USER MOD reduce.3.24.130724 H: found=0, std=0, add=1349, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1349 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 101 TYR OH : rot 180:sc= -2.48! USER MOD Set 1.2: A 163 THR OG1 : rot 73:sc= 1.27 USER MOD Set 2.1: A 80 ASN : amide:sc=-0.00433 X(o=-1.9,f=-2.2) USER MOD Set 2.2: A 83 THR OG1 : rot -168:sc= -1.89! USER MOD Set 3.1: A 49 ASN : amide:sc= -1.46 X(o=-1.6,f=-1.8) USER MOD Set 3.2: A 53 SER OG : rot -150:sc= -0.107 USER MOD Set 4.1: A 44 THR OG1 : rot 5:sc= 0.382 USER MOD Set 4.2: A 48 SER OG : rot -106:sc= -1.36 USER MOD Set 4.3: A 164 THR OG1 : rot 32:sc= 0.276 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.236 USER MOD Single : A 22 SER OG : rot 180:sc= 0.0503 USER MOD Single : A 23 SER OG : rot 180:sc= -0.303 USER MOD Single : A 28 LYS NZ :NH3+ -179:sc= 0 (180deg=-1.67e-05) USER MOD Single : A 29 GLN : amide:sc= -0.419 X(o=-0.42,f=-0.4) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.182) USER MOD Single : A 46 ASN : amide:sc= -0.316 K(o=-0.32,f=-4.5!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -117:sc= -1.04 (180deg=-5.3!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc=-0.00264 X(o=-0.0026,f=0) USER MOD Single : A 62 ASN : amide:sc= -0.392 K(o=-0.39,f=-3.1!) USER MOD Single : A 64 ASN : amide:sc= -0.0423 K(o=-0.042,f=-1.1) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -175:sc= -4.78! (180deg=-5.1!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 88:sc= -0.945 USER MOD Single : A 98 TYR OH : rot 152:sc= -4.42! USER MOD Single : A 103 GLN : amide:sc= -0.0191 X(o=-0.019,f=-0.11) USER MOD Single : A 104 ASN : amide:sc= -0.0266 X(o=-0.027,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= -0.332 USER MOD Single : A 112 GLN : amide:sc= -3.78! C(o=-3.8!,f=-5!) USER MOD Single : A 117 GLN : amide:sc= -0.248 K(o=-0.25,f=-2.2!) USER MOD Single : A 118 MET CE :methyl 159:sc= 0 (180deg=-0.481) USER MOD Single : A 119 SER OG : rot 2:sc= -1.65 USER MOD Single : A 120 THR OG1 : rot -41:sc= -3.03! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0.077) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 169:sc= 0.0504 (180deg=0.0318) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -0.239 K(o=-0.24,f=-1.7!) USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.114 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= -0.0121 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 ASN : amide:sc= -9.49! C(o=-9.5!,f=-14!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= -0.0282 (180deg=-0.0282) USER MOD Single : A 153 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.004) USER MOD Single : A 155 GLN : amide:sc= -0.0498 X(o=-0.05,f=-0.14) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 GLN : amide:sc= -1.34 K(o=-1.3,f=0) USER MOD Single : A 162 MET CE :methyl -118:sc= -12.3! (180deg=-20.1!) USER MOD Single : A 165 HIS : no HD1:sc= -0.563 K(o=-0.56,f=-1.8) USER MOD Single : A 170 SER OG : rot 98:sc= 1.24 USER MOD Single : A 172 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.0567) USER MOD Single : A 176 GLN : amide:sc= -0.353 K(o=-0.35,f=-3.3!) USER MOD Single : A 177 SER OG : rot 180:sc= 0 USER MOD Single : A 178 SER OG : rot 30:sc= -0.232 USER MOD Single : A 184 GLN : amide:sc= -1.11 K(o=-1.1,f=-5.2!) USER MOD Single : A 185 MET CE :methyl -137:sc= -1.82 (180deg=-4.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 20 20.490 15.196 2.613 1.00 1.22 N ATOM 2 CA LEU A 20 19.563 14.653 1.581 1.00 1.19 C ATOM 3 C LEU A 20 20.243 13.496 0.847 1.00 0.90 C ATOM 4 O LEU A 20 21.453 13.392 0.816 1.00 0.97 O ATOM 5 CB LEU A 20 19.208 15.756 0.582 1.00 1.32 C ATOM 6 CG LEU A 20 17.738 15.626 0.178 1.00 1.67 C ATOM 7 CD1 LEU A 20 16.859 16.328 1.215 1.00 1.61 C ATOM 8 CD2 LEU A 20 17.526 16.276 -1.191 1.00 2.01 C ATOM 0 HA LEU A 20 18.653 14.294 2.061 1.00 1.19 H new ATOM 0 HB2 LEU A 20 19.389 16.735 1.026 1.00 1.32 H new ATOM 0 HB3 LEU A 20 19.846 15.683 -0.299 1.00 1.32 H new ATOM 0 HG LEU A 20 17.468 14.571 0.127 1.00 1.67 H new ATOM 0 HD11 LEU A 20 15.812 16.235 0.927 1.00 1.61 H new ATOM 0 HD12 LEU A 20 17.009 15.867 2.191 1.00 1.61 H new ATOM 0 HD13 LEU A 20 17.129 17.383 1.267 1.00 1.61 H new ATOM 0 HD21 LEU A 20 16.479 16.184 -1.479 1.00 2.01 H new ATOM 0 HD22 LEU A 20 17.796 17.331 -1.139 1.00 2.01 H new ATOM 0 HD23 LEU A 20 18.152 15.777 -1.931 1.00 2.01 H new ATOM 20 N THR A 21 19.474 12.625 0.255 1.00 1.35 N ATOM 21 CA THR A 21 20.074 11.474 -0.476 1.00 1.03 C ATOM 22 C THR A 21 18.957 10.644 -1.112 1.00 0.72 C ATOM 23 O THR A 21 17.788 10.898 -0.902 1.00 0.75 O ATOM 24 CB THR A 21 20.869 10.604 0.501 1.00 1.13 C ATOM 25 OG1 THR A 21 21.422 9.498 -0.195 1.00 1.04 O ATOM 26 CG2 THR A 21 19.946 10.102 1.612 1.00 1.11 C ATOM 0 H THR A 21 18.455 12.661 0.246 1.00 1.35 H new ATOM 0 HA THR A 21 20.743 11.843 -1.254 1.00 1.03 H new ATOM 0 HB THR A 21 21.672 11.195 0.941 1.00 1.13 H new ATOM 0 HG1 THR A 21 21.933 8.941 0.429 1.00 1.04 H new ATOM 0 HG21 THR A 21 20.515 9.483 2.306 1.00 1.11 H new ATOM 0 HG22 THR A 21 19.524 10.953 2.147 1.00 1.11 H new ATOM 0 HG23 THR A 21 19.140 9.512 1.176 1.00 1.11 H new ATOM 34 N SER A 22 19.305 9.654 -1.889 1.00 0.48 N ATOM 35 CA SER A 22 18.260 8.810 -2.539 1.00 0.27 C ATOM 36 C SER A 22 17.278 8.301 -1.479 1.00 0.28 C ATOM 37 O SER A 22 16.077 8.394 -1.638 1.00 0.28 O ATOM 38 CB SER A 22 18.925 7.619 -3.230 1.00 0.36 C ATOM 39 OG SER A 22 20.223 7.997 -3.671 1.00 1.46 O ATOM 0 H SER A 22 20.268 9.393 -2.102 1.00 0.48 H new ATOM 0 HA SER A 22 17.721 9.405 -3.276 1.00 0.27 H new ATOM 0 HB2 SER A 22 18.993 6.776 -2.542 1.00 0.36 H new ATOM 0 HB3 SER A 22 18.322 7.292 -4.077 1.00 0.36 H new ATOM 0 HG SER A 22 20.653 7.235 -4.113 1.00 1.46 H new ATOM 45 N SER A 23 17.781 7.770 -0.398 1.00 0.36 N ATOM 46 CA SER A 23 16.876 7.262 0.670 1.00 0.46 C ATOM 47 C SER A 23 15.964 8.394 1.140 1.00 0.55 C ATOM 48 O SER A 23 14.802 8.190 1.422 1.00 0.45 O ATOM 49 CB SER A 23 17.709 6.755 1.849 1.00 0.77 C ATOM 50 OG SER A 23 17.315 5.427 2.165 1.00 0.23 O ATOM 0 H SER A 23 18.778 7.666 -0.209 1.00 0.36 H new ATOM 0 HA SER A 23 16.271 6.445 0.277 1.00 0.46 H new ATOM 0 HB2 SER A 23 18.769 6.782 1.598 1.00 0.77 H new ATOM 0 HB3 SER A 23 17.569 7.404 2.714 1.00 0.77 H new ATOM 0 HG SER A 23 17.848 5.098 2.919 1.00 0.23 H new ATOM 56 N GLU A 24 16.479 9.591 1.221 1.00 0.84 N ATOM 57 CA GLU A 24 15.632 10.733 1.667 1.00 1.08 C ATOM 58 C GLU A 24 14.432 10.850 0.731 1.00 0.96 C ATOM 59 O GLU A 24 13.320 11.079 1.159 1.00 0.98 O ATOM 60 CB GLU A 24 16.447 12.028 1.621 1.00 1.48 C ATOM 61 CG GLU A 24 15.981 12.963 2.738 1.00 2.11 C ATOM 62 CD GLU A 24 16.419 12.401 4.092 1.00 0.88 C ATOM 63 OE1 GLU A 24 17.593 12.508 4.404 1.00 0.83 O ATOM 64 OE2 GLU A 24 15.572 11.872 4.793 1.00 1.42 O ATOM 0 H GLU A 24 17.446 9.827 0.998 1.00 0.84 H new ATOM 0 HA GLU A 24 15.291 10.564 2.688 1.00 1.08 H new ATOM 0 HB2 GLU A 24 17.508 11.807 1.736 1.00 1.48 H new ATOM 0 HB3 GLU A 24 16.326 12.513 0.652 1.00 1.48 H new ATOM 0 HG2 GLU A 24 16.401 13.958 2.592 1.00 2.11 H new ATOM 0 HG3 GLU A 24 14.896 13.068 2.710 1.00 2.11 H new ATOM 71 N ARG A 25 14.645 10.689 -0.546 1.00 0.92 N ATOM 72 CA ARG A 25 13.511 10.783 -1.506 1.00 1.00 C ATOM 73 C ARG A 25 12.551 9.616 -1.265 1.00 0.73 C ATOM 74 O ARG A 25 11.368 9.711 -1.512 1.00 0.90 O ATOM 75 CB ARG A 25 14.045 10.716 -2.940 1.00 1.14 C ATOM 76 CG ARG A 25 14.384 12.128 -3.426 1.00 1.25 C ATOM 77 CD ARG A 25 15.494 12.058 -4.477 1.00 1.52 C ATOM 78 NE ARG A 25 16.317 13.301 -4.415 1.00 0.96 N ATOM 79 CZ ARG A 25 16.093 14.275 -5.255 1.00 0.88 C ATOM 80 NH1 ARG A 25 16.389 14.130 -6.517 1.00 2.01 N ATOM 81 NH2 ARG A 25 15.575 15.396 -4.831 1.00 1.15 N ATOM 0 H ARG A 25 15.555 10.497 -0.965 1.00 0.92 H new ATOM 0 HA ARG A 25 12.986 11.727 -1.361 1.00 1.00 H new ATOM 0 HB2 ARG A 25 14.932 10.084 -2.980 1.00 1.14 H new ATOM 0 HB3 ARG A 25 13.301 10.263 -3.595 1.00 1.14 H new ATOM 0 HG2 ARG A 25 13.498 12.600 -3.850 1.00 1.25 H new ATOM 0 HG3 ARG A 25 14.703 12.745 -2.586 1.00 1.25 H new ATOM 0 HD2 ARG A 25 16.122 11.184 -4.301 1.00 1.52 H new ATOM 0 HD3 ARG A 25 15.062 11.945 -5.471 1.00 1.52 H new ATOM 0 HE ARG A 25 17.055 13.390 -3.716 1.00 0.96 H new ATOM 0 HH11 ARG A 25 16.796 13.255 -6.848 1.00 2.01 H new ATOM 0 HH12 ARG A 25 16.214 14.891 -7.173 1.00 2.01 H new ATOM 0 HH21 ARG A 25 15.346 15.511 -3.844 1.00 1.15 H new ATOM 0 HH22 ARG A 25 15.400 16.157 -5.487 1.00 1.15 H new ATOM 95 N ILE A 26 13.056 8.513 -0.785 1.00 0.37 N ATOM 96 CA ILE A 26 12.182 7.330 -0.528 1.00 0.34 C ATOM 97 C ILE A 26 11.203 7.641 0.616 1.00 0.20 C ATOM 98 O ILE A 26 10.012 7.436 0.498 1.00 0.25 O ATOM 99 CB ILE A 26 13.069 6.135 -0.143 1.00 0.46 C ATOM 100 CG1 ILE A 26 13.892 5.698 -1.360 1.00 0.80 C ATOM 101 CG2 ILE A 26 12.207 4.960 0.333 1.00 0.50 C ATOM 102 CD1 ILE A 26 12.959 5.239 -2.486 1.00 0.28 C ATOM 0 H ILE A 26 14.041 8.378 -0.558 1.00 0.37 H new ATOM 0 HA ILE A 26 11.609 7.093 -1.425 1.00 0.34 H new ATOM 0 HB ILE A 26 13.733 6.437 0.666 1.00 0.46 H new ATOM 0 HG12 ILE A 26 14.513 6.525 -1.705 1.00 0.80 H new ATOM 0 HG13 ILE A 26 14.566 4.888 -1.082 1.00 0.80 H new ATOM 0 HG21 ILE A 26 12.850 4.122 0.602 1.00 0.50 H new ATOM 0 HG22 ILE A 26 11.625 5.264 1.203 1.00 0.50 H new ATOM 0 HG23 ILE A 26 11.532 4.657 -0.467 1.00 0.50 H new ATOM 0 HD11 ILE A 26 13.552 4.930 -3.347 1.00 0.28 H new ATOM 0 HD12 ILE A 26 12.357 4.399 -2.140 1.00 0.28 H new ATOM 0 HD13 ILE A 26 12.303 6.061 -2.773 1.00 0.28 H new ATOM 114 N ASP A 27 11.703 8.108 1.726 1.00 0.10 N ATOM 115 CA ASP A 27 10.815 8.408 2.888 1.00 0.14 C ATOM 116 C ASP A 27 9.865 9.565 2.557 1.00 0.23 C ATOM 117 O ASP A 27 8.669 9.469 2.742 1.00 0.31 O ATOM 118 CB ASP A 27 11.684 8.790 4.092 1.00 0.19 C ATOM 119 CG ASP A 27 10.790 9.142 5.284 1.00 0.28 C ATOM 120 OD1 ASP A 27 10.325 10.268 5.338 1.00 0.97 O ATOM 121 OD2 ASP A 27 10.587 8.279 6.122 1.00 0.83 O ATOM 0 H ASP A 27 12.693 8.296 1.881 1.00 0.10 H new ATOM 0 HA ASP A 27 10.219 7.525 3.118 1.00 0.14 H new ATOM 0 HB2 ASP A 27 12.345 7.963 4.353 1.00 0.19 H new ATOM 0 HB3 ASP A 27 12.320 9.638 3.839 1.00 0.19 H new ATOM 126 N LYS A 28 10.391 10.663 2.092 1.00 0.19 N ATOM 127 CA LYS A 28 9.523 11.833 1.774 1.00 0.26 C ATOM 128 C LYS A 28 8.516 11.470 0.679 1.00 0.27 C ATOM 129 O LYS A 28 7.433 12.020 0.619 1.00 0.30 O ATOM 130 CB LYS A 28 10.395 12.997 1.300 1.00 0.28 C ATOM 131 CG LYS A 28 11.237 12.554 0.102 1.00 2.03 C ATOM 132 CD LYS A 28 10.547 12.982 -1.196 1.00 2.70 C ATOM 133 CE LYS A 28 11.312 14.150 -1.823 1.00 3.50 C ATOM 134 NZ LYS A 28 11.098 14.153 -3.299 1.00 4.66 N ATOM 0 H LYS A 28 11.386 10.802 1.918 1.00 0.19 H new ATOM 0 HA LYS A 28 8.976 12.121 2.672 1.00 0.26 H new ATOM 0 HB2 LYS A 28 9.768 13.845 1.023 1.00 0.28 H new ATOM 0 HB3 LYS A 28 11.044 13.331 2.109 1.00 0.28 H new ATOM 0 HG2 LYS A 28 12.232 12.996 0.160 1.00 2.03 H new ATOM 0 HG3 LYS A 28 11.368 11.472 0.117 1.00 2.03 H new ATOM 0 HD2 LYS A 28 10.508 12.144 -1.892 1.00 2.70 H new ATOM 0 HD3 LYS A 28 9.517 13.276 -0.993 1.00 2.70 H new ATOM 0 HE2 LYS A 28 10.972 15.093 -1.394 1.00 3.50 H new ATOM 0 HE3 LYS A 28 12.375 14.063 -1.600 1.00 3.50 H new ATOM 0 HZ1 LYS A 28 11.632 14.937 -3.726 1.00 4.66 H new ATOM 0 HZ2 LYS A 28 11.427 13.251 -3.699 1.00 4.66 H new ATOM 0 HZ3 LYS A 28 10.085 14.273 -3.503 1.00 4.66 H new ATOM 148 N GLN A 29 8.855 10.560 -0.191 1.00 0.24 N ATOM 149 CA GLN A 29 7.900 10.186 -1.276 1.00 0.25 C ATOM 150 C GLN A 29 6.733 9.394 -0.681 1.00 0.24 C ATOM 151 O GLN A 29 5.588 9.597 -1.041 1.00 0.22 O ATOM 152 CB GLN A 29 8.613 9.346 -2.338 1.00 0.24 C ATOM 153 CG GLN A 29 7.706 9.201 -3.563 1.00 1.54 C ATOM 154 CD GLN A 29 7.436 10.583 -4.164 1.00 1.49 C ATOM 155 OE1 GLN A 29 6.298 10.973 -4.333 1.00 2.37 O ATOM 156 NE2 GLN A 29 8.442 11.344 -4.498 1.00 0.76 N ATOM 0 H GLN A 29 9.745 10.061 -0.200 1.00 0.24 H new ATOM 0 HA GLN A 29 7.518 11.093 -1.745 1.00 0.25 H new ATOM 0 HB2 GLN A 29 9.553 9.819 -2.621 1.00 0.24 H new ATOM 0 HB3 GLN A 29 8.859 8.363 -1.936 1.00 0.24 H new ATOM 0 HG2 GLN A 29 8.178 8.556 -4.304 1.00 1.54 H new ATOM 0 HG3 GLN A 29 6.767 8.726 -3.279 1.00 1.54 H new ATOM 0 HE21 GLN A 29 9.398 11.017 -4.356 1.00 0.76 H new ATOM 0 HE22 GLN A 29 8.273 12.266 -4.901 1.00 0.76 H new ATOM 165 N ILE A 30 7.000 8.500 0.238 1.00 0.27 N ATOM 166 CA ILE A 30 5.877 7.732 0.842 1.00 0.27 C ATOM 167 C ILE A 30 5.022 8.706 1.654 1.00 0.26 C ATOM 168 O ILE A 30 3.828 8.546 1.764 1.00 0.19 O ATOM 169 CB ILE A 30 6.410 6.607 1.742 1.00 0.30 C ATOM 170 CG1 ILE A 30 7.055 5.525 0.866 1.00 0.60 C ATOM 171 CG2 ILE A 30 5.261 5.997 2.546 1.00 0.18 C ATOM 172 CD1 ILE A 30 7.492 4.341 1.733 1.00 0.68 C ATOM 0 H ILE A 30 7.931 8.274 0.589 1.00 0.27 H new ATOM 0 HA ILE A 30 5.279 7.268 0.058 1.00 0.27 H new ATOM 0 HB ILE A 30 7.150 7.013 2.431 1.00 0.30 H new ATOM 0 HG12 ILE A 30 6.347 5.190 0.108 1.00 0.60 H new ATOM 0 HG13 ILE A 30 7.915 5.937 0.339 1.00 0.60 H new ATOM 0 HG21 ILE A 30 5.645 5.200 3.182 1.00 0.18 H new ATOM 0 HG22 ILE A 30 4.802 6.767 3.166 1.00 0.18 H new ATOM 0 HG23 ILE A 30 4.516 5.589 1.863 1.00 0.18 H new ATOM 0 HD11 ILE A 30 7.949 3.578 1.103 1.00 0.68 H new ATOM 0 HD12 ILE A 30 8.216 4.680 2.474 1.00 0.68 H new ATOM 0 HD13 ILE A 30 6.623 3.921 2.240 1.00 0.68 H new ATOM 184 N ARG A 31 5.622 9.731 2.204 1.00 0.32 N ATOM 185 CA ARG A 31 4.824 10.724 2.980 1.00 0.33 C ATOM 186 C ARG A 31 3.695 11.233 2.082 1.00 0.28 C ATOM 187 O ARG A 31 2.622 11.579 2.538 1.00 0.24 O ATOM 188 CB ARG A 31 5.718 11.895 3.398 1.00 0.44 C ATOM 189 CG ARG A 31 5.171 12.524 4.682 1.00 0.30 C ATOM 190 CD ARG A 31 4.679 13.942 4.386 1.00 1.07 C ATOM 191 NE ARG A 31 5.842 14.870 4.329 1.00 1.88 N ATOM 192 CZ ARG A 31 6.333 15.372 5.430 1.00 1.59 C ATOM 193 NH1 ARG A 31 5.664 16.276 6.090 1.00 1.23 N ATOM 194 NH2 ARG A 31 7.495 14.969 5.868 1.00 2.60 N ATOM 0 H ARG A 31 6.623 9.921 2.149 1.00 0.32 H new ATOM 0 HA ARG A 31 4.415 10.260 3.877 1.00 0.33 H new ATOM 0 HB2 ARG A 31 6.739 11.548 3.557 1.00 0.44 H new ATOM 0 HB3 ARG A 31 5.755 12.640 2.603 1.00 0.44 H new ATOM 0 HG2 ARG A 31 4.354 11.919 5.077 1.00 0.30 H new ATOM 0 HG3 ARG A 31 5.947 12.549 5.447 1.00 0.30 H new ATOM 0 HD2 ARG A 31 4.139 13.961 3.439 1.00 1.07 H new ATOM 0 HD3 ARG A 31 3.980 14.264 5.158 1.00 1.07 H new ATOM 0 HE ARG A 31 6.256 15.114 3.429 1.00 1.88 H new ATOM 0 HH11 ARG A 31 4.757 16.591 5.746 1.00 1.23 H new ATOM 0 HH12 ARG A 31 6.048 16.668 6.950 1.00 1.23 H new ATOM 0 HH21 ARG A 31 8.018 14.263 5.350 1.00 2.60 H new ATOM 0 HH22 ARG A 31 7.880 15.360 6.728 1.00 2.60 H new ATOM 208 N TYR A 32 3.933 11.249 0.798 1.00 0.30 N ATOM 209 CA TYR A 32 2.892 11.696 -0.161 1.00 0.31 C ATOM 210 C TYR A 32 1.913 10.545 -0.365 1.00 0.27 C ATOM 211 O TYR A 32 0.722 10.739 -0.504 1.00 0.29 O ATOM 212 CB TYR A 32 3.550 12.046 -1.497 1.00 0.36 C ATOM 213 CG TYR A 32 3.145 13.438 -1.915 1.00 0.17 C ATOM 214 CD1 TYR A 32 1.792 13.792 -1.947 1.00 0.74 C ATOM 215 CD2 TYR A 32 4.124 14.370 -2.274 1.00 0.86 C ATOM 216 CE1 TYR A 32 1.419 15.083 -2.338 1.00 0.61 C ATOM 217 CE2 TYR A 32 3.751 15.661 -2.666 1.00 1.04 C ATOM 218 CZ TYR A 32 2.398 16.019 -2.697 1.00 0.46 C ATOM 219 OH TYR A 32 2.029 17.291 -3.083 1.00 0.69 O ATOM 0 H TYR A 32 4.816 10.967 0.372 1.00 0.30 H new ATOM 0 HA TYR A 32 2.372 12.574 0.222 1.00 0.31 H new ATOM 0 HB2 TYR A 32 4.634 11.984 -1.406 1.00 0.36 H new ATOM 0 HB3 TYR A 32 3.252 11.326 -2.259 1.00 0.36 H new ATOM 0 HD1 TYR A 32 1.037 13.071 -1.671 1.00 0.74 H new ATOM 0 HD2 TYR A 32 5.168 14.094 -2.249 1.00 0.86 H new ATOM 0 HE1 TYR A 32 0.375 15.358 -2.363 1.00 0.61 H new ATOM 0 HE2 TYR A 32 4.507 16.381 -2.944 1.00 1.04 H new ATOM 0 HH TYR A 32 2.830 17.813 -3.297 1.00 0.69 H new ATOM 229 N ILE A 33 2.414 9.339 -0.379 1.00 0.23 N ATOM 230 CA ILE A 33 1.522 8.162 -0.566 1.00 0.22 C ATOM 231 C ILE A 33 0.414 8.190 0.493 1.00 0.21 C ATOM 232 O ILE A 33 -0.740 7.953 0.202 1.00 0.26 O ATOM 233 CB ILE A 33 2.339 6.876 -0.422 1.00 0.19 C ATOM 234 CG1 ILE A 33 3.418 6.836 -1.507 1.00 0.21 C ATOM 235 CG2 ILE A 33 1.417 5.667 -0.581 1.00 0.20 C ATOM 236 CD1 ILE A 33 4.269 5.577 -1.335 1.00 0.26 C ATOM 0 H ILE A 33 3.404 9.119 -0.269 1.00 0.23 H new ATOM 0 HA ILE A 33 1.074 8.196 -1.559 1.00 0.22 H new ATOM 0 HB ILE A 33 2.808 6.851 0.562 1.00 0.19 H new ATOM 0 HG12 ILE A 33 2.956 6.843 -2.494 1.00 0.21 H new ATOM 0 HG13 ILE A 33 4.047 7.724 -1.442 1.00 0.21 H new ATOM 0 HG21 ILE A 33 1.998 4.750 -0.479 1.00 0.20 H new ATOM 0 HG22 ILE A 33 0.645 5.695 0.188 1.00 0.20 H new ATOM 0 HG23 ILE A 33 0.950 5.693 -1.566 1.00 0.20 H new ATOM 0 HD11 ILE A 33 5.037 5.549 -2.108 1.00 0.26 H new ATOM 0 HD12 ILE A 33 4.742 5.589 -0.353 1.00 0.26 H new ATOM 0 HD13 ILE A 33 3.635 4.695 -1.421 1.00 0.26 H new ATOM 248 N LEU A 34 0.759 8.481 1.718 1.00 0.18 N ATOM 249 CA LEU A 34 -0.268 8.525 2.798 1.00 0.17 C ATOM 250 C LEU A 34 -1.099 9.804 2.665 1.00 0.14 C ATOM 251 O LEU A 34 -2.293 9.803 2.891 1.00 0.08 O ATOM 252 CB LEU A 34 0.431 8.510 4.160 1.00 0.21 C ATOM 253 CG LEU A 34 0.118 7.200 4.886 1.00 0.26 C ATOM 254 CD1 LEU A 34 0.596 6.019 4.038 1.00 1.15 C ATOM 255 CD2 LEU A 34 0.839 7.183 6.235 1.00 0.53 C ATOM 0 H LEU A 34 1.711 8.691 2.018 1.00 0.18 H new ATOM 0 HA LEU A 34 -0.924 7.659 2.713 1.00 0.17 H new ATOM 0 HB2 LEU A 34 1.508 8.616 4.028 1.00 0.21 H new ATOM 0 HB3 LEU A 34 0.099 9.358 4.759 1.00 0.21 H new ATOM 0 HG LEU A 34 -0.957 7.120 5.046 1.00 0.26 H new ATOM 0 HD11 LEU A 34 0.373 5.086 4.555 1.00 1.15 H new ATOM 0 HD12 LEU A 34 0.085 6.032 3.076 1.00 1.15 H new ATOM 0 HD13 LEU A 34 1.671 6.097 3.878 1.00 1.15 H new ATOM 0 HD21 LEU A 34 0.618 6.251 6.754 1.00 0.53 H new ATOM 0 HD22 LEU A 34 1.914 7.262 6.074 1.00 0.53 H new ATOM 0 HD23 LEU A 34 0.500 8.024 6.839 1.00 0.53 H new ATOM 267 N ASP A 35 -0.481 10.896 2.292 1.00 0.22 N ATOM 268 CA ASP A 35 -1.246 12.167 2.136 1.00 0.20 C ATOM 269 C ASP A 35 -2.399 11.923 1.173 1.00 0.12 C ATOM 270 O ASP A 35 -3.461 12.501 1.290 1.00 0.08 O ATOM 271 CB ASP A 35 -0.331 13.256 1.571 1.00 0.26 C ATOM 272 CG ASP A 35 -0.983 14.625 1.768 1.00 0.92 C ATOM 273 OD1 ASP A 35 -1.917 14.926 1.043 1.00 2.26 O ATOM 274 OD2 ASP A 35 -0.538 15.351 2.642 1.00 0.39 O ATOM 0 H ASP A 35 0.517 10.961 2.090 1.00 0.22 H new ATOM 0 HA ASP A 35 -1.627 12.492 3.104 1.00 0.20 H new ATOM 0 HB2 ASP A 35 0.637 13.227 2.071 1.00 0.26 H new ATOM 0 HB3 ASP A 35 -0.148 13.078 0.511 1.00 0.26 H new ATOM 279 N GLY A 36 -2.199 11.050 0.230 1.00 0.12 N ATOM 280 CA GLY A 36 -3.280 10.737 -0.731 1.00 0.09 C ATOM 281 C GLY A 36 -4.308 9.863 -0.018 1.00 0.04 C ATOM 282 O GLY A 36 -5.493 10.108 -0.077 1.00 0.07 O ATOM 0 H GLY A 36 -1.328 10.539 0.085 1.00 0.12 H new ATOM 0 HA2 GLY A 36 -3.745 11.654 -1.093 1.00 0.09 H new ATOM 0 HA3 GLY A 36 -2.878 10.219 -1.601 1.00 0.09 H new ATOM 286 N ILE A 37 -3.853 8.841 0.659 1.00 0.05 N ATOM 287 CA ILE A 37 -4.792 7.937 1.381 1.00 0.01 C ATOM 288 C ILE A 37 -5.715 8.738 2.300 1.00 0.05 C ATOM 289 O ILE A 37 -6.771 8.269 2.672 1.00 0.11 O ATOM 290 CB ILE A 37 -4.012 6.924 2.221 1.00 0.03 C ATOM 291 CG1 ILE A 37 -3.078 6.108 1.315 1.00 0.08 C ATOM 292 CG2 ILE A 37 -5.001 5.990 2.926 1.00 0.06 C ATOM 293 CD1 ILE A 37 -3.896 5.214 0.378 1.00 0.21 C ATOM 0 H ILE A 37 -2.867 8.594 0.742 1.00 0.05 H new ATOM 0 HA ILE A 37 -5.392 7.413 0.637 1.00 0.01 H new ATOM 0 HB ILE A 37 -3.412 7.449 2.965 1.00 0.03 H new ATOM 0 HG12 ILE A 37 -2.449 6.779 0.731 1.00 0.08 H new ATOM 0 HG13 ILE A 37 -2.412 5.496 1.924 1.00 0.08 H new ATOM 0 HG21 ILE A 37 -4.452 5.265 3.527 1.00 0.06 H new ATOM 0 HG22 ILE A 37 -5.656 6.574 3.572 1.00 0.06 H new ATOM 0 HG23 ILE A 37 -5.600 5.465 2.182 1.00 0.06 H new ATOM 0 HD11 ILE A 37 -3.222 4.641 -0.259 1.00 0.21 H new ATOM 0 HD12 ILE A 37 -4.506 4.530 0.968 1.00 0.21 H new ATOM 0 HD13 ILE A 37 -4.543 5.834 -0.243 1.00 0.21 H new ATOM 305 N SER A 38 -5.350 9.936 2.666 1.00 0.07 N ATOM 306 CA SER A 38 -6.248 10.728 3.544 1.00 0.09 C ATOM 307 C SER A 38 -7.457 11.108 2.704 1.00 0.09 C ATOM 308 O SER A 38 -8.598 10.938 3.100 1.00 0.06 O ATOM 309 CB SER A 38 -5.528 11.986 4.031 1.00 0.10 C ATOM 310 OG SER A 38 -5.841 12.206 5.401 1.00 0.59 O ATOM 0 H SER A 38 -4.479 10.394 2.398 1.00 0.07 H new ATOM 0 HA SER A 38 -6.546 10.155 4.422 1.00 0.09 H new ATOM 0 HB2 SER A 38 -4.451 11.874 3.906 1.00 0.10 H new ATOM 0 HB3 SER A 38 -5.831 12.846 3.434 1.00 0.10 H new ATOM 0 HG SER A 38 -5.380 13.011 5.717 1.00 0.59 H new ATOM 316 N ALA A 39 -7.204 11.585 1.520 1.00 0.12 N ATOM 317 CA ALA A 39 -8.317 11.948 0.619 1.00 0.13 C ATOM 318 C ALA A 39 -8.920 10.668 0.033 1.00 0.14 C ATOM 319 O ALA A 39 -9.971 10.691 -0.576 1.00 0.17 O ATOM 320 CB ALA A 39 -7.795 12.835 -0.512 1.00 0.15 C ATOM 0 H ALA A 39 -6.270 11.738 1.141 1.00 0.12 H new ATOM 0 HA ALA A 39 -9.079 12.493 1.176 1.00 0.13 H new ATOM 0 HB1 ALA A 39 -8.618 13.101 -1.175 1.00 0.15 H new ATOM 0 HB2 ALA A 39 -7.360 13.742 -0.092 1.00 0.15 H new ATOM 0 HB3 ALA A 39 -7.035 12.295 -1.076 1.00 0.15 H new ATOM 326 N LEU A 40 -8.267 9.547 0.215 1.00 0.14 N ATOM 327 CA LEU A 40 -8.812 8.276 -0.327 1.00 0.14 C ATOM 328 C LEU A 40 -9.466 7.471 0.793 1.00 0.12 C ATOM 329 O LEU A 40 -10.092 6.464 0.550 1.00 0.15 O ATOM 330 CB LEU A 40 -7.693 7.449 -0.954 1.00 0.14 C ATOM 331 CG LEU A 40 -6.921 8.311 -1.948 1.00 0.19 C ATOM 332 CD1 LEU A 40 -5.544 7.697 -2.196 1.00 0.43 C ATOM 333 CD2 LEU A 40 -7.690 8.374 -3.265 1.00 0.11 C ATOM 0 H LEU A 40 -7.382 9.463 0.715 1.00 0.14 H new ATOM 0 HA LEU A 40 -9.555 8.512 -1.088 1.00 0.14 H new ATOM 0 HB2 LEU A 40 -7.022 7.079 -0.179 1.00 0.14 H new ATOM 0 HB3 LEU A 40 -8.109 6.577 -1.459 1.00 0.14 H new ATOM 0 HG LEU A 40 -6.803 9.316 -1.542 1.00 0.19 H new ATOM 0 HD11 LEU A 40 -4.993 8.314 -2.906 1.00 0.43 H new ATOM 0 HD12 LEU A 40 -4.994 7.646 -1.256 1.00 0.43 H new ATOM 0 HD13 LEU A 40 -5.661 6.692 -2.602 1.00 0.43 H new ATOM 0 HD21 LEU A 40 -7.141 8.989 -3.978 1.00 0.11 H new ATOM 0 HD22 LEU A 40 -7.805 7.368 -3.668 1.00 0.11 H new ATOM 0 HD23 LEU A 40 -8.674 8.810 -3.091 1.00 0.11 H new ATOM 345 N ARG A 41 -9.330 7.899 2.020 1.00 0.12 N ATOM 346 CA ARG A 41 -9.953 7.141 3.135 1.00 0.13 C ATOM 347 C ARG A 41 -10.973 8.021 3.862 1.00 0.02 C ATOM 348 O ARG A 41 -11.635 7.585 4.780 1.00 0.05 O ATOM 349 CB ARG A 41 -8.873 6.693 4.117 1.00 0.24 C ATOM 350 CG ARG A 41 -9.451 5.615 5.034 1.00 0.29 C ATOM 351 CD ARG A 41 -8.421 5.243 6.101 1.00 0.55 C ATOM 352 NE ARG A 41 -8.030 6.466 6.860 1.00 1.65 N ATOM 353 CZ ARG A 41 -8.658 6.784 7.960 1.00 1.79 C ATOM 354 NH1 ARG A 41 -9.889 6.391 8.148 1.00 1.90 N ATOM 355 NH2 ARG A 41 -8.058 7.497 8.873 1.00 2.52 N ATOM 0 H ARG A 41 -8.817 8.737 2.294 1.00 0.12 H new ATOM 0 HA ARG A 41 -10.462 6.266 2.729 1.00 0.13 H new ATOM 0 HB2 ARG A 41 -8.010 6.304 3.576 1.00 0.24 H new ATOM 0 HB3 ARG A 41 -8.524 7.541 4.706 1.00 0.24 H new ATOM 0 HG2 ARG A 41 -10.364 5.977 5.506 1.00 0.29 H new ATOM 0 HG3 ARG A 41 -9.721 4.734 4.451 1.00 0.29 H new ATOM 0 HD2 ARG A 41 -8.837 4.498 6.779 1.00 0.55 H new ATOM 0 HD3 ARG A 41 -7.544 4.795 5.635 1.00 0.55 H new ATOM 0 HE ARG A 41 -7.270 7.055 6.519 1.00 1.65 H new ATOM 0 HH11 ARG A 41 -10.361 5.835 7.435 1.00 1.90 H new ATOM 0 HH12 ARG A 41 -10.378 6.640 9.008 1.00 1.90 H new ATOM 0 HH21 ARG A 41 -7.097 7.807 8.728 1.00 2.52 H new ATOM 0 HH22 ARG A 41 -8.550 7.745 9.732 1.00 2.52 H new ATOM 369 N LYS A 42 -11.122 9.253 3.464 1.00 0.06 N ATOM 370 CA LYS A 42 -12.115 10.120 4.140 1.00 0.17 C ATOM 371 C LYS A 42 -13.502 9.770 3.605 1.00 0.26 C ATOM 372 O LYS A 42 -14.469 9.699 4.341 1.00 0.30 O ATOM 373 CB LYS A 42 -11.798 11.588 3.831 1.00 0.32 C ATOM 374 CG LYS A 42 -12.850 12.500 4.467 1.00 1.01 C ATOM 375 CD LYS A 42 -13.058 13.732 3.584 1.00 1.90 C ATOM 376 CE LYS A 42 -13.170 14.979 4.462 1.00 2.03 C ATOM 377 NZ LYS A 42 -14.336 14.836 5.377 1.00 2.63 N ATOM 0 H LYS A 42 -10.601 9.691 2.705 1.00 0.06 H new ATOM 0 HA LYS A 42 -12.082 9.967 5.219 1.00 0.17 H new ATOM 0 HB2 LYS A 42 -10.808 11.842 4.211 1.00 0.32 H new ATOM 0 HB3 LYS A 42 -11.775 11.744 2.752 1.00 0.32 H new ATOM 0 HG2 LYS A 42 -13.790 11.961 4.585 1.00 1.01 H new ATOM 0 HG3 LYS A 42 -12.529 12.804 5.463 1.00 1.01 H new ATOM 0 HD2 LYS A 42 -12.226 13.838 2.888 1.00 1.90 H new ATOM 0 HD3 LYS A 42 -13.961 13.614 2.985 1.00 1.90 H new ATOM 0 HE2 LYS A 42 -12.255 15.114 5.039 1.00 2.03 H new ATOM 0 HE3 LYS A 42 -13.289 15.866 3.840 1.00 2.03 H new ATOM 0 HZ1 LYS A 42 -14.570 15.762 5.788 1.00 2.63 H new ATOM 0 HZ2 LYS A 42 -15.154 14.477 4.844 1.00 2.63 H new ATOM 0 HZ3 LYS A 42 -14.100 14.169 6.139 1.00 2.63 H new ATOM 391 N GLU A 43 -13.603 9.543 2.325 1.00 0.33 N ATOM 392 CA GLU A 43 -14.917 9.208 1.732 1.00 0.47 C ATOM 393 C GLU A 43 -15.169 7.707 1.832 1.00 0.49 C ATOM 394 O GLU A 43 -16.201 7.281 2.329 1.00 0.57 O ATOM 395 CB GLU A 43 -14.929 9.629 0.261 1.00 0.49 C ATOM 396 CG GLU A 43 -16.212 10.407 -0.040 1.00 0.47 C ATOM 397 CD GLU A 43 -16.081 11.836 0.490 1.00 1.55 C ATOM 398 OE1 GLU A 43 -16.337 12.036 1.666 1.00 2.93 O ATOM 399 OE2 GLU A 43 -15.725 12.706 -0.288 1.00 2.03 O ATOM 0 H GLU A 43 -12.826 9.576 1.665 1.00 0.33 H new ATOM 0 HA GLU A 43 -15.700 9.737 2.275 1.00 0.47 H new ATOM 0 HB2 GLU A 43 -14.058 10.246 0.042 1.00 0.49 H new ATOM 0 HB3 GLU A 43 -14.866 8.750 -0.380 1.00 0.49 H new ATOM 0 HG2 GLU A 43 -16.397 10.422 -1.114 1.00 0.47 H new ATOM 0 HG3 GLU A 43 -17.066 9.913 0.423 1.00 0.47 H new ATOM 406 N THR A 44 -14.245 6.907 1.349 1.00 0.46 N ATOM 407 CA THR A 44 -14.437 5.429 1.391 1.00 0.51 C ATOM 408 C THR A 44 -13.973 4.857 2.735 1.00 0.63 C ATOM 409 O THR A 44 -13.222 3.904 2.797 1.00 0.84 O ATOM 410 CB THR A 44 -13.673 4.764 0.239 1.00 0.50 C ATOM 411 OG1 THR A 44 -14.074 3.405 0.134 1.00 0.68 O ATOM 412 CG2 THR A 44 -12.167 4.831 0.492 1.00 0.50 C ATOM 0 H THR A 44 -13.369 7.218 0.929 1.00 0.46 H new ATOM 0 HA THR A 44 -15.500 5.218 1.279 1.00 0.51 H new ATOM 0 HB THR A 44 -13.898 5.291 -0.688 1.00 0.50 H new ATOM 0 HG1 THR A 44 -14.803 3.229 0.765 1.00 0.68 H new ATOM 0 HG21 THR A 44 -11.638 4.355 -0.334 1.00 0.50 H new ATOM 0 HG22 THR A 44 -11.857 5.873 0.569 1.00 0.50 H new ATOM 0 HG23 THR A 44 -11.931 4.312 1.421 1.00 0.50 H new ATOM 420 N CYS A 45 -14.446 5.423 3.798 1.00 0.56 N ATOM 421 CA CYS A 45 -14.094 4.934 5.152 1.00 0.65 C ATOM 422 C CYS A 45 -14.996 5.674 6.132 1.00 0.66 C ATOM 423 O CYS A 45 -15.532 5.097 7.057 1.00 0.75 O ATOM 424 CB CYS A 45 -12.622 5.209 5.453 1.00 0.70 C ATOM 425 SG CYS A 45 -11.826 3.693 6.051 1.00 1.35 S ATOM 0 H CYS A 45 -15.078 6.224 3.787 1.00 0.56 H new ATOM 0 HA CYS A 45 -14.239 3.857 5.231 1.00 0.65 H new ATOM 0 HB2 CYS A 45 -12.118 5.566 4.555 1.00 0.70 H new ATOM 0 HB3 CYS A 45 -12.535 5.996 6.202 1.00 0.70 H new ATOM 430 N ASN A 46 -15.215 6.945 5.911 1.00 0.58 N ATOM 431 CA ASN A 46 -16.132 7.688 6.805 1.00 0.60 C ATOM 432 C ASN A 46 -17.563 7.355 6.375 1.00 0.60 C ATOM 433 O ASN A 46 -18.352 6.851 7.150 1.00 0.74 O ATOM 434 CB ASN A 46 -15.889 9.194 6.677 1.00 0.54 C ATOM 435 CG ASN A 46 -16.290 9.882 7.983 1.00 0.56 C ATOM 436 OD1 ASN A 46 -16.581 9.225 8.964 1.00 1.32 O ATOM 437 ND2 ASN A 46 -16.320 11.186 8.041 1.00 0.35 N ATOM 0 H ASN A 46 -14.800 7.490 5.156 1.00 0.58 H new ATOM 0 HA ASN A 46 -15.964 7.404 7.844 1.00 0.60 H new ATOM 0 HB2 ASN A 46 -14.839 9.388 6.458 1.00 0.54 H new ATOM 0 HB3 ASN A 46 -16.468 9.598 5.847 1.00 0.54 H new ATOM 0 HD21 ASN A 46 -16.587 11.652 8.908 1.00 0.35 H new ATOM 0 HD22 ASN A 46 -16.076 11.739 7.219 1.00 0.35 H new ATOM 444 N LYS A 47 -17.899 7.616 5.134 1.00 0.45 N ATOM 445 CA LYS A 47 -19.271 7.294 4.652 1.00 0.45 C ATOM 446 C LYS A 47 -19.280 5.914 3.982 1.00 0.40 C ATOM 447 O LYS A 47 -20.189 5.582 3.247 1.00 0.36 O ATOM 448 CB LYS A 47 -19.720 8.354 3.645 1.00 0.40 C ATOM 449 CG LYS A 47 -21.097 8.889 4.046 1.00 0.89 C ATOM 450 CD LYS A 47 -22.174 7.875 3.653 1.00 2.42 C ATOM 451 CE LYS A 47 -23.541 8.371 4.130 1.00 2.92 C ATOM 452 NZ LYS A 47 -24.485 7.221 4.230 1.00 4.54 N ATOM 0 H LYS A 47 -17.282 8.037 4.439 1.00 0.45 H new ATOM 0 HA LYS A 47 -19.955 7.283 5.501 1.00 0.45 H new ATOM 0 HB2 LYS A 47 -18.997 9.169 3.612 1.00 0.40 H new ATOM 0 HB3 LYS A 47 -19.762 7.925 2.644 1.00 0.40 H new ATOM 0 HG2 LYS A 47 -21.129 9.071 5.120 1.00 0.89 H new ATOM 0 HG3 LYS A 47 -21.285 9.844 3.555 1.00 0.89 H new ATOM 0 HD2 LYS A 47 -22.182 7.738 2.572 1.00 2.42 H new ATOM 0 HD3 LYS A 47 -21.953 6.904 4.096 1.00 2.42 H new ATOM 0 HE2 LYS A 47 -23.444 8.860 5.100 1.00 2.92 H new ATOM 0 HE3 LYS A 47 -23.931 9.115 3.436 1.00 2.92 H new ATOM 0 HZ1 LYS A 47 -25.413 7.561 4.554 1.00 4.54 H new ATOM 0 HZ2 LYS A 47 -24.587 6.773 3.297 1.00 4.54 H new ATOM 0 HZ3 LYS A 47 -24.114 6.526 4.909 1.00 4.54 H new ATOM 466 N SER A 48 -18.269 5.118 4.203 1.00 0.48 N ATOM 467 CA SER A 48 -18.220 3.777 3.546 1.00 0.58 C ATOM 468 C SER A 48 -19.090 2.764 4.298 1.00 0.66 C ATOM 469 O SER A 48 -19.096 1.596 3.976 1.00 1.14 O ATOM 470 CB SER A 48 -16.775 3.276 3.529 1.00 0.69 C ATOM 471 OG SER A 48 -16.285 3.301 2.195 1.00 1.26 O ATOM 0 H SER A 48 -17.477 5.336 4.808 1.00 0.48 H new ATOM 0 HA SER A 48 -18.601 3.878 2.530 1.00 0.58 H new ATOM 0 HB2 SER A 48 -16.153 3.902 4.169 1.00 0.69 H new ATOM 0 HB3 SER A 48 -16.724 2.263 3.928 1.00 0.69 H new ATOM 0 HG SER A 48 -16.238 2.386 1.846 1.00 1.26 H new ATOM 477 N ASN A 49 -19.814 3.185 5.303 1.00 0.35 N ATOM 478 CA ASN A 49 -20.674 2.223 6.066 1.00 0.66 C ATOM 479 C ASN A 49 -19.890 0.945 6.411 1.00 0.68 C ATOM 480 O ASN A 49 -20.466 -0.095 6.666 1.00 1.22 O ATOM 481 CB ASN A 49 -21.888 1.848 5.213 1.00 0.97 C ATOM 482 CG ASN A 49 -22.848 0.994 6.043 1.00 1.60 C ATOM 483 OD1 ASN A 49 -22.890 -0.212 5.896 1.00 3.04 O ATOM 484 ND2 ASN A 49 -23.626 1.571 6.916 1.00 1.35 N ATOM 0 H ASN A 49 -19.849 4.151 5.630 1.00 0.35 H new ATOM 0 HA ASN A 49 -20.993 2.700 6.992 1.00 0.66 H new ATOM 0 HB2 ASN A 49 -22.394 2.749 4.865 1.00 0.97 H new ATOM 0 HB3 ASN A 49 -21.568 1.299 4.327 1.00 0.97 H new ATOM 0 HD21 ASN A 49 -24.269 1.010 7.475 1.00 1.35 H new ATOM 0 HD22 ASN A 49 -23.591 2.583 7.040 1.00 1.35 H new ATOM 491 N MET A 50 -18.586 1.012 6.417 1.00 0.18 N ATOM 492 CA MET A 50 -17.769 -0.192 6.739 1.00 0.31 C ATOM 493 C MET A 50 -16.366 0.261 7.146 1.00 0.32 C ATOM 494 O MET A 50 -15.373 -0.224 6.640 1.00 0.32 O ATOM 495 CB MET A 50 -17.675 -1.090 5.502 1.00 0.40 C ATOM 496 CG MET A 50 -18.686 -2.232 5.615 1.00 0.71 C ATOM 497 SD MET A 50 -17.998 -3.720 4.849 1.00 1.07 S ATOM 498 CE MET A 50 -18.385 -3.292 3.134 1.00 0.58 C ATOM 0 H MET A 50 -18.049 1.854 6.211 1.00 0.18 H new ATOM 0 HA MET A 50 -18.232 -0.749 7.554 1.00 0.31 H new ATOM 0 HB2 MET A 50 -17.870 -0.507 4.602 1.00 0.40 H new ATOM 0 HB3 MET A 50 -16.666 -1.492 5.409 1.00 0.40 H new ATOM 0 HG2 MET A 50 -18.920 -2.423 6.662 1.00 0.71 H new ATOM 0 HG3 MET A 50 -19.620 -1.956 5.125 1.00 0.71 H new ATOM 0 HE1 MET A 50 -19.083 -4.023 2.725 1.00 0.58 H new ATOM 0 HE2 MET A 50 -18.836 -2.300 3.099 1.00 0.58 H new ATOM 0 HE3 MET A 50 -17.469 -3.295 2.543 1.00 0.58 H new ATOM 508 N CYS A 51 -16.280 1.201 8.047 1.00 0.76 N ATOM 509 CA CYS A 51 -14.946 1.706 8.480 1.00 0.93 C ATOM 510 C CYS A 51 -15.149 2.728 9.605 1.00 1.32 C ATOM 511 O CYS A 51 -14.557 2.627 10.662 1.00 2.10 O ATOM 512 CB CYS A 51 -14.256 2.360 7.272 1.00 0.59 C ATOM 513 SG CYS A 51 -12.769 3.264 7.786 1.00 0.84 S ATOM 0 H CYS A 51 -17.078 1.642 8.503 1.00 0.76 H new ATOM 0 HA CYS A 51 -14.321 0.893 8.850 1.00 0.93 H new ATOM 0 HB2 CYS A 51 -13.988 1.595 6.543 1.00 0.59 H new ATOM 0 HB3 CYS A 51 -14.948 3.042 6.778 1.00 0.59 H new ATOM 518 N GLU A 52 -15.985 3.705 9.385 1.00 1.10 N ATOM 519 CA GLU A 52 -16.233 4.729 10.438 1.00 1.63 C ATOM 520 C GLU A 52 -17.740 4.957 10.574 1.00 1.36 C ATOM 521 O GLU A 52 -18.185 6.018 10.964 1.00 1.61 O ATOM 522 CB GLU A 52 -15.551 6.044 10.051 1.00 2.06 C ATOM 523 CG GLU A 52 -14.471 6.383 11.080 1.00 2.90 C ATOM 524 CD GLU A 52 -14.584 7.857 11.473 1.00 3.52 C ATOM 525 OE1 GLU A 52 -15.616 8.233 12.004 1.00 3.44 O ATOM 526 OE2 GLU A 52 -13.634 8.587 11.237 1.00 4.37 O ATOM 0 H GLU A 52 -16.508 3.838 8.520 1.00 1.10 H new ATOM 0 HA GLU A 52 -15.827 4.380 11.387 1.00 1.63 H new ATOM 0 HB2 GLU A 52 -15.108 5.958 9.059 1.00 2.06 H new ATOM 0 HB3 GLU A 52 -16.287 6.847 10.003 1.00 2.06 H new ATOM 0 HG2 GLU A 52 -14.583 5.751 11.961 1.00 2.90 H new ATOM 0 HG3 GLU A 52 -13.483 6.181 10.666 1.00 2.90 H new ATOM 533 N SER A 53 -18.529 3.968 10.253 1.00 1.23 N ATOM 534 CA SER A 53 -20.006 4.128 10.364 1.00 1.56 C ATOM 535 C SER A 53 -20.423 3.979 11.829 1.00 2.08 C ATOM 536 O SER A 53 -19.635 4.178 12.731 1.00 2.82 O ATOM 537 CB SER A 53 -20.699 3.055 9.526 1.00 1.62 C ATOM 538 OG SER A 53 -21.951 3.551 9.068 1.00 1.55 O ATOM 0 H SER A 53 -18.215 3.057 9.919 1.00 1.23 H new ATOM 0 HA SER A 53 -20.294 5.114 10.001 1.00 1.56 H new ATOM 0 HB2 SER A 53 -20.072 2.779 8.678 1.00 1.62 H new ATOM 0 HB3 SER A 53 -20.848 2.153 10.120 1.00 1.62 H new ATOM 0 HG SER A 53 -22.580 2.807 8.966 1.00 1.55 H new ATOM 544 N SER A 54 -21.655 3.627 12.073 1.00 2.18 N ATOM 545 CA SER A 54 -22.116 3.463 13.481 1.00 2.64 C ATOM 546 C SER A 54 -22.938 2.178 13.600 1.00 3.16 C ATOM 547 O SER A 54 -24.151 2.206 13.652 1.00 3.86 O ATOM 548 CB SER A 54 -22.978 4.662 13.878 1.00 2.72 C ATOM 549 OG SER A 54 -22.384 5.852 13.375 1.00 2.22 O ATOM 0 H SER A 54 -22.362 3.446 11.360 1.00 2.18 H new ATOM 0 HA SER A 54 -21.252 3.404 14.143 1.00 2.64 H new ATOM 0 HB2 SER A 54 -23.986 4.548 13.480 1.00 2.72 H new ATOM 0 HB3 SER A 54 -23.068 4.717 14.963 1.00 2.72 H new ATOM 0 HG SER A 54 -22.934 6.623 13.626 1.00 2.22 H new ATOM 555 N LYS A 55 -22.284 1.048 13.642 1.00 3.09 N ATOM 556 CA LYS A 55 -23.027 -0.240 13.756 1.00 3.86 C ATOM 557 C LYS A 55 -22.030 -1.402 13.797 1.00 3.79 C ATOM 558 O LYS A 55 -22.172 -2.324 14.576 1.00 4.62 O ATOM 559 CB LYS A 55 -23.958 -0.407 12.550 1.00 3.88 C ATOM 560 CG LYS A 55 -23.221 -0.007 11.269 1.00 3.35 C ATOM 561 CD LYS A 55 -24.208 0.025 10.099 1.00 4.28 C ATOM 562 CE LYS A 55 -24.291 -1.365 9.467 1.00 5.49 C ATOM 563 NZ LYS A 55 -25.720 -1.725 9.241 1.00 6.31 N ATOM 0 H LYS A 55 -21.268 0.961 13.602 1.00 3.09 H new ATOM 0 HA LYS A 55 -23.619 -0.236 14.671 1.00 3.86 H new ATOM 0 HB2 LYS A 55 -24.295 -1.441 12.479 1.00 3.88 H new ATOM 0 HB3 LYS A 55 -24.847 0.210 12.677 1.00 3.88 H new ATOM 0 HG2 LYS A 55 -22.758 0.972 11.394 1.00 3.35 H new ATOM 0 HG3 LYS A 55 -22.419 -0.715 11.062 1.00 3.35 H new ATOM 0 HD2 LYS A 55 -25.192 0.338 10.448 1.00 4.28 H new ATOM 0 HD3 LYS A 55 -23.886 0.755 9.357 1.00 4.28 H new ATOM 0 HE2 LYS A 55 -23.748 -1.379 8.522 1.00 5.49 H new ATOM 0 HE3 LYS A 55 -23.818 -2.101 10.118 1.00 5.49 H new ATOM 0 HZ1 LYS A 55 -25.776 -2.670 8.811 1.00 6.31 H new ATOM 0 HZ2 LYS A 55 -26.225 -1.727 10.150 1.00 6.31 H new ATOM 0 HZ3 LYS A 55 -26.157 -1.029 8.604 1.00 6.31 H new ATOM 577 N GLU A 56 -21.023 -1.365 12.968 1.00 2.86 N ATOM 578 CA GLU A 56 -20.017 -2.470 12.965 1.00 2.76 C ATOM 579 C GLU A 56 -18.740 -1.995 12.265 1.00 1.65 C ATOM 580 O GLU A 56 -17.832 -1.492 12.894 1.00 1.67 O ATOM 581 CB GLU A 56 -20.570 -3.713 12.241 1.00 3.34 C ATOM 582 CG GLU A 56 -21.674 -3.325 11.246 1.00 3.71 C ATOM 583 CD GLU A 56 -22.018 -4.531 10.371 1.00 4.71 C ATOM 584 OE1 GLU A 56 -21.192 -4.897 9.551 1.00 5.14 O ATOM 585 OE2 GLU A 56 -23.101 -5.070 10.536 1.00 5.25 O ATOM 0 H GLU A 56 -20.852 -0.620 12.293 1.00 2.86 H new ATOM 0 HA GLU A 56 -19.796 -2.741 13.997 1.00 2.76 H new ATOM 0 HB2 GLU A 56 -19.762 -4.220 11.714 1.00 3.34 H new ATOM 0 HB3 GLU A 56 -20.966 -4.418 12.972 1.00 3.34 H new ATOM 0 HG2 GLU A 56 -22.560 -2.987 11.783 1.00 3.71 H new ATOM 0 HG3 GLU A 56 -21.342 -2.494 10.624 1.00 3.71 H new ATOM 592 N ALA A 57 -18.660 -2.149 10.971 1.00 1.32 N ATOM 593 CA ALA A 57 -17.440 -1.702 10.243 1.00 0.65 C ATOM 594 C ALA A 57 -16.205 -2.365 10.859 1.00 0.66 C ATOM 595 O ALA A 57 -15.107 -1.853 10.778 1.00 1.10 O ATOM 596 CB ALA A 57 -17.308 -0.184 10.356 1.00 0.47 C ATOM 0 H ALA A 57 -19.386 -2.565 10.388 1.00 1.32 H new ATOM 0 HA ALA A 57 -17.520 -1.985 9.193 1.00 0.65 H new ATOM 0 HB1 ALA A 57 -16.415 0.144 9.824 1.00 0.47 H new ATOM 0 HB2 ALA A 57 -18.186 0.291 9.919 1.00 0.47 H new ATOM 0 HB3 ALA A 57 -17.228 0.097 11.406 1.00 0.47 H new ATOM 602 N LEU A 58 -16.377 -3.502 11.475 1.00 0.81 N ATOM 603 CA LEU A 58 -15.215 -4.196 12.100 1.00 1.31 C ATOM 604 C LEU A 58 -14.253 -4.683 11.006 1.00 1.39 C ATOM 605 O LEU A 58 -13.330 -3.989 10.632 1.00 2.50 O ATOM 606 CB LEU A 58 -15.715 -5.390 12.918 1.00 1.73 C ATOM 607 CG LEU A 58 -16.267 -4.899 14.257 1.00 2.41 C ATOM 608 CD1 LEU A 58 -17.790 -4.786 14.174 1.00 2.11 C ATOM 609 CD2 LEU A 58 -15.889 -5.892 15.357 1.00 3.09 C ATOM 0 H LEU A 58 -17.272 -3.981 11.573 1.00 0.81 H new ATOM 0 HA LEU A 58 -14.688 -3.503 12.756 1.00 1.31 H new ATOM 0 HB2 LEU A 58 -16.490 -5.922 12.367 1.00 1.73 H new ATOM 0 HB3 LEU A 58 -14.901 -6.096 13.085 1.00 1.73 H new ATOM 0 HG LEU A 58 -15.844 -3.921 14.487 1.00 2.41 H new ATOM 0 HD11 LEU A 58 -18.181 -4.436 15.129 1.00 2.11 H new ATOM 0 HD12 LEU A 58 -18.060 -4.079 13.390 1.00 2.11 H new ATOM 0 HD13 LEU A 58 -18.215 -5.763 13.944 1.00 2.11 H new ATOM 0 HD21 LEU A 58 -16.282 -5.544 16.312 1.00 3.09 H new ATOM 0 HD22 LEU A 58 -16.312 -6.870 15.126 1.00 3.09 H new ATOM 0 HD23 LEU A 58 -14.804 -5.971 15.418 1.00 3.09 H new ATOM 621 N ALA A 59 -14.460 -5.867 10.491 1.00 0.99 N ATOM 622 CA ALA A 59 -13.555 -6.389 9.426 1.00 1.01 C ATOM 623 C ALA A 59 -14.018 -7.785 9.009 1.00 1.51 C ATOM 624 O ALA A 59 -13.720 -8.768 9.660 1.00 2.56 O ATOM 625 CB ALA A 59 -12.123 -6.467 9.961 1.00 2.23 C ATOM 0 H ALA A 59 -15.217 -6.495 10.762 1.00 0.99 H new ATOM 0 HA ALA A 59 -13.583 -5.720 8.566 1.00 1.01 H new ATOM 0 HB1 ALA A 59 -11.464 -6.849 9.181 1.00 2.23 H new ATOM 0 HB2 ALA A 59 -11.792 -5.473 10.262 1.00 2.23 H new ATOM 0 HB3 ALA A 59 -12.092 -7.135 10.822 1.00 2.23 H new ATOM 631 N GLU A 60 -14.743 -7.885 7.929 1.00 1.68 N ATOM 632 CA GLU A 60 -15.223 -9.220 7.476 1.00 2.87 C ATOM 633 C GLU A 60 -14.094 -9.948 6.742 1.00 2.17 C ATOM 634 O GLU A 60 -14.084 -11.159 6.643 1.00 2.57 O ATOM 635 CB GLU A 60 -16.412 -9.040 6.532 1.00 4.27 C ATOM 636 CG GLU A 60 -17.365 -10.228 6.675 1.00 5.70 C ATOM 637 CD GLU A 60 -18.171 -10.394 5.385 1.00 7.01 C ATOM 638 OE1 GLU A 60 -18.467 -9.388 4.761 1.00 7.34 O ATOM 639 OE2 GLU A 60 -18.480 -11.524 5.043 1.00 7.89 O ATOM 0 H GLU A 60 -15.023 -7.100 7.341 1.00 1.68 H new ATOM 0 HA GLU A 60 -15.531 -9.808 8.341 1.00 2.87 H new ATOM 0 HB2 GLU A 60 -16.935 -8.112 6.762 1.00 4.27 H new ATOM 0 HB3 GLU A 60 -16.063 -8.962 5.502 1.00 4.27 H new ATOM 0 HG2 GLU A 60 -16.801 -11.137 6.884 1.00 5.70 H new ATOM 0 HG3 GLU A 60 -18.037 -10.069 7.518 1.00 5.70 H new ATOM 646 N ASN A 61 -13.142 -9.218 6.227 1.00 1.20 N ATOM 647 CA ASN A 61 -12.014 -9.864 5.501 1.00 0.81 C ATOM 648 C ASN A 61 -10.775 -8.975 5.606 1.00 0.69 C ATOM 649 O ASN A 61 -10.873 -7.768 5.714 1.00 2.35 O ATOM 650 CB ASN A 61 -12.390 -10.046 4.029 1.00 1.48 C ATOM 651 CG ASN A 61 -11.941 -11.429 3.551 1.00 2.50 C ATOM 652 OD1 ASN A 61 -11.005 -11.545 2.784 1.00 3.46 O ATOM 653 ND2 ASN A 61 -12.574 -12.488 3.973 1.00 2.79 N ATOM 0 H ASN A 61 -13.098 -8.200 6.278 1.00 1.20 H new ATOM 0 HA ASN A 61 -11.804 -10.839 5.942 1.00 0.81 H new ATOM 0 HB2 ASN A 61 -13.467 -9.939 3.903 1.00 1.48 H new ATOM 0 HB3 ASN A 61 -11.919 -9.271 3.425 1.00 1.48 H new ATOM 0 HD21 ASN A 61 -12.284 -13.414 3.660 1.00 2.79 H new ATOM 0 HD22 ASN A 61 -13.359 -12.390 4.617 1.00 2.79 H new ATOM 660 N ASN A 62 -9.608 -9.557 5.577 1.00 0.92 N ATOM 661 CA ASN A 62 -8.369 -8.739 5.678 1.00 0.65 C ATOM 662 C ASN A 62 -7.649 -8.725 4.327 1.00 1.04 C ATOM 663 O ASN A 62 -6.454 -8.521 4.253 1.00 2.40 O ATOM 664 CB ASN A 62 -7.447 -9.336 6.742 1.00 1.11 C ATOM 665 CG ASN A 62 -7.600 -8.546 8.043 1.00 1.43 C ATOM 666 OD1 ASN A 62 -8.441 -7.675 8.142 1.00 1.36 O ATOM 667 ND2 ASN A 62 -6.815 -8.812 9.049 1.00 2.05 N ATOM 0 H ASN A 62 -9.460 -10.562 5.488 1.00 0.92 H new ATOM 0 HA ASN A 62 -8.633 -7.719 5.957 1.00 0.65 H new ATOM 0 HB2 ASN A 62 -7.695 -10.384 6.908 1.00 1.11 H new ATOM 0 HB3 ASN A 62 -6.412 -9.303 6.403 1.00 1.11 H new ATOM 0 HD21 ASN A 62 -6.907 -8.289 9.920 1.00 2.05 H new ATOM 0 HD22 ASN A 62 -6.109 -9.543 8.965 1.00 2.05 H new ATOM 674 N LEU A 63 -8.368 -8.936 3.259 1.00 0.10 N ATOM 675 CA LEU A 63 -7.722 -8.929 1.915 1.00 0.33 C ATOM 676 C LEU A 63 -6.607 -9.973 1.876 1.00 0.25 C ATOM 677 O LEU A 63 -6.422 -10.730 2.809 1.00 0.28 O ATOM 678 CB LEU A 63 -7.130 -7.547 1.647 1.00 0.73 C ATOM 679 CG LEU A 63 -8.056 -6.767 0.716 1.00 0.76 C ATOM 680 CD1 LEU A 63 -7.519 -5.348 0.541 1.00 1.04 C ATOM 681 CD2 LEU A 63 -8.113 -7.462 -0.647 1.00 0.98 C ATOM 0 H LEU A 63 -9.373 -9.113 3.258 1.00 0.10 H new ATOM 0 HA LEU A 63 -8.466 -9.165 1.154 1.00 0.33 H new ATOM 0 HB2 LEU A 63 -7.001 -7.007 2.585 1.00 0.73 H new ATOM 0 HB3 LEU A 63 -6.142 -7.644 1.197 1.00 0.73 H new ATOM 0 HG LEU A 63 -9.057 -6.728 1.146 1.00 0.76 H new ATOM 0 HD11 LEU A 63 -8.178 -4.789 -0.123 1.00 1.04 H new ATOM 0 HD12 LEU A 63 -7.476 -4.853 1.511 1.00 1.04 H new ATOM 0 HD13 LEU A 63 -6.519 -5.388 0.110 1.00 1.04 H new ATOM 0 HD21 LEU A 63 -8.774 -6.906 -1.312 1.00 0.98 H new ATOM 0 HD22 LEU A 63 -7.113 -7.500 -1.078 1.00 0.98 H new ATOM 0 HD23 LEU A 63 -8.493 -8.476 -0.523 1.00 0.98 H new ATOM 693 N ASN A 64 -5.860 -10.022 0.806 1.00 0.33 N ATOM 694 CA ASN A 64 -4.760 -11.021 0.720 1.00 0.46 C ATOM 695 C ASN A 64 -3.467 -10.330 0.284 1.00 0.47 C ATOM 696 O ASN A 64 -2.565 -10.955 -0.236 1.00 0.52 O ATOM 697 CB ASN A 64 -5.131 -12.108 -0.292 1.00 0.63 C ATOM 698 CG ASN A 64 -6.320 -12.913 0.237 1.00 1.39 C ATOM 699 OD1 ASN A 64 -6.408 -13.183 1.418 1.00 1.95 O ATOM 700 ND2 ASN A 64 -7.245 -13.311 -0.593 1.00 2.06 N ATOM 0 H ASN A 64 -5.964 -9.416 -0.008 1.00 0.33 H new ATOM 0 HA ASN A 64 -4.610 -11.476 1.699 1.00 0.46 H new ATOM 0 HB2 ASN A 64 -5.382 -11.656 -1.252 1.00 0.63 H new ATOM 0 HB3 ASN A 64 -4.279 -12.767 -0.463 1.00 0.63 H new ATOM 0 HD21 ASN A 64 -8.041 -13.848 -0.250 1.00 2.06 H new ATOM 0 HD22 ASN A 64 -7.172 -13.085 -1.585 1.00 2.06 H new ATOM 707 N LEU A 65 -3.364 -9.048 0.502 1.00 0.57 N ATOM 708 CA LEU A 65 -2.121 -8.326 0.111 1.00 0.57 C ATOM 709 C LEU A 65 -1.004 -8.694 1.103 1.00 0.91 C ATOM 710 O LEU A 65 -1.288 -9.180 2.180 1.00 1.53 O ATOM 711 CB LEU A 65 -2.387 -6.814 0.127 1.00 0.33 C ATOM 712 CG LEU A 65 -2.691 -6.338 1.546 1.00 0.63 C ATOM 713 CD1 LEU A 65 -2.071 -4.953 1.741 1.00 0.71 C ATOM 714 CD2 LEU A 65 -4.206 -6.248 1.738 1.00 0.79 C ATOM 0 H LEU A 65 -4.085 -8.470 0.933 1.00 0.57 H new ATOM 0 HA LEU A 65 -1.812 -8.612 -0.895 1.00 0.57 H new ATOM 0 HB2 LEU A 65 -1.519 -6.282 -0.263 1.00 0.33 H new ATOM 0 HB3 LEU A 65 -3.226 -6.580 -0.529 1.00 0.33 H new ATOM 0 HG LEU A 65 -2.277 -7.038 2.272 1.00 0.63 H new ATOM 0 HD11 LEU A 65 -2.280 -4.600 2.751 1.00 0.71 H new ATOM 0 HD12 LEU A 65 -0.993 -5.013 1.593 1.00 0.71 H new ATOM 0 HD13 LEU A 65 -2.498 -4.258 1.018 1.00 0.71 H new ATOM 0 HD21 LEU A 65 -4.425 -5.908 2.750 1.00 0.79 H new ATOM 0 HD22 LEU A 65 -4.622 -5.541 1.020 1.00 0.79 H new ATOM 0 HD23 LEU A 65 -4.652 -7.230 1.580 1.00 0.79 H new ATOM 726 N PRO A 66 0.237 -8.467 0.722 1.00 1.98 N ATOM 727 CA PRO A 66 1.389 -8.792 1.586 1.00 2.26 C ATOM 728 C PRO A 66 1.529 -7.771 2.720 1.00 1.23 C ATOM 729 O PRO A 66 1.276 -6.596 2.548 1.00 2.11 O ATOM 730 CB PRO A 66 2.586 -8.732 0.632 1.00 4.05 C ATOM 731 CG PRO A 66 2.151 -7.850 -0.561 1.00 4.72 C ATOM 732 CD PRO A 66 0.611 -7.871 -0.582 1.00 3.47 C ATOM 0 HA PRO A 66 1.292 -9.761 2.076 1.00 2.26 H new ATOM 0 HB2 PRO A 66 3.458 -8.309 1.130 1.00 4.05 H new ATOM 0 HB3 PRO A 66 2.864 -9.731 0.295 1.00 4.05 H new ATOM 0 HG2 PRO A 66 2.524 -6.832 -0.447 1.00 4.72 H new ATOM 0 HG3 PRO A 66 2.557 -8.235 -1.496 1.00 4.72 H new ATOM 0 HD2 PRO A 66 0.201 -6.867 -0.693 1.00 3.47 H new ATOM 0 HD3 PRO A 66 0.232 -8.464 -1.414 1.00 3.47 H new ATOM 740 N LYS A 67 1.923 -8.221 3.883 1.00 0.53 N ATOM 741 CA LYS A 67 2.074 -7.288 5.037 1.00 1.12 C ATOM 742 C LYS A 67 3.366 -7.607 5.795 1.00 0.42 C ATOM 743 O LYS A 67 4.199 -8.361 5.335 1.00 0.69 O ATOM 744 CB LYS A 67 0.880 -7.454 5.978 1.00 2.63 C ATOM 745 CG LYS A 67 0.273 -6.084 6.285 1.00 4.39 C ATOM 746 CD LYS A 67 0.207 -5.884 7.801 1.00 5.98 C ATOM 747 CE LYS A 67 -1.052 -5.092 8.157 1.00 7.66 C ATOM 748 NZ LYS A 67 -2.100 -6.025 8.657 1.00 8.08 N ATOM 0 H LYS A 67 2.147 -9.196 4.083 1.00 0.53 H new ATOM 0 HA LYS A 67 2.116 -6.262 4.671 1.00 1.12 H new ATOM 0 HB2 LYS A 67 0.131 -8.100 5.521 1.00 2.63 H new ATOM 0 HB3 LYS A 67 1.197 -7.938 6.902 1.00 2.63 H new ATOM 0 HG2 LYS A 67 0.874 -5.297 5.829 1.00 4.39 H new ATOM 0 HG3 LYS A 67 -0.726 -6.012 5.854 1.00 4.39 H new ATOM 0 HD2 LYS A 67 0.197 -6.850 8.306 1.00 5.98 H new ATOM 0 HD3 LYS A 67 1.094 -5.353 8.147 1.00 5.98 H new ATOM 0 HE2 LYS A 67 -0.822 -4.345 8.917 1.00 7.66 H new ATOM 0 HE3 LYS A 67 -1.416 -4.554 7.282 1.00 7.66 H new ATOM 0 HZ1 LYS A 67 -2.957 -5.487 8.899 1.00 8.08 H new ATOM 0 HZ2 LYS A 67 -2.326 -6.721 7.918 1.00 8.08 H new ATOM 0 HZ3 LYS A 67 -1.750 -6.519 9.503 1.00 8.08 H new ATOM 762 N MET A 68 3.536 -7.032 6.954 1.00 0.53 N ATOM 763 CA MET A 68 4.772 -7.292 7.750 1.00 0.36 C ATOM 764 C MET A 68 4.408 -8.029 9.041 1.00 0.46 C ATOM 765 O MET A 68 3.261 -8.346 9.287 1.00 0.42 O ATOM 766 CB MET A 68 5.436 -5.960 8.099 1.00 0.99 C ATOM 767 CG MET A 68 6.322 -5.507 6.934 1.00 1.05 C ATOM 768 SD MET A 68 5.687 -3.954 6.252 1.00 1.19 S ATOM 769 CE MET A 68 7.202 -2.980 6.434 1.00 0.86 C ATOM 0 H MET A 68 2.871 -6.391 7.386 1.00 0.53 H new ATOM 0 HA MET A 68 5.458 -7.905 7.165 1.00 0.36 H new ATOM 0 HB2 MET A 68 4.676 -5.206 8.306 1.00 0.99 H new ATOM 0 HB3 MET A 68 6.034 -6.066 9.004 1.00 0.99 H new ATOM 0 HG2 MET A 68 7.348 -5.373 7.276 1.00 1.05 H new ATOM 0 HG3 MET A 68 6.342 -6.274 6.160 1.00 1.05 H new ATOM 0 HE1 MET A 68 7.006 -1.946 6.150 1.00 0.86 H new ATOM 0 HE2 MET A 68 7.535 -3.015 7.471 1.00 0.86 H new ATOM 0 HE3 MET A 68 7.979 -3.392 5.790 1.00 0.86 H new ATOM 779 N ALA A 69 5.381 -8.304 9.865 1.00 0.65 N ATOM 780 CA ALA A 69 5.102 -9.022 11.140 1.00 0.81 C ATOM 781 C ALA A 69 5.738 -8.262 12.306 1.00 0.48 C ATOM 782 O ALA A 69 6.082 -7.102 12.189 1.00 0.81 O ATOM 783 CB ALA A 69 5.697 -10.429 11.063 1.00 1.39 C ATOM 0 H ALA A 69 6.360 -8.062 9.710 1.00 0.65 H new ATOM 0 HA ALA A 69 4.025 -9.086 11.297 1.00 0.81 H new ATOM 0 HB1 ALA A 69 5.496 -10.960 11.993 1.00 1.39 H new ATOM 0 HB2 ALA A 69 5.245 -10.970 10.232 1.00 1.39 H new ATOM 0 HB3 ALA A 69 6.774 -10.361 10.909 1.00 1.39 H new ATOM 789 N GLU A 70 5.898 -8.906 13.430 1.00 0.76 N ATOM 790 CA GLU A 70 6.514 -8.222 14.603 1.00 1.18 C ATOM 791 C GLU A 70 8.000 -8.564 14.665 1.00 1.57 C ATOM 792 O GLU A 70 8.846 -7.696 14.750 1.00 1.90 O ATOM 793 CB GLU A 70 5.828 -8.689 15.888 1.00 1.32 C ATOM 794 CG GLU A 70 4.606 -7.811 16.163 1.00 2.29 C ATOM 795 CD GLU A 70 3.653 -8.542 17.110 1.00 2.49 C ATOM 796 OE1 GLU A 70 3.564 -9.755 17.008 1.00 2.45 O ATOM 797 OE2 GLU A 70 3.029 -7.878 17.921 1.00 3.08 O ATOM 0 H GLU A 70 5.629 -9.877 13.587 1.00 0.76 H new ATOM 0 HA GLU A 70 6.392 -7.144 14.500 1.00 1.18 H new ATOM 0 HB2 GLU A 70 5.526 -9.732 15.793 1.00 1.32 H new ATOM 0 HB3 GLU A 70 6.524 -8.634 16.725 1.00 1.32 H new ATOM 0 HG2 GLU A 70 4.918 -6.864 16.604 1.00 2.29 H new ATOM 0 HG3 GLU A 70 4.097 -7.576 15.228 1.00 2.29 H new ATOM 804 N LYS A 71 8.326 -9.822 14.622 1.00 1.95 N ATOM 805 CA LYS A 71 9.757 -10.222 14.676 1.00 2.61 C ATOM 806 C LYS A 71 10.333 -10.298 13.256 1.00 2.15 C ATOM 807 O LYS A 71 11.466 -10.693 13.060 1.00 2.19 O ATOM 808 CB LYS A 71 9.862 -11.589 15.344 1.00 3.70 C ATOM 809 CG LYS A 71 8.919 -12.570 14.646 1.00 2.79 C ATOM 810 CD LYS A 71 9.667 -13.867 14.338 1.00 2.85 C ATOM 811 CE LYS A 71 9.563 -14.812 15.536 1.00 4.34 C ATOM 812 NZ LYS A 71 8.965 -16.104 15.100 1.00 4.03 N ATOM 0 H LYS A 71 7.662 -10.593 14.552 1.00 1.95 H new ATOM 0 HA LYS A 71 10.322 -9.485 15.247 1.00 2.61 H new ATOM 0 HB2 LYS A 71 10.888 -11.954 15.291 1.00 3.70 H new ATOM 0 HB3 LYS A 71 9.606 -11.510 16.400 1.00 3.70 H new ATOM 0 HG2 LYS A 71 8.058 -12.777 15.281 1.00 2.79 H new ATOM 0 HG3 LYS A 71 8.537 -12.130 13.724 1.00 2.79 H new ATOM 0 HD2 LYS A 71 9.246 -14.340 13.451 1.00 2.85 H new ATOM 0 HD3 LYS A 71 10.713 -13.653 14.120 1.00 2.85 H new ATOM 0 HE2 LYS A 71 10.551 -14.983 15.965 1.00 4.34 H new ATOM 0 HE3 LYS A 71 8.950 -14.361 16.316 1.00 4.34 H new ATOM 0 HZ1 LYS A 71 8.894 -16.746 15.915 1.00 4.03 H new ATOM 0 HZ2 LYS A 71 8.016 -15.933 14.710 1.00 4.03 H new ATOM 0 HZ3 LYS A 71 9.566 -16.536 14.370 1.00 4.03 H new ATOM 826 N ASP A 72 9.568 -9.922 12.263 1.00 1.83 N ATOM 827 CA ASP A 72 10.077 -9.973 10.863 1.00 1.72 C ATOM 828 C ASP A 72 9.274 -8.998 10.007 1.00 1.66 C ATOM 829 O ASP A 72 8.446 -9.400 9.212 1.00 3.19 O ATOM 830 CB ASP A 72 9.899 -11.385 10.303 1.00 3.25 C ATOM 831 CG ASP A 72 10.739 -12.371 11.115 1.00 4.96 C ATOM 832 OD1 ASP A 72 11.952 -12.253 11.081 1.00 4.98 O ATOM 833 OD2 ASP A 72 10.154 -13.227 11.758 1.00 6.44 O ATOM 0 H ASP A 72 8.612 -9.582 12.364 1.00 1.83 H new ATOM 0 HA ASP A 72 11.133 -9.705 10.850 1.00 1.72 H new ATOM 0 HB2 ASP A 72 8.848 -11.671 10.340 1.00 3.25 H new ATOM 0 HB3 ASP A 72 10.200 -11.412 9.256 1.00 3.25 H new ATOM 838 N GLY A 73 9.495 -7.721 10.161 1.00 1.29 N ATOM 839 CA GLY A 73 8.720 -6.749 9.346 1.00 3.19 C ATOM 840 C GLY A 73 9.334 -5.352 9.436 1.00 2.58 C ATOM 841 O GLY A 73 9.753 -4.790 8.444 1.00 3.41 O ATOM 0 H GLY A 73 10.170 -7.314 10.808 1.00 1.29 H new ATOM 0 HA2 GLY A 73 8.699 -7.075 8.306 1.00 3.19 H new ATOM 0 HA3 GLY A 73 7.687 -6.720 9.692 1.00 3.19 H new ATOM 845 N CYS A 74 9.370 -4.768 10.605 1.00 1.31 N ATOM 846 CA CYS A 74 9.934 -3.392 10.716 1.00 0.68 C ATOM 847 C CYS A 74 9.851 -2.896 12.161 1.00 0.42 C ATOM 848 O CYS A 74 9.268 -1.865 12.435 1.00 0.54 O ATOM 849 CB CYS A 74 9.110 -2.467 9.823 1.00 0.84 C ATOM 850 SG CYS A 74 10.215 -1.377 8.911 1.00 1.82 S ATOM 0 H CYS A 74 9.038 -5.179 11.477 1.00 1.31 H new ATOM 0 HA CYS A 74 10.980 -3.400 10.409 1.00 0.68 H new ATOM 0 HB2 CYS A 74 8.507 -3.054 9.130 1.00 0.84 H new ATOM 0 HB3 CYS A 74 8.419 -1.880 10.428 1.00 0.84 H new ATOM 855 N PHE A 75 10.420 -3.611 13.092 1.00 0.18 N ATOM 856 CA PHE A 75 10.352 -3.156 14.511 1.00 0.09 C ATOM 857 C PHE A 75 11.546 -3.706 15.295 1.00 0.41 C ATOM 858 O PHE A 75 12.326 -4.492 14.793 1.00 0.91 O ATOM 859 CB PHE A 75 9.047 -3.652 15.137 1.00 0.22 C ATOM 860 CG PHE A 75 7.887 -3.259 14.251 1.00 0.35 C ATOM 861 CD1 PHE A 75 7.259 -2.019 14.425 1.00 1.07 C ATOM 862 CD2 PHE A 75 7.440 -4.134 13.250 1.00 0.59 C ATOM 863 CE1 PHE A 75 6.187 -1.655 13.601 1.00 1.16 C ATOM 864 CE2 PHE A 75 6.369 -3.769 12.428 1.00 0.63 C ATOM 865 CZ PHE A 75 5.741 -2.530 12.603 1.00 0.61 C ATOM 0 H PHE A 75 10.925 -4.483 12.935 1.00 0.18 H new ATOM 0 HA PHE A 75 10.382 -2.067 14.544 1.00 0.09 H new ATOM 0 HB2 PHE A 75 9.077 -4.735 15.258 1.00 0.22 H new ATOM 0 HB3 PHE A 75 8.921 -3.224 16.131 1.00 0.22 H new ATOM 0 HD1 PHE A 75 7.602 -1.344 15.195 1.00 1.07 H new ATOM 0 HD2 PHE A 75 7.923 -5.090 13.114 1.00 0.59 H new ATOM 0 HE1 PHE A 75 5.704 -0.699 13.735 1.00 1.16 H new ATOM 0 HE2 PHE A 75 6.026 -4.444 11.657 1.00 0.63 H new ATOM 0 HZ PHE A 75 4.913 -2.249 11.969 1.00 0.61 H new ATOM 875 N GLN A 76 11.695 -3.292 16.525 1.00 0.32 N ATOM 876 CA GLN A 76 12.838 -3.778 17.350 1.00 0.59 C ATOM 877 C GLN A 76 12.814 -5.308 17.421 1.00 0.76 C ATOM 878 O GLN A 76 13.836 -5.958 17.328 1.00 1.10 O ATOM 879 CB GLN A 76 12.725 -3.198 18.762 1.00 0.81 C ATOM 880 CG GLN A 76 14.024 -3.453 19.528 1.00 1.53 C ATOM 881 CD GLN A 76 13.882 -2.931 20.960 1.00 1.98 C ATOM 882 OE1 GLN A 76 14.456 -1.919 21.310 1.00 2.15 O ATOM 883 NE2 GLN A 76 13.135 -3.585 21.808 1.00 2.82 N ATOM 0 H GLN A 76 11.072 -2.636 16.995 1.00 0.32 H new ATOM 0 HA GLN A 76 13.775 -3.456 16.895 1.00 0.59 H new ATOM 0 HB2 GLN A 76 12.525 -2.128 18.711 1.00 0.81 H new ATOM 0 HB3 GLN A 76 11.886 -3.654 19.287 1.00 0.81 H new ATOM 0 HG2 GLN A 76 14.249 -4.519 19.539 1.00 1.53 H new ATOM 0 HG3 GLN A 76 14.856 -2.957 19.029 1.00 1.53 H new ATOM 0 HE21 GLN A 76 12.653 -4.435 21.514 1.00 2.82 H new ATOM 0 HE22 GLN A 76 13.033 -3.246 22.765 1.00 2.82 H new ATOM 892 N SER A 77 11.656 -5.889 17.586 1.00 0.75 N ATOM 893 CA SER A 77 11.574 -7.376 17.663 1.00 1.16 C ATOM 894 C SER A 77 12.196 -7.988 16.406 1.00 1.33 C ATOM 895 O SER A 77 12.802 -9.039 16.450 1.00 1.36 O ATOM 896 CB SER A 77 10.109 -7.802 17.768 1.00 1.23 C ATOM 897 OG SER A 77 10.037 -9.221 17.821 1.00 2.28 O ATOM 0 H SER A 77 10.765 -5.399 17.671 1.00 0.75 H new ATOM 0 HA SER A 77 12.116 -7.724 18.542 1.00 1.16 H new ATOM 0 HB2 SER A 77 9.655 -7.369 18.660 1.00 1.23 H new ATOM 0 HB3 SER A 77 9.547 -7.429 16.912 1.00 1.23 H new ATOM 0 HG SER A 77 9.100 -9.499 17.890 1.00 2.28 H new ATOM 903 N GLY A 78 12.053 -7.335 15.285 1.00 2.39 N ATOM 904 CA GLY A 78 12.637 -7.877 14.025 1.00 2.67 C ATOM 905 C GLY A 78 13.156 -6.718 13.172 1.00 2.07 C ATOM 906 O GLY A 78 12.706 -6.499 12.065 1.00 2.41 O ATOM 0 H GLY A 78 11.557 -6.449 15.187 1.00 2.39 H new ATOM 0 HA2 GLY A 78 13.449 -8.568 14.254 1.00 2.67 H new ATOM 0 HA3 GLY A 78 11.884 -8.441 13.474 1.00 2.67 H new ATOM 910 N PHE A 79 14.097 -5.971 13.681 1.00 1.35 N ATOM 911 CA PHE A 79 14.643 -4.823 12.904 1.00 0.70 C ATOM 912 C PHE A 79 15.847 -5.284 12.081 1.00 0.53 C ATOM 913 O PHE A 79 16.981 -4.988 12.406 1.00 0.43 O ATOM 914 CB PHE A 79 15.080 -3.722 13.874 1.00 0.50 C ATOM 915 CG PHE A 79 15.210 -2.414 13.132 1.00 0.36 C ATOM 916 CD1 PHE A 79 14.175 -1.978 12.295 1.00 0.34 C ATOM 917 CD2 PHE A 79 16.364 -1.636 13.283 1.00 0.89 C ATOM 918 CE1 PHE A 79 14.296 -0.763 11.609 1.00 0.72 C ATOM 919 CE2 PHE A 79 16.484 -0.422 12.597 1.00 1.31 C ATOM 920 CZ PHE A 79 15.450 0.014 11.760 1.00 1.20 C ATOM 0 H PHE A 79 14.512 -6.107 14.603 1.00 1.35 H new ATOM 0 HA PHE A 79 13.875 -4.439 12.233 1.00 0.70 H new ATOM 0 HB2 PHE A 79 14.352 -3.624 14.680 1.00 0.50 H new ATOM 0 HB3 PHE A 79 16.032 -3.986 14.335 1.00 0.50 H new ATOM 0 HD1 PHE A 79 13.285 -2.578 12.179 1.00 0.34 H new ATOM 0 HD2 PHE A 79 17.162 -1.973 13.929 1.00 0.89 H new ATOM 0 HE1 PHE A 79 13.499 -0.426 10.963 1.00 0.72 H new ATOM 0 HE2 PHE A 79 17.374 0.178 12.713 1.00 1.31 H new ATOM 0 HZ PHE A 79 15.543 0.951 11.230 1.00 1.20 H new ATOM 930 N ASN A 80 15.618 -6.002 11.014 1.00 0.83 N ATOM 931 CA ASN A 80 16.760 -6.472 10.178 1.00 0.83 C ATOM 932 C ASN A 80 17.104 -5.422 9.118 1.00 0.88 C ATOM 933 O ASN A 80 17.924 -5.655 8.255 1.00 2.17 O ATOM 934 CB ASN A 80 16.390 -7.786 9.488 1.00 0.90 C ATOM 935 CG ASN A 80 17.030 -8.959 10.236 1.00 1.04 C ATOM 936 OD1 ASN A 80 17.071 -8.972 11.450 1.00 1.65 O ATOM 937 ND2 ASN A 80 17.535 -9.951 9.554 1.00 1.30 N ATOM 0 H ASN A 80 14.694 -6.282 10.686 1.00 0.83 H new ATOM 0 HA ASN A 80 17.625 -6.629 10.822 1.00 0.83 H new ATOM 0 HB2 ASN A 80 15.307 -7.904 9.466 1.00 0.90 H new ATOM 0 HB3 ASN A 80 16.731 -7.773 8.453 1.00 0.90 H new ATOM 0 HD21 ASN A 80 17.964 -10.738 10.040 1.00 1.30 H new ATOM 0 HD22 ASN A 80 17.500 -9.939 8.535 1.00 1.30 H new ATOM 944 N GLU A 81 16.495 -4.268 9.183 1.00 1.00 N ATOM 945 CA GLU A 81 16.795 -3.198 8.191 1.00 0.92 C ATOM 946 C GLU A 81 16.477 -3.674 6.766 1.00 0.94 C ATOM 947 O GLU A 81 15.393 -3.461 6.262 1.00 1.17 O ATOM 948 CB GLU A 81 18.274 -2.810 8.287 1.00 0.88 C ATOM 949 CG GLU A 81 18.506 -1.997 9.561 1.00 0.89 C ATOM 950 CD GLU A 81 19.679 -1.041 9.348 1.00 1.04 C ATOM 951 OE1 GLU A 81 19.807 -0.526 8.249 1.00 1.67 O ATOM 952 OE2 GLU A 81 20.433 -0.839 10.285 1.00 0.92 O ATOM 0 H GLU A 81 15.798 -4.020 9.886 1.00 1.00 H new ATOM 0 HA GLU A 81 16.172 -2.332 8.414 1.00 0.92 H new ATOM 0 HB2 GLU A 81 18.896 -3.705 8.296 1.00 0.88 H new ATOM 0 HB3 GLU A 81 18.566 -2.228 7.413 1.00 0.88 H new ATOM 0 HG2 GLU A 81 17.607 -1.436 9.816 1.00 0.89 H new ATOM 0 HG3 GLU A 81 18.714 -2.664 10.398 1.00 0.89 H new ATOM 959 N GLU A 82 17.419 -4.296 6.104 1.00 0.80 N ATOM 960 CA GLU A 82 17.175 -4.760 4.707 1.00 0.85 C ATOM 961 C GLU A 82 15.984 -5.723 4.648 1.00 0.75 C ATOM 962 O GLU A 82 15.451 -5.982 3.588 1.00 0.68 O ATOM 963 CB GLU A 82 18.424 -5.473 4.185 1.00 0.84 C ATOM 964 CG GLU A 82 18.496 -5.332 2.663 1.00 1.09 C ATOM 965 CD GLU A 82 19.249 -6.527 2.077 1.00 0.99 C ATOM 966 OE1 GLU A 82 20.463 -6.452 1.991 1.00 2.08 O ATOM 967 OE2 GLU A 82 18.598 -7.497 1.723 1.00 1.38 O ATOM 0 H GLU A 82 18.348 -4.502 6.472 1.00 0.80 H new ATOM 0 HA GLU A 82 16.950 -3.891 4.089 1.00 0.85 H new ATOM 0 HB2 GLU A 82 19.317 -5.047 4.643 1.00 0.84 H new ATOM 0 HB3 GLU A 82 18.396 -6.527 4.462 1.00 0.84 H new ATOM 0 HG2 GLU A 82 17.491 -5.280 2.244 1.00 1.09 H new ATOM 0 HG3 GLU A 82 19.001 -4.404 2.396 1.00 1.09 H new ATOM 974 N THR A 83 15.552 -6.256 5.760 1.00 0.76 N ATOM 975 CA THR A 83 14.394 -7.190 5.715 1.00 0.66 C ATOM 976 C THR A 83 13.110 -6.374 5.630 1.00 0.63 C ATOM 977 O THR A 83 12.157 -6.764 4.985 1.00 0.57 O ATOM 978 CB THR A 83 14.367 -8.067 6.967 1.00 0.69 C ATOM 979 OG1 THR A 83 15.551 -8.849 7.021 1.00 0.67 O ATOM 980 CG2 THR A 83 13.147 -8.990 6.908 1.00 0.74 C ATOM 0 H THR A 83 15.946 -6.087 6.685 1.00 0.76 H new ATOM 0 HA THR A 83 14.484 -7.838 4.843 1.00 0.66 H new ATOM 0 HB THR A 83 14.308 -7.438 7.855 1.00 0.69 H new ATOM 0 HG1 THR A 83 15.455 -9.541 7.708 1.00 0.67 H new ATOM 0 HG21 THR A 83 13.122 -9.618 7.799 1.00 0.74 H new ATOM 0 HG22 THR A 83 12.238 -8.390 6.862 1.00 0.74 H new ATOM 0 HG23 THR A 83 13.210 -9.620 6.021 1.00 0.74 H new ATOM 988 N CYS A 84 13.078 -5.235 6.263 1.00 0.70 N ATOM 989 CA CYS A 84 11.855 -4.399 6.192 1.00 0.70 C ATOM 990 C CYS A 84 11.801 -3.758 4.810 1.00 0.61 C ATOM 991 O CYS A 84 10.859 -3.939 4.067 1.00 0.47 O ATOM 992 CB CYS A 84 11.889 -3.308 7.269 1.00 0.86 C ATOM 993 SG CYS A 84 10.413 -2.265 7.109 1.00 1.65 S ATOM 0 H CYS A 84 13.841 -4.852 6.821 1.00 0.70 H new ATOM 0 HA CYS A 84 10.973 -5.017 6.362 1.00 0.70 H new ATOM 0 HB2 CYS A 84 11.924 -3.760 8.260 1.00 0.86 H new ATOM 0 HB3 CYS A 84 12.790 -2.703 7.163 1.00 0.86 H new ATOM 998 N LEU A 85 12.822 -3.020 4.455 1.00 0.77 N ATOM 999 CA LEU A 85 12.851 -2.369 3.113 1.00 0.69 C ATOM 1000 C LEU A 85 12.513 -3.403 2.037 1.00 0.57 C ATOM 1001 O LEU A 85 11.819 -3.114 1.080 1.00 0.46 O ATOM 1002 CB LEU A 85 14.248 -1.803 2.859 1.00 0.75 C ATOM 1003 CG LEU A 85 14.153 -0.619 1.896 1.00 0.97 C ATOM 1004 CD1 LEU A 85 13.900 0.663 2.691 1.00 1.08 C ATOM 1005 CD2 LEU A 85 15.465 -0.485 1.121 1.00 0.77 C ATOM 0 H LEU A 85 13.638 -2.841 5.039 1.00 0.77 H new ATOM 0 HA LEU A 85 12.119 -1.562 3.080 1.00 0.69 H new ATOM 0 HB2 LEU A 85 14.699 -1.485 3.799 1.00 0.75 H new ATOM 0 HB3 LEU A 85 14.894 -2.575 2.440 1.00 0.75 H new ATOM 0 HG LEU A 85 13.333 -0.784 1.197 1.00 0.97 H new ATOM 0 HD11 LEU A 85 13.832 1.508 2.006 1.00 1.08 H new ATOM 0 HD12 LEU A 85 12.966 0.569 3.245 1.00 1.08 H new ATOM 0 HD13 LEU A 85 14.721 0.827 3.389 1.00 1.08 H new ATOM 0 HD21 LEU A 85 15.397 0.359 0.434 1.00 0.77 H new ATOM 0 HD22 LEU A 85 16.285 -0.320 1.820 1.00 0.77 H new ATOM 0 HD23 LEU A 85 15.649 -1.399 0.556 1.00 0.77 H new ATOM 1017 N VAL A 86 12.983 -4.612 2.193 1.00 0.61 N ATOM 1018 CA VAL A 86 12.662 -5.655 1.185 1.00 0.52 C ATOM 1019 C VAL A 86 11.147 -5.864 1.191 1.00 0.47 C ATOM 1020 O VAL A 86 10.527 -5.924 0.161 1.00 0.37 O ATOM 1021 CB VAL A 86 13.413 -6.966 1.525 1.00 0.55 C ATOM 1022 CG1 VAL A 86 12.652 -8.200 1.013 1.00 0.80 C ATOM 1023 CG2 VAL A 86 14.784 -6.939 0.850 1.00 0.40 C ATOM 0 H VAL A 86 13.570 -4.918 2.969 1.00 0.61 H new ATOM 0 HA VAL A 86 12.981 -5.345 0.190 1.00 0.52 H new ATOM 0 HB VAL A 86 13.503 -7.033 2.609 1.00 0.55 H new ATOM 0 HG11 VAL A 86 13.208 -9.102 1.269 1.00 0.80 H new ATOM 0 HG12 VAL A 86 11.666 -8.237 1.476 1.00 0.80 H new ATOM 0 HG13 VAL A 86 12.542 -8.136 -0.070 1.00 0.80 H new ATOM 0 HG21 VAL A 86 15.322 -7.858 1.083 1.00 0.40 H new ATOM 0 HG22 VAL A 86 14.657 -6.856 -0.229 1.00 0.40 H new ATOM 0 HG23 VAL A 86 15.352 -6.083 1.215 1.00 0.40 H new ATOM 1033 N LYS A 87 10.549 -5.973 2.343 1.00 0.54 N ATOM 1034 CA LYS A 87 9.075 -6.175 2.391 1.00 0.50 C ATOM 1035 C LYS A 87 8.365 -4.964 1.776 1.00 0.46 C ATOM 1036 O LYS A 87 7.214 -5.040 1.399 1.00 0.50 O ATOM 1037 CB LYS A 87 8.631 -6.341 3.845 1.00 0.58 C ATOM 1038 CG LYS A 87 7.819 -7.630 3.987 1.00 0.90 C ATOM 1039 CD LYS A 87 8.705 -8.832 3.655 1.00 0.35 C ATOM 1040 CE LYS A 87 9.161 -9.500 4.953 1.00 1.21 C ATOM 1041 NZ LYS A 87 8.417 -10.778 5.149 1.00 1.18 N ATOM 0 H LYS A 87 11.014 -5.931 3.250 1.00 0.54 H new ATOM 0 HA LYS A 87 8.816 -7.070 1.825 1.00 0.50 H new ATOM 0 HB2 LYS A 87 9.501 -6.373 4.501 1.00 0.58 H new ATOM 0 HB3 LYS A 87 8.031 -5.485 4.153 1.00 0.58 H new ATOM 0 HG2 LYS A 87 7.433 -7.719 5.003 1.00 0.90 H new ATOM 0 HG3 LYS A 87 6.957 -7.605 3.320 1.00 0.90 H new ATOM 0 HD2 LYS A 87 8.155 -9.544 3.040 1.00 0.35 H new ATOM 0 HD3 LYS A 87 9.570 -8.511 3.075 1.00 0.35 H new ATOM 0 HE2 LYS A 87 10.233 -9.694 4.916 1.00 1.21 H new ATOM 0 HE3 LYS A 87 8.986 -8.833 5.797 1.00 1.21 H new ATOM 0 HZ1 LYS A 87 8.729 -11.230 6.032 1.00 1.18 H new ATOM 0 HZ2 LYS A 87 7.397 -10.581 5.203 1.00 1.18 H new ATOM 0 HZ3 LYS A 87 8.605 -11.415 4.349 1.00 1.18 H new ATOM 1055 N ILE A 88 9.037 -3.847 1.670 1.00 0.43 N ATOM 1056 CA ILE A 88 8.382 -2.644 1.078 1.00 0.45 C ATOM 1057 C ILE A 88 8.369 -2.765 -0.446 1.00 0.42 C ATOM 1058 O ILE A 88 7.415 -2.387 -1.091 1.00 0.47 O ATOM 1059 CB ILE A 88 9.144 -1.379 1.480 1.00 0.54 C ATOM 1060 CG1 ILE A 88 9.314 -1.333 3.003 1.00 0.22 C ATOM 1061 CG2 ILE A 88 8.363 -0.147 1.019 1.00 0.80 C ATOM 1062 CD1 ILE A 88 7.946 -1.431 3.685 1.00 0.57 C ATOM 0 H ILE A 88 10.004 -3.716 1.966 1.00 0.43 H new ATOM 0 HA ILE A 88 7.359 -2.579 1.450 1.00 0.45 H new ATOM 0 HB ILE A 88 10.127 -1.389 1.010 1.00 0.54 H new ATOM 0 HG12 ILE A 88 9.953 -2.153 3.331 1.00 0.22 H new ATOM 0 HG13 ILE A 88 9.809 -0.407 3.294 1.00 0.22 H new ATOM 0 HG21 ILE A 88 8.904 0.755 1.305 1.00 0.80 H new ATOM 0 HG22 ILE A 88 8.248 -0.173 -0.065 1.00 0.80 H new ATOM 0 HG23 ILE A 88 7.379 -0.143 1.488 1.00 0.80 H new ATOM 0 HD11 ILE A 88 8.076 -1.398 4.767 1.00 0.57 H new ATOM 0 HD12 ILE A 88 7.321 -0.596 3.368 1.00 0.57 H new ATOM 0 HD13 ILE A 88 7.467 -2.369 3.406 1.00 0.57 H new ATOM 1074 N ILE A 89 9.405 -3.303 -1.030 1.00 0.39 N ATOM 1075 CA ILE A 89 9.412 -3.461 -2.512 1.00 0.39 C ATOM 1076 C ILE A 89 8.458 -4.596 -2.844 1.00 0.27 C ATOM 1077 O ILE A 89 7.586 -4.493 -3.684 1.00 0.46 O ATOM 1078 CB ILE A 89 10.818 -3.833 -2.979 1.00 0.42 C ATOM 1079 CG1 ILE A 89 11.785 -2.694 -2.635 1.00 0.67 C ATOM 1080 CG2 ILE A 89 10.812 -4.064 -4.493 1.00 0.48 C ATOM 1081 CD1 ILE A 89 13.181 -3.023 -3.167 1.00 0.50 C ATOM 0 H ILE A 89 10.240 -3.637 -0.550 1.00 0.39 H new ATOM 0 HA ILE A 89 9.111 -2.536 -3.004 1.00 0.39 H new ATOM 0 HB ILE A 89 11.139 -4.746 -2.478 1.00 0.42 H new ATOM 0 HG12 ILE A 89 11.431 -1.760 -3.070 1.00 0.67 H new ATOM 0 HG13 ILE A 89 11.822 -2.549 -1.555 1.00 0.67 H new ATOM 0 HG21 ILE A 89 11.816 -4.329 -4.825 1.00 0.48 H new ATOM 0 HG22 ILE A 89 10.124 -4.874 -4.735 1.00 0.48 H new ATOM 0 HG23 ILE A 89 10.492 -3.153 -4.999 1.00 0.48 H new ATOM 0 HD11 ILE A 89 13.865 -2.211 -2.920 1.00 0.50 H new ATOM 0 HD12 ILE A 89 13.536 -3.947 -2.711 1.00 0.50 H new ATOM 0 HD13 ILE A 89 13.138 -3.145 -4.249 1.00 0.50 H new ATOM 1093 N THR A 90 8.624 -5.672 -2.143 1.00 0.30 N ATOM 1094 CA THR A 90 7.757 -6.857 -2.322 1.00 0.51 C ATOM 1095 C THR A 90 6.328 -6.477 -1.931 1.00 0.41 C ATOM 1096 O THR A 90 5.368 -7.079 -2.369 1.00 0.60 O ATOM 1097 CB THR A 90 8.260 -7.971 -1.395 1.00 0.83 C ATOM 1098 OG1 THR A 90 9.631 -7.767 -1.090 1.00 1.91 O ATOM 1099 CG2 THR A 90 8.102 -9.320 -2.076 1.00 0.79 C ATOM 0 H THR A 90 9.347 -5.782 -1.432 1.00 0.30 H new ATOM 0 HA THR A 90 7.778 -7.198 -3.357 1.00 0.51 H new ATOM 0 HB THR A 90 7.674 -7.951 -0.476 1.00 0.83 H new ATOM 0 HG1 THR A 90 9.708 -7.191 -0.301 1.00 1.91 H new ATOM 0 HG21 THR A 90 8.461 -10.107 -1.413 1.00 0.79 H new ATOM 0 HG22 THR A 90 7.050 -9.491 -2.306 1.00 0.79 H new ATOM 0 HG23 THR A 90 8.681 -9.332 -2.999 1.00 0.79 H new ATOM 1107 N GLY A 91 6.186 -5.476 -1.102 1.00 0.24 N ATOM 1108 CA GLY A 91 4.831 -5.042 -0.668 1.00 0.27 C ATOM 1109 C GLY A 91 4.337 -3.893 -1.553 1.00 0.18 C ATOM 1110 O GLY A 91 3.176 -3.542 -1.533 1.00 0.20 O ATOM 0 H GLY A 91 6.957 -4.939 -0.706 1.00 0.24 H new ATOM 0 HA2 GLY A 91 4.136 -5.880 -0.726 1.00 0.27 H new ATOM 0 HA3 GLY A 91 4.859 -4.723 0.374 1.00 0.27 H new ATOM 1114 N LEU A 92 5.205 -3.298 -2.325 1.00 0.31 N ATOM 1115 CA LEU A 92 4.768 -2.171 -3.194 1.00 0.30 C ATOM 1116 C LEU A 92 4.235 -2.715 -4.522 1.00 0.30 C ATOM 1117 O LEU A 92 3.391 -2.111 -5.148 1.00 0.27 O ATOM 1118 CB LEU A 92 5.955 -1.247 -3.471 1.00 0.42 C ATOM 1119 CG LEU A 92 6.176 -0.317 -2.279 1.00 0.43 C ATOM 1120 CD1 LEU A 92 7.651 0.085 -2.216 1.00 0.74 C ATOM 1121 CD2 LEU A 92 5.312 0.935 -2.443 1.00 0.55 C ATOM 0 H LEU A 92 6.193 -3.543 -2.391 1.00 0.31 H new ATOM 0 HA LEU A 92 3.980 -1.616 -2.686 1.00 0.30 H new ATOM 0 HB2 LEU A 92 6.852 -1.838 -3.654 1.00 0.42 H new ATOM 0 HB3 LEU A 92 5.769 -0.661 -4.371 1.00 0.42 H new ATOM 0 HG LEU A 92 5.899 -0.831 -1.359 1.00 0.43 H new ATOM 0 HD11 LEU A 92 7.811 0.749 -1.366 1.00 0.74 H new ATOM 0 HD12 LEU A 92 8.267 -0.807 -2.101 1.00 0.74 H new ATOM 0 HD13 LEU A 92 7.927 0.600 -3.136 1.00 0.74 H new ATOM 0 HD21 LEU A 92 5.469 1.599 -1.593 1.00 0.55 H new ATOM 0 HD22 LEU A 92 5.589 1.451 -3.362 1.00 0.55 H new ATOM 0 HD23 LEU A 92 4.261 0.648 -2.490 1.00 0.55 H new ATOM 1133 N LEU A 93 4.717 -3.851 -4.957 1.00 0.36 N ATOM 1134 CA LEU A 93 4.218 -4.422 -6.243 1.00 0.38 C ATOM 1135 C LEU A 93 2.781 -4.902 -6.026 1.00 0.34 C ATOM 1136 O LEU A 93 1.862 -4.512 -6.728 1.00 0.32 O ATOM 1137 CB LEU A 93 5.104 -5.598 -6.671 1.00 0.45 C ATOM 1138 CG LEU A 93 6.574 -5.176 -6.611 1.00 0.45 C ATOM 1139 CD1 LEU A 93 7.358 -6.169 -5.751 1.00 0.85 C ATOM 1140 CD2 LEU A 93 7.159 -5.159 -8.026 1.00 0.78 C ATOM 0 H LEU A 93 5.430 -4.404 -4.481 1.00 0.36 H new ATOM 0 HA LEU A 93 4.247 -3.666 -7.027 1.00 0.38 H new ATOM 0 HB2 LEU A 93 4.933 -6.453 -6.017 1.00 0.45 H new ATOM 0 HB3 LEU A 93 4.846 -5.913 -7.682 1.00 0.45 H new ATOM 0 HG LEU A 93 6.646 -4.180 -6.174 1.00 0.45 H new ATOM 0 HD11 LEU A 93 8.405 -5.867 -5.709 1.00 0.85 H new ATOM 0 HD12 LEU A 93 6.944 -6.183 -4.743 1.00 0.85 H new ATOM 0 HD13 LEU A 93 7.285 -7.165 -6.187 1.00 0.85 H new ATOM 0 HD21 LEU A 93 8.206 -4.858 -7.983 1.00 0.78 H new ATOM 0 HD22 LEU A 93 7.085 -6.155 -8.462 1.00 0.78 H new ATOM 0 HD23 LEU A 93 6.603 -4.451 -8.641 1.00 0.78 H new ATOM 1152 N GLU A 94 2.571 -5.723 -5.032 1.00 0.32 N ATOM 1153 CA GLU A 94 1.192 -6.193 -4.742 1.00 0.29 C ATOM 1154 C GLU A 94 0.356 -4.960 -4.409 1.00 0.22 C ATOM 1155 O GLU A 94 -0.750 -4.792 -4.880 1.00 0.19 O ATOM 1156 CB GLU A 94 1.210 -7.148 -3.546 1.00 0.27 C ATOM 1157 CG GLU A 94 1.603 -8.552 -4.015 1.00 0.40 C ATOM 1158 CD GLU A 94 0.351 -9.422 -4.172 1.00 1.10 C ATOM 1159 OE1 GLU A 94 -0.695 -9.022 -3.691 1.00 1.44 O ATOM 1160 OE2 GLU A 94 0.463 -10.478 -4.772 1.00 1.66 O ATOM 0 H GLU A 94 3.295 -6.086 -4.412 1.00 0.32 H new ATOM 0 HA GLU A 94 0.775 -6.725 -5.597 1.00 0.29 H new ATOM 0 HB2 GLU A 94 1.916 -6.793 -2.795 1.00 0.27 H new ATOM 0 HB3 GLU A 94 0.228 -7.173 -3.073 1.00 0.27 H new ATOM 0 HG2 GLU A 94 2.135 -8.492 -4.964 1.00 0.40 H new ATOM 0 HG3 GLU A 94 2.284 -9.007 -3.296 1.00 0.40 H new ATOM 1167 N PHE A 95 0.905 -4.074 -3.621 1.00 0.21 N ATOM 1168 CA PHE A 95 0.175 -2.823 -3.276 1.00 0.16 C ATOM 1169 C PHE A 95 -0.212 -2.120 -4.572 1.00 0.17 C ATOM 1170 O PHE A 95 -1.213 -1.447 -4.655 1.00 0.16 O ATOM 1171 CB PHE A 95 1.105 -1.899 -2.490 1.00 0.15 C ATOM 1172 CG PHE A 95 0.964 -2.140 -1.007 1.00 0.18 C ATOM 1173 CD1 PHE A 95 0.723 -3.429 -0.517 1.00 0.79 C ATOM 1174 CD2 PHE A 95 1.089 -1.066 -0.121 1.00 0.39 C ATOM 1175 CE1 PHE A 95 0.607 -3.643 0.858 1.00 0.85 C ATOM 1176 CE2 PHE A 95 0.972 -1.278 1.254 1.00 0.34 C ATOM 1177 CZ PHE A 95 0.731 -2.567 1.747 1.00 0.32 C ATOM 0 H PHE A 95 1.830 -4.165 -3.201 1.00 0.21 H new ATOM 0 HA PHE A 95 -0.708 -3.059 -2.682 1.00 0.16 H new ATOM 0 HB2 PHE A 95 2.138 -2.069 -2.795 1.00 0.15 H new ATOM 0 HB3 PHE A 95 0.872 -0.859 -2.719 1.00 0.15 H new ATOM 0 HD1 PHE A 95 0.627 -4.258 -1.202 1.00 0.79 H new ATOM 0 HD2 PHE A 95 1.276 -0.072 -0.500 1.00 0.39 H new ATOM 0 HE1 PHE A 95 0.422 -4.638 1.236 1.00 0.85 H new ATOM 0 HE2 PHE A 95 1.067 -0.448 1.938 1.00 0.34 H new ATOM 0 HZ PHE A 95 0.641 -2.731 2.811 1.00 0.32 H new ATOM 1187 N GLU A 96 0.599 -2.276 -5.582 1.00 0.20 N ATOM 1188 CA GLU A 96 0.319 -1.623 -6.889 1.00 0.20 C ATOM 1189 C GLU A 96 -0.978 -2.172 -7.467 1.00 0.21 C ATOM 1190 O GLU A 96 -1.786 -1.436 -7.982 1.00 0.17 O ATOM 1191 CB GLU A 96 1.469 -1.901 -7.855 1.00 0.23 C ATOM 1192 CG GLU A 96 1.655 -0.700 -8.784 1.00 0.46 C ATOM 1193 CD GLU A 96 0.366 -0.458 -9.571 1.00 1.27 C ATOM 1194 OE1 GLU A 96 0.222 -1.048 -10.630 1.00 1.32 O ATOM 1195 OE2 GLU A 96 -0.456 0.312 -9.103 1.00 2.20 O ATOM 0 H GLU A 96 1.452 -2.834 -5.556 1.00 0.20 H new ATOM 0 HA GLU A 96 0.221 -0.547 -6.743 1.00 0.20 H new ATOM 0 HB2 GLU A 96 2.387 -2.090 -7.299 1.00 0.23 H new ATOM 0 HB3 GLU A 96 1.259 -2.797 -8.439 1.00 0.23 H new ATOM 0 HG2 GLU A 96 1.911 0.186 -8.203 1.00 0.46 H new ATOM 0 HG3 GLU A 96 2.483 -0.882 -9.469 1.00 0.46 H new ATOM 1202 N VAL A 97 -1.191 -3.458 -7.391 1.00 0.26 N ATOM 1203 CA VAL A 97 -2.460 -4.016 -7.943 1.00 0.28 C ATOM 1204 C VAL A 97 -3.639 -3.389 -7.178 1.00 0.25 C ATOM 1205 O VAL A 97 -4.588 -2.898 -7.762 1.00 0.26 O ATOM 1206 CB VAL A 97 -2.455 -5.560 -7.831 1.00 0.35 C ATOM 1207 CG1 VAL A 97 -3.096 -6.043 -6.520 1.00 0.78 C ATOM 1208 CG2 VAL A 97 -3.231 -6.146 -9.010 1.00 0.17 C ATOM 0 H VAL A 97 -0.553 -4.138 -6.978 1.00 0.26 H new ATOM 0 HA VAL A 97 -2.559 -3.773 -9.001 1.00 0.28 H new ATOM 0 HB VAL A 97 -1.418 -5.895 -7.841 1.00 0.35 H new ATOM 0 HG11 VAL A 97 -3.072 -7.132 -6.483 1.00 0.78 H new ATOM 0 HG12 VAL A 97 -2.542 -5.638 -5.673 1.00 0.78 H new ATOM 0 HG13 VAL A 97 -4.130 -5.702 -6.473 1.00 0.78 H new ATOM 0 HG21 VAL A 97 -3.233 -7.234 -8.940 1.00 0.17 H new ATOM 0 HG22 VAL A 97 -4.257 -5.779 -8.989 1.00 0.17 H new ATOM 0 HG23 VAL A 97 -2.757 -5.844 -9.944 1.00 0.17 H new ATOM 1218 N TYR A 98 -3.570 -3.381 -5.873 1.00 0.34 N ATOM 1219 CA TYR A 98 -4.667 -2.762 -5.077 1.00 0.30 C ATOM 1220 C TYR A 98 -4.698 -1.259 -5.372 1.00 0.21 C ATOM 1221 O TYR A 98 -5.702 -0.593 -5.185 1.00 0.23 O ATOM 1222 CB TYR A 98 -4.409 -2.977 -3.585 1.00 0.38 C ATOM 1223 CG TYR A 98 -4.214 -4.447 -3.304 1.00 0.22 C ATOM 1224 CD1 TYR A 98 -5.323 -5.296 -3.202 1.00 0.31 C ATOM 1225 CD2 TYR A 98 -2.923 -4.959 -3.135 1.00 0.10 C ATOM 1226 CE1 TYR A 98 -5.139 -6.658 -2.933 1.00 0.29 C ATOM 1227 CE2 TYR A 98 -2.738 -6.319 -2.864 1.00 0.15 C ATOM 1228 CZ TYR A 98 -3.845 -7.169 -2.762 1.00 0.23 C ATOM 1229 OH TYR A 98 -3.661 -8.508 -2.485 1.00 0.37 O ATOM 0 H TYR A 98 -2.804 -3.775 -5.327 1.00 0.34 H new ATOM 0 HA TYR A 98 -5.619 -3.220 -5.345 1.00 0.30 H new ATOM 0 HB2 TYR A 98 -3.526 -2.418 -3.276 1.00 0.38 H new ATOM 0 HB3 TYR A 98 -5.248 -2.595 -3.003 1.00 0.38 H new ATOM 0 HD1 TYR A 98 -6.320 -4.901 -3.331 1.00 0.31 H new ATOM 0 HD2 TYR A 98 -2.068 -4.304 -3.214 1.00 0.10 H new ATOM 0 HE1 TYR A 98 -5.993 -7.314 -2.857 1.00 0.29 H new ATOM 0 HE2 TYR A 98 -1.741 -6.713 -2.734 1.00 0.15 H new ATOM 0 HH TYR A 98 -2.787 -8.795 -2.823 1.00 0.37 H new ATOM 1239 N LEU A 99 -3.611 -0.721 -5.862 1.00 0.21 N ATOM 1240 CA LEU A 99 -3.588 0.723 -6.196 1.00 0.25 C ATOM 1241 C LEU A 99 -4.373 0.885 -7.484 1.00 0.25 C ATOM 1242 O LEU A 99 -5.061 1.861 -7.693 1.00 0.34 O ATOM 1243 CB LEU A 99 -2.147 1.196 -6.389 1.00 0.34 C ATOM 1244 CG LEU A 99 -1.488 1.386 -5.024 1.00 0.36 C ATOM 1245 CD1 LEU A 99 0.033 1.335 -5.176 1.00 0.61 C ATOM 1246 CD2 LEU A 99 -1.898 2.739 -4.451 1.00 0.31 C ATOM 0 H LEU A 99 -2.742 -1.224 -6.043 1.00 0.21 H new ATOM 0 HA LEU A 99 -4.025 1.319 -5.395 1.00 0.25 H new ATOM 0 HB2 LEU A 99 -1.589 0.467 -6.976 1.00 0.34 H new ATOM 0 HB3 LEU A 99 -2.132 2.133 -6.946 1.00 0.34 H new ATOM 0 HG LEU A 99 -1.809 0.591 -4.351 1.00 0.36 H new ATOM 0 HD11 LEU A 99 0.501 1.471 -4.201 1.00 0.61 H new ATOM 0 HD12 LEU A 99 0.325 0.369 -5.587 1.00 0.61 H new ATOM 0 HD13 LEU A 99 0.358 2.129 -5.848 1.00 0.61 H new ATOM 0 HD21 LEU A 99 -1.430 2.878 -3.477 1.00 0.31 H new ATOM 0 HD22 LEU A 99 -1.576 3.532 -5.125 1.00 0.31 H new ATOM 0 HD23 LEU A 99 -2.982 2.774 -4.341 1.00 0.31 H new ATOM 1258 N GLU A 100 -4.323 -0.117 -8.320 1.00 0.21 N ATOM 1259 CA GLU A 100 -5.111 -0.097 -9.569 1.00 0.29 C ATOM 1260 C GLU A 100 -6.566 0.002 -9.137 1.00 0.36 C ATOM 1261 O GLU A 100 -7.384 0.654 -9.754 1.00 0.46 O ATOM 1262 CB GLU A 100 -4.868 -1.410 -10.317 1.00 0.29 C ATOM 1263 CG GLU A 100 -4.646 -1.135 -11.803 1.00 0.47 C ATOM 1264 CD GLU A 100 -5.995 -0.941 -12.499 1.00 0.41 C ATOM 1265 OE1 GLU A 100 -6.897 -1.717 -12.227 1.00 1.03 O ATOM 1266 OE2 GLU A 100 -6.103 -0.021 -13.293 1.00 0.52 O ATOM 0 H GLU A 100 -3.760 -0.956 -8.182 1.00 0.21 H new ATOM 0 HA GLU A 100 -4.840 0.729 -10.226 1.00 0.29 H new ATOM 0 HB2 GLU A 100 -3.999 -1.920 -9.900 1.00 0.29 H new ATOM 0 HB3 GLU A 100 -5.721 -2.075 -10.186 1.00 0.29 H new ATOM 0 HG2 GLU A 100 -4.029 -0.245 -11.930 1.00 0.47 H new ATOM 0 HG3 GLU A 100 -4.106 -1.965 -12.260 1.00 0.47 H new ATOM 1273 N TYR A 101 -6.865 -0.625 -8.027 1.00 0.32 N ATOM 1274 CA TYR A 101 -8.231 -0.568 -7.467 1.00 0.39 C ATOM 1275 C TYR A 101 -8.604 0.892 -7.250 1.00 0.41 C ATOM 1276 O TYR A 101 -9.630 1.365 -7.698 1.00 0.49 O ATOM 1277 CB TYR A 101 -8.241 -1.289 -6.116 1.00 0.39 C ATOM 1278 CG TYR A 101 -9.391 -2.261 -6.060 1.00 0.36 C ATOM 1279 CD1 TYR A 101 -9.455 -3.314 -6.975 1.00 0.26 C ATOM 1280 CD2 TYR A 101 -10.389 -2.112 -5.089 1.00 0.50 C ATOM 1281 CE1 TYR A 101 -10.518 -4.223 -6.925 1.00 0.22 C ATOM 1282 CE2 TYR A 101 -11.452 -3.019 -5.038 1.00 0.48 C ATOM 1283 CZ TYR A 101 -11.518 -4.075 -5.956 1.00 0.30 C ATOM 1284 OH TYR A 101 -12.568 -4.967 -5.904 1.00 0.29 O ATOM 0 H TYR A 101 -6.204 -1.180 -7.484 1.00 0.32 H new ATOM 0 HA TYR A 101 -8.940 -1.041 -8.147 1.00 0.39 H new ATOM 0 HB2 TYR A 101 -7.299 -1.818 -5.970 1.00 0.39 H new ATOM 0 HB3 TYR A 101 -8.328 -0.563 -5.308 1.00 0.39 H new ATOM 0 HD1 TYR A 101 -8.683 -3.427 -7.722 1.00 0.26 H new ATOM 0 HD2 TYR A 101 -10.338 -1.298 -4.381 1.00 0.50 H new ATOM 0 HE1 TYR A 101 -10.567 -5.037 -7.633 1.00 0.22 H new ATOM 0 HE2 TYR A 101 -12.223 -2.905 -4.290 1.00 0.48 H new ATOM 0 HH TYR A 101 -13.171 -4.720 -5.172 1.00 0.29 H new ATOM 1294 N LEU A 102 -7.775 1.598 -6.540 1.00 0.37 N ATOM 1295 CA LEU A 102 -8.060 3.029 -6.247 1.00 0.42 C ATOM 1296 C LEU A 102 -7.417 3.934 -7.307 1.00 0.52 C ATOM 1297 O LEU A 102 -7.351 5.133 -7.137 1.00 0.61 O ATOM 1298 CB LEU A 102 -7.504 3.388 -4.864 1.00 0.38 C ATOM 1299 CG LEU A 102 -7.721 2.227 -3.882 1.00 0.30 C ATOM 1300 CD1 LEU A 102 -6.415 1.935 -3.146 1.00 0.24 C ATOM 1301 CD2 LEU A 102 -8.804 2.608 -2.877 1.00 0.31 C ATOM 0 H LEU A 102 -6.904 1.243 -6.146 1.00 0.37 H new ATOM 0 HA LEU A 102 -9.139 3.182 -6.263 1.00 0.42 H new ATOM 0 HB2 LEU A 102 -6.440 3.614 -4.940 1.00 0.38 H new ATOM 0 HB3 LEU A 102 -7.995 4.286 -4.489 1.00 0.38 H new ATOM 0 HG LEU A 102 -8.034 1.338 -4.429 1.00 0.30 H new ATOM 0 HD11 LEU A 102 -6.567 1.111 -2.448 1.00 0.24 H new ATOM 0 HD12 LEU A 102 -5.644 1.663 -3.867 1.00 0.24 H new ATOM 0 HD13 LEU A 102 -6.101 2.822 -2.597 1.00 0.24 H new ATOM 0 HD21 LEU A 102 -8.959 1.785 -2.180 1.00 0.31 H new ATOM 0 HD22 LEU A 102 -8.494 3.496 -2.327 1.00 0.31 H new ATOM 0 HD23 LEU A 102 -9.734 2.815 -3.406 1.00 0.31 H new ATOM 1313 N GLN A 103 -6.941 3.386 -8.394 1.00 0.52 N ATOM 1314 CA GLN A 103 -6.310 4.250 -9.437 1.00 0.63 C ATOM 1315 C GLN A 103 -7.288 4.449 -10.599 1.00 0.63 C ATOM 1316 O GLN A 103 -6.898 4.783 -11.700 1.00 0.97 O ATOM 1317 CB GLN A 103 -5.031 3.594 -9.963 1.00 0.95 C ATOM 1318 CG GLN A 103 -4.286 4.583 -10.865 1.00 1.09 C ATOM 1319 CD GLN A 103 -4.016 3.937 -12.225 1.00 0.90 C ATOM 1320 OE1 GLN A 103 -4.564 4.351 -13.228 1.00 1.43 O ATOM 1321 NE2 GLN A 103 -3.187 2.931 -12.304 1.00 1.61 N ATOM 0 H GLN A 103 -6.961 2.388 -8.604 1.00 0.52 H new ATOM 0 HA GLN A 103 -6.062 5.214 -8.993 1.00 0.63 H new ATOM 0 HB2 GLN A 103 -4.395 3.293 -9.131 1.00 0.95 H new ATOM 0 HB3 GLN A 103 -5.276 2.690 -10.520 1.00 0.95 H new ATOM 0 HG2 GLN A 103 -4.877 5.490 -10.993 1.00 1.09 H new ATOM 0 HG3 GLN A 103 -3.346 4.878 -10.399 1.00 1.09 H new ATOM 0 HE21 GLN A 103 -2.726 2.582 -11.463 1.00 1.61 H new ATOM 0 HE22 GLN A 103 -3.000 2.494 -13.206 1.00 1.61 H new ATOM 1330 N ASN A 104 -8.554 4.244 -10.365 1.00 0.79 N ATOM 1331 CA ASN A 104 -9.555 4.419 -11.454 1.00 0.74 C ATOM 1332 C ASN A 104 -10.959 4.356 -10.855 1.00 0.64 C ATOM 1333 O ASN A 104 -11.843 5.096 -11.236 1.00 0.76 O ATOM 1334 CB ASN A 104 -9.387 3.305 -12.491 1.00 0.89 C ATOM 1335 CG ASN A 104 -10.279 3.592 -13.699 1.00 0.28 C ATOM 1336 OD1 ASN A 104 -11.174 2.829 -14.003 1.00 1.27 O ATOM 1337 ND2 ASN A 104 -10.072 4.669 -14.406 1.00 1.42 N ATOM 0 H ASN A 104 -8.940 3.962 -9.464 1.00 0.79 H new ATOM 0 HA ASN A 104 -9.406 5.383 -11.939 1.00 0.74 H new ATOM 0 HB2 ASN A 104 -8.345 3.239 -12.803 1.00 0.89 H new ATOM 0 HB3 ASN A 104 -9.650 2.343 -12.052 1.00 0.89 H new ATOM 0 HD21 ASN A 104 -10.662 4.870 -15.214 1.00 1.42 H new ATOM 0 HD22 ASN A 104 -9.321 5.310 -14.151 1.00 1.42 H new ATOM 1344 N ARG A 105 -11.168 3.478 -9.912 1.00 0.49 N ATOM 1345 CA ARG A 105 -12.509 3.367 -9.278 1.00 0.51 C ATOM 1346 C ARG A 105 -12.919 4.730 -8.716 1.00 0.44 C ATOM 1347 O ARG A 105 -14.087 5.017 -8.545 1.00 0.47 O ATOM 1348 CB ARG A 105 -12.446 2.342 -8.142 1.00 0.47 C ATOM 1349 CG ARG A 105 -13.861 1.885 -7.787 1.00 0.84 C ATOM 1350 CD ARG A 105 -13.846 1.201 -6.418 1.00 0.79 C ATOM 1351 NE ARG A 105 -14.659 1.998 -5.457 1.00 2.24 N ATOM 1352 CZ ARG A 105 -15.474 1.397 -4.634 1.00 2.53 C ATOM 1353 NH1 ARG A 105 -16.322 0.512 -5.082 1.00 1.84 N ATOM 1354 NH2 ARG A 105 -15.442 1.683 -3.361 1.00 3.93 N ATOM 0 H ARG A 105 -10.465 2.832 -9.554 1.00 0.49 H new ATOM 0 HA ARG A 105 -13.241 3.046 -10.019 1.00 0.51 H new ATOM 0 HB2 ARG A 105 -11.841 1.487 -8.443 1.00 0.47 H new ATOM 0 HB3 ARG A 105 -11.964 2.781 -7.268 1.00 0.47 H new ATOM 0 HG2 ARG A 105 -14.538 2.739 -7.772 1.00 0.84 H new ATOM 0 HG3 ARG A 105 -14.234 1.197 -8.546 1.00 0.84 H new ATOM 0 HD2 ARG A 105 -14.247 0.191 -6.500 1.00 0.79 H new ATOM 0 HD3 ARG A 105 -12.822 1.109 -6.056 1.00 0.79 H new ATOM 0 HE ARG A 105 -14.578 3.015 -5.442 1.00 2.24 H new ATOM 0 HH11 ARG A 105 -16.348 0.289 -6.077 1.00 1.84 H new ATOM 0 HH12 ARG A 105 -16.958 0.043 -4.437 1.00 1.84 H new ATOM 0 HH21 ARG A 105 -14.780 2.376 -3.010 1.00 3.93 H new ATOM 0 HH22 ARG A 105 -16.079 1.214 -2.717 1.00 3.93 H new ATOM 1368 N PHE A 106 -11.964 5.574 -8.427 1.00 0.36 N ATOM 1369 CA PHE A 106 -12.295 6.919 -7.876 1.00 0.30 C ATOM 1370 C PHE A 106 -12.571 7.889 -9.028 1.00 0.42 C ATOM 1371 O PHE A 106 -11.703 8.624 -9.453 1.00 0.52 O ATOM 1372 CB PHE A 106 -11.118 7.438 -7.047 1.00 0.19 C ATOM 1373 CG PHE A 106 -11.045 6.685 -5.739 1.00 0.37 C ATOM 1374 CD1 PHE A 106 -10.857 5.296 -5.738 1.00 2.24 C ATOM 1375 CD2 PHE A 106 -11.165 7.374 -4.526 1.00 1.02 C ATOM 1376 CE1 PHE A 106 -10.792 4.599 -4.525 1.00 2.73 C ATOM 1377 CE2 PHE A 106 -11.099 6.677 -3.315 1.00 0.58 C ATOM 1378 CZ PHE A 106 -10.913 5.290 -3.314 1.00 1.38 C ATOM 0 H PHE A 106 -10.968 5.389 -8.549 1.00 0.36 H new ATOM 0 HA PHE A 106 -13.179 6.842 -7.243 1.00 0.30 H new ATOM 0 HB2 PHE A 106 -10.188 7.314 -7.601 1.00 0.19 H new ATOM 0 HB3 PHE A 106 -11.237 8.505 -6.857 1.00 0.19 H new ATOM 0 HD1 PHE A 106 -10.762 4.763 -6.673 1.00 2.24 H new ATOM 0 HD2 PHE A 106 -11.309 8.444 -4.525 1.00 1.02 H new ATOM 0 HE1 PHE A 106 -10.649 3.529 -4.524 1.00 2.73 H new ATOM 0 HE2 PHE A 106 -11.192 7.210 -2.380 1.00 0.58 H new ATOM 0 HZ PHE A 106 -10.863 4.753 -2.378 1.00 1.38 H new ATOM 1388 N GLU A 107 -13.772 7.899 -9.535 1.00 0.50 N ATOM 1389 CA GLU A 107 -14.099 8.821 -10.660 1.00 0.62 C ATOM 1390 C GLU A 107 -14.430 10.214 -10.115 1.00 0.60 C ATOM 1391 O GLU A 107 -14.412 11.192 -10.836 1.00 0.66 O ATOM 1392 CB GLU A 107 -15.302 8.278 -11.433 1.00 0.77 C ATOM 1393 CG GLU A 107 -16.531 8.234 -10.520 1.00 0.42 C ATOM 1394 CD GLU A 107 -17.697 7.577 -11.263 1.00 0.24 C ATOM 1395 OE1 GLU A 107 -17.690 7.610 -12.482 1.00 0.67 O ATOM 1396 OE2 GLU A 107 -18.576 7.052 -10.599 1.00 1.15 O ATOM 0 H GLU A 107 -14.542 7.309 -9.220 1.00 0.50 H new ATOM 0 HA GLU A 107 -13.238 8.892 -11.325 1.00 0.62 H new ATOM 0 HB2 GLU A 107 -15.504 8.909 -12.299 1.00 0.77 H new ATOM 0 HB3 GLU A 107 -15.082 7.279 -11.810 1.00 0.77 H new ATOM 0 HG2 GLU A 107 -16.303 7.675 -9.613 1.00 0.42 H new ATOM 0 HG3 GLU A 107 -16.805 9.243 -10.212 1.00 0.42 H new ATOM 1403 N SER A 108 -14.725 10.316 -8.849 1.00 0.52 N ATOM 1404 CA SER A 108 -15.047 11.649 -8.266 1.00 0.49 C ATOM 1405 C SER A 108 -13.758 12.279 -7.750 1.00 0.42 C ATOM 1406 O SER A 108 -13.477 13.438 -7.984 1.00 0.47 O ATOM 1407 CB SER A 108 -16.035 11.480 -7.113 1.00 0.45 C ATOM 1408 OG SER A 108 -17.246 10.927 -7.610 1.00 0.76 O ATOM 0 H SER A 108 -14.757 9.535 -8.193 1.00 0.52 H new ATOM 0 HA SER A 108 -15.496 12.289 -9.025 1.00 0.49 H new ATOM 0 HB2 SER A 108 -15.611 10.829 -6.348 1.00 0.45 H new ATOM 0 HB3 SER A 108 -16.228 12.443 -6.640 1.00 0.45 H new ATOM 0 HG SER A 108 -17.882 10.816 -6.872 1.00 0.76 H new ATOM 1414 N SER A 109 -12.966 11.510 -7.062 1.00 0.34 N ATOM 1415 CA SER A 109 -11.678 12.035 -6.535 1.00 0.32 C ATOM 1416 C SER A 109 -10.545 11.382 -7.318 1.00 0.38 C ATOM 1417 O SER A 109 -9.487 11.106 -6.791 1.00 0.41 O ATOM 1418 CB SER A 109 -11.546 11.683 -5.053 1.00 0.19 C ATOM 1419 OG SER A 109 -10.825 12.712 -4.389 1.00 0.29 O ATOM 0 H SER A 109 -13.156 10.533 -6.840 1.00 0.34 H new ATOM 0 HA SER A 109 -11.639 13.119 -6.644 1.00 0.32 H new ATOM 0 HB2 SER A 109 -12.533 11.568 -4.605 1.00 0.19 H new ATOM 0 HB3 SER A 109 -11.030 10.729 -4.938 1.00 0.19 H new ATOM 0 HG SER A 109 -10.740 12.490 -3.438 1.00 0.29 H new ATOM 1425 N GLU A 110 -10.776 11.118 -8.577 1.00 0.40 N ATOM 1426 CA GLU A 110 -9.747 10.461 -9.425 1.00 0.47 C ATOM 1427 C GLU A 110 -8.372 11.111 -9.214 1.00 0.49 C ATOM 1428 O GLU A 110 -7.368 10.436 -9.109 1.00 0.48 O ATOM 1429 CB GLU A 110 -10.153 10.600 -10.892 1.00 0.53 C ATOM 1430 CG GLU A 110 -9.120 9.906 -11.775 1.00 0.91 C ATOM 1431 CD GLU A 110 -9.696 9.709 -13.178 1.00 0.77 C ATOM 1432 OE1 GLU A 110 -9.691 10.664 -13.938 1.00 1.53 O ATOM 1433 OE2 GLU A 110 -10.131 8.608 -13.469 1.00 0.16 O ATOM 0 H GLU A 110 -11.649 11.335 -9.058 1.00 0.40 H new ATOM 0 HA GLU A 110 -9.678 9.409 -9.148 1.00 0.47 H new ATOM 0 HB2 GLU A 110 -11.137 10.160 -11.051 1.00 0.53 H new ATOM 0 HB3 GLU A 110 -10.228 11.654 -11.161 1.00 0.53 H new ATOM 0 HG2 GLU A 110 -8.209 10.503 -11.825 1.00 0.91 H new ATOM 0 HG3 GLU A 110 -8.847 8.943 -11.344 1.00 0.91 H new ATOM 1440 N GLU A 111 -8.320 12.414 -9.159 1.00 0.54 N ATOM 1441 CA GLU A 111 -7.010 13.103 -8.963 1.00 0.59 C ATOM 1442 C GLU A 111 -6.296 12.528 -7.735 1.00 0.48 C ATOM 1443 O GLU A 111 -5.157 12.112 -7.808 1.00 0.36 O ATOM 1444 CB GLU A 111 -7.247 14.601 -8.759 1.00 0.72 C ATOM 1445 CG GLU A 111 -7.599 15.250 -10.099 1.00 0.61 C ATOM 1446 CD GLU A 111 -8.564 16.414 -9.864 1.00 1.28 C ATOM 1447 OE1 GLU A 111 -9.674 16.158 -9.427 1.00 1.90 O ATOM 1448 OE2 GLU A 111 -8.175 17.540 -10.126 1.00 1.53 O ATOM 0 H GLU A 111 -9.127 13.032 -9.241 1.00 0.54 H new ATOM 0 HA GLU A 111 -6.388 12.947 -9.845 1.00 0.59 H new ATOM 0 HB2 GLU A 111 -8.054 14.758 -8.044 1.00 0.72 H new ATOM 0 HB3 GLU A 111 -6.355 15.067 -8.340 1.00 0.72 H new ATOM 0 HG2 GLU A 111 -6.694 15.607 -10.591 1.00 0.61 H new ATOM 0 HG3 GLU A 111 -8.054 14.515 -10.763 1.00 0.61 H new ATOM 1455 N GLN A 112 -6.954 12.503 -6.608 1.00 0.54 N ATOM 1456 CA GLN A 112 -6.307 11.957 -5.382 1.00 0.47 C ATOM 1457 C GLN A 112 -5.895 10.505 -5.633 1.00 0.30 C ATOM 1458 O GLN A 112 -4.847 10.062 -5.207 1.00 0.28 O ATOM 1459 CB GLN A 112 -7.295 12.018 -4.214 1.00 0.51 C ATOM 1460 CG GLN A 112 -7.698 13.472 -3.967 1.00 0.60 C ATOM 1461 CD GLN A 112 -6.758 14.094 -2.934 1.00 0.92 C ATOM 1462 OE1 GLN A 112 -5.634 13.658 -2.776 1.00 1.77 O ATOM 1463 NE2 GLN A 112 -7.171 15.104 -2.218 1.00 0.91 N ATOM 0 H GLN A 112 -7.910 12.836 -6.484 1.00 0.54 H new ATOM 0 HA GLN A 112 -5.424 12.548 -5.138 1.00 0.47 H new ATOM 0 HB2 GLN A 112 -8.177 11.417 -4.437 1.00 0.51 H new ATOM 0 HB3 GLN A 112 -6.841 11.597 -3.317 1.00 0.51 H new ATOM 0 HG2 GLN A 112 -7.655 14.036 -4.899 1.00 0.60 H new ATOM 0 HG3 GLN A 112 -8.728 13.520 -3.613 1.00 0.60 H new ATOM 0 HE21 GLN A 112 -8.114 15.471 -2.350 1.00 0.91 H new ATOM 0 HE22 GLN A 112 -6.551 15.527 -1.527 1.00 0.91 H new ATOM 1472 N ALA A 113 -6.710 9.765 -6.331 1.00 0.26 N ATOM 1473 CA ALA A 113 -6.368 8.345 -6.625 1.00 0.21 C ATOM 1474 C ALA A 113 -5.015 8.294 -7.337 1.00 0.24 C ATOM 1475 O ALA A 113 -4.230 7.386 -7.145 1.00 0.10 O ATOM 1476 CB ALA A 113 -7.445 7.749 -7.532 1.00 0.48 C ATOM 0 H ALA A 113 -7.601 10.083 -6.712 1.00 0.26 H new ATOM 0 HA ALA A 113 -6.315 7.774 -5.698 1.00 0.21 H new ATOM 0 HB1 ALA A 113 -7.201 6.710 -7.752 1.00 0.48 H new ATOM 0 HB2 ALA A 113 -8.411 7.797 -7.030 1.00 0.48 H new ATOM 0 HB3 ALA A 113 -7.491 8.315 -8.462 1.00 0.48 H new ATOM 1482 N ARG A 114 -4.740 9.268 -8.161 1.00 0.50 N ATOM 1483 CA ARG A 114 -3.443 9.292 -8.896 1.00 0.61 C ATOM 1484 C ARG A 114 -2.344 9.826 -7.974 1.00 0.61 C ATOM 1485 O ARG A 114 -1.178 9.541 -8.156 1.00 0.67 O ATOM 1486 CB ARG A 114 -3.572 10.212 -10.112 1.00 0.76 C ATOM 1487 CG ARG A 114 -3.358 9.408 -11.397 1.00 0.26 C ATOM 1488 CD ARG A 114 -4.029 10.132 -12.565 1.00 0.47 C ATOM 1489 NE ARG A 114 -2.986 10.740 -13.440 1.00 1.44 N ATOM 1490 CZ ARG A 114 -2.047 9.992 -13.955 1.00 1.76 C ATOM 1491 NH1 ARG A 114 -2.299 8.753 -14.273 1.00 2.25 N ATOM 1492 NH2 ARG A 114 -0.856 10.487 -14.152 1.00 2.93 N ATOM 0 H ARG A 114 -5.361 10.053 -8.358 1.00 0.50 H new ATOM 0 HA ARG A 114 -3.188 8.283 -9.221 1.00 0.61 H new ATOM 0 HB2 ARG A 114 -4.557 10.678 -10.124 1.00 0.76 H new ATOM 0 HB3 ARG A 114 -2.840 11.017 -10.050 1.00 0.76 H new ATOM 0 HG2 ARG A 114 -2.292 9.289 -11.592 1.00 0.26 H new ATOM 0 HG3 ARG A 114 -3.775 8.407 -11.287 1.00 0.26 H new ATOM 0 HD2 ARG A 114 -4.637 9.433 -13.139 1.00 0.47 H new ATOM 0 HD3 ARG A 114 -4.700 10.905 -12.190 1.00 0.47 H new ATOM 0 HE ARG A 114 -3.006 11.741 -13.637 1.00 1.44 H new ATOM 0 HH11 ARG A 114 -3.230 8.366 -14.120 1.00 2.25 H new ATOM 0 HH12 ARG A 114 -1.565 8.170 -14.675 1.00 2.25 H new ATOM 0 HH21 ARG A 114 -0.659 11.457 -13.904 1.00 2.93 H new ATOM 0 HH22 ARG A 114 -0.122 9.904 -14.554 1.00 2.93 H new ATOM 1506 N ALA A 115 -2.705 10.604 -6.993 1.00 0.58 N ATOM 1507 CA ALA A 115 -1.678 11.161 -6.068 1.00 0.66 C ATOM 1508 C ALA A 115 -1.125 10.050 -5.173 1.00 0.57 C ATOM 1509 O ALA A 115 0.010 10.099 -4.741 1.00 0.70 O ATOM 1510 CB ALA A 115 -2.315 12.244 -5.195 1.00 0.69 C ATOM 0 H ALA A 115 -3.666 10.879 -6.791 1.00 0.58 H new ATOM 0 HA ALA A 115 -0.864 11.590 -6.653 1.00 0.66 H new ATOM 0 HB1 ALA A 115 -1.565 12.653 -4.518 1.00 0.69 H new ATOM 0 HB2 ALA A 115 -2.704 13.041 -5.829 1.00 0.69 H new ATOM 0 HB3 ALA A 115 -3.130 11.811 -4.615 1.00 0.69 H new ATOM 1516 N VAL A 116 -1.913 9.049 -4.884 1.00 0.38 N ATOM 1517 CA VAL A 116 -1.418 7.946 -4.011 1.00 0.33 C ATOM 1518 C VAL A 116 -0.767 6.855 -4.876 1.00 0.25 C ATOM 1519 O VAL A 116 0.200 6.233 -4.484 1.00 0.30 O ATOM 1520 CB VAL A 116 -2.587 7.357 -3.206 1.00 0.29 C ATOM 1521 CG1 VAL A 116 -3.532 6.577 -4.126 1.00 0.39 C ATOM 1522 CG2 VAL A 116 -2.036 6.419 -2.131 1.00 0.77 C ATOM 0 H VAL A 116 -2.873 8.948 -5.213 1.00 0.38 H new ATOM 0 HA VAL A 116 -0.675 8.339 -3.317 1.00 0.33 H new ATOM 0 HB VAL A 116 -3.143 8.172 -2.742 1.00 0.29 H new ATOM 0 HG11 VAL A 116 -4.354 6.167 -3.540 1.00 0.39 H new ATOM 0 HG12 VAL A 116 -3.929 7.245 -4.890 1.00 0.39 H new ATOM 0 HG13 VAL A 116 -2.986 5.764 -4.604 1.00 0.39 H new ATOM 0 HG21 VAL A 116 -2.862 5.999 -1.557 1.00 0.77 H new ATOM 0 HG22 VAL A 116 -1.475 5.613 -2.604 1.00 0.77 H new ATOM 0 HG23 VAL A 116 -1.378 6.976 -1.465 1.00 0.77 H new ATOM 1532 N GLN A 117 -1.298 6.617 -6.047 1.00 0.18 N ATOM 1533 CA GLN A 117 -0.724 5.562 -6.933 1.00 0.12 C ATOM 1534 C GLN A 117 0.615 6.028 -7.514 1.00 0.17 C ATOM 1535 O GLN A 117 1.634 5.394 -7.335 1.00 0.27 O ATOM 1536 CB GLN A 117 -1.701 5.276 -8.075 1.00 0.18 C ATOM 1537 CG GLN A 117 -1.449 3.870 -8.621 1.00 0.42 C ATOM 1538 CD GLN A 117 -0.621 3.962 -9.903 1.00 0.77 C ATOM 1539 OE1 GLN A 117 -0.920 4.750 -10.778 1.00 0.81 O ATOM 1540 NE2 GLN A 117 0.417 3.185 -10.053 1.00 1.84 N ATOM 0 H GLN A 117 -2.106 7.109 -6.428 1.00 0.18 H new ATOM 0 HA GLN A 117 -0.560 4.657 -6.349 1.00 0.12 H new ATOM 0 HB2 GLN A 117 -2.728 5.361 -7.719 1.00 0.18 H new ATOM 0 HB3 GLN A 117 -1.576 6.013 -8.868 1.00 0.18 H new ATOM 0 HG2 GLN A 117 -0.924 3.269 -7.879 1.00 0.42 H new ATOM 0 HG3 GLN A 117 -2.397 3.371 -8.823 1.00 0.42 H new ATOM 0 HE21 GLN A 117 0.669 2.523 -9.319 1.00 1.84 H new ATOM 0 HE22 GLN A 117 0.976 3.240 -10.904 1.00 1.84 H new ATOM 1549 N MET A 118 0.623 7.126 -8.217 1.00 0.11 N ATOM 1550 CA MET A 118 1.900 7.621 -8.814 1.00 0.18 C ATOM 1551 C MET A 118 2.994 7.663 -7.741 1.00 0.23 C ATOM 1552 O MET A 118 4.140 7.355 -8.001 1.00 0.26 O ATOM 1553 CB MET A 118 1.684 9.025 -9.379 1.00 0.21 C ATOM 1554 CG MET A 118 0.669 8.963 -10.520 1.00 0.19 C ATOM 1555 SD MET A 118 1.080 10.217 -11.758 1.00 0.95 S ATOM 1556 CE MET A 118 -0.028 11.506 -11.142 1.00 1.84 C ATOM 0 H MET A 118 -0.197 7.703 -8.405 1.00 0.11 H new ATOM 0 HA MET A 118 2.209 6.948 -9.614 1.00 0.18 H new ATOM 0 HB2 MET A 118 1.326 9.693 -8.596 1.00 0.21 H new ATOM 0 HB3 MET A 118 2.628 9.433 -9.739 1.00 0.21 H new ATOM 0 HG2 MET A 118 0.676 7.972 -10.974 1.00 0.19 H new ATOM 0 HG3 MET A 118 -0.337 9.131 -10.136 1.00 0.19 H new ATOM 0 HE1 MET A 118 0.309 12.478 -11.502 1.00 1.84 H new ATOM 0 HE2 MET A 118 -1.040 11.318 -11.500 1.00 1.84 H new ATOM 0 HE3 MET A 118 -0.022 11.500 -10.052 1.00 1.84 H new ATOM 1566 N SER A 119 2.649 8.037 -6.538 1.00 0.31 N ATOM 1567 CA SER A 119 3.673 8.090 -5.457 1.00 0.40 C ATOM 1568 C SER A 119 4.214 6.680 -5.200 1.00 0.30 C ATOM 1569 O SER A 119 5.407 6.468 -5.134 1.00 0.25 O ATOM 1570 CB SER A 119 3.041 8.636 -4.177 1.00 0.58 C ATOM 1571 OG SER A 119 1.785 8.007 -3.970 1.00 2.59 O ATOM 0 H SER A 119 1.706 8.307 -6.259 1.00 0.31 H new ATOM 0 HA SER A 119 4.490 8.744 -5.763 1.00 0.40 H new ATOM 0 HB2 SER A 119 3.697 8.452 -3.326 1.00 0.58 H new ATOM 0 HB3 SER A 119 2.912 9.716 -4.253 1.00 0.58 H new ATOM 0 HG SER A 119 1.630 7.345 -4.676 1.00 2.59 H new ATOM 1577 N THR A 120 3.346 5.713 -5.063 1.00 0.34 N ATOM 1578 CA THR A 120 3.819 4.320 -4.821 1.00 0.40 C ATOM 1579 C THR A 120 4.557 3.807 -6.062 1.00 0.32 C ATOM 1580 O THR A 120 5.283 2.836 -6.004 1.00 0.47 O ATOM 1581 CB THR A 120 2.624 3.414 -4.525 1.00 0.51 C ATOM 1582 OG1 THR A 120 1.843 3.256 -5.704 1.00 1.13 O ATOM 1583 CG2 THR A 120 1.775 4.041 -3.417 1.00 0.47 C ATOM 0 H THR A 120 2.333 5.827 -5.108 1.00 0.34 H new ATOM 0 HA THR A 120 4.496 4.313 -3.967 1.00 0.40 H new ATOM 0 HB THR A 120 2.977 2.436 -4.198 1.00 0.51 H new ATOM 0 HG1 THR A 120 1.775 4.116 -6.169 1.00 1.13 H new ATOM 0 HG21 THR A 120 0.922 3.397 -3.204 1.00 0.47 H new ATOM 0 HG22 THR A 120 2.378 4.154 -2.516 1.00 0.47 H new ATOM 0 HG23 THR A 120 1.419 5.019 -3.741 1.00 0.47 H new ATOM 1591 N LYS A 121 4.398 4.466 -7.179 1.00 0.16 N ATOM 1592 CA LYS A 121 5.111 4.030 -8.407 1.00 0.28 C ATOM 1593 C LYS A 121 6.524 4.598 -8.347 1.00 0.21 C ATOM 1594 O LYS A 121 7.455 4.054 -8.903 1.00 0.41 O ATOM 1595 CB LYS A 121 4.380 4.573 -9.638 1.00 0.39 C ATOM 1596 CG LYS A 121 5.141 4.181 -10.903 1.00 1.63 C ATOM 1597 CD LYS A 121 5.139 2.658 -11.046 1.00 1.09 C ATOM 1598 CE LYS A 121 5.768 2.266 -12.384 1.00 1.82 C ATOM 1599 NZ LYS A 121 4.702 1.791 -13.309 1.00 1.16 N ATOM 0 H LYS A 121 3.804 5.288 -7.291 1.00 0.16 H new ATOM 0 HA LYS A 121 5.143 2.942 -8.473 1.00 0.28 H new ATOM 0 HB2 LYS A 121 3.365 4.176 -9.675 1.00 0.39 H new ATOM 0 HB3 LYS A 121 4.296 5.658 -9.574 1.00 0.39 H new ATOM 0 HG2 LYS A 121 4.677 4.640 -11.776 1.00 1.63 H new ATOM 0 HG3 LYS A 121 6.165 4.551 -10.854 1.00 1.63 H new ATOM 0 HD2 LYS A 121 5.695 2.205 -10.225 1.00 1.09 H new ATOM 0 HD3 LYS A 121 4.119 2.279 -10.988 1.00 1.09 H new ATOM 0 HE2 LYS A 121 6.288 3.120 -12.818 1.00 1.82 H new ATOM 0 HE3 LYS A 121 6.511 1.483 -12.234 1.00 1.82 H new ATOM 0 HZ1 LYS A 121 5.127 1.524 -14.220 1.00 1.16 H new ATOM 0 HZ2 LYS A 121 4.225 0.965 -12.894 1.00 1.16 H new ATOM 0 HZ3 LYS A 121 4.009 2.552 -13.460 1.00 1.16 H new ATOM 1613 N VAL A 122 6.684 5.693 -7.653 1.00 0.14 N ATOM 1614 CA VAL A 122 8.026 6.309 -7.518 1.00 0.24 C ATOM 1615 C VAL A 122 8.826 5.520 -6.481 1.00 0.32 C ATOM 1616 O VAL A 122 10.031 5.429 -6.558 1.00 0.44 O ATOM 1617 CB VAL A 122 7.863 7.755 -7.057 1.00 0.37 C ATOM 1618 CG1 VAL A 122 9.237 8.381 -6.828 1.00 0.48 C ATOM 1619 CG2 VAL A 122 7.119 8.544 -8.135 1.00 0.40 C ATOM 0 H VAL A 122 5.933 6.188 -7.172 1.00 0.14 H new ATOM 0 HA VAL A 122 8.551 6.292 -8.473 1.00 0.24 H new ATOM 0 HB VAL A 122 7.298 7.778 -6.125 1.00 0.37 H new ATOM 0 HG11 VAL A 122 9.116 9.413 -6.499 1.00 0.48 H new ATOM 0 HG12 VAL A 122 9.771 7.817 -6.064 1.00 0.48 H new ATOM 0 HG13 VAL A 122 9.806 8.361 -7.758 1.00 0.48 H new ATOM 0 HG21 VAL A 122 6.999 9.578 -7.812 1.00 0.40 H new ATOM 0 HG22 VAL A 122 7.689 8.518 -9.064 1.00 0.40 H new ATOM 0 HG23 VAL A 122 6.137 8.099 -8.299 1.00 0.40 H new ATOM 1629 N LEU A 123 8.162 4.940 -5.515 1.00 0.28 N ATOM 1630 CA LEU A 123 8.888 4.143 -4.484 1.00 0.41 C ATOM 1631 C LEU A 123 9.286 2.798 -5.093 1.00 0.40 C ATOM 1632 O LEU A 123 10.251 2.179 -4.692 1.00 0.52 O ATOM 1633 CB LEU A 123 7.973 3.896 -3.280 1.00 0.51 C ATOM 1634 CG LEU A 123 8.119 5.033 -2.267 1.00 0.63 C ATOM 1635 CD1 LEU A 123 9.571 5.125 -1.796 1.00 1.12 C ATOM 1636 CD2 LEU A 123 7.710 6.353 -2.918 1.00 0.21 C ATOM 0 H LEU A 123 7.150 4.984 -5.396 1.00 0.28 H new ATOM 0 HA LEU A 123 9.774 4.688 -4.157 1.00 0.41 H new ATOM 0 HB2 LEU A 123 6.937 3.823 -3.610 1.00 0.51 H new ATOM 0 HB3 LEU A 123 8.226 2.945 -2.810 1.00 0.51 H new ATOM 0 HG LEU A 123 7.475 4.834 -1.410 1.00 0.63 H new ATOM 0 HD11 LEU A 123 9.669 5.936 -1.075 1.00 1.12 H new ATOM 0 HD12 LEU A 123 9.861 4.185 -1.326 1.00 1.12 H new ATOM 0 HD13 LEU A 123 10.219 5.319 -2.651 1.00 1.12 H new ATOM 0 HD21 LEU A 123 7.814 7.163 -2.196 1.00 0.21 H new ATOM 0 HD22 LEU A 123 8.351 6.549 -3.778 1.00 0.21 H new ATOM 0 HD23 LEU A 123 6.672 6.291 -3.246 1.00 0.21 H new ATOM 1648 N ILE A 124 8.541 2.344 -6.063 1.00 0.33 N ATOM 1649 CA ILE A 124 8.853 1.043 -6.716 1.00 0.42 C ATOM 1650 C ILE A 124 10.037 1.226 -7.667 1.00 0.41 C ATOM 1651 O ILE A 124 11.010 0.499 -7.618 1.00 0.36 O ATOM 1652 CB ILE A 124 7.622 0.572 -7.500 1.00 0.44 C ATOM 1653 CG1 ILE A 124 6.476 0.295 -6.527 1.00 0.36 C ATOM 1654 CG2 ILE A 124 7.946 -0.708 -8.268 1.00 0.56 C ATOM 1655 CD1 ILE A 124 5.143 0.359 -7.275 1.00 0.68 C ATOM 0 H ILE A 124 7.721 2.824 -6.434 1.00 0.33 H new ATOM 0 HA ILE A 124 9.111 0.299 -5.963 1.00 0.42 H new ATOM 0 HB ILE A 124 7.332 1.351 -8.205 1.00 0.44 H new ATOM 0 HG12 ILE A 124 6.602 -0.687 -6.071 1.00 0.36 H new ATOM 0 HG13 ILE A 124 6.487 1.026 -5.719 1.00 0.36 H new ATOM 0 HG21 ILE A 124 7.065 -1.033 -8.821 1.00 0.56 H new ATOM 0 HG22 ILE A 124 8.762 -0.517 -8.965 1.00 0.56 H new ATOM 0 HG23 ILE A 124 8.243 -1.488 -7.567 1.00 0.56 H new ATOM 0 HD11 ILE A 124 4.326 0.161 -6.581 1.00 0.68 H new ATOM 0 HD12 ILE A 124 5.017 1.350 -7.710 1.00 0.68 H new ATOM 0 HD13 ILE A 124 5.134 -0.389 -8.068 1.00 0.68 H new ATOM 1667 N GLN A 125 9.960 2.197 -8.529 1.00 0.48 N ATOM 1668 CA GLN A 125 11.062 2.440 -9.485 1.00 0.49 C ATOM 1669 C GLN A 125 12.322 2.858 -8.726 1.00 0.50 C ATOM 1670 O GLN A 125 13.422 2.501 -9.092 1.00 0.64 O ATOM 1671 CB GLN A 125 10.630 3.554 -10.428 1.00 0.35 C ATOM 1672 CG GLN A 125 9.951 2.936 -11.650 1.00 0.62 C ATOM 1673 CD GLN A 125 9.943 3.945 -12.801 1.00 0.97 C ATOM 1674 OE1 GLN A 125 9.334 4.992 -12.702 1.00 1.65 O ATOM 1675 NE2 GLN A 125 10.598 3.672 -13.897 1.00 0.76 N ATOM 0 H GLN A 125 9.170 2.838 -8.610 1.00 0.48 H new ATOM 0 HA GLN A 125 11.283 1.534 -10.049 1.00 0.49 H new ATOM 0 HB2 GLN A 125 9.945 4.233 -9.920 1.00 0.35 H new ATOM 0 HB3 GLN A 125 11.494 4.143 -10.735 1.00 0.35 H new ATOM 0 HG2 GLN A 125 10.477 2.030 -11.951 1.00 0.62 H new ATOM 0 HG3 GLN A 125 8.930 2.644 -11.402 1.00 0.62 H new ATOM 0 HE21 GLN A 125 11.109 2.793 -13.980 1.00 0.76 H new ATOM 0 HE22 GLN A 125 10.599 4.337 -14.670 1.00 0.76 H new ATOM 1684 N PHE A 126 12.170 3.611 -7.674 1.00 0.50 N ATOM 1685 CA PHE A 126 13.363 4.049 -6.889 1.00 0.67 C ATOM 1686 C PHE A 126 13.938 2.855 -6.120 1.00 0.85 C ATOM 1687 O PHE A 126 15.026 2.393 -6.387 1.00 1.51 O ATOM 1688 CB PHE A 126 12.952 5.131 -5.886 1.00 0.71 C ATOM 1689 CG PHE A 126 13.126 6.497 -6.504 1.00 0.74 C ATOM 1690 CD1 PHE A 126 12.442 6.830 -7.680 1.00 0.45 C ATOM 1691 CD2 PHE A 126 13.971 7.435 -5.897 1.00 1.16 C ATOM 1692 CE1 PHE A 126 12.605 8.099 -8.249 1.00 0.64 C ATOM 1693 CE2 PHE A 126 14.133 8.704 -6.466 1.00 1.29 C ATOM 1694 CZ PHE A 126 13.450 9.037 -7.642 1.00 1.05 C ATOM 0 H PHE A 126 11.273 3.944 -7.321 1.00 0.50 H new ATOM 0 HA PHE A 126 14.113 4.446 -7.573 1.00 0.67 H new ATOM 0 HB2 PHE A 126 11.914 4.987 -5.587 1.00 0.71 H new ATOM 0 HB3 PHE A 126 13.557 5.051 -4.983 1.00 0.71 H new ATOM 0 HD1 PHE A 126 11.789 6.108 -8.148 1.00 0.45 H new ATOM 0 HD2 PHE A 126 14.498 7.179 -4.990 1.00 1.16 H new ATOM 0 HE1 PHE A 126 12.079 8.355 -9.157 1.00 0.64 H new ATOM 0 HE2 PHE A 126 14.785 9.426 -5.998 1.00 1.29 H new ATOM 0 HZ PHE A 126 13.575 10.016 -8.081 1.00 1.05 H new ATOM 1704 N LEU A 127 13.213 2.355 -5.157 1.00 0.42 N ATOM 1705 CA LEU A 127 13.712 1.199 -4.353 1.00 0.53 C ATOM 1706 C LEU A 127 14.237 0.079 -5.263 1.00 0.67 C ATOM 1707 O LEU A 127 14.998 -0.764 -4.836 1.00 1.18 O ATOM 1708 CB LEU A 127 12.572 0.656 -3.489 1.00 0.45 C ATOM 1709 CG LEU A 127 12.373 1.567 -2.275 1.00 0.41 C ATOM 1710 CD1 LEU A 127 10.997 1.307 -1.659 1.00 1.33 C ATOM 1711 CD2 LEU A 127 13.459 1.274 -1.238 1.00 0.48 C ATOM 0 H LEU A 127 12.291 2.699 -4.890 1.00 0.42 H new ATOM 0 HA LEU A 127 14.532 1.544 -3.723 1.00 0.53 H new ATOM 0 HB2 LEU A 127 11.653 0.604 -4.072 1.00 0.45 H new ATOM 0 HB3 LEU A 127 12.801 -0.358 -3.162 1.00 0.45 H new ATOM 0 HG LEU A 127 12.438 2.609 -2.588 1.00 0.41 H new ATOM 0 HD11 LEU A 127 10.857 1.956 -0.795 1.00 1.33 H new ATOM 0 HD12 LEU A 127 10.223 1.514 -2.398 1.00 1.33 H new ATOM 0 HD13 LEU A 127 10.930 0.265 -1.345 1.00 1.33 H new ATOM 0 HD21 LEU A 127 13.320 1.922 -0.372 1.00 0.48 H new ATOM 0 HD22 LEU A 127 13.392 0.232 -0.926 1.00 0.48 H new ATOM 0 HD23 LEU A 127 14.440 1.460 -1.676 1.00 0.48 H new ATOM 1723 N GLN A 128 13.834 0.045 -6.504 1.00 0.30 N ATOM 1724 CA GLN A 128 14.315 -1.036 -7.411 1.00 0.46 C ATOM 1725 C GLN A 128 15.604 -0.599 -8.120 1.00 0.62 C ATOM 1726 O GLN A 128 16.487 -1.396 -8.361 1.00 0.81 O ATOM 1727 CB GLN A 128 13.236 -1.328 -8.456 1.00 0.58 C ATOM 1728 CG GLN A 128 13.430 -2.738 -9.015 1.00 1.08 C ATOM 1729 CD GLN A 128 13.778 -2.654 -10.503 1.00 1.73 C ATOM 1730 OE1 GLN A 128 14.930 -2.514 -10.863 1.00 2.70 O ATOM 1731 NE2 GLN A 128 12.823 -2.734 -11.388 1.00 1.74 N ATOM 0 H GLN A 128 13.194 0.717 -6.928 1.00 0.30 H new ATOM 0 HA GLN A 128 14.520 -1.931 -6.824 1.00 0.46 H new ATOM 0 HB2 GLN A 128 12.247 -1.237 -8.007 1.00 0.58 H new ATOM 0 HB3 GLN A 128 13.289 -0.596 -9.262 1.00 0.58 H new ATOM 0 HG2 GLN A 128 14.226 -3.249 -8.473 1.00 1.08 H new ATOM 0 HG3 GLN A 128 12.522 -3.324 -8.876 1.00 1.08 H new ATOM 0 HE21 GLN A 128 11.856 -2.852 -11.086 1.00 1.74 H new ATOM 0 HE22 GLN A 128 13.043 -2.679 -12.382 1.00 1.74 H new ATOM 1740 N LYS A 129 15.711 0.655 -8.465 1.00 0.59 N ATOM 1741 CA LYS A 129 16.936 1.136 -9.172 1.00 0.78 C ATOM 1742 C LYS A 129 17.977 1.621 -8.162 1.00 0.79 C ATOM 1743 O LYS A 129 19.081 1.117 -8.104 1.00 0.88 O ATOM 1744 CB LYS A 129 16.566 2.291 -10.102 1.00 0.93 C ATOM 1745 CG LYS A 129 16.191 1.739 -11.477 1.00 1.45 C ATOM 1746 CD LYS A 129 14.864 2.352 -11.925 1.00 1.82 C ATOM 1747 CE LYS A 129 13.773 1.279 -11.895 1.00 3.36 C ATOM 1748 NZ LYS A 129 13.877 0.430 -13.116 1.00 4.41 N ATOM 0 H LYS A 129 15.004 1.369 -8.289 1.00 0.59 H new ATOM 0 HA LYS A 129 17.355 0.311 -9.749 1.00 0.78 H new ATOM 0 HB2 LYS A 129 15.732 2.855 -9.685 1.00 0.93 H new ATOM 0 HB3 LYS A 129 17.404 2.982 -10.192 1.00 0.93 H new ATOM 0 HG2 LYS A 129 16.974 1.970 -12.200 1.00 1.45 H new ATOM 0 HG3 LYS A 129 16.107 0.653 -11.435 1.00 1.45 H new ATOM 0 HD2 LYS A 129 14.593 3.180 -11.270 1.00 1.82 H new ATOM 0 HD3 LYS A 129 14.961 2.760 -12.931 1.00 1.82 H new ATOM 0 HE2 LYS A 129 13.878 0.664 -11.001 1.00 3.36 H new ATOM 0 HE3 LYS A 129 12.790 1.746 -11.847 1.00 3.36 H new ATOM 0 HZ1 LYS A 129 13.136 -0.299 -13.096 1.00 4.41 H new ATOM 0 HZ2 LYS A 129 13.757 1.023 -13.962 1.00 4.41 H new ATOM 0 HZ3 LYS A 129 14.811 -0.026 -13.143 1.00 4.41 H new ATOM 1762 N LYS A 130 17.642 2.614 -7.382 1.00 0.90 N ATOM 1763 CA LYS A 130 18.617 3.156 -6.391 1.00 1.07 C ATOM 1764 C LYS A 130 18.608 2.340 -5.093 1.00 0.92 C ATOM 1765 O LYS A 130 18.813 2.877 -4.023 1.00 1.15 O ATOM 1766 CB LYS A 130 18.265 4.611 -6.074 1.00 1.45 C ATOM 1767 CG LYS A 130 16.887 4.671 -5.409 1.00 1.80 C ATOM 1768 CD LYS A 130 17.029 5.191 -3.975 1.00 1.69 C ATOM 1769 CE LYS A 130 16.458 4.157 -3.001 1.00 1.82 C ATOM 1770 NZ LYS A 130 17.292 4.116 -1.763 1.00 1.21 N ATOM 0 H LYS A 130 16.732 3.075 -7.389 1.00 0.90 H new ATOM 0 HA LYS A 130 19.614 3.094 -6.828 1.00 1.07 H new ATOM 0 HB2 LYS A 130 19.018 5.043 -5.414 1.00 1.45 H new ATOM 0 HB3 LYS A 130 18.265 5.204 -6.989 1.00 1.45 H new ATOM 0 HG2 LYS A 130 16.225 5.323 -5.979 1.00 1.80 H new ATOM 0 HG3 LYS A 130 16.431 3.681 -5.404 1.00 1.80 H new ATOM 0 HD2 LYS A 130 18.078 5.381 -3.747 1.00 1.69 H new ATOM 0 HD3 LYS A 130 16.502 6.139 -3.866 1.00 1.69 H new ATOM 0 HE2 LYS A 130 15.428 4.411 -2.749 1.00 1.82 H new ATOM 0 HE3 LYS A 130 16.438 3.173 -3.470 1.00 1.82 H new ATOM 0 HZ1 LYS A 130 16.804 3.557 -1.034 1.00 1.21 H new ATOM 0 HZ2 LYS A 130 18.211 3.678 -1.978 1.00 1.21 H new ATOM 0 HZ3 LYS A 130 17.443 5.084 -1.414 1.00 1.21 H new ATOM 1784 N ALA A 131 18.402 1.051 -5.165 1.00 0.65 N ATOM 1785 CA ALA A 131 18.424 0.233 -3.919 1.00 0.71 C ATOM 1786 C ALA A 131 19.868 -0.207 -3.640 1.00 0.71 C ATOM 1787 O ALA A 131 20.132 -1.358 -3.352 1.00 0.67 O ATOM 1788 CB ALA A 131 17.536 -1.003 -4.091 1.00 0.57 C ATOM 0 H ALA A 131 18.221 0.534 -6.025 1.00 0.65 H new ATOM 0 HA ALA A 131 18.048 0.826 -3.085 1.00 0.71 H new ATOM 0 HB1 ALA A 131 17.557 -1.596 -3.177 1.00 0.57 H new ATOM 0 HB2 ALA A 131 16.513 -0.690 -4.297 1.00 0.57 H new ATOM 0 HB3 ALA A 131 17.906 -1.604 -4.922 1.00 0.57 H new ATOM 1794 N LYS A 132 20.811 0.703 -3.730 1.00 0.84 N ATOM 1795 CA LYS A 132 22.239 0.343 -3.475 1.00 0.95 C ATOM 1796 C LYS A 132 22.348 -0.461 -2.177 1.00 1.27 C ATOM 1797 O LYS A 132 21.648 -0.205 -1.217 1.00 1.44 O ATOM 1798 CB LYS A 132 23.073 1.621 -3.352 1.00 1.01 C ATOM 1799 CG LYS A 132 22.349 2.624 -2.453 1.00 1.38 C ATOM 1800 CD LYS A 132 23.240 2.975 -1.259 1.00 1.38 C ATOM 1801 CE LYS A 132 22.368 3.440 -0.088 1.00 1.86 C ATOM 1802 NZ LYS A 132 22.399 2.425 1.005 1.00 1.61 N ATOM 0 H LYS A 132 20.650 1.681 -3.970 1.00 0.84 H new ATOM 0 HA LYS A 132 22.610 -0.259 -4.304 1.00 0.95 H new ATOM 0 HB2 LYS A 132 24.054 1.388 -2.937 1.00 1.01 H new ATOM 0 HB3 LYS A 132 23.239 2.055 -4.338 1.00 1.01 H new ATOM 0 HG2 LYS A 132 22.107 3.525 -3.017 1.00 1.38 H new ATOM 0 HG3 LYS A 132 21.406 2.202 -2.105 1.00 1.38 H new ATOM 0 HD2 LYS A 132 23.830 2.107 -0.964 1.00 1.38 H new ATOM 0 HD3 LYS A 132 23.944 3.760 -1.536 1.00 1.38 H new ATOM 0 HE2 LYS A 132 22.727 4.399 0.285 1.00 1.86 H new ATOM 0 HE3 LYS A 132 21.343 3.592 -0.425 1.00 1.86 H new ATOM 0 HZ1 LYS A 132 21.805 2.748 1.795 1.00 1.61 H new ATOM 0 HZ2 LYS A 132 22.036 1.518 0.647 1.00 1.61 H new ATOM 0 HZ3 LYS A 132 23.377 2.300 1.335 1.00 1.61 H new ATOM 1816 N ASN A 133 23.211 -1.436 -2.144 1.00 1.43 N ATOM 1817 CA ASN A 133 23.347 -2.259 -0.912 1.00 1.78 C ATOM 1818 C ASN A 133 21.996 -2.891 -0.593 1.00 1.74 C ATOM 1819 O ASN A 133 21.555 -2.917 0.540 1.00 2.01 O ATOM 1820 CB ASN A 133 23.791 -1.374 0.254 1.00 2.02 C ATOM 1821 CG ASN A 133 25.282 -1.588 0.519 1.00 2.26 C ATOM 1822 OD1 ASN A 133 26.005 -2.045 -0.343 1.00 1.94 O ATOM 1823 ND2 ASN A 133 25.773 -1.275 1.686 1.00 3.08 N ATOM 0 H ASN A 133 23.826 -1.698 -2.914 1.00 1.43 H new ATOM 0 HA ASN A 133 24.093 -3.038 -1.068 1.00 1.78 H new ATOM 0 HB2 ASN A 133 23.599 -0.326 0.023 1.00 2.02 H new ATOM 0 HB3 ASN A 133 23.214 -1.614 1.147 1.00 2.02 H new ATOM 0 HD21 ASN A 133 26.766 -1.414 1.876 1.00 3.08 H new ATOM 0 HD22 ASN A 133 25.164 -0.891 2.409 1.00 3.08 H new ATOM 1830 N LEU A 134 21.337 -3.397 -1.593 1.00 1.44 N ATOM 1831 CA LEU A 134 20.008 -4.029 -1.374 1.00 1.39 C ATOM 1832 C LEU A 134 19.695 -4.961 -2.538 1.00 1.18 C ATOM 1833 O LEU A 134 20.567 -5.364 -3.280 1.00 1.18 O ATOM 1834 CB LEU A 134 18.931 -2.947 -1.281 1.00 1.27 C ATOM 1835 CG LEU A 134 17.988 -3.271 -0.120 1.00 1.39 C ATOM 1836 CD1 LEU A 134 18.300 -2.354 1.064 1.00 1.78 C ATOM 1837 CD2 LEU A 134 16.539 -3.054 -0.564 1.00 1.66 C ATOM 0 H LEU A 134 21.663 -3.401 -2.560 1.00 1.44 H new ATOM 0 HA LEU A 134 20.026 -4.598 -0.444 1.00 1.39 H new ATOM 0 HB2 LEU A 134 19.392 -1.971 -1.129 1.00 1.27 H new ATOM 0 HB3 LEU A 134 18.372 -2.893 -2.215 1.00 1.27 H new ATOM 0 HG LEU A 134 18.126 -4.310 0.179 1.00 1.39 H new ATOM 0 HD11 LEU A 134 17.628 -2.585 1.890 1.00 1.78 H new ATOM 0 HD12 LEU A 134 19.331 -2.508 1.381 1.00 1.78 H new ATOM 0 HD13 LEU A 134 18.163 -1.315 0.765 1.00 1.78 H new ATOM 0 HD21 LEU A 134 15.867 -3.285 0.262 1.00 1.66 H new ATOM 0 HD22 LEU A 134 16.402 -2.015 -0.864 1.00 1.66 H new ATOM 0 HD23 LEU A 134 16.315 -3.708 -1.407 1.00 1.66 H new ATOM 1849 N ASP A 135 18.453 -5.311 -2.696 1.00 1.07 N ATOM 1850 CA ASP A 135 18.073 -6.225 -3.807 1.00 0.97 C ATOM 1851 C ASP A 135 16.987 -5.574 -4.661 1.00 1.22 C ATOM 1852 O ASP A 135 16.621 -4.432 -4.462 1.00 2.63 O ATOM 1853 CB ASP A 135 17.542 -7.536 -3.222 1.00 1.66 C ATOM 1854 CG ASP A 135 18.673 -8.563 -3.149 1.00 2.18 C ATOM 1855 OD1 ASP A 135 19.822 -8.160 -3.233 1.00 2.52 O ATOM 1856 OD2 ASP A 135 18.373 -9.737 -3.009 1.00 2.76 O ATOM 0 H ASP A 135 17.682 -5.004 -2.103 1.00 1.07 H new ATOM 0 HA ASP A 135 18.947 -6.425 -4.427 1.00 0.97 H new ATOM 0 HB2 ASP A 135 17.131 -7.362 -2.228 1.00 1.66 H new ATOM 0 HB3 ASP A 135 16.730 -7.919 -3.840 1.00 1.66 H new ATOM 1861 N ALA A 136 16.451 -6.307 -5.596 1.00 0.45 N ATOM 1862 CA ALA A 136 15.375 -5.766 -6.450 1.00 0.96 C ATOM 1863 C ALA A 136 14.060 -6.390 -6.016 1.00 0.83 C ATOM 1864 O ALA A 136 12.994 -5.869 -6.271 1.00 1.43 O ATOM 1865 CB ALA A 136 15.653 -6.093 -7.917 1.00 1.32 C ATOM 0 H ALA A 136 16.721 -7.269 -5.802 1.00 0.45 H new ATOM 0 HA ALA A 136 15.326 -4.682 -6.345 1.00 0.96 H new ATOM 0 HB1 ALA A 136 14.853 -5.689 -8.538 1.00 1.32 H new ATOM 0 HB2 ALA A 136 16.603 -5.649 -8.215 1.00 1.32 H new ATOM 0 HB3 ALA A 136 15.702 -7.174 -8.046 1.00 1.32 H new ATOM 1871 N ILE A 137 14.146 -7.496 -5.328 1.00 0.31 N ATOM 1872 CA ILE A 137 12.946 -8.176 -4.810 1.00 0.18 C ATOM 1873 C ILE A 137 12.044 -8.713 -5.931 1.00 0.24 C ATOM 1874 O ILE A 137 11.035 -9.333 -5.659 1.00 0.28 O ATOM 1875 CB ILE A 137 12.215 -7.187 -3.894 1.00 0.42 C ATOM 1876 CG1 ILE A 137 12.978 -7.107 -2.571 1.00 0.86 C ATOM 1877 CG2 ILE A 137 10.784 -7.641 -3.628 1.00 0.42 C ATOM 1878 CD1 ILE A 137 14.147 -6.127 -2.709 1.00 0.76 C ATOM 0 H ILE A 137 15.025 -7.961 -5.103 1.00 0.31 H new ATOM 0 HA ILE A 137 13.238 -9.061 -4.244 1.00 0.18 H new ATOM 0 HB ILE A 137 12.174 -6.211 -4.378 1.00 0.42 H new ATOM 0 HG12 ILE A 137 12.310 -6.781 -1.774 1.00 0.86 H new ATOM 0 HG13 ILE A 137 13.349 -8.094 -2.293 1.00 0.86 H new ATOM 0 HG21 ILE A 137 10.289 -6.921 -2.976 1.00 0.42 H new ATOM 0 HG22 ILE A 137 10.242 -7.708 -4.571 1.00 0.42 H new ATOM 0 HG23 ILE A 137 10.796 -8.619 -3.146 1.00 0.42 H new ATOM 0 HD11 ILE A 137 14.689 -6.072 -1.765 1.00 0.76 H new ATOM 0 HD12 ILE A 137 14.820 -6.472 -3.494 1.00 0.76 H new ATOM 0 HD13 ILE A 137 13.765 -5.139 -2.966 1.00 0.76 H new ATOM 1890 N THR A 138 12.391 -8.522 -7.175 1.00 0.94 N ATOM 1891 CA THR A 138 11.538 -9.056 -8.274 1.00 1.19 C ATOM 1892 C THR A 138 10.062 -8.723 -8.005 1.00 0.74 C ATOM 1893 O THR A 138 9.747 -7.774 -7.316 1.00 0.50 O ATOM 1894 CB THR A 138 11.714 -10.576 -8.355 1.00 1.63 C ATOM 1895 OG1 THR A 138 12.846 -10.966 -7.588 1.00 1.85 O ATOM 1896 CG2 THR A 138 11.913 -10.992 -9.814 1.00 2.15 C ATOM 0 H THR A 138 13.226 -8.020 -7.477 1.00 0.94 H new ATOM 0 HA THR A 138 11.838 -8.599 -9.217 1.00 1.19 H new ATOM 0 HB THR A 138 10.824 -11.065 -7.959 1.00 1.63 H new ATOM 0 HG1 THR A 138 12.957 -11.938 -7.639 1.00 1.85 H new ATOM 0 HG21 THR A 138 12.038 -12.073 -9.870 1.00 2.15 H new ATOM 0 HG22 THR A 138 11.042 -10.697 -10.399 1.00 2.15 H new ATOM 0 HG23 THR A 138 12.801 -10.503 -10.214 1.00 2.15 H new ATOM 1904 N THR A 139 9.159 -9.508 -8.524 1.00 0.62 N ATOM 1905 CA THR A 139 7.716 -9.246 -8.278 1.00 0.24 C ATOM 1906 C THR A 139 6.973 -10.590 -8.173 1.00 0.63 C ATOM 1907 O THR A 139 6.603 -11.165 -9.179 1.00 0.16 O ATOM 1908 CB THR A 139 7.149 -8.419 -9.430 1.00 0.48 C ATOM 1909 OG1 THR A 139 5.763 -8.197 -9.217 1.00 1.03 O ATOM 1910 CG2 THR A 139 7.352 -9.159 -10.751 1.00 0.51 C ATOM 0 H THR A 139 9.360 -10.320 -9.108 1.00 0.62 H new ATOM 0 HA THR A 139 7.589 -8.692 -7.348 1.00 0.24 H new ATOM 0 HB THR A 139 7.669 -7.462 -9.474 1.00 0.48 H new ATOM 0 HG1 THR A 139 5.400 -7.665 -9.955 1.00 1.03 H new ATOM 0 HG21 THR A 139 6.945 -8.563 -11.568 1.00 0.51 H new ATOM 0 HG22 THR A 139 8.417 -9.323 -10.916 1.00 0.51 H new ATOM 0 HG23 THR A 139 6.839 -10.120 -10.712 1.00 0.51 H new ATOM 1918 N PRO A 140 6.784 -11.070 -6.958 1.00 1.68 N ATOM 1919 CA PRO A 140 6.098 -12.355 -6.722 1.00 2.30 C ATOM 1920 C PRO A 140 4.586 -12.214 -6.916 1.00 2.62 C ATOM 1921 O PRO A 140 3.980 -11.250 -6.493 1.00 3.04 O ATOM 1922 CB PRO A 140 6.438 -12.685 -5.265 1.00 3.41 C ATOM 1923 CG PRO A 140 6.807 -11.346 -4.588 1.00 3.49 C ATOM 1924 CD PRO A 140 7.222 -10.386 -5.716 1.00 2.37 C ATOM 0 HA PRO A 140 6.412 -13.135 -7.415 1.00 2.30 H new ATOM 0 HB2 PRO A 140 5.590 -13.152 -4.765 1.00 3.41 H new ATOM 0 HB3 PRO A 140 7.268 -13.389 -5.210 1.00 3.41 H new ATOM 0 HG2 PRO A 140 5.960 -10.947 -4.031 1.00 3.49 H new ATOM 0 HG3 PRO A 140 7.621 -11.483 -3.876 1.00 3.49 H new ATOM 0 HD2 PRO A 140 6.743 -9.413 -5.607 1.00 2.37 H new ATOM 0 HD3 PRO A 140 8.298 -10.213 -5.715 1.00 2.37 H new ATOM 1932 N ASP A 141 3.976 -13.174 -7.557 1.00 2.76 N ATOM 1933 CA ASP A 141 2.510 -13.111 -7.788 1.00 3.55 C ATOM 1934 C ASP A 141 2.145 -11.892 -8.651 1.00 2.87 C ATOM 1935 O ASP A 141 1.249 -11.154 -8.294 1.00 2.39 O ATOM 1936 CB ASP A 141 1.801 -13.000 -6.435 1.00 4.70 C ATOM 1937 CG ASP A 141 0.297 -13.201 -6.619 1.00 5.92 C ATOM 1938 OD1 ASP A 141 -0.389 -12.218 -6.851 1.00 6.47 O ATOM 1939 OD2 ASP A 141 -0.145 -14.334 -6.524 1.00 6.53 O ATOM 0 H ASP A 141 4.436 -14.004 -7.932 1.00 2.76 H new ATOM 0 HA ASP A 141 2.196 -14.014 -8.312 1.00 3.55 H new ATOM 0 HB2 ASP A 141 2.195 -13.747 -5.746 1.00 4.70 H new ATOM 0 HB3 ASP A 141 1.995 -12.023 -5.992 1.00 4.70 H new ATOM 1944 N PRO A 142 2.824 -11.705 -9.769 1.00 3.01 N ATOM 1945 CA PRO A 142 2.531 -10.575 -10.665 1.00 2.74 C ATOM 1946 C PRO A 142 1.328 -10.922 -11.544 1.00 2.21 C ATOM 1947 O PRO A 142 0.290 -10.296 -11.474 1.00 2.26 O ATOM 1948 CB PRO A 142 3.793 -10.450 -11.520 1.00 3.46 C ATOM 1949 CG PRO A 142 4.479 -11.836 -11.486 1.00 3.88 C ATOM 1950 CD PRO A 142 3.929 -12.572 -10.250 1.00 3.70 C ATOM 0 HA PRO A 142 2.291 -9.653 -10.135 1.00 2.74 H new ATOM 0 HB2 PRO A 142 3.544 -10.164 -12.542 1.00 3.46 H new ATOM 0 HB3 PRO A 142 4.455 -9.679 -11.126 1.00 3.46 H new ATOM 0 HG2 PRO A 142 4.266 -12.396 -12.397 1.00 3.88 H new ATOM 0 HG3 PRO A 142 5.562 -11.730 -11.423 1.00 3.88 H new ATOM 0 HD2 PRO A 142 3.570 -13.568 -10.507 1.00 3.70 H new ATOM 0 HD3 PRO A 142 4.697 -12.697 -9.487 1.00 3.70 H new ATOM 1958 N THR A 143 1.463 -11.931 -12.363 1.00 1.77 N ATOM 1959 CA THR A 143 0.333 -12.339 -13.237 1.00 1.36 C ATOM 1960 C THR A 143 -0.779 -12.892 -12.356 1.00 0.88 C ATOM 1961 O THR A 143 -1.949 -12.734 -12.641 1.00 0.82 O ATOM 1962 CB THR A 143 0.807 -13.413 -14.216 1.00 1.14 C ATOM 1963 OG1 THR A 143 0.970 -14.644 -13.523 1.00 1.14 O ATOM 1964 CG2 THR A 143 2.140 -12.982 -14.827 1.00 1.85 C ATOM 0 H THR A 143 2.311 -12.489 -12.462 1.00 1.77 H new ATOM 0 HA THR A 143 -0.035 -11.485 -13.805 1.00 1.36 H new ATOM 0 HB THR A 143 0.070 -13.543 -15.009 1.00 1.14 H new ATOM 0 HG1 THR A 143 1.272 -15.334 -14.149 1.00 1.14 H new ATOM 0 HG21 THR A 143 2.483 -13.744 -15.526 1.00 1.85 H new ATOM 0 HG22 THR A 143 2.010 -12.037 -15.355 1.00 1.85 H new ATOM 0 HG23 THR A 143 2.879 -12.856 -14.036 1.00 1.85 H new ATOM 1972 N THR A 144 -0.423 -13.515 -11.266 1.00 0.82 N ATOM 1973 CA THR A 144 -1.467 -14.039 -10.353 1.00 0.64 C ATOM 1974 C THR A 144 -2.177 -12.837 -9.733 1.00 0.59 C ATOM 1975 O THR A 144 -3.344 -12.892 -9.399 1.00 0.51 O ATOM 1976 CB THR A 144 -0.822 -14.892 -9.261 1.00 1.11 C ATOM 1977 OG1 THR A 144 -0.191 -16.018 -9.855 1.00 1.49 O ATOM 1978 CG2 THR A 144 -1.896 -15.362 -8.280 1.00 1.31 C ATOM 0 H THR A 144 0.540 -13.681 -10.973 1.00 0.82 H new ATOM 0 HA THR A 144 -2.177 -14.664 -10.895 1.00 0.64 H new ATOM 0 HB THR A 144 -0.079 -14.301 -8.725 1.00 1.11 H new ATOM 0 HG1 THR A 144 0.225 -16.566 -9.157 1.00 1.49 H new ATOM 0 HG21 THR A 144 -1.436 -15.970 -7.501 1.00 1.31 H new ATOM 0 HG22 THR A 144 -2.379 -14.496 -7.827 1.00 1.31 H new ATOM 0 HG23 THR A 144 -2.640 -15.955 -8.812 1.00 1.31 H new ATOM 1986 N ASN A 145 -1.479 -11.735 -9.607 1.00 0.76 N ATOM 1987 CA ASN A 145 -2.108 -10.511 -9.045 1.00 0.73 C ATOM 1988 C ASN A 145 -3.155 -10.015 -10.040 1.00 0.52 C ATOM 1989 O ASN A 145 -4.109 -9.366 -9.677 1.00 0.41 O ATOM 1990 CB ASN A 145 -1.048 -9.426 -8.836 1.00 1.06 C ATOM 1991 CG ASN A 145 -0.874 -9.166 -7.339 1.00 1.27 C ATOM 1992 OD1 ASN A 145 0.236 -9.039 -6.856 1.00 1.59 O ATOM 1993 ND2 ASN A 145 -1.930 -9.078 -6.577 1.00 1.13 N ATOM 0 H ASN A 145 -0.499 -11.635 -9.871 1.00 0.76 H new ATOM 0 HA ASN A 145 -2.570 -10.737 -8.084 1.00 0.73 H new ATOM 0 HB2 ASN A 145 -0.100 -9.739 -9.274 1.00 1.06 H new ATOM 0 HB3 ASN A 145 -1.346 -8.508 -9.343 1.00 1.06 H new ATOM 0 HD21 ASN A 145 -1.825 -8.903 -5.578 1.00 1.13 H new ATOM 0 HD22 ASN A 145 -2.861 -9.184 -6.981 1.00 1.13 H new ATOM 2000 N ALA A 146 -2.984 -10.335 -11.297 1.00 0.65 N ATOM 2001 CA ALA A 146 -3.974 -9.909 -12.322 1.00 0.87 C ATOM 2002 C ALA A 146 -5.296 -10.601 -12.019 1.00 0.84 C ATOM 2003 O ALA A 146 -6.361 -10.055 -12.225 1.00 1.11 O ATOM 2004 CB ALA A 146 -3.474 -10.317 -13.712 1.00 1.10 C ATOM 0 H ALA A 146 -2.197 -10.875 -11.656 1.00 0.65 H new ATOM 0 HA ALA A 146 -4.107 -8.827 -12.302 1.00 0.87 H new ATOM 0 HB1 ALA A 146 -4.198 -10.006 -14.465 1.00 1.10 H new ATOM 0 HB2 ALA A 146 -2.516 -9.836 -13.910 1.00 1.10 H new ATOM 0 HB3 ALA A 146 -3.352 -11.399 -13.752 1.00 1.10 H new ATOM 2010 N SER A 147 -5.233 -11.797 -11.506 1.00 0.66 N ATOM 2011 CA SER A 147 -6.484 -12.518 -11.159 1.00 0.93 C ATOM 2012 C SER A 147 -6.943 -12.045 -9.781 1.00 0.82 C ATOM 2013 O SER A 147 -8.114 -12.056 -9.462 1.00 0.90 O ATOM 2014 CB SER A 147 -6.217 -14.025 -11.129 1.00 1.06 C ATOM 2015 OG SER A 147 -7.215 -14.692 -11.890 1.00 1.67 O ATOM 0 H SER A 147 -4.370 -12.305 -11.313 1.00 0.66 H new ATOM 0 HA SER A 147 -7.256 -12.314 -11.901 1.00 0.93 H new ATOM 0 HB2 SER A 147 -5.229 -14.239 -11.536 1.00 1.06 H new ATOM 0 HB3 SER A 147 -6.224 -14.387 -10.101 1.00 1.06 H new ATOM 0 HG SER A 147 -7.047 -15.657 -11.875 1.00 1.67 H new ATOM 2021 N LEU A 148 -6.028 -11.606 -8.961 1.00 0.65 N ATOM 2022 CA LEU A 148 -6.426 -11.111 -7.619 1.00 0.56 C ATOM 2023 C LEU A 148 -7.187 -9.796 -7.808 1.00 0.55 C ATOM 2024 O LEU A 148 -8.035 -9.444 -7.022 1.00 0.67 O ATOM 2025 CB LEU A 148 -5.170 -10.891 -6.758 1.00 0.38 C ATOM 2026 CG LEU A 148 -5.450 -9.874 -5.641 1.00 0.34 C ATOM 2027 CD1 LEU A 148 -6.626 -10.345 -4.783 1.00 0.56 C ATOM 2028 CD2 LEU A 148 -4.216 -9.730 -4.768 1.00 0.33 C ATOM 0 H LEU A 148 -5.029 -11.570 -9.163 1.00 0.65 H new ATOM 0 HA LEU A 148 -7.063 -11.836 -7.112 1.00 0.56 H new ATOM 0 HB2 LEU A 148 -4.851 -11.838 -6.323 1.00 0.38 H new ATOM 0 HB3 LEU A 148 -4.351 -10.535 -7.384 1.00 0.38 H new ATOM 0 HG LEU A 148 -5.699 -8.912 -6.090 1.00 0.34 H new ATOM 0 HD11 LEU A 148 -6.816 -9.617 -3.994 1.00 0.56 H new ATOM 0 HD12 LEU A 148 -7.514 -10.444 -5.407 1.00 0.56 H new ATOM 0 HD13 LEU A 148 -6.387 -11.310 -4.336 1.00 0.56 H new ATOM 0 HD21 LEU A 148 -4.413 -9.009 -3.975 1.00 0.33 H new ATOM 0 HD22 LEU A 148 -3.968 -10.695 -4.327 1.00 0.33 H new ATOM 0 HD23 LEU A 148 -3.380 -9.383 -5.375 1.00 0.33 H new ATOM 2040 N LEU A 149 -6.893 -9.081 -8.853 1.00 0.53 N ATOM 2041 CA LEU A 149 -7.609 -7.805 -9.106 1.00 0.57 C ATOM 2042 C LEU A 149 -8.945 -8.166 -9.744 1.00 0.78 C ATOM 2043 O LEU A 149 -9.970 -7.581 -9.456 1.00 0.80 O ATOM 2044 CB LEU A 149 -6.765 -6.934 -10.051 1.00 0.60 C ATOM 2045 CG LEU A 149 -7.613 -5.803 -10.645 1.00 0.61 C ATOM 2046 CD1 LEU A 149 -8.196 -4.952 -9.519 1.00 0.75 C ATOM 2047 CD2 LEU A 149 -6.735 -4.928 -11.544 1.00 0.62 C ATOM 0 H LEU A 149 -6.185 -9.326 -9.545 1.00 0.53 H new ATOM 0 HA LEU A 149 -7.773 -7.241 -8.188 1.00 0.57 H new ATOM 0 HB2 LEU A 149 -5.918 -6.514 -9.508 1.00 0.60 H new ATOM 0 HB3 LEU A 149 -6.356 -7.549 -10.853 1.00 0.60 H new ATOM 0 HG LEU A 149 -8.426 -6.230 -11.232 1.00 0.61 H new ATOM 0 HD11 LEU A 149 -8.798 -4.149 -9.944 1.00 0.75 H new ATOM 0 HD12 LEU A 149 -8.821 -5.574 -8.879 1.00 0.75 H new ATOM 0 HD13 LEU A 149 -7.385 -4.524 -8.929 1.00 0.75 H new ATOM 0 HD21 LEU A 149 -7.336 -4.123 -11.967 1.00 0.62 H new ATOM 0 HD22 LEU A 149 -5.922 -4.503 -10.956 1.00 0.62 H new ATOM 0 HD23 LEU A 149 -6.321 -5.534 -12.350 1.00 0.62 H new ATOM 2059 N THR A 150 -8.937 -9.158 -10.590 1.00 0.92 N ATOM 2060 CA THR A 150 -10.195 -9.600 -11.231 1.00 1.11 C ATOM 2061 C THR A 150 -11.045 -10.345 -10.179 1.00 1.06 C ATOM 2062 O THR A 150 -12.192 -10.672 -10.411 1.00 1.13 O ATOM 2063 CB THR A 150 -9.850 -10.497 -12.448 1.00 1.38 C ATOM 2064 OG1 THR A 150 -10.841 -10.326 -13.451 1.00 1.48 O ATOM 2065 CG2 THR A 150 -9.774 -11.980 -12.065 1.00 1.22 C ATOM 0 H THR A 150 -8.105 -9.681 -10.863 1.00 0.92 H new ATOM 0 HA THR A 150 -10.775 -8.753 -11.597 1.00 1.11 H new ATOM 0 HB THR A 150 -8.870 -10.195 -12.818 1.00 1.38 H new ATOM 0 HG1 THR A 150 -10.626 -10.890 -14.223 1.00 1.48 H new ATOM 0 HG21 THR A 150 -9.530 -12.572 -12.947 1.00 1.22 H new ATOM 0 HG22 THR A 150 -9.002 -12.121 -11.309 1.00 1.22 H new ATOM 0 HG23 THR A 150 -10.736 -12.303 -11.666 1.00 1.22 H new ATOM 2073 N LYS A 151 -10.480 -10.611 -9.019 1.00 1.02 N ATOM 2074 CA LYS A 151 -11.239 -11.326 -7.954 1.00 1.04 C ATOM 2075 C LYS A 151 -11.807 -10.316 -6.950 1.00 0.85 C ATOM 2076 O LYS A 151 -12.935 -10.438 -6.516 1.00 0.98 O ATOM 2077 CB LYS A 151 -10.303 -12.293 -7.226 1.00 1.07 C ATOM 2078 CG LYS A 151 -11.089 -13.066 -6.165 1.00 1.15 C ATOM 2079 CD LYS A 151 -10.181 -13.360 -4.968 1.00 1.07 C ATOM 2080 CE LYS A 151 -10.122 -12.131 -4.058 1.00 1.22 C ATOM 2081 NZ LYS A 151 -9.050 -12.314 -3.035 1.00 1.73 N ATOM 0 H LYS A 151 -9.523 -10.360 -8.771 1.00 1.02 H new ATOM 0 HA LYS A 151 -12.060 -11.880 -8.409 1.00 1.04 H new ATOM 0 HB2 LYS A 151 -9.854 -12.986 -7.938 1.00 1.07 H new ATOM 0 HB3 LYS A 151 -9.486 -11.743 -6.759 1.00 1.07 H new ATOM 0 HG2 LYS A 151 -11.954 -12.486 -5.844 1.00 1.15 H new ATOM 0 HG3 LYS A 151 -11.468 -13.998 -6.585 1.00 1.15 H new ATOM 0 HD2 LYS A 151 -10.559 -14.219 -4.413 1.00 1.07 H new ATOM 0 HD3 LYS A 151 -9.180 -13.619 -5.312 1.00 1.07 H new ATOM 0 HE2 LYS A 151 -9.925 -11.237 -4.650 1.00 1.22 H new ATOM 0 HE3 LYS A 151 -11.084 -11.983 -3.568 1.00 1.22 H new ATOM 0 HZ1 LYS A 151 -9.012 -11.477 -2.418 1.00 1.73 H new ATOM 0 HZ2 LYS A 151 -9.257 -13.157 -2.462 1.00 1.73 H new ATOM 0 HZ3 LYS A 151 -8.133 -12.435 -3.511 1.00 1.73 H new ATOM 2095 N LEU A 152 -11.049 -9.311 -6.578 1.00 0.54 N ATOM 2096 CA LEU A 152 -11.583 -8.312 -5.613 1.00 0.37 C ATOM 2097 C LEU A 152 -12.751 -7.601 -6.278 1.00 0.42 C ATOM 2098 O LEU A 152 -13.699 -7.197 -5.635 1.00 0.42 O ATOM 2099 CB LEU A 152 -10.509 -7.272 -5.263 1.00 0.21 C ATOM 2100 CG LEU A 152 -9.205 -7.963 -4.864 1.00 0.47 C ATOM 2101 CD1 LEU A 152 -8.023 -7.161 -5.413 1.00 0.44 C ATOM 2102 CD2 LEU A 152 -9.101 -8.023 -3.339 1.00 0.82 C ATOM 0 H LEU A 152 -10.095 -9.145 -6.899 1.00 0.54 H new ATOM 0 HA LEU A 152 -11.892 -8.817 -4.698 1.00 0.37 H new ATOM 0 HB2 LEU A 152 -10.335 -6.619 -6.118 1.00 0.21 H new ATOM 0 HB3 LEU A 152 -10.858 -6.641 -4.446 1.00 0.21 H new ATOM 0 HG LEU A 152 -9.191 -8.974 -5.271 1.00 0.47 H new ATOM 0 HD11 LEU A 152 -7.090 -7.649 -5.131 1.00 0.44 H new ATOM 0 HD12 LEU A 152 -8.092 -7.109 -6.500 1.00 0.44 H new ATOM 0 HD13 LEU A 152 -8.044 -6.153 -5.000 1.00 0.44 H new ATOM 0 HD21 LEU A 152 -8.171 -8.516 -3.057 1.00 0.82 H new ATOM 0 HD22 LEU A 152 -9.113 -7.011 -2.933 1.00 0.82 H new ATOM 0 HD23 LEU A 152 -9.945 -8.585 -2.939 1.00 0.82 H new ATOM 2114 N GLN A 153 -12.681 -7.439 -7.569 1.00 0.51 N ATOM 2115 CA GLN A 153 -13.779 -6.748 -8.285 1.00 0.65 C ATOM 2116 C GLN A 153 -14.910 -7.735 -8.588 1.00 0.81 C ATOM 2117 O GLN A 153 -16.030 -7.344 -8.854 1.00 0.91 O ATOM 2118 CB GLN A 153 -13.247 -6.160 -9.594 1.00 0.80 C ATOM 2119 CG GLN A 153 -12.642 -4.779 -9.328 1.00 0.79 C ATOM 2120 CD GLN A 153 -13.038 -3.821 -10.453 1.00 1.00 C ATOM 2121 OE1 GLN A 153 -12.190 -3.227 -11.087 1.00 2.26 O ATOM 2122 NE2 GLN A 153 -14.302 -3.643 -10.726 1.00 1.52 N ATOM 0 H GLN A 153 -11.910 -7.756 -8.156 1.00 0.51 H new ATOM 0 HA GLN A 153 -14.165 -5.946 -7.656 1.00 0.65 H new ATOM 0 HB2 GLN A 153 -12.494 -6.822 -10.022 1.00 0.80 H new ATOM 0 HB3 GLN A 153 -14.053 -6.081 -10.323 1.00 0.80 H new ATOM 0 HG2 GLN A 153 -12.992 -4.396 -8.370 1.00 0.79 H new ATOM 0 HG3 GLN A 153 -11.556 -4.852 -9.264 1.00 0.79 H new ATOM 0 HE21 GLN A 153 -15.014 -4.142 -10.193 1.00 1.52 H new ATOM 0 HE22 GLN A 153 -14.578 -3.005 -11.472 1.00 1.52 H new ATOM 2131 N ALA A 154 -14.630 -9.010 -8.556 1.00 0.85 N ATOM 2132 CA ALA A 154 -15.691 -10.014 -8.848 1.00 1.05 C ATOM 2133 C ALA A 154 -16.342 -10.473 -7.541 1.00 0.84 C ATOM 2134 O ALA A 154 -16.675 -11.631 -7.378 1.00 0.78 O ATOM 2135 CB ALA A 154 -15.067 -11.219 -9.553 1.00 1.39 C ATOM 0 H ALA A 154 -13.712 -9.399 -8.340 1.00 0.85 H new ATOM 0 HA ALA A 154 -16.448 -9.563 -9.490 1.00 1.05 H new ATOM 0 HB1 ALA A 154 -15.841 -11.956 -9.768 1.00 1.39 H new ATOM 0 HB2 ALA A 154 -14.605 -10.896 -10.486 1.00 1.39 H new ATOM 0 HB3 ALA A 154 -14.310 -11.666 -8.909 1.00 1.39 H new ATOM 2141 N GLN A 155 -16.526 -9.580 -6.609 1.00 0.91 N ATOM 2142 CA GLN A 155 -17.154 -9.974 -5.315 1.00 0.76 C ATOM 2143 C GLN A 155 -18.463 -9.205 -5.125 1.00 0.57 C ATOM 2144 O GLN A 155 -18.833 -8.377 -5.934 1.00 0.66 O ATOM 2145 CB GLN A 155 -16.201 -9.648 -4.163 1.00 0.61 C ATOM 2146 CG GLN A 155 -14.880 -10.389 -4.369 1.00 0.86 C ATOM 2147 CD GLN A 155 -14.800 -11.570 -3.399 1.00 1.15 C ATOM 2148 OE1 GLN A 155 -15.643 -12.444 -3.419 1.00 1.53 O ATOM 2149 NE2 GLN A 155 -13.814 -11.633 -2.546 1.00 1.05 N ATOM 0 H GLN A 155 -16.270 -8.596 -6.686 1.00 0.91 H new ATOM 0 HA GLN A 155 -17.360 -11.044 -5.325 1.00 0.76 H new ATOM 0 HB2 GLN A 155 -16.024 -8.573 -4.116 1.00 0.61 H new ATOM 0 HB3 GLN A 155 -16.649 -9.939 -3.213 1.00 0.61 H new ATOM 0 HG2 GLN A 155 -14.806 -10.744 -5.397 1.00 0.86 H new ATOM 0 HG3 GLN A 155 -14.042 -9.712 -4.204 1.00 0.86 H new ATOM 0 HE21 GLN A 155 -13.106 -10.899 -2.530 1.00 1.05 H new ATOM 0 HE22 GLN A 155 -13.751 -12.417 -1.896 1.00 1.05 H new ATOM 2158 N ASN A 156 -19.167 -9.472 -4.058 1.00 0.36 N ATOM 2159 CA ASN A 156 -20.450 -8.756 -3.814 1.00 0.36 C ATOM 2160 C ASN A 156 -20.152 -7.296 -3.466 1.00 0.36 C ATOM 2161 O ASN A 156 -19.028 -6.934 -3.179 1.00 0.43 O ATOM 2162 CB ASN A 156 -21.193 -9.420 -2.654 1.00 0.28 C ATOM 2163 CG ASN A 156 -22.030 -10.587 -3.184 1.00 0.51 C ATOM 2164 OD1 ASN A 156 -23.221 -10.453 -3.386 1.00 1.30 O ATOM 2165 ND2 ASN A 156 -21.453 -11.733 -3.418 1.00 1.08 N ATOM 0 H ASN A 156 -18.908 -10.155 -3.346 1.00 0.36 H new ATOM 0 HA ASN A 156 -21.071 -8.799 -4.709 1.00 0.36 H new ATOM 0 HB2 ASN A 156 -20.481 -9.778 -1.910 1.00 0.28 H new ATOM 0 HB3 ASN A 156 -21.836 -8.694 -2.157 1.00 0.28 H new ATOM 0 HD21 ASN A 156 -22.001 -12.517 -3.771 1.00 1.08 H new ATOM 0 HD22 ASN A 156 -20.453 -11.845 -3.248 1.00 1.08 H new ATOM 2172 N GLN A 157 -21.147 -6.453 -3.487 1.00 0.54 N ATOM 2173 CA GLN A 157 -20.915 -5.019 -3.157 1.00 0.58 C ATOM 2174 C GLN A 157 -20.292 -4.910 -1.764 1.00 0.48 C ATOM 2175 O GLN A 157 -19.529 -4.008 -1.483 1.00 0.48 O ATOM 2176 CB GLN A 157 -22.248 -4.268 -3.180 1.00 0.80 C ATOM 2177 CG GLN A 157 -21.995 -2.772 -2.994 1.00 1.16 C ATOM 2178 CD GLN A 157 -22.508 -2.011 -4.218 1.00 1.13 C ATOM 2179 OE1 GLN A 157 -23.625 -1.531 -4.226 1.00 1.83 O ATOM 2180 NE2 GLN A 157 -21.734 -1.879 -5.261 1.00 1.25 N ATOM 0 H GLN A 157 -22.110 -6.695 -3.718 1.00 0.54 H new ATOM 0 HA GLN A 157 -20.239 -4.582 -3.892 1.00 0.58 H new ATOM 0 HB2 GLN A 157 -22.761 -4.446 -4.125 1.00 0.80 H new ATOM 0 HB3 GLN A 157 -22.900 -4.638 -2.389 1.00 0.80 H new ATOM 0 HG2 GLN A 157 -22.498 -2.417 -2.095 1.00 1.16 H new ATOM 0 HG3 GLN A 157 -20.930 -2.587 -2.858 1.00 1.16 H new ATOM 0 HE21 GLN A 157 -20.797 -2.281 -5.255 1.00 1.25 H new ATOM 0 HE22 GLN A 157 -22.066 -1.373 -6.082 1.00 1.25 H new ATOM 2189 N TRP A 158 -20.612 -5.824 -0.890 1.00 0.44 N ATOM 2190 CA TRP A 158 -20.039 -5.770 0.484 1.00 0.49 C ATOM 2191 C TRP A 158 -18.518 -5.936 0.412 1.00 0.37 C ATOM 2192 O TRP A 158 -17.771 -5.074 0.835 1.00 0.41 O ATOM 2193 CB TRP A 158 -20.633 -6.898 1.332 1.00 0.59 C ATOM 2194 CG TRP A 158 -20.160 -6.757 2.744 1.00 0.74 C ATOM 2195 CD1 TRP A 158 -18.965 -7.191 3.209 1.00 0.90 C ATOM 2196 CD2 TRP A 158 -20.844 -6.148 3.879 1.00 0.82 C ATOM 2197 NE1 TRP A 158 -18.873 -6.887 4.556 1.00 1.01 N ATOM 2198 CE2 TRP A 158 -20.006 -6.244 5.015 1.00 0.94 C ATOM 2199 CE3 TRP A 158 -22.097 -5.528 4.031 1.00 0.90 C ATOM 2200 CZ2 TRP A 158 -20.396 -5.743 6.257 1.00 1.04 C ATOM 2201 CZ3 TRP A 158 -22.493 -5.023 5.280 1.00 1.05 C ATOM 2202 CH2 TRP A 158 -21.644 -5.130 6.390 1.00 1.08 C ATOM 0 H TRP A 158 -21.244 -6.604 -1.067 1.00 0.44 H new ATOM 0 HA TRP A 158 -20.279 -4.808 0.937 1.00 0.49 H new ATOM 0 HB2 TRP A 158 -21.722 -6.861 1.296 1.00 0.59 H new ATOM 0 HB3 TRP A 158 -20.333 -7.866 0.931 1.00 0.59 H new ATOM 0 HD1 TRP A 158 -18.208 -7.692 2.625 1.00 0.90 H new ATOM 0 HE1 TRP A 158 -18.066 -7.111 5.139 1.00 1.01 H new ATOM 0 HE3 TRP A 158 -22.759 -5.440 3.182 1.00 0.90 H new ATOM 0 HZ2 TRP A 158 -19.738 -5.828 7.109 1.00 1.04 H new ATOM 0 HZ3 TRP A 158 -23.458 -4.549 5.386 1.00 1.05 H new ATOM 0 HH2 TRP A 158 -21.955 -4.739 7.348 1.00 1.08 H new ATOM 2213 N LEU A 159 -18.054 -7.034 -0.116 1.00 0.32 N ATOM 2214 CA LEU A 159 -16.581 -7.249 -0.208 1.00 0.43 C ATOM 2215 C LEU A 159 -15.961 -6.210 -1.148 1.00 0.37 C ATOM 2216 O LEU A 159 -14.763 -6.012 -1.159 1.00 0.53 O ATOM 2217 CB LEU A 159 -16.302 -8.655 -0.746 1.00 0.56 C ATOM 2218 CG LEU A 159 -16.454 -9.671 0.388 1.00 0.61 C ATOM 2219 CD1 LEU A 159 -16.755 -11.051 -0.199 1.00 0.82 C ATOM 2220 CD2 LEU A 159 -15.153 -9.735 1.193 1.00 1.08 C ATOM 0 H LEU A 159 -18.628 -7.791 -0.487 1.00 0.32 H new ATOM 0 HA LEU A 159 -16.141 -7.144 0.784 1.00 0.43 H new ATOM 0 HB2 LEU A 159 -16.993 -8.891 -1.556 1.00 0.56 H new ATOM 0 HB3 LEU A 159 -15.295 -8.705 -1.161 1.00 0.56 H new ATOM 0 HG LEU A 159 -17.273 -9.366 1.040 1.00 0.61 H new ATOM 0 HD11 LEU A 159 -16.863 -11.774 0.609 1.00 0.82 H new ATOM 0 HD12 LEU A 159 -17.680 -11.008 -0.774 1.00 0.82 H new ATOM 0 HD13 LEU A 159 -15.936 -11.355 -0.851 1.00 0.82 H new ATOM 0 HD21 LEU A 159 -15.260 -10.459 2.001 1.00 1.08 H new ATOM 0 HD22 LEU A 159 -14.335 -10.039 0.540 1.00 1.08 H new ATOM 0 HD23 LEU A 159 -14.936 -8.753 1.612 1.00 1.08 H new ATOM 2232 N GLN A 160 -16.762 -5.541 -1.935 1.00 0.37 N ATOM 2233 CA GLN A 160 -16.205 -4.515 -2.862 1.00 0.52 C ATOM 2234 C GLN A 160 -15.769 -3.295 -2.050 1.00 0.40 C ATOM 2235 O GLN A 160 -14.647 -2.839 -2.149 1.00 0.31 O ATOM 2236 CB GLN A 160 -17.280 -4.108 -3.874 1.00 0.80 C ATOM 2237 CG GLN A 160 -16.622 -3.433 -5.078 1.00 1.45 C ATOM 2238 CD GLN A 160 -16.382 -4.471 -6.178 1.00 0.55 C ATOM 2239 OE1 GLN A 160 -16.475 -4.164 -7.350 1.00 1.09 O ATOM 2240 NE2 GLN A 160 -16.074 -5.696 -5.847 1.00 2.02 N ATOM 0 H GLN A 160 -17.774 -5.661 -1.975 1.00 0.37 H new ATOM 0 HA GLN A 160 -15.347 -4.923 -3.396 1.00 0.52 H new ATOM 0 HB2 GLN A 160 -17.840 -4.985 -4.197 1.00 0.80 H new ATOM 0 HB3 GLN A 160 -17.993 -3.428 -3.408 1.00 0.80 H new ATOM 0 HG2 GLN A 160 -17.259 -2.632 -5.452 1.00 1.45 H new ATOM 0 HG3 GLN A 160 -15.677 -2.977 -4.781 1.00 1.45 H new ATOM 0 HE21 GLN A 160 -15.996 -5.954 -4.863 1.00 2.02 H new ATOM 0 HE22 GLN A 160 -15.912 -6.395 -6.572 1.00 2.02 H new ATOM 2249 N ASP A 161 -16.641 -2.771 -1.235 1.00 0.47 N ATOM 2250 CA ASP A 161 -16.269 -1.590 -0.409 1.00 0.52 C ATOM 2251 C ASP A 161 -15.225 -2.019 0.623 1.00 0.38 C ATOM 2252 O ASP A 161 -14.418 -1.229 1.072 1.00 0.51 O ATOM 2253 CB ASP A 161 -17.509 -1.058 0.309 1.00 0.69 C ATOM 2254 CG ASP A 161 -17.218 0.339 0.860 1.00 0.82 C ATOM 2255 OD1 ASP A 161 -17.295 1.285 0.092 1.00 0.81 O ATOM 2256 OD2 ASP A 161 -16.922 0.439 2.039 1.00 1.85 O ATOM 0 H ASP A 161 -17.594 -3.109 -1.105 1.00 0.47 H new ATOM 0 HA ASP A 161 -15.860 -0.806 -1.046 1.00 0.52 H new ATOM 0 HB2 ASP A 161 -18.353 -1.021 -0.380 1.00 0.69 H new ATOM 0 HB3 ASP A 161 -17.789 -1.730 1.120 1.00 0.69 H new ATOM 2261 N MET A 162 -15.233 -3.269 0.996 1.00 0.26 N ATOM 2262 CA MET A 162 -14.240 -3.758 1.993 1.00 0.40 C ATOM 2263 C MET A 162 -12.857 -3.801 1.343 1.00 0.39 C ATOM 2264 O MET A 162 -11.855 -3.553 1.979 1.00 0.56 O ATOM 2265 CB MET A 162 -14.639 -5.166 2.456 1.00 0.55 C ATOM 2266 CG MET A 162 -13.554 -5.742 3.372 1.00 0.44 C ATOM 2267 SD MET A 162 -12.518 -6.890 2.428 1.00 1.51 S ATOM 2268 CE MET A 162 -10.957 -5.992 2.604 1.00 0.63 C ATOM 0 H MET A 162 -15.885 -3.974 0.653 1.00 0.26 H new ATOM 0 HA MET A 162 -14.216 -3.089 2.853 1.00 0.40 H new ATOM 0 HB2 MET A 162 -15.591 -5.128 2.985 1.00 0.55 H new ATOM 0 HB3 MET A 162 -14.780 -5.816 1.592 1.00 0.55 H new ATOM 0 HG2 MET A 162 -12.944 -4.937 3.782 1.00 0.44 H new ATOM 0 HG3 MET A 162 -14.011 -6.258 4.216 1.00 0.44 H new ATOM 0 HE1 MET A 162 -10.599 -5.688 1.620 1.00 0.63 H new ATOM 0 HE2 MET A 162 -11.114 -5.108 3.222 1.00 0.63 H new ATOM 0 HE3 MET A 162 -10.217 -6.638 3.076 1.00 0.63 H new ATOM 2278 N THR A 163 -12.793 -4.116 0.080 1.00 0.30 N ATOM 2279 CA THR A 163 -11.473 -4.175 -0.603 1.00 0.33 C ATOM 2280 C THR A 163 -10.767 -2.821 -0.470 1.00 0.26 C ATOM 2281 O THR A 163 -9.657 -2.738 0.011 1.00 0.22 O ATOM 2282 CB THR A 163 -11.677 -4.515 -2.082 1.00 0.37 C ATOM 2283 OG1 THR A 163 -12.265 -5.803 -2.190 1.00 0.47 O ATOM 2284 CG2 THR A 163 -10.325 -4.510 -2.798 1.00 0.52 C ATOM 0 H THR A 163 -13.597 -4.335 -0.508 1.00 0.30 H new ATOM 0 HA THR A 163 -10.857 -4.946 -0.141 1.00 0.33 H new ATOM 0 HB THR A 163 -12.332 -3.774 -2.540 1.00 0.37 H new ATOM 0 HG1 THR A 163 -13.203 -5.759 -1.911 1.00 0.47 H new ATOM 0 HG21 THR A 163 -10.470 -4.752 -3.851 1.00 0.52 H new ATOM 0 HG22 THR A 163 -9.871 -3.523 -2.712 1.00 0.52 H new ATOM 0 HG23 THR A 163 -9.669 -5.252 -2.342 1.00 0.52 H new ATOM 2292 N THR A 164 -11.400 -1.760 -0.892 1.00 0.26 N ATOM 2293 CA THR A 164 -10.756 -0.418 -0.789 1.00 0.21 C ATOM 2294 C THR A 164 -10.428 -0.110 0.676 1.00 0.17 C ATOM 2295 O THR A 164 -9.511 0.630 0.977 1.00 0.10 O ATOM 2296 CB THR A 164 -11.716 0.645 -1.332 1.00 0.24 C ATOM 2297 OG1 THR A 164 -13.043 0.323 -0.944 1.00 1.19 O ATOM 2298 CG2 THR A 164 -11.623 0.684 -2.858 1.00 1.55 C ATOM 0 H THR A 164 -12.334 -1.764 -1.303 1.00 0.26 H new ATOM 0 HA THR A 164 -9.834 -0.413 -1.370 1.00 0.21 H new ATOM 0 HB THR A 164 -11.446 1.621 -0.929 1.00 0.24 H new ATOM 0 HG1 THR A 164 -13.029 -0.133 -0.076 1.00 1.19 H new ATOM 0 HG21 THR A 164 -12.306 1.440 -3.245 1.00 1.55 H new ATOM 0 HG22 THR A 164 -10.603 0.930 -3.154 1.00 1.55 H new ATOM 0 HG23 THR A 164 -11.893 -0.291 -3.264 1.00 1.55 H new ATOM 2306 N HIS A 165 -11.175 -0.668 1.587 1.00 0.34 N ATOM 2307 CA HIS A 165 -10.919 -0.405 3.032 1.00 0.39 C ATOM 2308 C HIS A 165 -9.565 -1.005 3.446 1.00 0.39 C ATOM 2309 O HIS A 165 -8.639 -0.295 3.787 1.00 0.37 O ATOM 2310 CB HIS A 165 -12.050 -1.040 3.855 1.00 0.51 C ATOM 2311 CG HIS A 165 -11.713 -1.022 5.324 1.00 0.61 C ATOM 2312 ND1 HIS A 165 -11.841 -2.147 6.123 1.00 0.61 N ATOM 2313 CD2 HIS A 165 -11.242 -0.029 6.148 1.00 0.85 C ATOM 2314 CE1 HIS A 165 -11.455 -1.809 7.365 1.00 0.73 C ATOM 2315 NE2 HIS A 165 -11.080 -0.528 7.436 1.00 0.89 N ATOM 0 H HIS A 165 -11.954 -1.297 1.393 1.00 0.34 H new ATOM 0 HA HIS A 165 -10.889 0.670 3.212 1.00 0.39 H new ATOM 0 HB2 HIS A 165 -12.980 -0.498 3.683 1.00 0.51 H new ATOM 0 HB3 HIS A 165 -12.214 -2.066 3.527 1.00 0.51 H new ATOM 0 HD2 HIS A 165 -11.030 0.985 5.842 1.00 0.85 H new ATOM 0 HE1 HIS A 165 -11.449 -2.489 8.204 1.00 0.73 H new ATOM 0 HE2 HIS A 165 -10.747 -0.025 8.258 1.00 0.89 H new ATOM 2323 N LEU A 166 -9.455 -2.304 3.448 1.00 0.42 N ATOM 2324 CA LEU A 166 -8.179 -2.952 3.871 1.00 0.44 C ATOM 2325 C LEU A 166 -6.995 -2.395 3.086 1.00 0.39 C ATOM 2326 O LEU A 166 -5.936 -2.184 3.638 1.00 0.34 O ATOM 2327 CB LEU A 166 -8.265 -4.459 3.637 1.00 0.48 C ATOM 2328 CG LEU A 166 -8.647 -5.169 4.943 1.00 0.83 C ATOM 2329 CD1 LEU A 166 -7.526 -4.991 5.968 1.00 0.69 C ATOM 2330 CD2 LEU A 166 -9.943 -4.571 5.502 1.00 1.82 C ATOM 0 H LEU A 166 -10.196 -2.949 3.174 1.00 0.42 H new ATOM 0 HA LEU A 166 -8.028 -2.743 4.930 1.00 0.44 H new ATOM 0 HB2 LEU A 166 -9.005 -4.675 2.866 1.00 0.48 H new ATOM 0 HB3 LEU A 166 -7.308 -4.835 3.275 1.00 0.48 H new ATOM 0 HG LEU A 166 -8.796 -6.230 4.742 1.00 0.83 H new ATOM 0 HD11 LEU A 166 -7.798 -5.495 6.895 1.00 0.69 H new ATOM 0 HD12 LEU A 166 -6.604 -5.422 5.577 1.00 0.69 H new ATOM 0 HD13 LEU A 166 -7.376 -3.929 6.163 1.00 0.69 H new ATOM 0 HD21 LEU A 166 -10.208 -5.080 6.429 1.00 1.82 H new ATOM 0 HD22 LEU A 166 -9.798 -3.509 5.700 1.00 1.82 H new ATOM 0 HD23 LEU A 166 -10.746 -4.699 4.776 1.00 1.82 H new ATOM 2342 N ILE A 167 -7.139 -2.165 1.806 1.00 0.41 N ATOM 2343 CA ILE A 167 -5.979 -1.637 1.035 1.00 0.38 C ATOM 2344 C ILE A 167 -5.486 -0.349 1.690 1.00 0.37 C ATOM 2345 O ILE A 167 -4.314 -0.184 1.950 1.00 0.39 O ATOM 2346 CB ILE A 167 -6.372 -1.335 -0.411 1.00 0.34 C ATOM 2347 CG1 ILE A 167 -6.900 -2.605 -1.077 1.00 0.24 C ATOM 2348 CG2 ILE A 167 -5.138 -0.834 -1.169 1.00 0.42 C ATOM 2349 CD1 ILE A 167 -7.668 -2.232 -2.345 1.00 0.07 C ATOM 0 H ILE A 167 -7.994 -2.317 1.271 1.00 0.41 H new ATOM 0 HA ILE A 167 -5.194 -2.393 1.034 1.00 0.38 H new ATOM 0 HB ILE A 167 -7.151 -0.573 -0.428 1.00 0.34 H new ATOM 0 HG12 ILE A 167 -6.073 -3.271 -1.322 1.00 0.24 H new ATOM 0 HG13 ILE A 167 -7.551 -3.145 -0.390 1.00 0.24 H new ATOM 0 HG21 ILE A 167 -5.409 -0.616 -2.202 1.00 0.42 H new ATOM 0 HG22 ILE A 167 -4.762 0.072 -0.694 1.00 0.42 H new ATOM 0 HG23 ILE A 167 -4.364 -1.601 -1.151 1.00 0.42 H new ATOM 0 HD11 ILE A 167 -8.045 -3.137 -2.821 1.00 0.07 H new ATOM 0 HD12 ILE A 167 -8.504 -1.583 -2.086 1.00 0.07 H new ATOM 0 HD13 ILE A 167 -7.003 -1.710 -3.033 1.00 0.07 H new ATOM 2361 N LEU A 168 -6.377 0.564 1.956 1.00 0.37 N ATOM 2362 CA LEU A 168 -5.963 1.844 2.595 1.00 0.37 C ATOM 2363 C LEU A 168 -5.458 1.571 4.014 1.00 0.42 C ATOM 2364 O LEU A 168 -4.704 2.343 4.572 1.00 0.49 O ATOM 2365 CB LEU A 168 -7.161 2.792 2.654 1.00 0.38 C ATOM 2366 CG LEU A 168 -7.166 3.683 1.411 1.00 0.82 C ATOM 2367 CD1 LEU A 168 -7.384 2.823 0.164 1.00 2.08 C ATOM 2368 CD2 LEU A 168 -8.298 4.705 1.525 1.00 1.28 C ATOM 0 H LEU A 168 -7.374 0.480 1.759 1.00 0.37 H new ATOM 0 HA LEU A 168 -5.165 2.300 2.009 1.00 0.37 H new ATOM 0 HB2 LEU A 168 -8.088 2.221 2.709 1.00 0.38 H new ATOM 0 HB3 LEU A 168 -7.110 3.405 3.554 1.00 0.38 H new ATOM 0 HG LEU A 168 -6.210 4.201 1.332 1.00 0.82 H new ATOM 0 HD11 LEU A 168 -7.387 3.459 -0.721 1.00 2.08 H new ATOM 0 HD12 LEU A 168 -6.580 2.091 0.082 1.00 2.08 H new ATOM 0 HD13 LEU A 168 -8.340 2.305 0.242 1.00 2.08 H new ATOM 0 HD21 LEU A 168 -8.304 5.342 0.640 1.00 1.28 H new ATOM 0 HD22 LEU A 168 -9.252 4.184 1.604 1.00 1.28 H new ATOM 0 HD23 LEU A 168 -8.146 5.319 2.413 1.00 1.28 H new ATOM 2380 N ARG A 169 -5.866 0.481 4.605 1.00 0.40 N ATOM 2381 CA ARG A 169 -5.404 0.167 5.988 1.00 0.45 C ATOM 2382 C ARG A 169 -3.934 -0.252 5.950 1.00 0.43 C ATOM 2383 O ARG A 169 -3.173 0.031 6.856 1.00 0.46 O ATOM 2384 CB ARG A 169 -6.246 -0.973 6.566 1.00 0.50 C ATOM 2385 CG ARG A 169 -6.264 -0.870 8.093 1.00 0.63 C ATOM 2386 CD ARG A 169 -6.575 -2.241 8.695 1.00 1.19 C ATOM 2387 NE ARG A 169 -5.824 -2.404 9.972 1.00 1.51 N ATOM 2388 CZ ARG A 169 -6.465 -2.405 11.109 1.00 1.07 C ATOM 2389 NH1 ARG A 169 -7.592 -3.053 11.222 1.00 1.53 N ATOM 2390 NH2 ARG A 169 -5.977 -1.760 12.133 1.00 1.20 N ATOM 0 H ARG A 169 -6.498 -0.205 4.191 1.00 0.40 H new ATOM 0 HA ARG A 169 -5.515 1.051 6.616 1.00 0.45 H new ATOM 0 HB2 ARG A 169 -7.262 -0.923 6.175 1.00 0.50 H new ATOM 0 HB3 ARG A 169 -5.834 -1.935 6.260 1.00 0.50 H new ATOM 0 HG2 ARG A 169 -5.300 -0.513 8.455 1.00 0.63 H new ATOM 0 HG3 ARG A 169 -7.013 -0.144 8.410 1.00 0.63 H new ATOM 0 HD2 ARG A 169 -7.646 -2.337 8.875 1.00 1.19 H new ATOM 0 HD3 ARG A 169 -6.298 -3.029 7.995 1.00 1.19 H new ATOM 0 HE ARG A 169 -4.810 -2.515 9.957 1.00 1.51 H new ATOM 0 HH11 ARG A 169 -7.972 -3.559 10.422 1.00 1.53 H new ATOM 0 HH12 ARG A 169 -8.093 -3.054 12.111 1.00 1.53 H new ATOM 0 HH21 ARG A 169 -5.095 -1.255 12.045 1.00 1.20 H new ATOM 0 HH22 ARG A 169 -6.478 -1.760 13.022 1.00 1.20 H new ATOM 2404 N SER A 170 -3.521 -0.913 4.902 1.00 0.40 N ATOM 2405 CA SER A 170 -2.105 -1.335 4.803 1.00 0.41 C ATOM 2406 C SER A 170 -1.276 -0.117 4.423 1.00 0.36 C ATOM 2407 O SER A 170 -0.267 0.172 5.014 1.00 0.39 O ATOM 2408 CB SER A 170 -1.968 -2.411 3.723 1.00 0.40 C ATOM 2409 OG SER A 170 -1.916 -1.791 2.445 1.00 2.40 O ATOM 0 H SER A 170 -4.109 -1.177 4.111 1.00 0.40 H new ATOM 0 HA SER A 170 -1.761 -1.744 5.753 1.00 0.41 H new ATOM 0 HB2 SER A 170 -1.066 -2.999 3.892 1.00 0.40 H new ATOM 0 HB3 SER A 170 -2.811 -3.100 3.771 1.00 0.40 H new ATOM 0 HG SER A 170 -0.982 -1.703 2.162 1.00 2.40 H new ATOM 2415 N PHE A 171 -1.707 0.620 3.446 1.00 0.30 N ATOM 2416 CA PHE A 171 -0.943 1.827 3.041 1.00 0.25 C ATOM 2417 C PHE A 171 -0.684 2.697 4.269 1.00 0.29 C ATOM 2418 O PHE A 171 0.410 3.164 4.485 1.00 0.29 O ATOM 2419 CB PHE A 171 -1.742 2.600 2.000 1.00 0.19 C ATOM 2420 CG PHE A 171 -1.436 2.015 0.646 1.00 0.16 C ATOM 2421 CD1 PHE A 171 -1.779 0.687 0.365 1.00 0.41 C ATOM 2422 CD2 PHE A 171 -0.792 2.791 -0.321 1.00 0.45 C ATOM 2423 CE1 PHE A 171 -1.477 0.136 -0.884 1.00 0.40 C ATOM 2424 CE2 PHE A 171 -0.493 2.242 -1.571 1.00 0.44 C ATOM 2425 CZ PHE A 171 -0.835 0.914 -1.854 1.00 0.13 C ATOM 0 H PHE A 171 -2.555 0.440 2.909 1.00 0.30 H new ATOM 0 HA PHE A 171 0.014 1.536 2.608 1.00 0.25 H new ATOM 0 HB2 PHE A 171 -2.809 2.532 2.212 1.00 0.19 H new ATOM 0 HB3 PHE A 171 -1.479 3.657 2.026 1.00 0.19 H new ATOM 0 HD1 PHE A 171 -2.277 0.088 1.113 1.00 0.41 H new ATOM 0 HD2 PHE A 171 -0.525 3.815 -0.103 1.00 0.45 H new ATOM 0 HE1 PHE A 171 -1.739 -0.889 -1.100 1.00 0.40 H new ATOM 0 HE2 PHE A 171 0.002 2.843 -2.319 1.00 0.44 H new ATOM 0 HZ PHE A 171 -0.603 0.490 -2.820 1.00 0.13 H new ATOM 2435 N LYS A 172 -1.673 2.901 5.089 1.00 0.33 N ATOM 2436 CA LYS A 172 -1.455 3.728 6.305 1.00 0.38 C ATOM 2437 C LYS A 172 -0.356 3.092 7.164 1.00 0.42 C ATOM 2438 O LYS A 172 0.699 3.661 7.364 1.00 0.41 O ATOM 2439 CB LYS A 172 -2.751 3.805 7.111 1.00 0.42 C ATOM 2440 CG LYS A 172 -3.466 5.121 6.801 1.00 0.43 C ATOM 2441 CD LYS A 172 -4.976 4.922 6.935 1.00 1.87 C ATOM 2442 CE LYS A 172 -5.434 5.412 8.312 1.00 2.40 C ATOM 2443 NZ LYS A 172 -6.413 4.447 8.894 1.00 4.41 N ATOM 0 H LYS A 172 -2.617 2.534 4.972 1.00 0.33 H new ATOM 0 HA LYS A 172 -1.152 4.733 6.011 1.00 0.38 H new ATOM 0 HB2 LYS A 172 -3.396 2.961 6.865 1.00 0.42 H new ATOM 0 HB3 LYS A 172 -2.533 3.739 8.177 1.00 0.42 H new ATOM 0 HG2 LYS A 172 -3.129 5.901 7.484 1.00 0.43 H new ATOM 0 HG3 LYS A 172 -3.220 5.453 5.792 1.00 0.43 H new ATOM 0 HD2 LYS A 172 -5.497 5.470 6.150 1.00 1.87 H new ATOM 0 HD3 LYS A 172 -5.228 3.869 6.809 1.00 1.87 H new ATOM 0 HE2 LYS A 172 -4.575 5.517 8.975 1.00 2.40 H new ATOM 0 HE3 LYS A 172 -5.890 6.398 8.224 1.00 2.40 H new ATOM 0 HZ1 LYS A 172 -6.932 4.905 9.671 1.00 4.41 H new ATOM 0 HZ2 LYS A 172 -7.084 4.147 8.158 1.00 4.41 H new ATOM 0 HZ3 LYS A 172 -5.906 3.616 9.259 1.00 4.41 H new ATOM 2457 N GLU A 173 -0.597 1.913 7.678 1.00 0.48 N ATOM 2458 CA GLU A 173 0.428 1.242 8.530 1.00 0.54 C ATOM 2459 C GLU A 173 1.608 0.778 7.667 1.00 0.52 C ATOM 2460 O GLU A 173 2.693 1.304 7.766 1.00 0.53 O ATOM 2461 CB GLU A 173 -0.202 0.032 9.223 1.00 0.58 C ATOM 2462 CG GLU A 173 0.824 -0.610 10.158 1.00 1.95 C ATOM 2463 CD GLU A 173 0.148 -0.985 11.479 1.00 1.43 C ATOM 2464 OE1 GLU A 173 0.073 -0.131 12.346 1.00 1.39 O ATOM 2465 OE2 GLU A 173 -0.282 -2.121 11.599 1.00 2.44 O ATOM 0 H GLU A 173 -1.460 1.386 7.544 1.00 0.48 H new ATOM 0 HA GLU A 173 0.789 1.949 9.277 1.00 0.54 H new ATOM 0 HB2 GLU A 173 -1.082 0.340 9.788 1.00 0.58 H new ATOM 0 HB3 GLU A 173 -0.537 -0.692 8.481 1.00 0.58 H new ATOM 0 HG2 GLU A 173 1.251 -1.498 9.691 1.00 1.95 H new ATOM 0 HG3 GLU A 173 1.647 0.081 10.342 1.00 1.95 H new ATOM 2472 N PHE A 174 1.386 -0.214 6.836 1.00 0.51 N ATOM 2473 CA PHE A 174 2.464 -0.767 5.940 1.00 0.51 C ATOM 2474 C PHE A 174 3.441 0.327 5.469 1.00 0.49 C ATOM 2475 O PHE A 174 4.634 0.245 5.709 1.00 0.58 O ATOM 2476 CB PHE A 174 1.799 -1.409 4.718 1.00 0.46 C ATOM 2477 CG PHE A 174 2.763 -2.344 4.036 1.00 0.57 C ATOM 2478 CD1 PHE A 174 2.857 -3.676 4.451 1.00 1.36 C ATOM 2479 CD2 PHE A 174 3.557 -1.877 2.985 1.00 2.06 C ATOM 2480 CE1 PHE A 174 3.752 -4.544 3.813 1.00 1.21 C ATOM 2481 CE2 PHE A 174 4.451 -2.744 2.346 1.00 2.27 C ATOM 2482 CZ PHE A 174 4.549 -4.077 2.760 1.00 0.92 C ATOM 0 H PHE A 174 0.482 -0.677 6.736 1.00 0.51 H new ATOM 0 HA PHE A 174 3.038 -1.500 6.507 1.00 0.51 H new ATOM 0 HB2 PHE A 174 0.906 -1.954 5.025 1.00 0.46 H new ATOM 0 HB3 PHE A 174 1.476 -0.635 4.021 1.00 0.46 H new ATOM 0 HD1 PHE A 174 2.241 -4.035 5.262 1.00 1.36 H new ATOM 0 HD2 PHE A 174 3.481 -0.848 2.666 1.00 2.06 H new ATOM 0 HE1 PHE A 174 3.828 -5.573 4.133 1.00 1.21 H new ATOM 0 HE2 PHE A 174 5.065 -2.384 1.534 1.00 2.27 H new ATOM 0 HZ PHE A 174 5.239 -4.746 2.268 1.00 0.92 H new ATOM 2492 N LEU A 175 2.964 1.348 4.800 1.00 0.39 N ATOM 2493 CA LEU A 175 3.906 2.409 4.338 1.00 0.38 C ATOM 2494 C LEU A 175 4.538 3.080 5.556 1.00 0.40 C ATOM 2495 O LEU A 175 5.714 3.367 5.574 1.00 0.41 O ATOM 2496 CB LEU A 175 3.172 3.465 3.510 1.00 0.34 C ATOM 2497 CG LEU A 175 2.723 2.871 2.172 1.00 0.31 C ATOM 2498 CD1 LEU A 175 1.549 3.680 1.628 1.00 0.27 C ATOM 2499 CD2 LEU A 175 3.877 2.939 1.169 1.00 0.31 C ATOM 0 H LEU A 175 1.983 1.490 4.559 1.00 0.39 H new ATOM 0 HA LEU A 175 4.673 1.948 3.716 1.00 0.38 H new ATOM 0 HB2 LEU A 175 2.307 3.833 4.061 1.00 0.34 H new ATOM 0 HB3 LEU A 175 3.826 4.320 3.336 1.00 0.34 H new ATOM 0 HG LEU A 175 2.423 1.834 2.321 1.00 0.31 H new ATOM 0 HD11 LEU A 175 1.227 3.259 0.675 1.00 0.27 H new ATOM 0 HD12 LEU A 175 0.723 3.644 2.338 1.00 0.27 H new ATOM 0 HD13 LEU A 175 1.857 4.715 1.482 1.00 0.27 H new ATOM 0 HD21 LEU A 175 3.557 2.516 0.217 1.00 0.31 H new ATOM 0 HD22 LEU A 175 4.172 3.978 1.024 1.00 0.31 H new ATOM 0 HD23 LEU A 175 4.725 2.371 1.551 1.00 0.31 H new ATOM 2511 N GLN A 176 3.766 3.336 6.579 1.00 0.41 N ATOM 2512 CA GLN A 176 4.337 3.988 7.790 1.00 0.44 C ATOM 2513 C GLN A 176 5.490 3.138 8.330 1.00 0.47 C ATOM 2514 O GLN A 176 6.371 3.631 9.003 1.00 0.51 O ATOM 2515 CB GLN A 176 3.253 4.132 8.856 1.00 0.38 C ATOM 2516 CG GLN A 176 2.570 5.494 8.696 1.00 0.58 C ATOM 2517 CD GLN A 176 2.769 6.332 9.962 1.00 0.96 C ATOM 2518 OE1 GLN A 176 3.572 5.996 10.810 1.00 1.69 O ATOM 2519 NE2 GLN A 176 2.066 7.420 10.124 1.00 1.66 N ATOM 0 H GLN A 176 2.770 3.122 6.627 1.00 0.41 H new ATOM 0 HA GLN A 176 4.711 4.978 7.528 1.00 0.44 H new ATOM 0 HB2 GLN A 176 2.521 3.330 8.758 1.00 0.38 H new ATOM 0 HB3 GLN A 176 3.690 4.045 9.851 1.00 0.38 H new ATOM 0 HG2 GLN A 176 2.983 6.018 7.834 1.00 0.58 H new ATOM 0 HG3 GLN A 176 1.506 5.356 8.505 1.00 0.58 H new ATOM 0 HE21 GLN A 176 1.392 7.702 9.412 1.00 1.66 H new ATOM 0 HE22 GLN A 176 2.191 7.988 10.962 1.00 1.66 H new ATOM 2528 N SER A 177 5.503 1.869 8.027 1.00 0.73 N ATOM 2529 CA SER A 177 6.615 1.005 8.508 1.00 0.76 C ATOM 2530 C SER A 177 7.832 1.277 7.635 1.00 0.62 C ATOM 2531 O SER A 177 8.953 1.299 8.102 1.00 0.52 O ATOM 2532 CB SER A 177 6.226 -0.468 8.391 1.00 0.96 C ATOM 2533 OG SER A 177 5.177 -0.753 9.309 1.00 0.94 O ATOM 0 H SER A 177 4.793 1.395 7.469 1.00 0.73 H new ATOM 0 HA SER A 177 6.832 1.225 9.553 1.00 0.76 H new ATOM 0 HB2 SER A 177 5.905 -0.691 7.374 1.00 0.96 H new ATOM 0 HB3 SER A 177 7.089 -1.101 8.599 1.00 0.96 H new ATOM 0 HG SER A 177 4.925 -1.697 9.235 1.00 0.94 H new ATOM 2539 N SER A 178 7.616 1.494 6.367 1.00 0.64 N ATOM 2540 CA SER A 178 8.758 1.782 5.454 1.00 0.57 C ATOM 2541 C SER A 178 9.439 3.079 5.901 1.00 0.39 C ATOM 2542 O SER A 178 10.636 3.127 6.101 1.00 0.42 O ATOM 2543 CB SER A 178 8.240 1.947 4.025 1.00 0.68 C ATOM 2544 OG SER A 178 9.332 2.234 3.161 1.00 1.66 O ATOM 0 H SER A 178 6.698 1.484 5.923 1.00 0.64 H new ATOM 0 HA SER A 178 9.472 0.959 5.487 1.00 0.57 H new ATOM 0 HB2 SER A 178 7.735 1.037 3.702 1.00 0.68 H new ATOM 0 HB3 SER A 178 7.506 2.752 3.982 1.00 0.68 H new ATOM 0 HG SER A 178 10.145 1.814 3.511 1.00 1.66 H new ATOM 2550 N LEU A 179 8.682 4.132 6.060 1.00 0.51 N ATOM 2551 CA LEU A 179 9.280 5.426 6.494 1.00 0.32 C ATOM 2552 C LEU A 179 9.813 5.292 7.922 1.00 0.21 C ATOM 2553 O LEU A 179 10.763 5.946 8.304 1.00 0.49 O ATOM 2554 CB LEU A 179 8.221 6.537 6.430 1.00 0.58 C ATOM 2555 CG LEU A 179 7.007 6.175 7.290 1.00 1.69 C ATOM 2556 CD1 LEU A 179 7.304 6.485 8.760 1.00 3.04 C ATOM 2557 CD2 LEU A 179 5.806 7.005 6.831 1.00 2.33 C ATOM 0 H LEU A 179 7.674 4.151 5.907 1.00 0.51 H new ATOM 0 HA LEU A 179 10.103 5.684 5.828 1.00 0.32 H new ATOM 0 HB2 LEU A 179 8.651 7.477 6.776 1.00 0.58 H new ATOM 0 HB3 LEU A 179 7.909 6.690 5.397 1.00 0.58 H new ATOM 0 HG LEU A 179 6.788 5.112 7.184 1.00 1.69 H new ATOM 0 HD11 LEU A 179 6.438 6.226 9.369 1.00 3.04 H new ATOM 0 HD12 LEU A 179 8.165 5.903 9.088 1.00 3.04 H new ATOM 0 HD13 LEU A 179 7.521 7.547 8.871 1.00 3.04 H new ATOM 0 HD21 LEU A 179 4.936 6.754 7.438 1.00 2.33 H new ATOM 0 HD22 LEU A 179 6.032 8.065 6.943 1.00 2.33 H new ATOM 0 HD23 LEU A 179 5.592 6.788 5.784 1.00 2.33 H new ATOM 2569 N ARG A 180 9.214 4.444 8.715 1.00 0.54 N ATOM 2570 CA ARG A 180 9.692 4.267 10.117 1.00 0.70 C ATOM 2571 C ARG A 180 10.967 3.416 10.120 1.00 0.48 C ATOM 2572 O ARG A 180 11.737 3.439 11.062 1.00 0.72 O ATOM 2573 CB ARG A 180 8.610 3.565 10.941 1.00 1.04 C ATOM 2574 CG ARG A 180 8.923 3.713 12.431 1.00 1.24 C ATOM 2575 CD ARG A 180 7.785 4.472 13.115 1.00 0.80 C ATOM 2576 NE ARG A 180 6.588 3.592 13.201 1.00 2.31 N ATOM 2577 CZ ARG A 180 5.502 4.020 13.783 1.00 2.64 C ATOM 2578 NH1 ARG A 180 5.584 4.730 14.875 1.00 1.91 N ATOM 2579 NH2 ARG A 180 4.334 3.740 13.273 1.00 3.93 N ATOM 0 H ARG A 180 8.415 3.867 8.453 1.00 0.54 H new ATOM 0 HA ARG A 180 9.905 5.243 10.553 1.00 0.70 H new ATOM 0 HB2 ARG A 180 7.633 3.996 10.720 1.00 1.04 H new ATOM 0 HB3 ARG A 180 8.561 2.510 10.672 1.00 1.04 H new ATOM 0 HG2 ARG A 180 9.046 2.731 12.888 1.00 1.24 H new ATOM 0 HG3 ARG A 180 9.864 4.247 12.565 1.00 1.24 H new ATOM 0 HD2 ARG A 180 8.091 4.787 14.112 1.00 0.80 H new ATOM 0 HD3 ARG A 180 7.547 5.376 12.554 1.00 0.80 H new ATOM 0 HE ARG A 180 6.617 2.653 12.804 1.00 2.31 H new ATOM 0 HH11 ARG A 180 6.497 4.950 15.273 1.00 1.91 H new ATOM 0 HH12 ARG A 180 4.735 5.065 15.330 1.00 1.91 H new ATOM 0 HH21 ARG A 180 4.270 3.186 12.419 1.00 3.93 H new ATOM 0 HH22 ARG A 180 3.485 4.075 13.729 1.00 3.93 H new ATOM 2593 N ALA A 181 11.204 2.674 9.070 1.00 0.15 N ATOM 2594 CA ALA A 181 12.430 1.834 9.009 1.00 0.14 C ATOM 2595 C ALA A 181 13.596 2.714 8.578 1.00 0.59 C ATOM 2596 O ALA A 181 14.694 2.614 9.091 1.00 0.94 O ATOM 2597 CB ALA A 181 12.231 0.720 7.984 1.00 0.46 C ATOM 0 H ALA A 181 10.598 2.615 8.252 1.00 0.15 H new ATOM 0 HA ALA A 181 12.632 1.393 9.985 1.00 0.14 H new ATOM 0 HB1 ALA A 181 13.129 0.103 7.938 1.00 0.46 H new ATOM 0 HB2 ALA A 181 11.382 0.103 8.277 1.00 0.46 H new ATOM 0 HB3 ALA A 181 12.041 1.157 7.004 1.00 0.46 H new ATOM 2603 N LEU A 182 13.360 3.585 7.636 1.00 0.60 N ATOM 2604 CA LEU A 182 14.442 4.485 7.165 1.00 1.00 C ATOM 2605 C LEU A 182 14.861 5.396 8.316 1.00 1.17 C ATOM 2606 O LEU A 182 16.031 5.624 8.550 1.00 1.58 O ATOM 2607 CB LEU A 182 13.932 5.334 5.999 1.00 1.12 C ATOM 2608 CG LEU A 182 14.907 5.233 4.826 1.00 1.95 C ATOM 2609 CD1 LEU A 182 14.969 3.785 4.336 1.00 2.20 C ATOM 2610 CD2 LEU A 182 14.425 6.135 3.686 1.00 1.95 C ATOM 0 H LEU A 182 12.460 3.710 7.173 1.00 0.60 H new ATOM 0 HA LEU A 182 15.295 3.895 6.830 1.00 1.00 H new ATOM 0 HB2 LEU A 182 12.943 4.993 5.693 1.00 1.12 H new ATOM 0 HB3 LEU A 182 13.829 6.373 6.311 1.00 1.12 H new ATOM 0 HG LEU A 182 15.899 5.550 5.149 1.00 1.95 H new ATOM 0 HD11 LEU A 182 15.664 3.713 3.500 1.00 2.20 H new ATOM 0 HD12 LEU A 182 15.309 3.141 5.147 1.00 2.20 H new ATOM 0 HD13 LEU A 182 13.978 3.468 4.012 1.00 2.20 H new ATOM 0 HD21 LEU A 182 15.119 6.065 2.848 1.00 1.95 H new ATOM 0 HD22 LEU A 182 13.434 5.816 3.364 1.00 1.95 H new ATOM 0 HD23 LEU A 182 14.379 7.167 4.033 1.00 1.95 H new ATOM 2622 N ARG A 183 13.908 5.914 9.042 1.00 0.97 N ATOM 2623 CA ARG A 183 14.242 6.806 10.185 1.00 1.32 C ATOM 2624 C ARG A 183 14.978 5.997 11.253 1.00 1.37 C ATOM 2625 O ARG A 183 15.883 6.485 11.900 1.00 1.56 O ATOM 2626 CB ARG A 183 12.952 7.381 10.777 1.00 1.36 C ATOM 2627 CG ARG A 183 13.298 8.336 11.921 1.00 2.28 C ATOM 2628 CD ARG A 183 12.073 9.181 12.270 1.00 2.66 C ATOM 2629 NE ARG A 183 12.459 10.234 13.253 1.00 3.06 N ATOM 2630 CZ ARG A 183 12.716 11.448 12.845 1.00 2.18 C ATOM 2631 NH1 ARG A 183 13.142 11.655 11.629 1.00 0.73 N ATOM 2632 NH2 ARG A 183 12.548 12.457 13.656 1.00 2.97 N ATOM 0 H ARG A 183 12.911 5.757 8.891 1.00 0.97 H new ATOM 0 HA ARG A 183 14.877 7.623 9.841 1.00 1.32 H new ATOM 0 HB2 ARG A 183 12.389 7.908 10.007 1.00 1.36 H new ATOM 0 HB3 ARG A 183 12.316 6.575 11.142 1.00 1.36 H new ATOM 0 HG2 ARG A 183 13.624 7.771 12.794 1.00 2.28 H new ATOM 0 HG3 ARG A 183 14.127 8.981 11.632 1.00 2.28 H new ATOM 0 HD2 ARG A 183 11.667 9.641 11.369 1.00 2.66 H new ATOM 0 HD3 ARG A 183 11.289 8.549 12.687 1.00 2.66 H new ATOM 0 HE ARG A 183 12.522 10.006 14.245 1.00 3.06 H new ATOM 0 HH11 ARG A 183 13.275 10.868 10.994 1.00 0.73 H new ATOM 0 HH12 ARG A 183 13.342 12.604 11.313 1.00 0.73 H new ATOM 0 HH21 ARG A 183 12.216 12.297 14.607 1.00 2.97 H new ATOM 0 HH22 ARG A 183 12.748 13.405 13.338 1.00 2.97 H new ATOM 2646 N GLN A 184 14.597 4.762 11.444 1.00 1.21 N ATOM 2647 CA GLN A 184 15.279 3.923 12.471 1.00 1.27 C ATOM 2648 C GLN A 184 16.504 3.232 11.859 1.00 1.29 C ATOM 2649 O GLN A 184 17.216 2.513 12.533 1.00 1.53 O ATOM 2650 CB GLN A 184 14.304 2.863 12.985 1.00 1.26 C ATOM 2651 CG GLN A 184 13.138 3.546 13.701 1.00 1.74 C ATOM 2652 CD GLN A 184 13.606 4.048 15.069 1.00 1.83 C ATOM 2653 OE1 GLN A 184 14.788 4.192 15.306 1.00 1.28 O ATOM 2654 NE2 GLN A 184 12.720 4.321 15.987 1.00 2.76 N ATOM 0 H GLN A 184 13.845 4.299 10.934 1.00 1.21 H new ATOM 0 HA GLN A 184 15.604 4.559 13.294 1.00 1.27 H new ATOM 0 HB2 GLN A 184 13.933 2.262 12.155 1.00 1.26 H new ATOM 0 HB3 GLN A 184 14.815 2.183 13.667 1.00 1.26 H new ATOM 0 HG2 GLN A 184 12.767 4.379 13.103 1.00 1.74 H new ATOM 0 HG3 GLN A 184 12.311 2.847 13.821 1.00 1.74 H new ATOM 0 HE21 GLN A 184 11.727 4.200 15.789 1.00 2.76 H new ATOM 0 HE22 GLN A 184 13.021 4.655 16.903 1.00 2.76 H new ATOM 2663 N MET A 185 16.759 3.436 10.593 1.00 1.23 N ATOM 2664 CA MET A 185 17.939 2.782 9.960 1.00 1.26 C ATOM 2665 C MET A 185 19.187 3.633 10.206 1.00 1.63 C ATOM 2666 O MET A 185 19.082 4.844 10.112 1.00 1.99 O ATOM 2667 CB MET A 185 17.703 2.647 8.453 1.00 1.16 C ATOM 2668 CG MET A 185 17.143 1.257 8.144 1.00 0.92 C ATOM 2669 SD MET A 185 16.782 1.133 6.374 1.00 0.84 S ATOM 2670 CE MET A 185 15.201 0.264 6.521 1.00 0.69 C ATOM 2671 OXT MET A 185 20.226 3.058 10.485 1.00 2.03 O ATOM 0 H MET A 185 16.203 4.025 9.973 1.00 1.23 H new ATOM 0 HA MET A 185 18.081 1.793 10.395 1.00 1.26 H new ATOM 0 HB2 MET A 185 17.007 3.414 8.113 1.00 1.16 H new ATOM 0 HB3 MET A 185 18.637 2.802 7.913 1.00 1.16 H new ATOM 0 HG2 MET A 185 17.862 0.491 8.434 1.00 0.92 H new ATOM 0 HG3 MET A 185 16.237 1.081 8.724 1.00 0.92 H new ATOM 0 HE1 MET A 185 15.152 -0.531 5.777 1.00 0.69 H new ATOM 0 HE2 MET A 185 15.114 -0.167 7.518 1.00 0.69 H new ATOM 0 HE3 MET A 185 14.383 0.966 6.356 1.00 0.69 H new TER 2681 MET A 185