.311 1.00 0.00 C ATOM 148 C SER A 11 6.697 10.022 -4.857 1.00 0.00 C ATOM 149 O SER A 11 6.521 8.817 -5.071 1.00 0.00 O ATOM 150 CB SER A 11 9.096 10.710 -5.440 1.00 0.00 C ATOM 151 OG SER A 11 8.679 11.668 -6.405 1.00 0.00 O ATOM 0 H SER A 11 8.545 8.649 -3.565 1.00 0.00 H new ATOM 0 HA SER A 11 7.855 11.539 -3.873 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.052 11.012 -5.013 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.254 9.747 -5.925 1.00 0.00 H new ATOM 0 HG SER A 11 9.360 11.745 -7.105 1.00 0.00 H new ATOM 157 N GLN A 12 5.763 10.955 -5.114 1.00 0.00 N ATOM 158 CA GLN A 12 4.466 10.649 -5.767 1.00 0.00 C ATOM 159 C GLN A 12 4.350 11.482 -7.071 1.00 0.00 C ATOM 160 O GLN A 12 4.562 12.700 -7.088 1.00 0.00 O ATOM 161 CB GLN A 12 3.251 10.963 -4.854 1.00 0.00 C ATOM 162 CG GLN A 12 3.054 10.036 -3.633 1.00 0.00 C ATOM 163 CD GLN A 12 3.579 10.593 -2.300 1.00 0.00 C ATOM 164 OE1 GLN A 12 4.780 10.601 -2.032 1.00 0.00 O ATOM 165 NE2 GLN A 12 2.686 11.037 -1.429 1.00 0.00 N ATOM 0 H GLN A 12 5.880 11.940 -4.878 1.00 0.00 H new ATOM 0 HA GLN A 12 4.448 9.580 -5.980 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.349 11.987 -4.494 1.00 0.00 H new ATOM 0 HB3 GLN A 12 2.347 10.925 -5.462 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.990 9.823 -3.526 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.551 9.087 -3.833 1.00 0.00 H new ATOM 0 HE21 GLN A 12 1.694 11.024 -1.665 1.00 0.00 H new ATOM 0 HE22 GLN A 12 2.990 11.392 -0.522 1.00 0.00 H new ATOM 174 N GLU A 13 3.930 10.799 -8.147 1.00 0.00 N ATOM 175 CA GLU A 13 3.540 11.442 -9.428 1.00 0.00 C ATOM 176 C GLU A 13 2.131 12.108 -9.338 1.00 0.00 C ATOM 177 O GLU A 13 2.040 13.325 -9.521 1.00 0.00 O ATOM 178 CB GLU A 13 3.672 10.382 -10.556 1.00 0.00 C ATOM 179 CG GLU A 13 3.495 10.904 -11.997 1.00 0.00 C ATOM 180 CD GLU A 13 3.603 9.784 -13.037 1.00 0.00 C ATOM 181 OE1 GLU A 13 4.737 9.383 -13.381 1.00 0.00 O ATOM 182 OE2 GLU A 13 2.554 9.295 -13.512 1.00 0.00 O ATOM 0 H GLU A 13 3.848 9.782 -8.161 1.00 0.00 H new ATOM 0 HA GLU A 13 4.208 12.271 -9.661 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.655 9.917 -10.477 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.934 9.600 -10.381 1.00 0.00 H new ATOM 0 HG2 GLU A 13 2.524 11.390 -12.089 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.251 11.662 -12.202 1.00 0.00 H new ATOM 189 N ASN A 14 1.060 11.325 -9.082 1.00 0.00 N ATOM 190 CA ASN A 14 -0.344 11.822 -9.124 1.00 0.00 C ATOM 191 C ASN A 14 -1.108 11.462 -7.811 1.00 0.00 C ATOM 192 O ASN A 14 -2.063 10.679 -7.824 1.00 0.00 O ATOM 193 CB ASN A 14 -1.016 11.251 -10.413 1.00 0.00 C ATOM 194 CG ASN A 14 -0.695 11.944 -11.756 1.00 0.00 C ATOM 195 OD1 ASN A 14 0.106 12.873 -11.859 1.00 0.00 O ATOM 196 ND2 ASN A 14 -1.331 11.494 -12.825 1.00 0.00 N ATOM 0 H ASN A 14 1.137 10.337 -8.842 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.371 12.910 -9.175 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.735 10.202 -10.501 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.096 11.281 -10.270 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.158 11.917 -13.737 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.994 10.724 -12.737 1.00 0.00 H new ATOM 203 N PHE A 15 -0.712 12.080 -6.675 1.00 0.00 N ATOM 204 CA PHE A 15 -1.408 11.905 -5.365 1.00 0.00 C ATOM 205 C PHE A 15 -2.762 12.671 -5.271 1.00 0.00 C ATOM 206 O PHE A 15 -3.768 12.059 -4.903 1.00 0.00 O ATOM 207 CB PHE A 15 -0.424 12.247 -4.205 1.00 0.00 C ATOM 208 CG PHE A 15 -0.914 11.897 -2.785 1.00 0.00 C ATOM 209 CD1 PHE A 15 -0.705 10.616 -2.265 1.00 0.00 C ATOM 210 CD2 PHE A 15 -1.572 12.852 -2.000 1.00 0.00 C ATOM 211 CE1 PHE A 15 -1.148 10.290 -0.987 1.00 0.00 C ATOM 212 CE2 PHE A 15 -2.022 12.522 -0.724 1.00 0.00 C ATOM 213 CZ PHE A 15 -1.812 11.242 -0.219 1.00 0.00 C ATOM 0 H PHE A 15 0.090 12.709 -6.632 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.697 10.858 -5.273 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.515 11.724 -4.384 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.206 13.314 -4.241 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -0.195 9.873 -2.861 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -1.731 13.848 -2.386 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -0.977 9.300 -0.592 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -2.535 13.260 -0.125 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.165 10.987 0.770 1.00 0.00 H new ATOM 223 N GLU A 16 -2.785 13.987 -5.572 1.00 0.00 N ATOM 224 CA GLU A 16 -4.000 14.841 -5.423 1.00 0.00 C ATOM 225 C GLU A 16 -5.177 14.495 -6.389 1.00 0.00 C ATOM 226 O GLU A 16 -6.324 14.430 -5.934 1.00 0.00 O ATOM 227 CB GLU A 16 -3.650 16.356 -5.480 1.00 0.00 C ATOM 228 CG GLU A 16 -2.531 16.840 -4.523 1.00 0.00 C ATOM 229 CD GLU A 16 -2.469 18.361 -4.371 1.00 0.00 C ATOM 230 OE1 GLU A 16 -1.827 19.029 -5.211 1.00 0.00 O ATOM 231 OE2 GLU A 16 -3.057 18.896 -3.405 1.00 0.00 O ATOM 0 H GLU A 16 -1.971 14.492 -5.923 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.376 14.604 -4.428 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.356 16.601 -6.501 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.555 16.924 -5.263 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.685 16.391 -3.542 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -1.570 16.481 -4.891 1.00 0.00 H new ATOM 238 N ALA A 17 -4.894 14.235 -7.684 1.00 0.00 N ATOM 239 CA ALA A 17 -5.887 13.673 -8.641 1.00 0.00 C ATOM 240 C ALA A 17 -6.477 12.275 -8.276 1.00 0.00 C ATOM 241 O ALA A 17 -7.693 12.101 -8.393 1.00 0.00 O ATOM 242 CB ALA A 17 -5.252 13.651 -10.045 1.00 0.00 C ATOM 0 H ALA A 17 -3.978 14.406 -8.099 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.754 14.332 -8.598 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.965 13.242 -10.761 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.984 14.666 -10.339 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.357 13.030 -10.030 1.00 0.00 H new ATOM 248 N PHE A 18 -5.650 11.303 -7.832 1.00 0.00 N ATOM 249 CA PHE A 18 -6.119 9.939 -7.451 1.00 0.00 C ATOM 250 C PHE A 18 -7.009 9.899 -6.170 1.00 0.00 C ATOM 251 O PHE A 18 -8.089 9.309 -6.226 1.00 0.00 O ATOM 252 CB PHE A 18 -4.895 8.984 -7.369 1.00 0.00 C ATOM 253 CG PHE A 18 -5.233 7.492 -7.182 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.385 6.965 -5.892 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.386 6.648 -8.288 1.00 0.00 C ATOM 256 CE1 PHE A 18 -5.685 5.619 -5.713 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.684 5.299 -8.104 1.00 0.00 C ATOM 258 CZ PHE A 18 -5.839 4.788 -6.818 1.00 0.00 C ATOM 0 H PHE A 18 -4.644 11.434 -7.726 1.00 0.00 H new ATOM 0 HA PHE A 18 -6.792 9.591 -8.235 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.307 9.095 -8.280 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.262 9.302 -6.541 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.268 7.608 -5.032 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.273 7.043 -9.287 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.798 5.219 -4.716 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.795 4.649 -8.960 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.079 3.744 -6.678 1.00 0.00 H new ATOM 268 N MET A 19 -6.557 10.491 -5.043 1.00 0.00 N ATOM 269 CA MET A 19 -7.317 10.535 -3.761 1.00 0.00 C ATOM 270 C MET A 19 -8.741 11.167 -3.858 1.00 0.00 C ATOM 271 O MET A 19 -9.702 10.540 -3.405 1.00 0.00 O ATOM 272 CB MET A 19 -6.455 11.248 -2.682 1.00 0.00 C ATOM 273 CG MET A 19 -5.411 10.385 -1.955 1.00 0.00 C ATOM 274 SD MET A 19 -4.306 9.507 -3.082 1.00 0.00 S ATOM 275 CE MET A 19 -3.919 8.060 -2.073 1.00 0.00 C ATOM 0 H MET A 19 -5.651 10.956 -4.990 1.00 0.00 H new ATOM 0 HA MET A 19 -7.506 9.499 -3.478 1.00 0.00 H new ATOM 0 HB2 MET A 19 -5.937 12.082 -3.156 1.00 0.00 H new ATOM 0 HB3 MET A 19 -7.126 11.672 -1.935 1.00 0.00 H new ATOM 0 HG2 MET A 19 -4.818 11.020 -1.297 1.00 0.00 H new ATOM 0 HG3 MET A 19 -5.924 9.661 -1.322 1.00 0.00 H new ATOM 0 HE1 MET A 19 -3.053 7.546 -2.491 1.00 0.00 H new ATOM 0 HE2 MET A 19 -3.696 8.376 -1.054 1.00 0.00 H new ATOM 0 HE3 MET A 19 -4.774 7.383 -2.064 1.00 0.00 H new ATOM 285 N LYS A 20 -8.884 12.356 -4.479 1.00 0.00 N ATOM 286 CA LYS A 20 -10.201 12.964 -4.798 1.00 0.00 C ATOM 287 C LYS A 20 -11.106 12.118 -5.759 1.00 0.00 C ATOM 288 O LYS A 20 -12.306 12.005 -5.496 1.00 0.00 O ATOM 289 CB LYS A 20 -9.898 14.391 -5.333 1.00 0.00 C ATOM 290 CG LYS A 20 -11.136 15.290 -5.523 1.00 0.00 C ATOM 291 CD LYS A 20 -10.830 16.748 -5.925 1.00 0.00 C ATOM 292 CE LYS A 20 -10.238 16.915 -7.340 1.00 0.00 C ATOM 293 NZ LYS A 20 -10.031 18.335 -7.669 1.00 0.00 N ATOM 0 H LYS A 20 -8.091 12.925 -4.775 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.813 13.001 -3.897 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.212 14.883 -4.644 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.381 14.303 -6.289 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.775 14.845 -6.286 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -11.706 15.298 -4.594 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -11.750 17.329 -5.860 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.133 17.171 -5.202 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.289 16.382 -7.405 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.907 16.464 -8.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.632 18.415 -8.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.941 18.837 -7.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.373 18.758 -6.983 1.00 0.00 H new ATOM 307 N ALA A 21 -10.540 11.520 -6.830 1.00 0.00 N ATOM 308 CA ALA A 21 -11.286 10.617 -7.748 1.00 0.00 C ATOM 309 C ALA A 21 -11.784 9.256 -7.164 1.00 0.00 C ATOM 310 O ALA A 21 -12.822 8.772 -7.627 1.00 0.00 O ATOM 311 CB ALA A 21 -10.424 10.392 -9.002 1.00 0.00 C ATOM 0 H ALA A 21 -9.560 11.645 -7.086 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.220 11.133 -7.969 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -10.950 9.732 -9.692 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.234 11.348 -9.489 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.476 9.936 -8.715 1.00 0.00 H new ATOM 317 N ILE A 22 -11.096 8.653 -6.166 1.00 0.00 N ATOM 318 CA ILE A 22 -11.608 7.450 -5.433 1.00 0.00 C ATOM 319 C ILE A 22 -12.706 7.812 -4.375 1.00 0.00 C ATOM 320 O ILE A 22 -13.762 7.174 -4.368 1.00 0.00 O ATOM 321 CB ILE A 22 -10.481 6.497 -4.889 1.00 0.00 C ATOM 322 CG1 ILE A 22 -9.544 7.091 -3.793 1.00 0.00 C ATOM 323 CG2 ILE A 22 -9.648 5.889 -6.046 1.00 0.00 C ATOM 324 CD1 ILE A 22 -8.663 6.071 -3.052 1.00 0.00 C ATOM 0 H ILE A 22 -10.183 8.973 -5.843 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.114 6.845 -6.185 1.00 0.00 H new ATOM 0 HB ILE A 22 -11.037 5.713 -4.375 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.896 7.835 -4.257 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.157 7.615 -3.060 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.878 5.236 -5.636 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -10.301 5.313 -6.701 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.178 6.690 -6.616 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.051 6.588 -2.313 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -9.297 5.339 -2.551 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.016 5.562 -3.767 1.00 0.00 H new ATOM 336 N GLY A 23 -12.464 8.821 -3.515 1.00 0.00 N ATOM 337 CA GLY A 23 -13.452 9.323 -2.536 1.00 0.00 C ATOM 338 C GLY A 23 -12.823 9.591 -1.155 1.00 0.00 C ATOM 339 O GLY A 23 -13.193 8.928 -0.182 1.00 0.00 O ATOM 0 H GLY A 23 -11.572 9.315 -3.479 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.899 10.242 -2.914 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.258 8.596 -2.431 1.00 0.00 H new ATOM 343 N LEU A 24 -11.900 10.571 -1.076 1.00 0.00 N ATOM 344 CA LEU A 24 -11.209 10.958 0.176 1.00 0.00 C ATOM 345 C LEU A 24 -11.256 12.513 0.369 1.00 0.00 C ATOM 346 O LEU A 24 -11.202 13.248 -0.627 1.00 0.00 O ATOM 347 CB LEU A 24 -9.737 10.451 0.139 1.00 0.00 C ATOM 348 CG LEU A 24 -9.513 8.982 0.593 1.00 0.00 C ATOM 349 CD1 LEU A 24 -8.140 8.464 0.129 1.00 0.00 C ATOM 350 CD2 LEU A 24 -9.650 8.789 2.117 1.00 0.00 C ATOM 0 H LEU A 24 -11.609 11.122 -1.884 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.719 10.498 1.023 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.362 10.557 -0.879 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.133 11.102 0.771 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.304 8.401 0.119 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.009 7.434 0.460 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.084 8.506 -0.959 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.353 9.085 0.557 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.482 7.742 2.368 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.913 9.407 2.630 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -10.652 9.081 2.432 1.00 0.00 H new ATOM 362 N PRO A 25 -11.311 13.064 1.622 1.00 0.00 N ATOM 363 CA PRO A 25 -11.365 14.529 1.870 1.00 0.00 C ATOM 364 C PRO A 25 -10.073 15.292 1.482 1.00 0.00 C ATOM 365 O PRO A 25 -8.965 14.766 1.622 1.00 0.00 O ATOM 366 CB PRO A 25 -11.616 14.613 3.392 1.00 0.00 C ATOM 367 CG PRO A 25 -11.111 13.295 3.977 1.00 0.00 C ATOM 368 CD PRO A 25 -11.344 12.271 2.866 1.00 0.00 C ATOM 0 HA PRO A 25 -12.130 15.003 1.256 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.088 15.461 3.828 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.676 14.754 3.605 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.056 13.358 4.245 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.655 13.028 4.883 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.572 11.501 2.867 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.301 11.763 2.988 1.00 0.00 H new ATOM 376 N GLU A 26 -10.238 16.560 1.069 1.00 0.00 N ATOM 377 CA GLU A 26 -9.108 17.496 0.835 1.00 0.00 C ATOM 378 C GLU A 26 -8.181 17.794 2.058 1.00 0.00 C ATOM 379 O GLU A 26 -6.993 18.043 1.842 1.00 0.00 O ATOM 380 CB GLU A 26 -9.673 18.787 0.186 1.00 0.00 C ATOM 381 CG GLU A 26 -9.764 18.795 -1.360 1.00 0.00 C ATOM 382 CD GLU A 26 -10.883 17.924 -1.948 1.00 0.00 C ATOM 383 OE1 GLU A 26 -12.022 18.420 -2.092 1.00 0.00 O ATOM 384 OE2 GLU A 26 -10.631 16.739 -2.263 1.00 0.00 O ATOM 0 H GLU A 26 -11.153 16.971 0.886 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.420 16.988 0.160 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.671 18.964 0.588 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.051 19.626 0.496 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.909 19.822 -1.695 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.810 18.459 -1.767 1.00 0.00 H new ATOM 391 N GLU A 27 -8.671 17.719 3.315 1.00 0.00 N ATOM 392 CA GLU A 27 -7.800 17.704 4.522 1.00 0.00 C ATOM 393 C GLU A 27 -6.825 16.486 4.606 1.00 0.00 C ATOM 394 O GLU A 27 -5.641 16.722 4.853 1.00 0.00 O ATOM 395 CB GLU A 27 -8.667 17.887 5.794 1.00 0.00 C ATOM 396 CG GLU A 27 -7.885 18.174 7.095 1.00 0.00 C ATOM 397 CD GLU A 27 -7.081 19.480 7.106 1.00 0.00 C ATOM 398 OE1 GLU A 27 -7.665 20.549 7.388 1.00 0.00 O ATOM 399 OE2 GLU A 27 -5.861 19.440 6.828 1.00 0.00 O ATOM 0 H GLU A 27 -9.668 17.668 3.526 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.122 18.553 4.439 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.365 18.706 5.622 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.262 16.986 5.940 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -8.591 18.195 7.926 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -7.201 17.345 7.278 1.00 0.00 H new ATOM 406 N LEU A 28 -7.268 15.227 4.364 1.00 0.00 N ATOM 407 CA LEU A 28 -6.324 14.079 4.157 1.00 0.00 C ATOM 408 C LEU A 28 -5.459 14.096 2.849 1.00 0.00 C ATOM 409 O LEU A 28 -4.451 13.383 2.805 1.00 0.00 O ATOM 410 CB LEU A 28 -7.058 12.712 4.293 1.00 0.00 C ATOM 411 CG LEU A 28 -7.592 12.313 5.700 1.00 0.00 C ATOM 412 CD1 LEU A 28 -8.409 11.007 5.614 1.00 0.00 C ATOM 413 CD2 LEU A 28 -6.474 12.142 6.754 1.00 0.00 C ATOM 0 H LEU A 28 -8.254 14.974 4.306 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.600 14.213 4.960 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.902 12.714 3.603 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.375 11.930 3.960 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.224 13.139 6.027 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -8.775 10.741 6.606 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.254 11.150 4.941 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.775 10.206 5.235 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -6.916 11.864 7.711 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.786 11.361 6.431 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.931 13.081 6.864 1.00 0.00 H new ATOM 425 N ILE A 29 -5.794 14.902 1.818 1.00 0.00 N ATOM 426 CA ILE A 29 -4.903 15.159 0.645 1.00 0.00 C ATOM 427 C ILE A 29 -3.736 16.120 1.043 1.00 0.00 C ATOM 428 O ILE A 29 -2.577 15.763 0.833 1.00 0.00 O ATOM 429 CB ILE A 29 -5.701 15.625 -0.627 1.00 0.00 C ATOM 430 CG1 ILE A 29 -6.781 14.588 -1.049 1.00 0.00 C ATOM 431 CG2 ILE A 29 -4.760 15.910 -1.825 1.00 0.00 C ATOM 432 CD1 ILE A 29 -7.716 14.978 -2.202 1.00 0.00 C ATOM 0 H ILE A 29 -6.685 15.396 1.767 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.447 14.214 0.351 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.201 16.552 -0.347 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.273 13.664 -1.324 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.395 14.366 -0.176 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.351 16.229 -2.684 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.056 16.698 -1.556 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.210 15.004 -2.080 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.418 14.166 -2.392 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.268 15.879 -1.934 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.127 15.166 -3.100 1.00 0.00 H new ATOM 444 N GLN A 30 -4.033 17.316 1.588 1.00 0.00 N ATOM 445 CA GLN A 30 -3.000 18.290 2.042 1.00 0.00 C ATOM 446 C GLN A 30 -2.138 17.858 3.276 1.00 0.00 C ATOM 447 O GLN A 30 -0.978 18.271 3.362 1.00 0.00 O ATOM 448 CB GLN A 30 -3.655 19.680 2.294 1.00 0.00 C ATOM 449 CG GLN A 30 -3.962 20.543 1.046 1.00 0.00 C ATOM 450 CD GLN A 30 -5.234 20.193 0.252 1.00 0.00 C ATOM 451 OE1 GLN A 30 -6.343 20.570 0.629 1.00 0.00 O ATOM 452 NE2 GLN A 30 -5.106 19.502 -0.871 1.00 0.00 N ATOM 0 H GLN A 30 -4.990 17.641 1.729 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.284 18.337 1.222 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.587 19.523 2.836 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -2.998 20.252 2.949 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -4.036 21.583 1.363 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -3.110 20.475 0.369 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -4.183 19.193 -1.177 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -5.930 19.279 -1.429 1.00 0.00 H new ATOM 461 N LYS A 31 -2.668 17.033 4.201 1.00 0.00 N ATOM 462 CA LYS A 31 -1.868 16.366 5.261 1.00 0.00 C ATOM 463 C LYS A 31 -1.048 15.171 4.691 1.00 0.00 C ATOM 464 O LYS A 31 0.178 15.178 4.825 1.00 0.00 O ATOM 465 CB LYS A 31 -2.809 15.934 6.421 1.00 0.00 C ATOM 466 CG LYS A 31 -3.347 17.070 7.329 1.00 0.00 C ATOM 467 CD LYS A 31 -2.537 17.364 8.611 1.00 0.00 C ATOM 468 CE LYS A 31 -1.123 17.937 8.391 1.00 0.00 C ATOM 469 NZ LYS A 31 -0.482 18.286 9.671 1.00 0.00 N ATOM 0 H LYS A 31 -3.662 16.807 4.239 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.137 17.072 5.656 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.661 15.407 5.992 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.274 15.220 7.047 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.397 17.985 6.739 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.368 16.822 7.619 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.103 18.066 9.223 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -2.450 16.441 9.184 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -0.510 17.207 7.862 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.181 18.822 7.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 0.468 18.669 9.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -1.056 19.001 10.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -0.405 17.435 10.264 1.00 0.00 H new ATOM 483 N GLY A 32 -1.703 14.184 4.044 1.00 0.00 N ATOM 484 CA GLY A 32 -1.023 13.020 3.429 1.00 0.00 C ATOM 485 C GLY A 32 -0.008 13.218 2.275 1.00 0.00 C ATOM 486 O GLY A 32 0.806 12.318 2.055 1.00 0.00 O ATOM 0 H GLY A 32 -2.717 14.170 3.932 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.502 12.493 4.228 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.801 12.351 3.061 1.00 0.00 H new ATOM 490 N LYS A 33 -0.025 14.362 1.560 1.00 0.00 N ATOM 491 CA LYS A 33 1.056 14.741 0.603 1.00 0.00 C ATOM 492 C LYS A 33 2.432 15.049 1.290 1.00 0.00 C ATOM 493 O LYS A 33 3.465 14.548 0.838 1.00 0.00 O ATOM 494 CB LYS A 33 0.554 15.851 -0.365 1.00 0.00 C ATOM 495 CG LYS A 33 0.391 17.280 0.201 1.00 0.00 C ATOM 496 CD LYS A 33 -0.246 18.293 -0.771 1.00 0.00 C ATOM 497 CE LYS A 33 0.612 18.700 -1.985 1.00 0.00 C ATOM 498 NZ LYS A 33 1.844 19.429 -1.623 1.00 0.00 N ATOM 0 H LYS A 33 -0.777 15.048 1.622 1.00 0.00 H new ATOM 0 HA LYS A 33 1.282 13.866 -0.007 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.246 15.901 -1.206 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -0.410 15.537 -0.764 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.219 17.231 1.103 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.371 17.651 0.499 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.183 17.874 -1.138 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.498 19.194 -0.211 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.881 17.804 -2.545 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.013 19.323 -2.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.371 19.671 -2.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.595 20.301 -1.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 2.436 18.829 -1.013 1.00 0.00 H new ATOM 512 N ASP A 34 2.421 15.821 2.397 1.00 0.00 N ATOM 513 CA ASP A 34 3.599 16.030 3.286 1.00 0.00 C ATOM 514 C ASP A 34 4.042 14.771 4.103 1.00 0.00 C ATOM 515 O ASP A 34 5.248 14.570 4.267 1.00 0.00 O ATOM 516 CB ASP A 34 3.324 17.217 4.252 1.00 0.00 C ATOM 517 CG ASP A 34 3.157 18.592 3.585 1.00 0.00 C ATOM 518 OD1 ASP A 34 4.179 19.261 3.313 1.00 0.00 O ATOM 519 OD2 ASP A 34 2.004 19.003 3.327 1.00 0.00 O ATOM 0 H ASP A 34 1.590 16.324 2.708 1.00 0.00 H new ATOM 0 HA ASP A 34 4.433 16.251 2.619 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.421 16.997 4.821 1.00 0.00 H new ATOM 0 HB3 ASP A 34 4.144 17.277 4.967 1.00 0.00 H new ATOM 524 N ILE A 35 3.099 13.937 4.606 1.00 0.00 N ATOM 525 CA ILE A 35 3.407 12.695 5.375 1.00 0.00 C ATOM 526 C ILE A 35 3.915 11.608 4.372 1.00 0.00 C ATOM 527 O ILE A 35 3.232 11.276 3.397 1.00 0.00 O ATOM 528 CB ILE A 35 2.159 12.199 6.203 1.00 0.00 C ATOM 529 CG1 ILE A 35 1.582 13.254 7.200 1.00 0.00 C ATOM 530 CG2 ILE A 35 2.450 10.889 6.988 1.00 0.00 C ATOM 531 CD1 ILE A 35 0.117 13.018 7.612 1.00 0.00 C ATOM 0 H ILE A 35 2.099 14.103 4.492 1.00 0.00 H new ATOM 0 HA ILE A 35 4.187 12.901 6.108 1.00 0.00 H new ATOM 0 HB ILE A 35 1.405 12.017 5.437 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.201 13.262 8.097 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.663 14.243 6.748 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.559 10.591 7.541 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.725 10.099 6.289 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.270 11.057 7.686 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.196 13.799 8.305 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.518 13.042 6.727 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.027 12.046 8.097 1.00 0.00 H new ATOM 543 N LYS A 36 5.100 11.039 4.663 1.00 0.00 N ATOM 544 CA LYS A 36 5.671 9.913 3.879 1.00 0.00 C ATOM 545 C LYS A 36 5.101 8.580 4.444 1.00 0.00 C ATOM 546 O LYS A 36 5.555 8.080 5.478 1.00 0.00 O ATOM 547 CB LYS A 36 7.224 9.941 3.902 1.00 0.00 C ATOM 548 CG LYS A 36 7.903 11.053 3.068 1.00 0.00 C ATOM 549 CD LYS A 36 8.121 12.393 3.804 1.00 0.00 C ATOM 550 CE LYS A 36 8.768 13.499 2.948 1.00 0.00 C ATOM 551 NZ LYS A 36 10.189 13.246 2.640 1.00 0.00 N ATOM 0 H LYS A 36 5.689 11.339 5.440 1.00 0.00 H new ATOM 0 HA LYS A 36 5.383 10.007 2.832 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.549 10.044 4.937 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.589 8.977 3.548 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.870 10.686 2.723 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.298 11.239 2.181 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.159 12.752 4.170 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.748 12.215 4.677 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.213 13.597 2.015 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.681 14.451 3.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.563 14.026 2.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 10.730 13.180 3.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.277 12.353 2.114 1.00 0.00 H new ATOM 565 N GLY A 37 4.072 8.042 3.763 1.00 0.00 N ATOM 566 CA GLY A 37 3.311 6.875 4.255 1.00 0.00 C ATOM 567 C GLY A 37 3.928 5.530 3.834 1.00 0.00 C ATOM 568 O GLY A 37 3.887 5.167 2.656 1.00 0.00 O ATOM 0 H GLY A 37 3.746 8.399 2.865 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.255 6.918 5.343 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.289 6.932 3.881 1.00 0.00 H new ATOM 572 N VAL A 38 4.460 4.793 4.823 1.00 0.00 N ATOM 573 CA VAL A 38 5.165 3.495 4.605 1.00 0.00 C ATOM 574 C VAL A 38 4.162 2.405 4.104 1.00 0.00 C ATOM 575 O VAL A 38 3.113 2.170 4.716 1.00 0.00 O ATOM 576 CB VAL A 38 5.922 3.034 5.907 1.00 0.00 C ATOM 577 CG1 VAL A 38 6.720 1.716 5.732 1.00 0.00 C ATOM 578 CG2 VAL A 38 6.910 4.081 6.476 1.00 0.00 C ATOM 0 H VAL A 38 4.419 5.072 5.803 1.00 0.00 H new ATOM 0 HA VAL A 38 5.918 3.638 3.830 1.00 0.00 H new ATOM 0 HB VAL A 38 5.099 2.888 6.607 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.214 1.463 6.670 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.039 0.913 5.452 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.469 1.845 4.951 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.387 3.682 7.371 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.671 4.307 5.729 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.368 4.992 6.729 1.00 0.00 H new ATOM 588 N SER A 39 4.536 1.733 3.002 1.00 0.00 N ATOM 589 CA SER A 39 3.825 0.532 2.499 1.00 0.00 C ATOM 590 C SER A 39 4.585 -0.731 2.963 1.00 0.00 C ATOM 591 O SER A 39 5.652 -1.071 2.443 1.00 0.00 O ATOM 592 CB SER A 39 3.654 0.591 0.969 1.00 0.00 C ATOM 593 OG SER A 39 4.884 0.756 0.267 1.00 0.00 O ATOM 0 H SER A 39 5.338 2.002 2.431 1.00 0.00 H new ATOM 0 HA SER A 39 2.817 0.496 2.913 1.00 0.00 H new ATOM 0 HB2 SER A 39 3.171 -0.325 0.629 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.987 1.416 0.717 1.00 0.00 H new ATOM 0 HG SER A 39 4.709 0.784 -0.697 1.00 0.00 H new ATOM 599 N GLU A 40 4.007 -1.417 3.956 1.00 0.00 N ATOM 600 CA GLU A 40 4.549 -2.687 4.490 1.00 0.00 C ATOM 601 C GLU A 40 4.030 -3.887 3.663 1.00 0.00 C ATOM 602 O GLU A 40 2.942 -3.845 3.085 1.00 0.00 O ATOM 603 CB GLU A 40 4.130 -2.853 5.969 1.00 0.00 C ATOM 604 CG GLU A 40 4.758 -1.867 6.971 1.00 0.00 C ATOM 605 CD GLU A 40 3.809 -0.762 7.447 1.00 0.00 C ATOM 606 OE1 GLU A 40 3.745 0.306 6.799 1.00 0.00 O ATOM 607 OE2 GLU A 40 3.118 -0.958 8.471 1.00 0.00 O ATOM 0 H GLU A 40 3.149 -1.113 4.417 1.00 0.00 H new ATOM 0 HA GLU A 40 5.636 -2.659 4.421 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.046 -2.759 6.030 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.380 -3.866 6.284 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.112 -2.424 7.838 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.632 -1.406 6.510 1.00 0.00 H new ATOM 614 N ILE A 41 4.841 -4.954 3.613 1.00 0.00 N ATOM 615 CA ILE A 41 4.505 -6.192 2.849 1.00 0.00 C ATOM 616 C ILE A 41 4.981 -7.405 3.709 1.00 0.00 C ATOM 617 O ILE A 41 6.073 -7.400 4.285 1.00 0.00 O ATOM 618 CB ILE A 41 5.077 -6.202 1.376 1.00 0.00 C ATOM 619 CG1 ILE A 41 4.619 -4.966 0.537 1.00 0.00 C ATOM 620 CG2 ILE A 41 4.695 -7.510 0.633 1.00 0.00 C ATOM 621 CD1 ILE A 41 5.163 -4.824 -0.891 1.00 0.00 C ATOM 0 H ILE A 41 5.741 -4.996 4.091 1.00 0.00 H new ATOM 0 HA ILE A 41 3.428 -6.247 2.692 1.00 0.00 H new ATOM 0 HB ILE A 41 6.161 -6.147 1.476 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.531 -4.986 0.479 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.893 -4.067 1.090 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.103 -7.487 -0.378 1.00 0.00 H new ATOM 0 HG22 ILE A 41 5.104 -8.366 1.170 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.610 -7.597 0.584 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.758 -3.921 -1.347 1.00 0.00 H new ATOM 0 HD12 ILE A 41 6.251 -4.759 -0.861 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.868 -5.692 -1.481 1.00 0.00 H new ATOM 633 N VAL A 42 4.144 -8.460 3.745 1.00 0.00 N ATOM 634 CA VAL A 42 4.499 -9.766 4.361 1.00 0.00 C ATOM 635 C VAL A 42 4.143 -10.831 3.280 1.00 0.00 C ATOM 636 O VAL A 42 2.969 -11.168 3.094 1.00 0.00 O ATOM 637 CB VAL A 42 3.767 -10.010 5.728 1.00 0.00 C ATOM 638 CG1 VAL A 42 4.215 -11.328 6.405 1.00 0.00 C ATOM 639 CG2 VAL A 42 3.910 -8.854 6.749 1.00 0.00 C ATOM 0 H VAL A 42 3.204 -8.437 3.351 1.00 0.00 H new ATOM 0 HA VAL A 42 5.555 -9.811 4.629 1.00 0.00 H new ATOM 0 HB VAL A 42 2.715 -10.072 5.448 1.00 0.00 H new ATOM 0 HG11 VAL A 42 3.681 -11.453 7.347 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.992 -12.169 5.748 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.287 -11.292 6.598 1.00 0.00 H new ATOM 0 HG21 VAL A 42 3.374 -9.108 7.663 1.00 0.00 H new ATOM 0 HG22 VAL A 42 4.964 -8.699 6.978 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.493 -7.941 6.325 1.00 0.00 H new ATOM 649 N GLN A 43 5.170 -11.371 2.597 1.00 0.00 N ATOM 650 CA GLN A 43 5.011 -12.505 1.648 1.00 0.00 C ATOM 651 C GLN A 43 5.195 -13.833 2.436 1.00 0.00 C ATOM 652 O GLN A 43 6.299 -14.136 2.903 1.00 0.00 O ATOM 653 CB GLN A 43 6.036 -12.339 0.492 1.00 0.00 C ATOM 654 CG GLN A 43 5.992 -13.441 -0.597 1.00 0.00 C ATOM 655 CD GLN A 43 7.032 -13.236 -1.713 1.00 0.00 C ATOM 656 OE1 GLN A 43 8.239 -13.203 -1.470 1.00 0.00 O ATOM 657 NE2 GLN A 43 6.599 -13.099 -2.956 1.00 0.00 N ATOM 0 H GLN A 43 6.131 -11.040 2.682 1.00 0.00 H new ATOM 0 HA GLN A 43 4.018 -12.522 1.198 1.00 0.00 H new ATOM 0 HB2 GLN A 43 5.867 -11.373 0.015 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.039 -12.313 0.919 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.158 -14.411 -0.129 1.00 0.00 H new ATOM 0 HG3 GLN A 43 4.996 -13.466 -1.038 1.00 0.00 H new ATOM 0 HE21 GLN A 43 5.599 -13.127 -3.154 1.00 0.00 H new ATOM 0 HE22 GLN A 43 7.266 -12.966 -3.716 1.00 0.00 H new ATOM 666 N ASN A 44 4.107 -14.618 2.555 1.00 0.00 N ATOM 667 CA ASN A 44 4.139 -15.965 3.192 1.00 0.00 C ATOM 668 C ASN A 44 3.647 -17.039 2.168 1.00 0.00 C ATOM 669 O ASN A 44 2.620 -17.693 2.378 1.00 0.00 O ATOM 670 CB ASN A 44 3.304 -15.890 4.511 1.00 0.00 C ATOM 671 CG ASN A 44 3.731 -16.891 5.597 1.00 0.00 C ATOM 672 OD1 ASN A 44 3.365 -18.066 5.569 1.00 0.00 O ATOM 673 ND2 ASN A 44 4.502 -16.435 6.575 1.00 0.00 N ATOM 0 H ASN A 44 3.184 -14.346 2.218 1.00 0.00 H new ATOM 0 HA ASN A 44 5.148 -16.272 3.468 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.379 -14.881 4.916 1.00 0.00 H new ATOM 0 HB3 ASN A 44 2.254 -16.060 4.271 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.802 -17.061 7.322 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.795 -15.458 6.580 1.00 0.00 H new ATOM 680 N GLY A 45 4.382 -17.205 1.044 1.00 0.00 N ATOM 681 CA GLY A 45 3.968 -18.084 -0.076 1.00 0.00 C ATOM 682 C GLY A 45 2.757 -17.535 -0.864 1.00 0.00 C ATOM 683 O GLY A 45 2.851 -16.494 -1.523 1.00 0.00 O ATOM 0 H GLY A 45 5.274 -16.736 0.888 1.00 0.00 H new ATOM 0 HA2 GLY A 45 4.809 -18.214 -0.758 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.721 -19.070 0.317 1.00 0.00 H new ATOM 687 N LYS A 46 1.618 -18.234 -0.737 1.00 0.00 N ATOM 688 CA LYS A 46 0.297 -17.748 -1.223 1.00 0.00 C ATOM 689 C LYS A 46 -0.338 -16.645 -0.316 1.00 0.00 C ATOM 690 O LYS A 46 -0.862 -15.670 -0.858 1.00 0.00 O ATOM 691 CB LYS A 46 -0.683 -18.943 -1.387 1.00 0.00 C ATOM 692 CG LYS A 46 -0.326 -19.983 -2.477 1.00 0.00 C ATOM 693 CD LYS A 46 -1.257 -21.220 -2.508 1.00 0.00 C ATOM 694 CE LYS A 46 -2.695 -21.003 -3.024 1.00 0.00 C ATOM 695 NZ LYS A 46 -2.761 -20.789 -4.482 1.00 0.00 N ATOM 0 H LYS A 46 1.577 -19.153 -0.296 1.00 0.00 H new ATOM 0 HA LYS A 46 0.478 -17.278 -2.190 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.753 -19.461 -0.431 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.674 -18.545 -1.607 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.357 -19.496 -3.451 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.699 -20.318 -2.320 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.786 -21.983 -3.128 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -1.317 -21.624 -1.497 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.303 -21.869 -2.762 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.131 -20.142 -2.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.682 -21.113 -4.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.646 -19.776 -4.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.001 -21.326 -4.946 1.00 0.00 H new ATOM 709 N HIS A 47 -0.295 -16.785 1.032 1.00 0.00 N ATOM 710 CA HIS A 47 -0.884 -15.807 1.991 1.00 0.00 C ATOM 711 C HIS A 47 -0.004 -14.535 2.050 1.00 0.00 C ATOM 712 O HIS A 47 1.146 -14.579 2.488 1.00 0.00 O ATOM 713 CB HIS A 47 -1.000 -16.446 3.405 1.00 0.00 C ATOM 714 CG HIS A 47 -2.192 -17.391 3.637 1.00 0.00 C ATOM 715 ND1 HIS A 47 -2.916 -17.419 4.814 1.00 0.00 N ATOM 716 CD2 HIS A 47 -2.721 -18.345 2.739 1.00 0.00 C ATOM 717 CE1 HIS A 47 -3.832 -18.391 4.512 1.00 0.00 C ATOM 718 NE2 HIS A 47 -3.805 -19.013 3.290 1.00 0.00 N ATOM 0 H HIS A 47 0.150 -17.581 1.490 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.882 -15.532 1.650 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.082 -16.999 3.605 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.054 -15.642 4.139 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.331 -18.531 1.749 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.580 -18.669 5.240 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.401 -19.745 2.903 1.00 0.00 H new ATOM 726 N PHE A 48 -0.540 -13.427 1.523 1.00 0.00 N ATOM 727 CA PHE A 48 0.297 -12.313 1.019 1.00 0.00 C ATOM 728 C PHE A 48 -0.480 -11.007 1.321 1.00 0.00 C ATOM 729 O PHE A 48 -1.389 -10.619 0.585 1.00 0.00 O ATOM 730 CB PHE A 48 0.587 -12.590 -0.487 1.00 0.00 C ATOM 731 CG PHE A 48 1.748 -11.861 -1.187 1.00 0.00 C ATOM 732 CD1 PHE A 48 2.130 -10.545 -0.888 1.00 0.00 C ATOM 733 CD2 PHE A 48 2.401 -12.538 -2.226 1.00 0.00 C ATOM 734 CE1 PHE A 48 3.153 -9.932 -1.605 1.00 0.00 C ATOM 735 CE2 PHE A 48 3.419 -11.918 -2.941 1.00 0.00 C ATOM 736 CZ PHE A 48 3.807 -10.623 -2.618 1.00 0.00 C ATOM 0 H PHE A 48 -1.544 -13.271 1.431 1.00 0.00 H new ATOM 0 HA PHE A 48 1.272 -12.217 1.497 1.00 0.00 H new ATOM 0 HB2 PHE A 48 0.764 -13.660 -0.593 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -0.323 -12.361 -1.041 1.00 0.00 H new ATOM 0 HD1 PHE A 48 1.628 -10.005 -0.098 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.111 -13.549 -2.473 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.439 -8.917 -1.374 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.909 -12.443 -3.748 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.618 -10.153 -3.155 1.00 0.00 H new ATOM 746 N LYS A 49 -0.115 -10.357 2.435 1.00 0.00 N ATOM 747 CA LYS A 49 -0.831 -9.176 2.980 1.00 0.00 C ATOM 748 C LYS A 49 0.060 -7.905 2.944 1.00 0.00 C ATOM 749 O LYS A 49 1.290 -7.979 2.844 1.00 0.00 O ATOM 750 CB LYS A 49 -1.414 -9.494 4.389 1.00 0.00 C ATOM 751 CG LYS A 49 -0.471 -9.862 5.566 1.00 0.00 C ATOM 752 CD LYS A 49 0.087 -11.308 5.630 1.00 0.00 C ATOM 753 CE LYS A 49 -0.889 -12.433 6.035 1.00 0.00 C ATOM 754 NZ LYS A 49 -1.828 -12.837 4.972 1.00 0.00 N ATOM 0 H LYS A 49 0.692 -10.632 2.994 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.682 -8.950 2.338 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -1.994 -8.626 4.701 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -2.116 -10.319 4.268 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.377 -9.178 5.540 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.007 -9.670 6.495 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.495 -11.554 4.650 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.920 -11.316 6.333 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.312 -13.305 6.343 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.461 -12.106 6.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.072 -13.841 5.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.692 -12.262 5.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.383 -12.693 4.043 1.00 0.00 H new ATOM 768 N PHE A 50 -0.588 -6.728 3.018 1.00 0.00 N ATOM 769 CA PHE A 50 0.112 -5.419 2.949 1.00 0.00 C ATOM 770 C PHE A 50 -0.586 -4.373 3.856 1.00 0.00 C ATOM 771 O PHE A 50 -1.800 -4.173 3.749 1.00 0.00 O ATOM 772 CB PHE A 50 0.289 -4.922 1.480 1.00 0.00 C ATOM 773 CG PHE A 50 -0.945 -4.425 0.686 1.00 0.00 C ATOM 774 CD1 PHE A 50 -1.932 -5.319 0.257 1.00 0.00 C ATOM 775 CD2 PHE A 50 -1.069 -3.069 0.363 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.018 -4.867 -0.489 1.00 0.00 C ATOM 777 CE2 PHE A 50 -2.159 -2.617 -0.379 1.00 0.00 C ATOM 778 CZ PHE A 50 -3.132 -3.516 -0.803 1.00 0.00 C ATOM 0 H PHE A 50 -1.599 -6.650 3.126 1.00 0.00 H new ATOM 0 HA PHE A 50 1.121 -5.559 3.336 1.00 0.00 H new ATOM 0 HB2 PHE A 50 1.015 -4.109 1.496 1.00 0.00 H new ATOM 0 HB3 PHE A 50 0.736 -5.738 0.911 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -1.851 -6.367 0.506 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -0.315 -2.368 0.691 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.771 -5.565 -0.824 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -2.248 -1.569 -0.625 1.00 0.00 H new ATOM 0 HZ PHE A 50 -3.977 -3.165 -1.377 1.00 0.00 H new ATOM 788 N THR A 51 0.203 -3.678 4.701 1.00 0.00 N ATOM 789 CA THR A 51 -0.312 -2.558 5.541 1.00 0.00 C ATOM 790 C THR A 51 0.065 -1.222 4.841 1.00 0.00 C ATOM 791 O THR A 51 1.159 -0.682 5.042 1.00 0.00 O ATOM 792 CB THR A 51 0.146 -2.658 7.028 1.00 0.00 C ATOM 793 OG1 THR A 51 -0.123 -3.953 7.553 1.00 0.00 O ATOM 794 CG2 THR A 51 -0.545 -1.644 7.958 1.00 0.00 C ATOM 0 H THR A 51 1.198 -3.866 4.825 1.00 0.00 H new ATOM 0 HA THR A 51 -1.398 -2.613 5.614 1.00 0.00 H new ATOM 0 HB THR A 51 1.214 -2.443 7.006 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.173 -3.996 8.486 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.176 -1.773 8.976 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.326 -0.631 7.619 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.622 -1.808 7.939 1.00 0.00 H new ATOM 802 N ILE A 52 -0.875 -0.701 4.029 1.00 0.00 N ATOM 803 CA ILE A 52 -0.736 0.616 3.350 1.00 0.00 C ATOM 804 C ILE A 52 -1.240 1.727 4.311 1.00 0.00 C ATOM 805 O ILE A 52 -2.414 1.762 4.690 1.00 0.00 O ATOM 806 CB ILE A 52 -1.406 0.641 1.928 1.00 0.00 C ATOM 807 CG1 ILE A 52 -1.201 1.968 1.134 1.00 0.00 C ATOM 808 CG2 ILE A 52 -2.913 0.278 1.898 1.00 0.00 C ATOM 809 CD1 ILE A 52 0.254 2.325 0.802 1.00 0.00 C ATOM 0 H ILE A 52 -1.754 -1.175 3.821 1.00 0.00 H new ATOM 0 HA ILE A 52 0.316 0.807 3.137 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.856 -0.156 1.429 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.762 1.903 0.202 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.634 2.786 1.710 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.278 0.325 0.872 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.052 -0.731 2.287 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -3.470 0.984 2.514 1.00 0.00 H new ATOM 0 HD11 ILE A 52 0.281 3.264 0.250 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.823 2.430 1.726 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.693 1.534 0.194 1.00 0.00 H new ATOM 821 N THR A 53 -0.324 2.640 4.664 1.00 0.00 N ATOM 822 CA THR A 53 -0.654 3.836 5.483 1.00 0.00 C ATOM 823 C THR A 53 -0.883 5.010 4.491 1.00 0.00 C ATOM 824 O THR A 53 0.073 5.638 4.022 1.00 0.00 O ATOM 825 CB THR A 53 0.404 4.119 6.592 1.00 0.00 C ATOM 826 OG1 THR A 53 1.674 4.440 6.038 1.00 0.00 O ATOM 827 CG2 THR A 53 0.605 2.968 7.596 1.00 0.00 C ATOM 0 H THR A 53 0.659 2.580 4.398 1.00 0.00 H new ATOM 0 HA THR A 53 -1.565 3.676 6.060 1.00 0.00 H new ATOM 0 HB THR A 53 -0.012 4.968 7.135 1.00 0.00 H new ATOM 0 HG1 THR A 53 2.066 3.639 5.632 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.358 3.253 8.330 1.00 0.00 H new ATOM 0 HG22 THR A 53 -0.337 2.760 8.104 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.936 2.075 7.065 1.00 0.00 H new ATOM 835 N ALA A 54 -2.159 5.255 4.133 1.00 0.00 N ATOM 836 CA ALA A 54 -2.529 6.223 3.066 1.00 0.00 C ATOM 837 C ALA A 54 -2.742 7.637 3.665 1.00 0.00 C ATOM 838 O ALA A 54 -3.856 8.012 4.048 1.00 0.00 O ATOM 839 CB ALA A 54 -3.770 5.687 2.324 1.00 0.00 C ATOM 0 H ALA A 54 -2.960 4.796 4.567 1.00 0.00 H new ATOM 0 HA ALA A 54 -1.721 6.324 2.341 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -4.054 6.386 1.538 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -3.539 4.718 1.882 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -4.595 5.577 3.027 1.00 0.00 H new ATOM 845 N GLY A 55 -1.632 8.391 3.785 1.00 0.00 N ATOM 846 CA GLY A 55 -1.606 9.672 4.521 1.00 0.00 C ATOM 847 C GLY A 55 -1.615 9.469 6.048 1.00 0.00 C ATOM 848 O GLY A 55 -0.578 9.159 6.642 1.00 0.00 O ATOM 0 H GLY A 55 -0.733 8.132 3.378 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -0.716 10.234 4.237 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.468 10.272 4.231 1.00 0.00 H new ATOM 852 N SER A 56 -2.813 9.592 6.644 1.00 0.00 N ATOM 853 CA SER A 56 -3.089 9.086 8.012 1.00 0.00 C ATOM 854 C SER A 56 -4.351 8.176 7.943 1.00 0.00 C ATOM 855 O SER A 56 -5.469 8.614 8.238 1.00 0.00 O ATOM 856 CB SER A 56 -3.221 10.285 8.980 1.00 0.00 C ATOM 857 OG SER A 56 -3.432 9.837 10.314 1.00 0.00 O ATOM 0 H SER A 56 -3.615 10.040 6.201 1.00 0.00 H new ATOM 0 HA SER A 56 -2.274 8.476 8.402 1.00 0.00 H new ATOM 0 HB2 SER A 56 -2.319 10.895 8.935 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.051 10.919 8.669 1.00 0.00 H new ATOM 0 HG SER A 56 -3.511 10.611 10.910 1.00 0.00 H new ATOM 863 N LYS A 57 -4.155 6.905 7.529 1.00 0.00 N ATOM 864 CA LYS A 57 -5.248 5.896 7.447 1.00 0.00 C ATOM 865 C LYS A 57 -4.557 4.508 7.337 1.00 0.00 C ATOM 866 O LYS A 57 -4.101 4.114 6.259 1.00 0.00 O ATOM 867 CB LYS A 57 -6.248 6.171 6.275 1.00 0.00 C ATOM 868 CG LYS A 57 -7.748 6.181 6.650 1.00 0.00 C ATOM 869 CD LYS A 57 -8.460 4.818 6.790 1.00 0.00 C ATOM 870 CE LYS A 57 -8.254 4.081 8.126 1.00 0.00 C ATOM 871 NZ LYS A 57 -9.019 2.822 8.173 1.00 0.00 N ATOM 0 H LYS A 57 -3.244 6.546 7.243 1.00 0.00 H new ATOM 0 HA LYS A 57 -5.876 5.943 8.337 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.999 7.134 5.830 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -6.092 5.415 5.506 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -7.854 6.714 7.595 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -8.279 6.761 5.895 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -9.529 4.973 6.645 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -8.119 4.168 5.984 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.194 3.869 8.266 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -8.562 4.726 8.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -8.857 2.351 9.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -10.033 3.027 8.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -8.707 2.198 7.402 1.00 0.00 H new ATOM 885 N VAL A 58 -4.476 3.773 8.463 1.00 0.00 N ATOM 886 CA VAL A 58 -3.731 2.481 8.551 1.00 0.00 C ATOM 887 C VAL A 58 -4.691 1.344 8.074 1.00 0.00 C ATOM 888 O VAL A 58 -5.726 1.087 8.699 1.00 0.00 O ATOM 889 CB VAL A 58 -3.162 2.261 9.997 1.00 0.00 C ATOM 890 CG1 VAL A 58 -2.354 0.947 10.128 1.00 0.00 C ATOM 891 CG2 VAL A 58 -2.264 3.420 10.502 1.00 0.00 C ATOM 0 H VAL A 58 -4.920 4.048 9.339 1.00 0.00 H new ATOM 0 HA VAL A 58 -2.856 2.484 7.901 1.00 0.00 H new ATOM 0 HB VAL A 58 -4.057 2.214 10.617 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.985 0.847 11.149 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -2.997 0.099 9.890 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.511 0.968 9.438 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.910 3.194 11.508 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -1.411 3.537 9.834 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -2.840 4.345 10.520 1.00 0.00 H new ATOM 901 N ILE A 59 -4.342 0.705 6.940 1.00 0.00 N ATOM 902 CA ILE A 59 -5.254 -0.212 6.198 1.00 0.00 C ATOM 903 C ILE A 59 -4.425 -1.504 5.945 1.00 0.00 C ATOM 904 O ILE A 59 -3.594 -1.521 5.030 1.00 0.00 O ATOM 905 CB ILE A 59 -5.747 0.449 4.855 1.00 0.00 C ATOM 906 CG1 ILE A 59 -6.534 1.787 5.022 1.00 0.00 C ATOM 907 CG2 ILE A 59 -6.580 -0.516 3.968 1.00 0.00 C ATOM 908 CD1 ILE A 59 -6.324 2.768 3.858 1.00 0.00 C ATOM 0 H ILE A 59 -3.424 0.804 6.507 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.160 -0.434 6.761 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.808 0.686 4.354 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.597 1.565 5.113 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.227 2.267 5.951 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.889 0.000 3.059 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.974 -1.383 3.705 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.463 -0.844 4.517 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -6.899 3.676 4.039 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.266 3.018 3.780 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -6.657 2.306 2.929 1.00 0.00 H new ATOM 920 N GLN A 60 -4.696 -2.593 6.691 1.00 0.00 N ATOM 921 CA GLN A 60 -4.160 -3.938 6.345 1.00 0.00 C ATOM 922 C GLN A 60 -5.210 -4.680 5.470 1.00 0.00 C ATOM 923 O GLN A 60 -6.351 -4.900 5.891 1.00 0.00 O ATOM 924 CB GLN A 60 -3.752 -4.743 7.604 1.00 0.00 C ATOM 925 CG GLN A 60 -2.869 -5.975 7.284 1.00 0.00 C ATOM 926 CD GLN A 60 -2.560 -6.844 8.511 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.405 -7.607 8.979 1.00 0.00 O ATOM 928 NE2 GLN A 60 -1.351 -6.765 9.047 1.00 0.00 N ATOM 0 H GLN A 60 -5.276 -2.576 7.530 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.241 -3.827 5.770 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -3.214 -4.087 8.288 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -4.652 -5.074 8.122 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -3.370 -6.586 6.533 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -1.931 -5.635 6.844 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -0.658 -6.129 8.651 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -1.113 -7.340 9.855 1.00 0.00 H new ATOM 937 N ASN A 61 -4.788 -5.049 4.251 1.00 0.00 N ATOM 938 CA ASN A 61 -5.657 -5.704 3.243 1.00 0.00 C ATOM 939 C ASN A 61 -4.989 -7.050 2.850 1.00 0.00 C ATOM 940 O ASN A 61 -3.907 -7.075 2.250 1.00 0.00 O ATOM 941 CB ASN A 61 -5.851 -4.726 2.052 1.00 0.00 C ATOM 942 CG ASN A 61 -6.875 -5.159 0.985 1.00 0.00 C ATOM 943 OD1 ASN A 61 -7.722 -6.028 1.195 1.00 0.00 O ATOM 944 ND2 ASN A 61 -6.834 -4.531 -0.176 1.00 0.00 N ATOM 0 H ASN A 61 -3.831 -4.904 3.929 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.653 -5.933 3.623 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -6.156 -3.758 2.448 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -4.887 -4.582 1.565 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -7.507 -4.765 -0.906 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.130 -3.812 -0.343 1.00 0.00 H new ATOM 951 N GLU A 62 -5.651 -8.163 3.213 1.00 0.00 N ATOM 952 CA GLU A 62 -5.079 -9.527 3.094 1.00 0.00 C ATOM 953 C GLU A 62 -5.599 -10.188 1.790 1.00 0.00 C ATOM 954 O GLU A 62 -6.812 -10.314 1.587 1.00 0.00 O ATOM 955 CB GLU A 62 -5.448 -10.427 4.313 1.00 0.00 C ATOM 956 CG GLU A 62 -5.018 -9.960 5.726 1.00 0.00 C ATOM 957 CD GLU A 62 -5.994 -8.990 6.404 1.00 0.00 C ATOM 958 OE1 GLU A 62 -7.073 -9.435 6.854 1.00 0.00 O ATOM 959 OE2 GLU A 62 -5.688 -7.782 6.491 1.00 0.00 O ATOM 0 H GLU A 62 -6.596 -8.148 3.597 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.993 -9.432 3.070 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.531 -10.551 4.319 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.015 -11.413 4.142 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.897 -10.837 6.363 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.042 -9.481 5.654 1.00 0.00 H new ATOM 966 N PHE A 63 -4.660 -10.626 0.936 1.00 0.00 N ATOM 967 CA PHE A 63 -4.977 -11.347 -0.329 1.00 0.00 C ATOM 968 C PHE A 63 -4.242 -12.711 -0.401 1.00 0.00 C ATOM 969 O PHE A 63 -3.119 -12.867 0.089 1.00 0.00 O ATOM 970 CB PHE A 63 -4.728 -10.463 -1.587 1.00 0.00 C ATOM 971 CG PHE A 63 -3.290 -9.994 -1.895 1.00 0.00 C ATOM 972 CD1 PHE A 63 -2.393 -10.848 -2.549 1.00 0.00 C ATOM 973 CD2 PHE A 63 -2.880 -8.698 -1.561 1.00 0.00 C ATOM 974 CE1 PHE A 63 -1.107 -10.414 -2.856 1.00 0.00 C ATOM 975 CE2 PHE A 63 -1.590 -8.269 -1.872 1.00 0.00 C ATOM 976 CZ PHE A 63 -0.706 -9.128 -2.513 1.00 0.00 C ATOM 0 H PHE A 63 -3.661 -10.496 1.093 1.00 0.00 H new ATOM 0 HA PHE A 63 -6.045 -11.564 -0.322 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.088 -11.016 -2.455 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.352 -9.574 -1.494 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.701 -11.848 -2.816 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.564 -8.029 -1.061 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.420 -11.077 -3.361 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.278 -7.268 -1.614 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.295 -8.796 -2.745 1.00 0.00 H new ATOM 986 N THR A 64 -4.872 -13.675 -1.090 1.00 0.00 N ATOM 987 CA THR A 64 -4.223 -14.956 -1.475 1.00 0.00 C ATOM 988 C THR A 64 -3.932 -14.877 -3.003 1.00 0.00 C ATOM 989 O THR A 64 -4.809 -14.538 -3.805 1.00 0.00 O ATOM 990 CB THR A 64 -5.140 -16.154 -1.080 1.00 0.00 C ATOM 991 OG1 THR A 64 -5.428 -16.113 0.315 1.00 0.00 O ATOM 992 CG2 THR A 64 -4.532 -17.540 -1.360 1.00 0.00 C ATOM 0 H THR A 64 -5.841 -13.598 -1.399 1.00 0.00 H new ATOM 0 HA THR A 64 -3.282 -15.118 -0.949 1.00 0.00 H new ATOM 0 HB THR A 64 -6.029 -16.036 -1.699 1.00 0.00 H new ATOM 0 HG1 THR A 64 -6.282 -15.655 0.459 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.236 -18.314 -1.055 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.324 -17.637 -2.425 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.605 -17.651 -0.798 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.695 -15.233 -3.399 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.286 -15.309 -4.832 1.00 0.00 C ATOM 1002 C VAL A 65 -2.824 -16.657 -5.399 1.00 0.00 C ATOM 1003 O VAL A 65 -2.469 -17.733 -4.904 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.734 -15.161 -4.985 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.198 -15.367 -6.423 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -0.198 -13.799 -4.484 1.00 0.00 C ATOM 0 H VAL A 65 -1.949 -15.476 -2.747 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.712 -14.484 -5.404 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.364 -15.971 -4.356 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.885 -15.245 -6.429 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.452 -16.370 -6.766 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.649 -14.631 -7.088 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.883 -13.762 -4.618 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.662 -12.994 -5.053 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.437 -13.681 -3.427 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.689 -16.567 -6.422 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.420 -17.748 -6.952 1.00 0.00 C ATOM 1018 C GLY A 66 -5.818 -18.093 -6.363 1.00 0.00 C ATOM 1019 O GLY A 66 -6.416 -19.065 -6.834 1.00 0.00 O ATOM 0 H GLY A 66 -3.905 -15.694 -6.903 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.541 -17.606 -8.026 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.780 -18.620 -6.815 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.355 -17.326 -5.390 1.00 0.00 N ATOM 1024 CA GLU A 67 -7.772 -17.422 -4.955 1.00 0.00 C ATOM 1025 C GLU A 67 -8.269 -16.000 -4.565 1.00 0.00 C ATOM 1026 O GLU A 67 -7.611 -15.276 -3.809 1.00 0.00 O ATOM 1027 CB GLU A 67 -7.895 -18.438 -3.786 1.00 0.00 C ATOM 1028 CG GLU A 67 -9.346 -18.790 -3.403 1.00 0.00 C ATOM 1029 CD GLU A 67 -9.428 -19.836 -2.289 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -9.411 -19.454 -1.098 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -9.509 -21.046 -2.599 1.00 0.00 O ATOM 0 H GLU A 67 -5.821 -16.621 -4.881 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.404 -17.791 -5.763 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.371 -19.354 -4.059 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.389 -18.030 -2.911 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.863 -17.885 -3.084 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.869 -19.162 -4.284 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.458 -15.618 -5.076 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.016 -14.248 -4.909 1.00 0.00 C ATOM 1040 C GLU A 68 -10.531 -13.972 -3.465 1.00 0.00 C ATOM 1041 O GLU A 68 -11.507 -14.571 -3.001 1.00 0.00 O ATOM 1042 CB GLU A 68 -11.030 -13.900 -6.032 1.00 0.00 C ATOM 1043 CG GLU A 68 -12.336 -14.714 -6.067 1.00 0.00 C ATOM 1044 CD GLU A 68 -13.271 -14.316 -7.211 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -13.075 -14.801 -8.347 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -14.210 -13.522 -6.980 1.00 0.00 O ATOM 0 H GLU A 68 -10.060 -16.242 -5.614 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.192 -13.546 -5.033 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.290 -12.845 -5.940 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.528 -14.022 -6.992 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.093 -15.773 -6.158 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.859 -14.588 -5.119 1.00 0.00 H new ATOM 1053 N CYS A 69 -9.839 -13.051 -2.775 1.00 0.00 N ATOM 1054 CA CYS A 69 -10.250 -12.542 -1.445 1.00 0.00 C ATOM 1055 C CYS A 69 -11.027 -11.203 -1.584 1.00 0.00 C ATOM 1056 O CYS A 69 -10.872 -10.464 -2.562 1.00 0.00 O ATOM 1057 CB CYS A 69 -8.978 -12.386 -0.585 1.00 0.00 C ATOM 1058 SG CYS A 69 -8.253 -14.024 -0.243 1.00 0.00 S ATOM 0 H CYS A 69 -8.975 -12.633 -3.120 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.930 -13.242 -0.959 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -8.253 -11.759 -1.104 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -9.221 -11.884 0.351 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.218 -13.887 0.532 1.00 0.00 H new ATOM 1064 N GLU A 70 -11.864 -10.895 -0.576 1.00 0.00 N ATOM 1065 CA GLU A 70 -12.688 -9.652 -0.542 1.00 0.00 C ATOM 1066 C GLU A 70 -11.828 -8.419 -0.137 1.00 0.00 C ATOM 1067 O GLU A 70 -11.470 -8.253 1.033 1.00 0.00 O ATOM 1068 CB GLU A 70 -13.994 -9.864 0.269 1.00 0.00 C ATOM 1069 CG GLU A 70 -13.834 -10.279 1.744 1.00 0.00 C ATOM 1070 CD GLU A 70 -15.149 -10.457 2.507 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -16.021 -11.229 2.049 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -15.311 -9.838 3.583 1.00 0.00 O ATOM 0 H GLU A 70 -11.995 -11.493 0.240 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.036 -9.417 -1.548 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -14.568 -8.938 0.237 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -14.588 -10.626 -0.236 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.277 -11.215 1.785 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.233 -9.527 2.255 1.00 0.00 H new ATOM 1079 N LEU A 71 -11.441 -7.602 -1.140 1.00 0.00 N ATOM 1080 CA LEU A 71 -10.377 -6.577 -0.976 1.00 0.00 C ATOM 1081 C LEU A 71 -10.975 -5.149 -1.005 1.00 0.00 C ATOM 1082 O LEU A 71 -11.690 -4.771 -1.940 1.00 0.00 O ATOM 1083 CB LEU A 71 -9.258 -6.701 -2.053 1.00 0.00 C ATOM 1084 CG LEU A 71 -8.477 -8.035 -2.206 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -7.236 -7.843 -3.099 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -8.045 -8.687 -0.878 1.00 0.00 C ATOM 0 H LEU A 71 -11.848 -7.629 -2.075 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.922 -6.759 -0.003 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.710 -6.477 -3.019 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.527 -5.917 -1.854 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.188 -8.718 -2.670 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.705 -8.790 -3.192 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.548 -7.503 -4.087 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.577 -7.100 -2.651 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.507 -9.612 -1.085 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.395 -8.004 -0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.927 -8.907 -0.277 1.00 0.00 H new ATOM 1098 N GLU A 72 -10.612 -4.351 0.014 1.00 0.00 N ATOM 1099 CA GLU A 72 -10.989 -2.919 0.102 1.00 0.00 C ATOM 1100 C GLU A 72 -10.013 -2.021 -0.713 1.00 0.00 C ATOM 1101 O GLU A 72 -8.798 -2.242 -0.719 1.00 0.00 O ATOM 1102 CB GLU A 72 -11.150 -2.471 1.580 1.00 0.00 C ATOM 1103 CG GLU A 72 -9.902 -2.382 2.497 1.00 0.00 C ATOM 1104 CD GLU A 72 -9.394 -3.664 3.179 1.00 0.00 C ATOM 1105 OE1 GLU A 72 -9.972 -4.759 2.998 1.00 0.00 O ATOM 1106 OE2 GLU A 72 -8.393 -3.565 3.923 1.00 0.00 O ATOM 0 H GLU A 72 -10.050 -4.674 0.801 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.967 -2.793 -0.362 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.619 -1.487 1.573 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -11.853 -3.156 2.053 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -9.083 -1.977 1.902 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -10.118 -1.655 3.279 1.00 0.00 H new ATOM 1113 N THR A 73 -10.557 -0.984 -1.373 1.00 0.00 N ATOM 1114 CA THR A 73 -9.754 -0.030 -2.200 1.00 0.00 C ATOM 1115 C THR A 73 -8.808 0.847 -1.317 1.00 0.00 C ATOM 1116 O THR A 73 -7.589 0.660 -1.368 1.00 0.00 O ATOM 1117 CB THR A 73 -10.644 0.784 -3.191 1.00 0.00 C ATOM 1118 OG1 THR A 73 -11.665 1.506 -2.503 1.00 0.00 O ATOM 1119 CG2 THR A 73 -11.302 -0.068 -4.290 1.00 0.00 C ATOM 0 H THR A 73 -11.555 -0.774 -1.357 1.00 0.00 H new ATOM 0 HA THR A 73 -9.092 -0.617 -2.837 1.00 0.00 H new ATOM 0 HB THR A 73 -9.952 1.472 -3.677 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.204 2.007 -3.150 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.903 0.572 -4.936 1.00 0.00 H new ATOM 0 HG22 THR A 73 -10.529 -0.558 -4.882 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.941 -0.823 -3.832 1.00 0.00 H new ATOM 1127 N MET A 74 -9.374 1.721 -0.463 1.00 0.00 N ATOM 1128 CA MET A 74 -8.692 2.215 0.764 1.00 0.00 C ATOM 1129 C MET A 74 -9.556 1.757 1.974 1.00 0.00 C ATOM 1130 O MET A 74 -9.164 0.811 2.660 1.00 0.00 O ATOM 1131 CB MET A 74 -8.388 3.737 0.705 1.00 0.00 C ATOM 1132 CG MET A 74 -7.235 4.115 -0.241 1.00 0.00 C ATOM 1133 SD MET A 74 -5.695 3.361 0.331 1.00 0.00 S ATOM 1134 CE MET A 74 -4.606 3.674 -1.072 1.00 0.00 C ATOM 0 H MET A 74 -10.309 2.106 -0.596 1.00 0.00 H new ATOM 0 HA MET A 74 -7.696 1.784 0.867 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.289 4.264 0.390 1.00 0.00 H new ATOM 0 HB3 MET A 74 -8.149 4.087 1.709 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.460 3.780 -1.254 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.126 5.199 -0.281 1.00 0.00 H new ATOM 0 HE1 MET A 74 -3.618 3.264 -0.864 1.00 0.00 H new ATOM 0 HE2 MET A 74 -5.015 3.199 -1.963 1.00 0.00 H new ATOM 0 HE3 MET A 74 -4.526 4.748 -1.238 1.00 0.00 H new ATOM 1144 N THR A 75 -10.735 2.367 2.211 1.00 0.00 N ATOM 1145 CA THR A 75 -11.782 1.785 3.095 1.00 0.00 C ATOM 1146 C THR A 75 -13.160 2.252 2.552 1.00 0.00 C ATOM 1147 O THR A 75 -13.442 3.454 2.476 1.00 0.00 O ATOM 1148 CB THR A 75 -11.559 2.045 4.614 1.00 0.00 C ATOM 1149 OG1 THR A 75 -12.566 1.373 5.363 1.00 0.00 O ATOM 1150 CG2 THR A 75 -11.511 3.511 5.077 1.00 0.00 C ATOM 0 H THR A 75 -10.993 3.266 1.804 1.00 0.00 H new ATOM 0 HA THR A 75 -11.730 0.697 3.054 1.00 0.00 H new ATOM 0 HB THR A 75 -10.555 1.660 4.796 1.00 0.00 H new ATOM 0 HG1 THR A 75 -12.425 1.535 6.319 1.00 0.00 H new ATOM 0 HG21 THR A 75 -11.351 3.547 6.155 1.00 0.00 H new ATOM 0 HG22 THR A 75 -10.694 4.026 4.571 1.00 0.00 H new ATOM 0 HG23 THR A 75 -12.454 4.000 4.834 1.00 0.00 H new ATOM 1158 N GLY A 76 -13.997 1.279 2.164 1.00 0.00 N ATOM 1159 CA GLY A 76 -15.296 1.560 1.512 1.00 0.00 C ATOM 1160 C GLY A 76 -15.717 0.452 0.534 1.00 0.00 C ATOM 1161 O GLY A 76 -16.620 -0.331 0.845 1.00 0.00 O ATOM 0 H GLY A 76 -13.802 0.286 2.288 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -16.064 1.676 2.276 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -15.233 2.507 0.977 1.00 0.00 H new ATOM 1165 N GLU A 77 -15.083 0.419 -0.655 1.00 0.00 N ATOM 1166 CA GLU A 77 -15.491 -0.475 -1.769 1.00 0.00 C ATOM 1167 C GLU A 77 -14.877 -1.894 -1.590 1.00 0.00 C ATOM 1168 O GLU A 77 -13.715 -2.132 -1.936 1.00 0.00 O ATOM 1169 CB GLU A 77 -15.091 0.218 -3.101 1.00 0.00 C ATOM 1170 CG GLU A 77 -15.533 -0.530 -4.375 1.00 0.00 C ATOM 1171 CD GLU A 77 -15.160 0.209 -5.661 1.00 0.00 C ATOM 1172 OE1 GLU A 77 -15.910 1.120 -6.074 1.00 0.00 O ATOM 1173 OE2 GLU A 77 -14.115 -0.118 -6.265 1.00 0.00 O ATOM 0 H GLU A 77 -14.278 1.006 -0.874 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.569 -0.633 -1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -15.521 1.220 -3.117 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.008 0.335 -3.123 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -15.076 -1.520 -4.386 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -16.613 -0.677 -4.347 1.00 0.00 H new ATOM 1180 N LYS A 78 -15.697 -2.825 -1.067 1.00 0.00 N ATOM 1181 CA LYS A 78 -15.297 -4.232 -0.825 1.00 0.00 C ATOM 1182 C LYS A 78 -15.649 -5.065 -2.090 1.00 0.00 C ATOM 1183 O LYS A 78 -16.820 -5.341 -2.367 1.00 0.00 O ATOM 1184 CB LYS A 78 -16.019 -4.719 0.459 1.00 0.00 C ATOM 1185 CG LYS A 78 -15.593 -6.125 0.932 1.00 0.00 C ATOM 1186 CD LYS A 78 -16.313 -6.615 2.204 1.00 0.00 C ATOM 1187 CE LYS A 78 -15.774 -6.005 3.511 1.00 0.00 C ATOM 1188 NZ LYS A 78 -16.488 -6.541 4.683 1.00 0.00 N ATOM 0 H LYS A 78 -16.660 -2.626 -0.798 1.00 0.00 H new ATOM 0 HA LYS A 78 -14.225 -4.343 -0.659 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -15.830 -4.006 1.261 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -17.094 -4.719 0.280 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -15.778 -6.837 0.128 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -14.519 -6.123 1.115 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -17.375 -6.383 2.119 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -16.228 -7.700 2.261 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.709 -6.217 3.602 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -15.881 -4.921 3.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -16.104 -6.112 5.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -17.501 -6.317 4.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -16.364 -7.573 4.723 1.00 0.00 H new ATOM 1202 N VAL A 79 -14.607 -5.419 -2.857 1.00 0.00 N ATOM 1203 CA VAL A 79 -14.748 -6.023 -4.213 1.00 0.00 C ATOM 1204 C VAL A 79 -13.712 -7.175 -4.337 1.00 0.00 C ATOM 1205 O VAL A 79 -12.511 -6.983 -4.108 1.00 0.00 O ATOM 1206 CB VAL A 79 -14.624 -4.977 -5.379 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -15.920 -4.154 -5.556 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -13.404 -4.025 -5.309 1.00 0.00 C ATOM 0 H VAL A 79 -13.637 -5.299 -2.565 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.758 -6.419 -4.318 1.00 0.00 H new ATOM 0 HB VAL A 79 -14.455 -5.604 -6.255 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -15.791 -3.443 -6.372 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -16.748 -4.824 -5.786 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -16.136 -3.613 -4.635 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -13.421 -3.348 -6.163 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -13.447 -3.446 -4.386 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -12.484 -4.610 -5.328 1.00 0.00 H new ATOM 1218 N LYS A 80 -14.194 -8.371 -4.732 1.00 0.00 N ATOM 1219 CA LYS A 80 -13.342 -9.582 -4.857 1.00 0.00 C ATOM 1220 C LYS A 80 -12.464 -9.527 -6.137 1.00 0.00 C ATOM 1221 O LYS A 80 -12.971 -9.459 -7.263 1.00 0.00 O ATOM 1222 CB LYS A 80 -14.188 -10.884 -4.831 1.00 0.00 C ATOM 1223 CG LYS A 80 -14.714 -11.282 -3.436 1.00 0.00 C ATOM 1224 CD LYS A 80 -15.439 -12.644 -3.421 1.00 0.00 C ATOM 1225 CE LYS A 80 -15.841 -13.134 -2.016 1.00 0.00 C ATOM 1226 NZ LYS A 80 -16.943 -12.355 -1.419 1.00 0.00 N ATOM 0 H LYS A 80 -15.173 -8.529 -4.972 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.680 -9.596 -3.991 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.037 -10.763 -5.504 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.584 -11.702 -5.224 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -13.879 -11.316 -2.737 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.397 -10.511 -3.080 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.335 -12.572 -4.038 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -14.793 -13.391 -3.882 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.136 -14.182 -2.075 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -14.973 -13.084 -1.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -17.165 -12.734 -0.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -16.657 -11.359 -1.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.785 -12.422 -2.026 1.00 0.00 H new ATOM 1240 N THR A 81 -11.140 -9.560 -5.921 1.00 0.00 N ATOM 1241 CA THR A 81 -10.123 -9.568 -7.006 1.00 0.00 C ATOM 1242 C THR A 81 -8.911 -10.431 -6.541 1.00 0.00 C ATOM 1243 O THR A 81 -8.504 -10.385 -5.372 1.00 0.00 O ATOM 1244 CB THR A 81 -9.750 -8.125 -7.469 1.00 0.00 C ATOM 1245 OG1 THR A 81 -8.894 -8.207 -8.604 1.00 0.00 O ATOM 1246 CG2 THR A 81 -9.075 -7.212 -6.428 1.00 0.00 C ATOM 0 H THR A 81 -10.733 -9.582 -4.986 1.00 0.00 H new ATOM 0 HA THR A 81 -10.532 -10.030 -7.904 1.00 0.00 H new ATOM 0 HB THR A 81 -10.712 -7.657 -7.680 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.979 -7.973 -8.342 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.869 -6.240 -6.876 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.738 -7.084 -5.572 1.00 0.00 H new ATOM 0 HG23 THR A 81 -8.140 -7.665 -6.098 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.332 -11.202 -7.485 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.128 -12.041 -7.217 1.00 0.00 C ATOM 1256 C VAL A 82 -5.876 -11.357 -7.837 1.00 0.00 C ATOM 1257 O VAL A 82 -5.872 -10.891 -8.982 1.00 0.00 O ATOM 1258 CB VAL A 82 -7.311 -13.542 -7.619 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -7.504 -13.862 -9.109 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -6.163 -14.421 -7.094 1.00 0.00 C ATOM 0 H VAL A 82 -8.674 -11.266 -8.444 1.00 0.00 H new ATOM 0 HA VAL A 82 -6.974 -12.096 -6.139 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.262 -13.774 -7.140 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.618 -14.938 -9.238 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.396 -13.356 -9.477 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -6.635 -13.519 -9.670 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -6.329 -15.455 -7.395 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -5.218 -14.070 -7.508 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -6.127 -14.361 -6.006 1.00 0.00 H new ATOM 1270 N VAL A 83 -4.802 -11.367 -7.037 1.00 0.00 N ATOM 1271 CA VAL A 83 -3.477 -10.834 -7.427 1.00 0.00 C ATOM 1272 C VAL A 83 -2.660 -12.001 -8.057 1.00 0.00 C ATOM 1273 O VAL A 83 -2.532 -13.073 -7.456 1.00 0.00 O ATOM 1274 CB VAL A 83 -2.760 -10.224 -6.176 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -1.433 -9.536 -6.554 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -3.603 -9.202 -5.367 1.00 0.00 C ATOM 0 H VAL A 83 -4.822 -11.747 -6.091 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.574 -10.033 -8.160 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.589 -11.093 -5.540 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -0.967 -9.126 -5.658 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.763 -10.264 -7.010 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -1.629 -8.730 -7.262 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.020 -8.837 -4.522 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.874 -8.364 -6.009 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.509 -9.686 -5.001 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.082 -11.761 -9.246 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.119 -12.707 -9.879 1.00 0.00 C ATOM 1288 C GLN A 84 0.326 -12.197 -9.639 1.00 0.00 C ATOM 1289 O GLN A 84 0.645 -11.018 -9.826 1.00 0.00 O ATOM 1290 CB GLN A 84 -1.402 -12.886 -11.396 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.428 -13.976 -11.790 1.00 0.00 C ATOM 1292 CD GLN A 84 -3.829 -13.853 -11.161 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -4.558 -12.888 -11.393 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -4.223 -14.822 -10.348 1.00 0.00 N ATOM 0 H GLN A 84 -2.259 -10.921 -9.797 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.239 -13.688 -9.419 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.751 -11.932 -11.791 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.459 -13.111 -11.893 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -2.538 -13.967 -12.874 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -2.016 -14.948 -11.520 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -3.609 -15.615 -10.165 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -5.141 -14.775 -9.905 1.00 0.00 H new ATOM 1303 N LEU A 85 1.190 -13.146 -9.253 1.00 0.00 N ATOM 1304 CA LEU A 85 2.627 -12.898 -9.013 1.00 0.00 C ATOM 1305 C LEU A 85 3.405 -13.320 -10.288 1.00 0.00 C ATOM 1306 O LEU A 85 3.629 -14.514 -10.517 1.00 0.00 O ATOM 1307 CB LEU A 85 3.040 -13.666 -7.724 1.00 0.00 C ATOM 1308 CG LEU A 85 4.538 -13.595 -7.334 1.00 0.00 C ATOM 1309 CD1 LEU A 85 5.017 -12.160 -7.042 1.00 0.00 C ATOM 1310 CD2 LEU A 85 4.847 -14.522 -6.143 1.00 0.00 C ATOM 0 H LEU A 85 0.914 -14.115 -9.096 1.00 0.00 H new ATOM 0 HA LEU A 85 2.859 -11.847 -8.838 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.451 -13.280 -6.892 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.768 -14.714 -7.848 1.00 0.00 H new ATOM 0 HG LEU A 85 5.095 -13.942 -8.204 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.074 -12.176 -6.775 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.877 -11.542 -7.929 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.440 -11.745 -6.216 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.905 -14.451 -5.892 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.249 -14.221 -5.283 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.606 -15.551 -6.410 1.00 0.00 H new ATOM 1322 N GLU A 86 3.818 -12.326 -11.098 1.00 0.00 N ATOM 1323 CA GLU A 86 4.626 -12.568 -12.320 1.00 0.00 C ATOM 1324 C GLU A 86 6.109 -12.229 -12.002 1.00 0.00 C ATOM 1325 O GLU A 86 6.472 -11.082 -11.722 1.00 0.00 O ATOM 1326 CB GLU A 86 4.078 -11.733 -13.506 1.00 0.00 C ATOM 1327 CG GLU A 86 4.487 -12.175 -14.931 1.00 0.00 C ATOM 1328 CD GLU A 86 5.948 -11.902 -15.314 1.00 0.00 C ATOM 1329 OE1 GLU A 86 6.343 -10.718 -15.401 1.00 0.00 O ATOM 1330 OE2 GLU A 86 6.708 -12.873 -15.526 1.00 0.00 O ATOM 0 H GLU A 86 3.607 -11.342 -10.931 1.00 0.00 H new ATOM 0 HA GLU A 86 4.562 -13.614 -12.619 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.989 -11.740 -13.450 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.398 -10.700 -13.368 1.00 0.00 H new ATOM 0 HG2 GLU A 86 4.298 -13.244 -15.029 1.00 0.00 H new ATOM 0 HG3 GLU A 86 3.841 -11.669 -15.649 1.00 0.00 H new ATOM 1337 N GLY A 87 6.942 -13.268 -12.092 1.00 0.00 N ATOM 1338 CA GLY A 87 8.421 -13.140 -12.003 1.00 0.00 C ATOM 1339 C GLY A 87 9.121 -12.936 -10.639 1.00 0.00 C ATOM 1340 O GLY A 87 10.303 -12.583 -10.622 1.00 0.00 O ATOM 0 H GLY A 87 6.623 -14.227 -12.229 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.847 -14.039 -12.449 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.708 -12.302 -12.638 1.00 0.00 H new ATOM 1344 N ASP A 88 8.398 -13.108 -9.521 1.00 0.00 N ATOM 1345 CA ASP A 88 8.825 -12.644 -8.162 1.00 0.00 C ATOM 1346 C ASP A 88 9.108 -11.103 -8.050 1.00 0.00 C ATOM 1347 O ASP A 88 10.086 -10.677 -7.424 1.00 0.00 O ATOM 1348 CB ASP A 88 9.926 -13.547 -7.525 1.00 0.00 C ATOM 1349 CG ASP A 88 9.498 -14.997 -7.249 1.00 0.00 C ATOM 1350 OD1 ASP A 88 8.833 -15.245 -6.219 1.00 0.00 O ATOM 1351 OD2 ASP A 88 9.820 -15.888 -8.065 1.00 0.00 O ATOM 0 H ASP A 88 7.491 -13.575 -9.519 1.00 0.00 H new ATOM 0 HA ASP A 88 7.944 -12.780 -7.535 1.00 0.00 H new ATOM 0 HB2 ASP A 88 10.792 -13.560 -8.187 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.248 -13.094 -6.587 1.00 0.00 H new ATOM 1356 N ASN A 89 8.228 -10.273 -8.649 1.00 0.00 N ATOM 1357 CA ASN A 89 8.377 -8.793 -8.689 1.00 0.00 C ATOM 1358 C ASN A 89 7.036 -8.039 -8.948 1.00 0.00 C ATOM 1359 O ASN A 89 6.805 -7.023 -8.291 1.00 0.00 O ATOM 1360 CB ASN A 89 9.528 -8.299 -9.614 1.00 0.00 C ATOM 1361 CG ASN A 89 9.419 -8.542 -11.137 1.00 0.00 C ATOM 1362 OD1 ASN A 89 9.022 -9.609 -11.603 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.802 -7.563 -11.943 1.00 0.00 N ATOM 0 H ASN A 89 7.388 -10.607 -9.122 1.00 0.00 H new ATOM 0 HA ASN A 89 8.681 -8.525 -7.677 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.638 -7.226 -9.459 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.451 -8.767 -9.271 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.768 -7.692 -12.954 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.130 -6.680 -11.552 1.00 0.00 H new ATOM 1370 N LYS A 90 6.178 -8.486 -9.889 1.00 0.00 N ATOM 1371 CA LYS A 90 4.925 -7.775 -10.260 1.00 0.00 C ATOM 1372 C LYS A 90 3.704 -8.350 -9.493 1.00 0.00 C ATOM 1373 O LYS A 90 3.545 -9.568 -9.375 1.00 0.00 O ATOM 1374 CB LYS A 90 4.665 -7.860 -11.786 1.00 0.00 C ATOM 1375 CG LYS A 90 5.711 -7.155 -12.680 1.00 0.00 C ATOM 1376 CD LYS A 90 5.355 -7.104 -14.178 1.00 0.00 C ATOM 1377 CE LYS A 90 4.254 -6.082 -14.522 1.00 0.00 C ATOM 1378 NZ LYS A 90 3.993 -6.037 -15.970 1.00 0.00 N ATOM 0 H LYS A 90 6.329 -9.347 -10.415 1.00 0.00 H new ATOM 0 HA LYS A 90 5.055 -6.729 -9.981 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.619 -8.911 -12.071 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.685 -7.430 -11.995 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.848 -6.136 -12.319 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.668 -7.665 -12.566 1.00 0.00 H new ATOM 0 HD2 LYS A 90 6.253 -6.862 -14.747 1.00 0.00 H new ATOM 0 HD3 LYS A 90 5.031 -8.094 -14.499 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.337 -6.342 -13.994 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.553 -5.093 -14.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 3.247 -5.339 -16.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.863 -5.765 -16.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.685 -6.975 -16.296 1.00 0.00 H new ATOM 1392 N LEU A 91 2.826 -7.447 -9.027 1.00 0.00 N ATOM 1393 CA LEU A 91 1.523 -7.811 -8.411 1.00 0.00 C ATOM 1394 C LEU A 91 0.420 -7.082 -9.222 1.00 0.00 C ATOM 1395 O LEU A 91 0.216 -5.875 -9.058 1.00 0.00 O ATOM 1396 CB LEU A 91 1.478 -7.416 -6.910 1.00 0.00 C ATOM 1397 CG LEU A 91 2.457 -8.130 -5.941 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.431 -7.436 -4.565 1.00 0.00 C ATOM 1399 CD2 LEU A 91 2.187 -9.640 -5.792 1.00 0.00 C ATOM 0 H LEU A 91 2.992 -6.441 -9.063 1.00 0.00 H new ATOM 0 HA LEU A 91 1.371 -8.890 -8.444 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.662 -6.344 -6.841 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.464 -7.590 -6.549 1.00 0.00 H new ATOM 0 HG LEU A 91 3.451 -8.046 -6.381 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.120 -7.942 -3.889 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.732 -6.394 -4.677 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.422 -7.480 -4.154 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.910 -10.072 -5.100 1.00 0.00 H new ATOM 0 HD22 LEU A 91 1.179 -9.793 -5.407 1.00 0.00 H new ATOM 0 HD23 LEU A 91 2.281 -10.124 -6.764 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.264 -7.825 -10.111 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.230 -7.249 -11.096 1.00 0.00 C ATOM 1413 C VAL A 92 -2.682 -7.585 -10.645 1.00 0.00 C ATOM 1414 O VAL A 92 -3.050 -8.762 -10.551 1.00 0.00 O ATOM 1415 CB VAL A 92 -0.910 -7.674 -12.573 1.00 0.00 C ATOM 1416 CG1 VAL A 92 0.405 -7.045 -13.089 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -0.895 -9.195 -12.862 1.00 0.00 C ATOM 0 H VAL A 92 -0.171 -8.839 -10.176 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.127 -6.164 -11.106 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.765 -7.277 -13.121 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.585 -7.368 -14.115 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.325 -5.958 -13.059 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.234 -7.365 -12.457 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.663 -9.363 -13.914 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.138 -9.676 -12.242 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.873 -9.618 -12.634 1.00 0.00 H new ATOM 1427 N THR A 93 -3.495 -6.548 -10.346 1.00 0.00 N ATOM 1428 CA THR A 93 -4.881 -6.742 -9.816 1.00 0.00 C ATOM 1429 C THR A 93 -5.809 -5.557 -10.210 1.00 0.00 C ATOM 1430 O THR A 93 -5.386 -4.399 -10.180 1.00 0.00 O ATOM 1431 CB THR A 93 -4.862 -7.021 -8.282 1.00 0.00 C ATOM 1432 OG1 THR A 93 -6.145 -7.467 -7.859 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.422 -5.864 -7.363 1.00 0.00 C ATOM 0 H THR A 93 -3.226 -5.570 -10.458 1.00 0.00 H new ATOM 0 HA THR A 93 -5.307 -7.629 -10.285 1.00 0.00 H new ATOM 0 HB THR A 93 -4.087 -7.780 -8.171 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.129 -7.643 -6.895 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.454 -6.192 -6.324 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.406 -5.564 -7.617 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.095 -5.017 -7.497 1.00 0.00 H new ATOM 1441 N THR A 94 -7.085 -5.852 -10.532 1.00 0.00 N ATOM 1442 CA THR A 94 -8.089 -4.810 -10.896 1.00 0.00 C ATOM 1443 C THR A 94 -9.264 -4.909 -9.884 1.00 0.00 C ATOM 1444 O THR A 94 -10.017 -5.888 -9.883 1.00 0.00 O ATOM 1445 CB THR A 94 -8.530 -4.937 -12.386 1.00 0.00 C ATOM 1446 OG1 THR A 94 -7.389 -4.849 -13.234 1.00 0.00 O ATOM 1447 CG2 THR A 94 -9.508 -3.839 -12.846 1.00 0.00 C ATOM 0 H THR A 94 -7.453 -6.803 -10.550 1.00 0.00 H new ATOM 0 HA THR A 94 -7.656 -3.812 -10.824 1.00 0.00 H new ATOM 0 HB THR A 94 -9.035 -5.900 -12.456 1.00 0.00 H new ATOM 0 HG1 THR A 94 -7.670 -4.931 -14.169 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.767 -3.997 -13.893 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.412 -3.879 -12.239 1.00 0.00 H new ATOM 0 HG23 THR A 94 -9.038 -2.862 -12.732 1.00 0.00 H new ATOM 1455 N PHE A 95 -9.427 -3.860 -9.057 1.00 0.00 N ATOM 1456 CA PHE A 95 -10.498 -3.778 -8.022 1.00 0.00 C ATOM 1457 C PHE A 95 -11.905 -3.607 -8.671 1.00 0.00 C ATOM 1458 O PHE A 95 -12.659 -4.579 -8.773 1.00 0.00 O ATOM 1459 CB PHE A 95 -10.143 -2.695 -6.956 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.975 -2.995 -5.993 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -7.646 -2.799 -6.392 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -9.241 -3.400 -4.679 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -6.602 -3.018 -5.496 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -8.196 -3.601 -3.783 1.00 0.00 C ATOM 1465 CZ PHE A 95 -6.878 -3.418 -4.191 1.00 0.00 C ATOM 0 H PHE A 95 -8.823 -3.038 -9.080 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.552 -4.724 -7.483 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -9.915 -1.768 -7.482 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -11.034 -2.510 -6.356 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.430 -2.476 -7.400 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.261 -3.557 -4.360 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.579 -2.878 -5.813 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -8.408 -3.900 -2.767 1.00 0.00 H new ATOM 0 HZ PHE A 95 -6.069 -3.586 -3.495 1.00 0.00 H new ATOM 1475 N LYS A 96 -12.213 -2.388 -9.134 1.00 0.00 N ATOM 1476 CA LYS A 96 -13.350 -2.106 -10.050 1.00 0.00 C ATOM 1477 C LYS A 96 -12.746 -1.465 -11.335 1.00 0.00 C ATOM 1478 O LYS A 96 -12.661 -2.148 -12.359 1.00 0.00 O ATOM 1479 CB LYS A 96 -14.450 -1.288 -9.318 1.00 0.00 C ATOM 1480 CG LYS A 96 -15.747 -1.093 -10.135 1.00 0.00 C ATOM 1481 CD LYS A 96 -16.818 -0.217 -9.456 1.00 0.00 C ATOM 1482 CE LYS A 96 -16.488 1.290 -9.451 1.00 0.00 C ATOM 1483 NZ LYS A 96 -17.597 2.084 -8.891 1.00 0.00 N ATOM 0 H LYS A 96 -11.680 -1.554 -8.886 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.883 -3.003 -10.364 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.696 -1.789 -8.382 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -14.047 -0.309 -9.059 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -15.490 -0.647 -11.096 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.178 -2.072 -10.343 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -17.771 -0.368 -9.964 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -16.948 -0.553 -8.427 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -15.584 1.464 -8.867 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.279 1.621 -10.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.342 3.092 -8.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.453 1.937 -9.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -17.779 1.784 -7.912 1.00 0.00 H new ATOM 1497 N ASN A 97 -12.284 -0.196 -11.271 1.00 0.00 N ATOM 1498 CA ASN A 97 -11.342 0.366 -12.278 1.00 0.00 C ATOM 1499 C ASN A 97 -10.118 1.013 -11.551 1.00 0.00 C ATOM 1500 O ASN A 97 -9.846 2.203 -11.718 1.00 0.00 O ATOM 1501 CB ASN A 97 -12.139 1.317 -13.219 1.00 0.00 C ATOM 1502 CG ASN A 97 -11.376 1.808 -14.469 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -10.818 1.023 -15.236 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -11.354 3.110 -14.708 1.00 0.00 N ATOM 0 H ASN A 97 -12.545 0.461 -10.536 1.00 0.00 H new ATOM 0 HA ASN A 97 -10.911 -0.405 -12.917 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -13.043 0.803 -13.545 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.457 2.187 -12.644 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -10.872 3.469 -15.532 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -11.819 3.754 -14.068 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.361 0.214 -10.772 1.00 0.00 N ATOM 1512 CA ILE A 98 -8.078 0.647 -10.145 1.00 0.00 C ATOM 1513 C ILE A 98 -7.116 -0.517 -10.503 1.00 0.00 C ATOM 1514 O ILE A 98 -7.101 -1.550 -9.823 1.00 0.00 O ATOM 1515 CB ILE A 98 -8.199 0.936 -8.603 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -9.143 2.135 -8.284 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.814 1.179 -7.940 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -9.618 2.227 -6.827 1.00 0.00 C ATOM 0 H ILE A 98 -9.614 -0.750 -10.555 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.722 1.609 -10.515 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.640 0.034 -8.179 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.627 3.060 -8.540 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -10.018 2.069 -8.931 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.949 1.374 -6.876 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.188 0.296 -8.070 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.332 2.037 -8.408 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -10.268 3.094 -6.710 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -10.168 1.323 -6.566 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -8.755 2.330 -6.169 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.323 -0.335 -11.574 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.418 -1.393 -12.088 1.00 0.00 C ATOM 1532 C LYS A 99 -4.026 -1.222 -11.418 1.00 0.00 C ATOM 1533 O LYS A 99 -3.166 -0.483 -11.909 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.421 -1.321 -13.636 1.00 0.00 C ATOM 1535 CG LYS A 99 -4.737 -2.517 -14.336 1.00 0.00 C ATOM 1536 CD LYS A 99 -4.764 -2.458 -15.877 1.00 0.00 C ATOM 1537 CE LYS A 99 -6.152 -2.710 -16.501 1.00 0.00 C ATOM 1538 NZ LYS A 99 -6.096 -2.670 -17.972 1.00 0.00 N ATOM 0 H LYS A 99 -6.287 0.535 -12.105 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.747 -2.400 -11.831 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.453 -1.256 -13.982 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.923 -0.402 -13.945 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.700 -2.570 -14.005 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.223 -3.437 -14.012 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.408 -1.479 -16.197 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.064 -3.196 -16.269 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.528 -3.680 -16.176 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.856 -1.959 -16.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.045 -2.843 -18.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -5.760 -1.735 -18.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -5.443 -3.403 -18.315 1.00 0.00 H new ATOM 1552 N SER A 100 -3.845 -1.910 -10.277 1.00 0.00 N ATOM 1553 CA SER A 100 -2.636 -1.803 -9.429 1.00 0.00 C ATOM 1554 C SER A 100 -1.542 -2.749 -9.974 1.00 0.00 C ATOM 1555 O SER A 100 -1.677 -3.973 -9.899 1.00 0.00 O ATOM 1556 CB SER A 100 -3.024 -2.146 -7.974 1.00 0.00 C ATOM 1557 OG SER A 100 -1.957 -1.841 -7.083 1.00 0.00 O ATOM 0 H SER A 100 -4.538 -2.563 -9.911 1.00 0.00 H new ATOM 0 HA SER A 100 -2.234 -0.790 -9.448 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.914 -1.586 -7.688 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.275 -3.204 -7.899 1.00 0.00 H new ATOM 0 HG SER A 100 -2.222 -2.064 -6.166 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.488 -2.151 -10.547 1.00 0.00 N ATOM 1564 CA VAL A 101 0.617 -2.893 -11.212 1.00 0.00 C ATOM 1565 C VAL A 101 1.877 -2.554 -10.365 1.00 0.00 C ATOM 1566 O VAL A 101 2.483 -1.492 -10.547 1.00 0.00 O ATOM 1567 CB VAL A 101 0.727 -2.472 -12.720 1.00 0.00 C ATOM 1568 CG1 VAL A 101 1.975 -3.052 -13.422 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.522 -2.846 -13.553 1.00 0.00 C ATOM 0 H VAL A 101 -0.368 -1.138 -10.568 1.00 0.00 H new ATOM 0 HA VAL A 101 0.466 -3.972 -11.246 1.00 0.00 H new ATOM 0 HB VAL A 101 0.812 -1.386 -12.681 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.993 -2.724 -14.461 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.874 -2.701 -12.915 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.940 -4.141 -13.385 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.380 -2.527 -14.585 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.669 -3.926 -13.524 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.399 -2.349 -13.137 1.00 0.00 H new ATOM 1579 N THR A 102 2.243 -3.446 -9.427 1.00 0.00 N ATOM 1580 CA THR A 102 3.226 -3.119 -8.358 1.00 0.00 C ATOM 1581 C THR A 102 4.533 -3.920 -8.615 1.00 0.00 C ATOM 1582 O THR A 102 4.722 -5.022 -8.090 1.00 0.00 O ATOM 1583 CB THR A 102 2.549 -3.317 -6.968 1.00 0.00 C ATOM 1584 OG1 THR A 102 1.343 -2.561 -6.889 1.00 0.00 O ATOM 1585 CG2 THR A 102 3.418 -2.908 -5.775 1.00 0.00 C ATOM 0 H THR A 102 1.879 -4.398 -9.381 1.00 0.00 H new ATOM 0 HA THR A 102 3.534 -2.073 -8.368 1.00 0.00 H new ATOM 0 HB THR A 102 2.368 -4.390 -6.901 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.929 -2.697 -6.011 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.869 -3.079 -4.849 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.332 -3.502 -5.770 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.673 -1.851 -5.856 1.00 0.00 H new ATOM 1593 N GLU A 103 5.423 -3.326 -9.436 1.00 0.00 N ATOM 1594 CA GLU A 103 6.683 -3.961 -9.898 1.00 0.00 C ATOM 1595 C GLU A 103 7.851 -3.610 -8.946 1.00 0.00 C ATOM 1596 O GLU A 103 8.070 -2.448 -8.603 1.00 0.00 O ATOM 1597 CB GLU A 103 6.989 -3.435 -11.323 1.00 0.00 C ATOM 1598 CG GLU A 103 8.139 -4.162 -12.057 1.00 0.00 C ATOM 1599 CD GLU A 103 8.287 -3.713 -13.512 1.00 0.00 C ATOM 1600 OE1 GLU A 103 8.919 -2.664 -13.761 1.00 0.00 O ATOM 1601 OE2 GLU A 103 7.768 -4.409 -14.413 1.00 0.00 O ATOM 0 H GLU A 103 5.290 -2.383 -9.803 1.00 0.00 H new ATOM 0 HA GLU A 103 6.570 -5.045 -9.905 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.085 -3.517 -11.926 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.233 -2.375 -11.258 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.075 -3.980 -11.528 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.960 -5.237 -12.029 1.00 0.00 H new ATOM 1608 N LEU A 104 8.628 -4.632 -8.581 1.00 0.00 N ATOM 1609 CA LEU A 104 9.733 -4.500 -7.601 1.00 0.00 C ATOM 1610 C LEU A 104 11.075 -4.452 -8.376 1.00 0.00 C ATOM 1611 O LEU A 104 11.505 -5.452 -8.961 1.00 0.00 O ATOM 1612 CB LEU A 104 9.634 -5.659 -6.570 1.00 0.00 C ATOM 1613 CG LEU A 104 10.172 -5.337 -5.153 1.00 0.00 C ATOM 1614 CD1 LEU A 104 9.832 -6.494 -4.206 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.676 -5.022 -5.099 1.00 0.00 C ATOM 0 H LEU A 104 8.518 -5.577 -8.950 1.00 0.00 H new ATOM 0 HA LEU A 104 9.668 -3.575 -7.028 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.589 -5.958 -6.484 1.00 0.00 H new ATOM 0 HB3 LEU A 104 10.180 -6.518 -6.961 1.00 0.00 H new ATOM 0 HG LEU A 104 9.676 -4.419 -4.836 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.209 -6.270 -3.208 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.751 -6.624 -4.164 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.294 -7.411 -4.571 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.966 -4.809 -4.070 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.241 -5.879 -5.465 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.889 -4.154 -5.723 1.00 0.00 H new ATOM 1627 N ASN A 105 11.714 -3.269 -8.379 1.00 0.00 N ATOM 1628 CA ASN A 105 12.927 -3.005 -9.200 1.00 0.00 C ATOM 1629 C ASN A 105 14.154 -2.862 -8.255 1.00 0.00 C ATOM 1630 O ASN A 105 14.463 -1.766 -7.776 1.00 0.00 O ATOM 1631 CB ASN A 105 12.698 -1.753 -10.097 1.00 0.00 C ATOM 1632 CG ASN A 105 11.580 -1.882 -11.157 1.00 0.00 C ATOM 1633 OD1 ASN A 105 10.433 -1.497 -10.926 1.00 0.00 O ATOM 1634 ND2 ASN A 105 11.887 -2.434 -12.321 1.00 0.00 N ATOM 0 H ASN A 105 11.414 -2.470 -7.820 1.00 0.00 H new ATOM 0 HA ASN A 105 13.127 -3.837 -9.875 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.466 -0.905 -9.453 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.632 -1.519 -10.608 1.00 0.00 H new ATOM 0 HD21 ASN A 105 11.170 -2.544 -13.038 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.840 -2.749 -12.500 1.00 0.00 H new ATOM 1641 N GLY A 106 14.840 -3.989 -7.977 1.00 0.00 N ATOM 1642 CA GLY A 106 16.026 -4.011 -7.087 1.00 0.00 C ATOM 1643 C GLY A 106 15.658 -3.954 -5.589 1.00 0.00 C ATOM 1644 O GLY A 106 15.095 -4.915 -5.056 1.00 0.00 O ATOM 0 H GLY A 106 14.593 -4.903 -8.357 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.601 -4.917 -7.280 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.671 -3.166 -7.329 1.00 0.00 H new ATOM 1648 N ASP A 107 15.957 -2.815 -4.939 1.00 0.00 N ATOM 1649 CA ASP A 107 15.421 -2.494 -3.581 1.00 0.00 C ATOM 1650 C ASP A 107 14.608 -1.155 -3.581 1.00 0.00 C ATOM 1651 O ASP A 107 14.817 -0.277 -2.737 1.00 0.00 O ATOM 1652 CB ASP A 107 16.565 -2.520 -2.527 1.00 0.00 C ATOM 1653 CG ASP A 107 17.110 -3.916 -2.190 1.00 0.00 C ATOM 1654 OD1 ASP A 107 16.477 -4.633 -1.381 1.00 0.00 O ATOM 1655 OD2 ASP A 107 18.168 -4.300 -2.735 1.00 0.00 O ATOM 0 H ASP A 107 16.567 -2.093 -5.323 1.00 0.00 H new ATOM 0 HA ASP A 107 14.708 -3.267 -3.295 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.387 -1.904 -2.891 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.203 -2.057 -1.609 1.00 0.00 H new ATOM 1660 N ILE A 108 13.618 -1.044 -4.487 1.00 0.00 N ATOM 1661 CA ILE A 108 12.490 -0.080 -4.374 1.00 0.00 C ATOM 1662 C ILE A 108 11.144 -0.880 -4.511 1.00 0.00 C ATOM 1663 O ILE A 108 11.115 -2.111 -4.429 1.00 0.00 O ATOM 1664 CB ILE A 108 12.644 1.147 -5.345 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.597 0.783 -6.855 1.00 0.00 C ATOM 1666 CG2 ILE A 108 13.845 2.068 -5.033 1.00 0.00 C ATOM 1667 CD1 ILE A 108 11.925 1.844 -7.733 1.00 0.00 C ATOM 0 H ILE A 108 13.572 -1.622 -5.326 1.00 0.00 H new ATOM 0 HA ILE A 108 12.490 0.393 -3.392 1.00 0.00 H new ATOM 0 HB ILE A 108 11.745 1.727 -5.134 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.615 0.623 -7.211 1.00 0.00 H new ATOM 0 HG13 ILE A 108 12.066 -0.161 -6.974 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.873 2.886 -5.753 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.741 2.473 -4.027 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.770 1.495 -5.100 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.933 1.515 -8.772 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.895 1.988 -7.406 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.468 2.785 -7.647 1.00 0.00 H new ATOM 1679 N ILE A 109 10.015 -0.183 -4.737 1.00 0.00 N ATOM 1680 CA ILE A 109 8.791 -0.802 -5.301 1.00 0.00 C ATOM 1681 C ILE A 109 7.968 0.306 -6.021 1.00 0.00 C ATOM 1682 O ILE A 109 7.621 1.336 -5.431 1.00 0.00 O ATOM 1683 CB ILE A 109 7.998 -1.682 -4.271 1.00 0.00 C ATOM 1684 CG1 ILE A 109 7.075 -2.689 -5.004 1.00 0.00 C ATOM 1685 CG2 ILE A 109 7.253 -0.890 -3.168 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.611 -3.876 -4.155 1.00 0.00 C ATOM 0 H ILE A 109 9.921 0.813 -4.538 1.00 0.00 H new ATOM 0 HA ILE A 109 9.063 -1.545 -6.051 1.00 0.00 H new ATOM 0 HB ILE A 109 8.754 -2.241 -3.719 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.197 -2.156 -5.367 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.601 -3.071 -5.879 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.736 -1.586 -2.507 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.971 -0.306 -2.591 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.527 -0.220 -3.629 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.971 -4.524 -4.754 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.479 -4.440 -3.813 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.053 -3.511 -3.293 1.00 0.00 H new ATOM 1698 N THR A 110 7.667 0.059 -7.307 1.00 0.00 N ATOM 1699 CA THR A 110 6.951 1.027 -8.181 1.00 0.00 C ATOM 1700 C THR A 110 5.457 0.593 -8.270 1.00 0.00 C ATOM 1701 O THR A 110 5.097 -0.273 -9.073 1.00 0.00 O ATOM 1702 CB THR A 110 7.654 1.093 -9.570 1.00 0.00 C ATOM 1703 OG1 THR A 110 9.035 1.413 -9.422 1.00 0.00 O ATOM 1704 CG2 THR A 110 7.053 2.137 -10.527 1.00 0.00 C ATOM 0 H THR A 110 7.909 -0.813 -7.777 1.00 0.00 H new ATOM 0 HA THR A 110 6.981 2.036 -7.770 1.00 0.00 H new ATOM 0 HB THR A 110 7.508 0.102 -10.000 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.459 1.448 -10.305 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.597 2.121 -11.471 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.004 1.903 -10.709 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.131 3.128 -10.080 1.00 0.00 H new ATOM 1712 N ASN A 111 4.601 1.226 -7.450 1.00 0.00 N ATOM 1713 CA ASN A 111 3.138 0.951 -7.411 1.00 0.00 C ATOM 1714 C ASN A 111 2.423 1.907 -8.403 1.00 0.00 C ATOM 1715 O ASN A 111 2.247 3.093 -8.112 1.00 0.00 O ATOM 1716 CB ASN A 111 2.663 1.090 -5.938 1.00 0.00 C ATOM 1717 CG ASN A 111 1.152 0.929 -5.661 1.00 0.00 C ATOM 1718 OD1 ASN A 111 0.354 1.813 -5.972 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.733 -0.163 -5.045 1.00 0.00 N ATOM 0 H ASN A 111 4.896 1.946 -6.791 1.00 0.00 H new ATOM 0 HA ASN A 111 2.892 -0.061 -7.732 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.196 0.350 -5.341 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.969 2.072 -5.576 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.256 -0.277 -4.825 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.399 -0.892 -4.790 1.00 0.00 H new ATOM 1726 N THR A 112 2.012 1.364 -9.563 1.00 0.00 N ATOM 1727 CA THR A 112 1.382 2.156 -10.654 1.00 0.00 C ATOM 1728 C THR A 112 -0.131 1.786 -10.710 1.00 0.00 C ATOM 1729 O THR A 112 -0.533 0.834 -11.386 1.00 0.00 O ATOM 1730 CB THR A 112 2.143 1.931 -11.995 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.539 2.169 -11.827 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.674 2.845 -13.139 1.00 0.00 C ATOM 0 H THR A 112 2.103 0.371 -9.777 1.00 0.00 H new ATOM 0 HA THR A 112 1.451 3.227 -10.463 1.00 0.00 H new ATOM 0 HB THR A 112 1.931 0.896 -12.263 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.001 2.021 -12.679 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.251 2.628 -14.038 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.616 2.669 -13.335 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.822 3.887 -12.856 1.00 0.00 H new ATOM 1740 N MET A 113 -0.952 2.576 -9.997 1.00 0.00 N ATOM 1741 CA MET A 113 -2.432 2.418 -9.968 1.00 0.00 C ATOM 1742 C MET A 113 -3.061 3.331 -11.052 1.00 0.00 C ATOM 1743 O MET A 113 -3.136 4.554 -10.886 1.00 0.00 O ATOM 1744 CB MET A 113 -2.991 2.762 -8.562 1.00 0.00 C ATOM 1745 CG MET A 113 -2.793 1.675 -7.499 1.00 0.00 C ATOM 1746 SD MET A 113 -3.423 2.263 -5.915 1.00 0.00 S ATOM 1747 CE MET A 113 -3.342 0.745 -4.947 1.00 0.00 C ATOM 0 H MET A 113 -0.615 3.347 -9.420 1.00 0.00 H new ATOM 0 HA MET A 113 -2.690 1.381 -10.180 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.516 3.679 -8.214 1.00 0.00 H new ATOM 0 HB3 MET A 113 -4.057 2.969 -8.653 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.313 0.764 -7.794 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.736 1.425 -7.412 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.797 0.911 -3.971 1.00 0.00 H new ATOM 0 HE2 MET A 113 -3.879 -0.048 -5.468 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.300 0.452 -4.816 1.00 0.00 H new ATOM 1757 N THR A 114 -3.513 2.717 -12.160 1.00 0.00 N ATOM 1758 CA THR A 114 -4.093 3.458 -13.313 1.00 0.00 C ATOM 1759 C THR A 114 -5.642 3.485 -13.167 1.00 0.00 C ATOM 1760 O THR A 114 -6.333 2.509 -13.476 1.00 0.00 O ATOM 1761 CB THR A 114 -3.608 2.920 -14.694 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.966 1.562 -14.893 1.00 0.00 O ATOM 1763 CG2 THR A 114 -2.094 3.046 -14.933 1.00 0.00 C ATOM 0 H THR A 114 -3.491 1.705 -12.289 1.00 0.00 H new ATOM 0 HA THR A 114 -3.727 4.484 -13.292 1.00 0.00 H new ATOM 0 HB THR A 114 -4.119 3.564 -15.410 1.00 0.00 H new ATOM 0 HG1 THR A 114 -3.645 1.264 -15.770 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.847 2.648 -15.917 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.804 4.095 -14.883 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.557 2.484 -14.169 1.00 0.00 H new ATOM 1771 N LEU A 115 -6.160 4.630 -12.687 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.618 4.894 -12.562 1.00 0.00 C ATOM 1773 C LEU A 115 -8.093 5.653 -13.834 1.00 0.00 C ATOM 1774 O LEU A 115 -8.172 6.886 -13.845 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.827 5.660 -11.221 1.00 0.00 C ATOM 1776 CG LEU A 115 -9.234 6.227 -10.876 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -10.337 5.158 -10.791 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -9.156 7.013 -9.556 1.00 0.00 C ATOM 0 H LEU A 115 -5.581 5.408 -12.371 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.227 3.991 -12.515 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.538 4.989 -10.412 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -7.126 6.495 -11.208 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.518 6.881 -11.701 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -11.287 5.634 -10.547 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -10.423 4.647 -11.750 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -10.084 4.435 -10.016 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.140 7.412 -9.311 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.824 6.350 -8.757 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.448 7.835 -9.663 1.00 0.00 H new ATOM 1790 N GLY A 116 -8.372 4.894 -14.913 1.00 0.00 N ATOM 1791 CA GLY A 116 -8.750 5.467 -16.226 1.00 0.00 C ATOM 1792 C GLY A 116 -7.568 6.134 -16.958 1.00 0.00 C ATOM 1793 O GLY A 116 -6.733 5.451 -17.557 1.00 0.00 O ATOM 0 H GLY A 116 -8.343 3.874 -14.902 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.161 4.678 -16.856 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.541 6.203 -16.080 1.00 0.00 H new ATOM 1797 N ASP A 117 -7.512 7.471 -16.858 1.00 0.00 N ATOM 1798 CA ASP A 117 -6.350 8.288 -17.322 1.00 0.00 C ATOM 1799 C ASP A 117 -5.340 8.710 -16.199 1.00 0.00 C ATOM 1800 O ASP A 117 -4.229 9.127 -16.539 1.00 0.00 O ATOM 1801 CB ASP A 117 -6.869 9.552 -18.066 1.00 0.00 C ATOM 1802 CG ASP A 117 -7.597 9.287 -19.396 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -6.921 9.028 -20.416 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -8.847 9.331 -19.420 1.00 0.00 O ATOM 0 H ASP A 117 -8.265 8.029 -16.455 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.782 7.638 -17.988 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -7.546 10.090 -17.403 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -6.023 10.211 -18.260 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.693 8.625 -14.894 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.856 9.122 -13.766 1.00 0.00 C ATOM 1811 C ILE A 118 -3.819 8.007 -13.422 1.00 0.00 C ATOM 1812 O ILE A 118 -4.176 6.980 -12.840 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.765 9.520 -12.542 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.811 10.635 -12.863 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -4.922 9.950 -11.310 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.968 10.757 -11.854 1.00 0.00 C ATOM 0 H ILE A 118 -6.572 8.207 -14.588 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.315 10.028 -14.040 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.319 8.611 -12.309 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.293 11.593 -12.916 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -7.230 10.445 -13.851 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.587 10.216 -10.489 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.279 9.125 -11.003 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.307 10.811 -11.572 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.639 11.558 -12.165 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.518 9.817 -11.816 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.567 10.983 -10.866 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.543 8.244 -13.774 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.447 7.253 -13.574 1.00 0.00 C ATOM 1830 C VAL A 119 -0.753 7.616 -12.226 1.00 0.00 C ATOM 1831 O VAL A 119 0.119 8.490 -12.185 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.474 7.226 -14.808 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.663 6.191 -14.648 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -1.174 6.949 -16.163 1.00 0.00 C ATOM 0 H VAL A 119 -2.234 9.117 -14.202 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.828 6.234 -13.511 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.066 8.237 -14.826 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.304 6.216 -15.529 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.252 6.432 -13.763 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.235 5.194 -14.539 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.432 6.947 -16.962 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.669 5.979 -16.125 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.913 7.726 -16.356 1.00 0.00 H new ATOM 1844 N PHE A 120 -1.153 6.934 -11.134 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.609 7.191 -9.776 1.00 0.00 C ATOM 1846 C PHE A 120 0.646 6.319 -9.535 1.00 0.00 C ATOM 1847 O PHE A 120 0.537 5.145 -9.178 1.00 0.00 O ATOM 1848 CB PHE A 120 -1.726 6.974 -8.717 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.363 7.166 -7.225 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -0.486 8.172 -6.796 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -1.974 6.348 -6.269 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -0.256 8.378 -5.441 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -1.752 6.564 -4.912 1.00 0.00 C ATOM 1854 CZ PHE A 120 -0.901 7.585 -4.499 1.00 0.00 C ATOM 0 H PHE A 120 -1.856 6.195 -11.162 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.285 8.228 -9.685 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.544 7.655 -8.951 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.109 5.961 -8.839 1.00 0.00 H new ATOM 0 HD1 PHE A 120 0.015 8.792 -7.525 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.622 5.544 -6.586 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.423 9.154 -5.120 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -2.240 5.939 -4.179 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.742 7.761 -3.445 1.00 0.00 H new ATOM 1864 N LYS A 121 1.823 6.939 -9.712 1.00 0.00 N ATOM 1865 CA LYS A 121 3.130 6.239 -9.576 1.00 0.00 C ATOM 1866 C LYS A 121 3.759 6.601 -8.200 1.00 0.00 C ATOM 1867 O LYS A 121 4.203 7.733 -7.985 1.00 0.00 O ATOM 1868 CB LYS A 121 4.022 6.599 -10.792 1.00 0.00 C ATOM 1869 CG LYS A 121 5.308 5.757 -10.944 1.00 0.00 C ATOM 1870 CD LYS A 121 6.137 6.202 -12.171 1.00 0.00 C ATOM 1871 CE LYS A 121 7.380 5.350 -12.486 1.00 0.00 C ATOM 1872 NZ LYS A 121 8.472 5.515 -11.508 1.00 0.00 N ATOM 0 H LYS A 121 1.907 7.927 -9.951 1.00 0.00 H new ATOM 0 HA LYS A 121 3.012 5.155 -9.586 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.429 6.492 -11.700 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.303 7.649 -10.716 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.913 5.850 -10.042 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.045 4.704 -11.044 1.00 0.00 H new ATOM 0 HD2 LYS A 121 5.487 6.198 -13.046 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.456 7.232 -12.015 1.00 0.00 H new ATOM 0 HE2 LYS A 121 7.091 4.300 -12.521 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.749 5.613 -13.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.276 4.914 -11.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.774 6.510 -11.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.137 5.238 -10.563 1.00 0.00 H new ATOM 1886 N ARG A 122 3.792 5.614 -7.290 1.00 0.00 N ATOM 1887 CA ARG A 122 4.422 5.748 -5.947 1.00 0.00 C ATOM 1888 C ARG A 122 5.811 5.056 -5.973 1.00 0.00 C ATOM 1889 O ARG A 122 5.924 3.875 -6.317 1.00 0.00 O ATOM 1890 CB ARG A 122 3.530 5.109 -4.851 1.00 0.00 C ATOM 1891 CG ARG A 122 2.285 5.928 -4.447 1.00 0.00 C ATOM 1892 CD ARG A 122 1.574 5.442 -3.166 1.00 0.00 C ATOM 1893 NE ARG A 122 0.793 4.192 -3.368 1.00 0.00 N ATOM 1894 CZ ARG A 122 -0.351 3.887 -2.722 1.00 0.00 C ATOM 1895 NH1 ARG A 122 -0.957 4.694 -1.851 1.00 0.00 N ATOM 1896 NH2 ARG A 122 -0.910 2.717 -2.967 1.00 0.00 N ATOM 0 H ARG A 122 3.384 4.694 -7.456 1.00 0.00 H new ATOM 0 HA ARG A 122 4.537 6.806 -5.711 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.202 4.130 -5.199 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.139 4.944 -3.962 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.582 6.968 -4.308 1.00 0.00 H new ATOM 0 HG3 ARG A 122 1.572 5.907 -5.271 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.317 5.276 -2.386 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.907 6.226 -2.809 1.00 0.00 H new ATOM 0 HE ARG A 122 1.149 3.516 -4.044 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -0.556 5.607 -1.637 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -1.822 4.398 -1.398 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -0.476 2.073 -3.629 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -1.776 2.456 -2.495 1.00 0.00 H new ATOM 1910 N ILE A 123 6.855 5.808 -5.585 1.00 0.00 N ATOM 1911 CA ILE A 123 8.264 5.321 -5.595 1.00 0.00 C ATOM 1912 C ILE A 123 8.640 5.166 -4.093 1.00 0.00 C ATOM 1913 O ILE A 123 8.895 6.168 -3.418 1.00 0.00 O ATOM 1914 CB ILE A 123 9.228 6.278 -6.395 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.850 6.501 -7.896 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.692 5.763 -6.346 1.00 0.00 C ATOM 1917 CD1 ILE A 123 7.811 7.600 -8.178 1.00 0.00 C ATOM 0 H ILE A 123 6.757 6.768 -5.255 1.00 0.00 H new ATOM 0 HA ILE A 123 8.369 4.373 -6.123 1.00 0.00 H new ATOM 0 HB ILE A 123 9.120 7.237 -5.888 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.760 6.740 -8.447 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.472 5.561 -8.298 1.00 0.00 H new ATOM 0 HG21 ILE A 123 11.335 6.442 -6.906 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.027 5.717 -5.310 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.743 4.768 -6.788 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.630 7.662 -9.251 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.879 7.360 -7.666 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.187 8.557 -7.817 1.00 0.00 H new ATOM 1929 N SER A 124 8.661 3.916 -3.591 1.00 0.00 N ATOM 1930 CA SER A 124 8.865 3.634 -2.142 1.00 0.00 C ATOM 1931 C SER A 124 10.124 2.748 -1.944 1.00 0.00 C ATOM 1932 O SER A 124 10.149 1.597 -2.385 1.00 0.00 O ATOM 1933 CB SER A 124 7.609 2.944 -1.560 1.00 0.00 C ATOM 1934 OG SER A 124 6.447 3.753 -1.684 1.00 0.00 O ATOM 0 H SER A 124 8.540 3.079 -4.162 1.00 0.00 H new ATOM 0 HA SER A 124 9.021 4.573 -1.611 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.446 1.996 -2.073 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.778 2.712 -0.508 1.00 0.00 H new ATOM 0 HG SER A 124 5.677 3.279 -1.306 1.00 0.00 H new ATOM 1940 N LYS A 125 11.168 3.284 -1.282 1.00 0.00 N ATOM 1941 CA LYS A 125 12.497 2.627 -1.194 1.00 0.00 C ATOM 1942 C LYS A 125 12.617 1.747 0.079 1.00 0.00 C ATOM 1943 O LYS A 125 12.299 2.188 1.188 1.00 0.00 O ATOM 1944 CB LYS A 125 13.587 3.723 -1.296 1.00 0.00 C ATOM 1945 CG LYS A 125 15.029 3.185 -1.419 1.00 0.00 C ATOM 1946 CD LYS A 125 16.047 4.235 -1.911 1.00 0.00 C ATOM 1947 CE LYS A 125 17.406 3.654 -2.349 1.00 0.00 C ATOM 1948 NZ LYS A 125 18.234 3.177 -1.225 1.00 0.00 N ATOM 0 H LYS A 125 11.120 4.179 -0.794 1.00 0.00 H new ATOM 0 HA LYS A 125 12.633 1.932 -2.023 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.372 4.351 -2.161 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.525 4.362 -0.415 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.350 2.809 -0.448 1.00 0.00 H new ATOM 0 HG3 LYS A 125 15.034 2.339 -2.106 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.612 4.779 -2.749 1.00 0.00 H new ATOM 0 HD3 LYS A 125 16.216 4.959 -1.114 1.00 0.00 H new ATOM 0 HE2 LYS A 125 17.233 2.828 -3.038 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.958 4.417 -2.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 19.132 2.800 -1.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 18.429 3.967 -0.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.726 2.427 -0.714 1.00 0.00 H new ATOM 1962 N ARG A 126 13.119 0.509 -0.099 1.00 0.00 N ATOM 1963 CA ARG A 126 13.193 -0.506 0.982 1.00 0.00 C ATOM 1964 C ARG A 126 14.181 -0.115 2.120 1.00 0.00 C ATOM 1965 O ARG A 126 15.286 0.384 1.880 1.00 0.00 O ATOM 1966 CB ARG A 126 13.527 -1.890 0.358 1.00 0.00 C ATOM 1967 CG ARG A 126 13.077 -3.103 1.203 1.00 0.00 C ATOM 1968 CD ARG A 126 14.135 -3.675 2.165 1.00 0.00 C ATOM 1969 NE ARG A 126 13.526 -4.706 3.040 1.00 0.00 N ATOM 1970 CZ ARG A 126 14.163 -5.319 4.056 1.00 0.00 C ATOM 1971 NH1 ARG A 126 15.437 -5.104 4.376 1.00 0.00 N ATOM 1972 NH2 ARG A 126 13.480 -6.187 4.777 1.00 0.00 N ATOM 0 H ARG A 126 13.485 0.181 -0.993 1.00 0.00 H new ATOM 0 HA ARG A 126 12.219 -0.560 1.468 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.058 -1.954 -0.624 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.604 -1.953 0.201 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.202 -2.813 1.785 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.761 -3.897 0.526 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.957 -4.109 1.596 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.556 -2.874 2.773 1.00 0.00 H new ATOM 0 HE ARG A 126 12.557 -4.969 2.860 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.993 -4.440 3.838 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.857 -5.604 5.160 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.502 -6.375 4.557 1.00 0.00 H new ATOM 0 HH22 ARG A 126 13.930 -6.670 5.554 1.00 0.00 H new ATOM 1986 N ILE A 127 13.721 -0.343 3.359 1.00 0.00 N ATOM 1987 CA ILE A 127 14.446 0.041 4.596 1.00 0.00 C ATOM 1988 C ILE A 127 14.287 -1.142 5.563 1.00 0.00 C ATOM 1989 O ILE A 127 15.144 -2.023 5.638 1.00 0.00 O ATOM 1990 CB ILE A 127 13.964 1.394 5.233 1.00 0.00 C ATOM 1991 CG1 ILE A 127 12.429 1.497 5.491 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.478 2.607 4.419 1.00 0.00 C ATOM 1993 CD1 ILE A 127 11.993 2.576 6.493 1.00 0.00 C ATOM 0 H ILE A 127 12.829 -0.802 3.540 1.00 0.00 H new ATOM 0 HA ILE A 127 15.492 0.236 4.361 1.00 0.00 H new ATOM 0 HB ILE A 127 14.412 1.409 6.227 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.931 1.688 4.540 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.074 0.531 5.848 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.130 3.530 4.882 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.568 2.598 4.402 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.099 2.548 3.399 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.908 2.559 6.596 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.453 2.380 7.462 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.308 3.555 6.133 1.00 0.00 H new TER 2005 ILE A 127