USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 0 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 110 THR OG1 : rot -10:sc= -0.344! USER MOD Set 1.2: A 139 TYR OH : rot 92:sc= 1.22 USER MOD Set 2.1: A 81 MET CE :methyl -136:sc= -1.36 (180deg=-2.01) USER MOD Set 2.2: A 113 SER OG : rot -67:sc= -1.14! USER MOD Set 2.3: A 116 HIS : no HE2:sc= -3.08 K(o=-5.8,f=-6.6!) USER MOD Set 2.4: A 119 LYS NZ :NH3+ -153:sc= -0.193 (180deg=0) USER MOD Set 3.1: A 31 SER OG : rot 164:sc= 0.794 USER MOD Set 3.2: A 108 TYR OH : rot 180:sc= 0.677 USER MOD Set 4.1: A 106 ASN : amide:sc= 0 K(o=-0.025,f=-0.88) USER MOD Set 4.2: A 107 HIS : no HD1:sc= -0.0254 X(o=-0.025,f=-0.5) USER MOD Set 5.1: A 90 SER OG : rot -78:sc= 1.22 USER MOD Set 5.2: A 97 CYS SG : rot 172:sc= -1.56! USER MOD Set 6.1: A 77 GLN : amide:sc= 0.124 X(o=-0.24,f=-0.6) USER MOD Set 6.2: A 91 GLN : amide:sc= -0.362 X(o=-0.24,f=-0.6) USER MOD Set 7.1: A 72 SER OG : rot 171:sc= 1.36 USER MOD Set 7.2: A 75 THR OG1 : rot -163:sc= 1.64 USER MOD Set 8.1: A 32 ASN : amide:sc= -4.84! C(o=-10!,f=-9!) USER MOD Set 8.2: A 35 HIS : no HD1:sc= -5.56! C(o=-10!,f=-22!) USER MOD Single : A 30 CYS SG : rot 168:sc= -2.14! USER MOD Single : A 44 THR OG1 : rot 64:sc= 0.623 USER MOD Single : A 48 THR OG1 : rot -178:sc= 1.98 USER MOD Single : A 52 SER OG : rot 180:sc= -0.159 USER MOD Single : A 54 GLN : amide:sc= 1.2 K(o=1.2,f=-0.088) USER MOD Single : A 55 HIS : no HD1:sc= -3.98! C(o=-4!,f=-3.6!) USER MOD Single : A 57 GLN : amide:sc= -2.33 K(o=-2.3,f=-6.9!) USER MOD Single : A 59 GLN : amide:sc= 0.561 K(o=0.56,f=-4.6!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 42:sc= 0.245 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 155:sc=0.000801 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0217 USER MOD Single : A 88 TYR OH : rot -30:sc= 1.18 USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0513 USER MOD Single : A 94 ASN : amide:sc= -0.937 K(o=-0.94,f=-4.5!) USER MOD Single : A 109 ASN : amide:sc= 0.403 X(o=0.4,f=0.017) USER MOD Single : A 111 TYR OH : rot 180:sc= -0.117 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -179:sc= -1.09! (180deg=-1.12!) USER MOD Single : A 128 ASN : amide:sc= -0.289 X(o=-0.29,f=0) USER MOD Single : A 130 SER OG : rot 95:sc= 0.908 USER MOD Single : A 131 CYS SG : rot -150:sc= -2.8 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 135:sc= 0.551 USER MOD Single : A 138 HIS : no HE2:sc= 0.634 K(o=0.63,f=-3.1!) USER MOD Single : A 141 GLN : amide:sc= 0.0519 K(o=0.052,f=-0.62) USER MOD Single : A 142 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0454) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -6.642 4.528 3.003 1.00 0.00 N ATOM 22 CA CYS A 30 -7.510 3.439 2.524 1.00 0.00 C ATOM 23 C CYS A 30 -8.879 3.522 3.183 1.00 0.00 C ATOM 24 O CYS A 30 -8.972 3.673 4.405 1.00 0.00 O ATOM 25 CB CYS A 30 -6.895 2.072 2.881 1.00 0.00 C ATOM 26 SG CYS A 30 -7.711 0.639 2.102 1.00 0.00 S ATOM 0 HA CYS A 30 -7.607 3.541 1.443 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -5.844 2.075 2.592 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -6.927 1.946 3.963 1.00 0.00 H new ATOM 0 HG CYS A 30 -6.969 -0.418 2.253 1.00 0.00 H new ATOM 27 N SER A 31 -9.917 3.275 2.382 1.00 0.00 N ATOM 28 CA SER A 31 -11.284 3.058 2.882 1.00 0.00 C ATOM 29 C SER A 31 -11.432 1.560 3.233 1.00 0.00 C ATOM 30 O SER A 31 -12.136 0.787 2.589 1.00 0.00 O ATOM 31 CB SER A 31 -12.331 3.507 1.861 1.00 0.00 C ATOM 32 OG SER A 31 -12.212 4.900 1.564 1.00 0.00 O ATOM 0 H SER A 31 -9.838 3.219 1.367 1.00 0.00 H new ATOM 0 HA SER A 31 -11.454 3.662 3.774 1.00 0.00 H new ATOM 0 HB2 SER A 31 -12.218 2.928 0.944 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.329 3.301 2.248 1.00 0.00 H new ATOM 0 HG SER A 31 -12.703 5.102 0.740 1.00 0.00 H new ATOM 33 N ASN A 32 -10.563 1.180 4.173 1.00 0.00 N ATOM 34 CA ASN A 32 -10.464 -0.200 4.677 1.00 0.00 C ATOM 35 C ASN A 32 -11.495 -0.395 5.822 1.00 0.00 C ATOM 36 O ASN A 32 -12.348 -1.275 5.749 1.00 0.00 O ATOM 37 CB ASN A 32 -9.033 -0.604 5.044 1.00 0.00 C ATOM 38 CG ASN A 32 -8.408 0.056 6.274 1.00 0.00 C ATOM 39 OD1 ASN A 32 -8.149 1.249 6.359 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.419 -0.719 7.335 1.00 0.00 N ATOM 0 H ASN A 32 -9.902 1.822 4.611 1.00 0.00 H new ATOM 0 HA ASN A 32 -10.721 -0.892 3.875 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -9.016 -1.683 5.196 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -8.393 -0.393 4.187 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.209 -0.329 8.254 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -8.638 -1.711 7.240 1.00 0.00 H new ATOM 41 N GLY A 33 -11.117 0.170 6.965 1.00 0.00 N ATOM 42 CA GLY A 33 -11.988 0.638 8.053 1.00 0.00 C ATOM 43 C GLY A 33 -11.951 2.156 7.846 1.00 0.00 C ATOM 44 O GLY A 33 -12.910 2.751 7.358 1.00 0.00 O ATOM 0 H GLY A 33 -10.131 0.326 7.175 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.998 0.238 7.970 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -11.610 0.349 9.034 1.00 0.00 H new ATOM 45 N GLY A 34 -10.769 2.714 8.120 1.00 0.00 N ATOM 46 CA GLY A 34 -10.373 3.989 7.506 1.00 0.00 C ATOM 47 C GLY A 34 -9.092 4.561 8.105 1.00 0.00 C ATOM 48 O GLY A 34 -9.122 5.414 8.997 1.00 0.00 O ATOM 0 H GLY A 34 -10.077 2.312 8.753 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -10.234 3.843 6.435 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -11.180 4.712 7.628 1.00 0.00 H new ATOM 49 N HIS A 35 -7.975 4.089 7.570 1.00 0.00 N ATOM 50 CA HIS A 35 -6.663 4.453 8.118 1.00 0.00 C ATOM 51 C HIS A 35 -5.811 5.178 7.057 1.00 0.00 C ATOM 52 O HIS A 35 -6.239 5.295 5.914 1.00 0.00 O ATOM 53 CB HIS A 35 -5.958 3.217 8.690 1.00 0.00 C ATOM 54 CG HIS A 35 -6.869 2.371 9.586 1.00 0.00 C ATOM 55 ND1 HIS A 35 -7.782 1.492 9.184 1.00 0.00 N ATOM 56 CD2 HIS A 35 -6.980 2.507 10.902 1.00 0.00 C ATOM 57 CE1 HIS A 35 -8.443 1.058 10.258 1.00 0.00 C ATOM 58 NE2 HIS A 35 -7.954 1.696 11.314 1.00 0.00 N ATOM 0 H HIS A 35 -7.943 3.461 6.767 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.805 5.152 8.942 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.592 2.601 7.868 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -5.087 3.535 9.263 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -6.387 3.158 11.527 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -9.233 0.321 10.267 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -8.270 1.585 12.277 1.00 0.00 H new ATOM 59 N PHE A 36 -4.545 5.386 7.392 1.00 0.00 N ATOM 60 CA PHE A 36 -3.621 6.237 6.618 1.00 0.00 C ATOM 61 C PHE A 36 -2.320 5.449 6.445 1.00 0.00 C ATOM 62 O PHE A 36 -1.800 4.909 7.411 1.00 0.00 O ATOM 63 CB PHE A 36 -3.366 7.524 7.397 1.00 0.00 C ATOM 64 CG PHE A 36 -4.359 8.634 7.038 1.00 0.00 C ATOM 65 CD1 PHE A 36 -5.697 8.584 7.512 1.00 0.00 C ATOM 66 CD2 PHE A 36 -3.913 9.701 6.234 1.00 0.00 C ATOM 67 CE1 PHE A 36 -6.595 9.623 7.178 1.00 0.00 C ATOM 68 CE2 PHE A 36 -4.805 10.749 5.890 1.00 0.00 C ATOM 69 CZ PHE A 36 -6.134 10.698 6.369 1.00 0.00 C ATOM 0 H PHE A 36 -4.115 4.968 8.217 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.034 6.499 5.644 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -3.429 7.317 8.465 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -2.352 7.870 7.198 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -6.026 7.757 8.124 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.893 9.721 5.880 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -7.615 9.601 7.532 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -4.475 11.571 5.273 1.00 0.00 H new ATOM 0 HZ PHE A 36 -6.816 11.495 6.114 1.00 0.00 H new ATOM 70 N LEU A 37 -1.924 5.301 5.192 1.00 0.00 N ATOM 71 CA LEU A 37 -0.751 4.508 4.814 1.00 0.00 C ATOM 72 C LEU A 37 0.520 5.282 5.192 1.00 0.00 C ATOM 73 O LEU A 37 0.987 6.159 4.466 1.00 0.00 O ATOM 74 CB LEU A 37 -0.809 4.261 3.307 1.00 0.00 C ATOM 75 CG LEU A 37 -0.110 2.976 2.855 1.00 0.00 C ATOM 76 CD1 LEU A 37 -0.301 2.856 1.342 1.00 0.00 C ATOM 77 CD2 LEU A 37 1.387 2.935 3.183 1.00 0.00 C ATOM 0 H LEU A 37 -2.405 5.727 4.400 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.740 3.551 5.336 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.853 4.222 2.996 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -0.355 5.108 2.793 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.558 2.144 3.399 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.186 1.949 0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.366 2.811 1.112 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.140 3.723 0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.811 1.994 2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.890 3.766 2.690 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.526 3.015 4.261 1.00 0.00 H new ATOM 78 N ARG A 38 1.033 4.975 6.378 1.00 0.00 N ATOM 79 CA ARG A 38 2.257 5.610 6.883 1.00 0.00 C ATOM 80 C ARG A 38 3.454 4.675 6.750 1.00 0.00 C ATOM 81 O ARG A 38 3.457 3.550 7.265 1.00 0.00 O ATOM 82 CB ARG A 38 2.052 6.097 8.326 1.00 0.00 C ATOM 83 CG ARG A 38 3.245 6.898 8.852 1.00 0.00 C ATOM 84 CD ARG A 38 3.114 7.396 10.288 1.00 0.00 C ATOM 85 NE ARG A 38 2.804 6.243 11.140 1.00 0.00 N ATOM 86 CZ ARG A 38 1.903 6.146 12.127 1.00 0.00 C ATOM 87 NH1 ARG A 38 0.870 6.969 12.211 1.00 0.00 N ATOM 88 NH2 ARG A 38 1.878 5.045 12.864 1.00 0.00 N ATOM 0 H ARG A 38 0.624 4.290 7.013 1.00 0.00 H new ATOM 0 HA ARG A 38 2.476 6.486 6.272 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.155 6.715 8.373 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.882 5.238 8.975 1.00 0.00 H new ATOM 0 HG2 ARG A 38 4.138 6.277 8.780 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.401 7.757 8.200 1.00 0.00 H new ATOM 0 HD2 ARG A 38 4.039 7.872 10.612 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.327 8.147 10.361 1.00 0.00 H new ATOM 0 HE ARG A 38 3.348 5.400 10.956 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.744 7.702 11.513 1.00 0.00 H new ATOM 0 HH12 ARG A 38 0.200 6.871 12.974 1.00 0.00 H new ATOM 0 HH21 ARG A 38 2.537 4.290 12.675 1.00 0.00 H new ATOM 0 HH22 ARG A 38 1.199 4.953 13.620 1.00 0.00 H new ATOM 89 N ILE A 39 4.355 5.111 5.885 1.00 0.00 N ATOM 90 CA ILE A 39 5.700 4.522 5.793 1.00 0.00 C ATOM 91 C ILE A 39 6.598 5.318 6.732 1.00 0.00 C ATOM 92 O ILE A 39 6.884 6.505 6.558 1.00 0.00 O ATOM 93 CB ILE A 39 6.141 4.429 4.319 1.00 0.00 C ATOM 94 CG1 ILE A 39 7.368 3.521 4.199 1.00 0.00 C ATOM 95 CG2 ILE A 39 6.413 5.788 3.674 1.00 0.00 C ATOM 96 CD1 ILE A 39 7.465 2.898 2.805 1.00 0.00 C ATOM 0 H ILE A 39 4.187 5.874 5.229 1.00 0.00 H new ATOM 0 HA ILE A 39 5.747 3.485 6.127 1.00 0.00 H new ATOM 0 HB ILE A 39 5.304 3.999 3.769 1.00 0.00 H new ATOM 0 HG12 ILE A 39 8.270 4.096 4.406 1.00 0.00 H new ATOM 0 HG13 ILE A 39 7.314 2.732 4.949 1.00 0.00 H new ATOM 0 HG21 ILE A 39 6.719 5.644 2.638 1.00 0.00 H new ATOM 0 HG22 ILE A 39 5.507 6.393 3.704 1.00 0.00 H new ATOM 0 HG23 ILE A 39 7.208 6.297 4.219 1.00 0.00 H new ATOM 0 HD11 ILE A 39 8.347 2.259 2.753 1.00 0.00 H new ATOM 0 HD12 ILE A 39 6.573 2.303 2.610 1.00 0.00 H new ATOM 0 HD13 ILE A 39 7.544 3.688 2.058 1.00 0.00 H new ATOM 97 N LEU A 40 6.763 4.677 7.872 1.00 0.00 N ATOM 98 CA LEU A 40 7.406 5.252 9.052 1.00 0.00 C ATOM 99 C LEU A 40 8.837 5.712 8.730 1.00 0.00 C ATOM 100 O LEU A 40 9.499 5.050 7.927 1.00 0.00 O ATOM 101 CB LEU A 40 7.456 4.212 10.187 1.00 0.00 C ATOM 102 CG LEU A 40 6.166 4.011 10.989 1.00 0.00 C ATOM 103 CD1 LEU A 40 5.903 5.270 11.790 1.00 0.00 C ATOM 104 CD2 LEU A 40 4.944 3.642 10.148 1.00 0.00 C ATOM 0 H LEU A 40 6.448 3.717 8.014 1.00 0.00 H new ATOM 0 HA LEU A 40 6.819 6.115 9.366 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.743 3.252 9.758 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.247 4.501 10.880 1.00 0.00 H new ATOM 0 HG LEU A 40 6.322 3.151 11.640 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.988 5.148 12.369 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.739 5.452 12.466 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.793 6.116 11.112 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.078 3.520 10.799 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.746 4.434 9.426 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.135 2.708 9.619 1.00 0.00 H new ATOM 105 N PRO A 41 9.357 6.713 9.455 1.00 0.00 N ATOM 106 CA PRO A 41 10.781 7.102 9.341 1.00 0.00 C ATOM 107 C PRO A 41 11.716 5.905 9.623 1.00 0.00 C ATOM 108 O PRO A 41 12.670 5.676 8.883 1.00 0.00 O ATOM 109 CB PRO A 41 10.959 8.257 10.322 1.00 0.00 C ATOM 110 CG PRO A 41 9.825 8.078 11.342 1.00 0.00 C ATOM 111 CD PRO A 41 8.684 7.440 10.540 1.00 0.00 C ATOM 0 HA PRO A 41 11.049 7.416 8.332 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.936 8.220 10.805 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.889 9.220 9.817 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.133 7.440 12.170 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.523 9.033 11.771 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.091 6.768 11.160 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.003 8.196 10.148 1.00 0.00 H new ATOM 112 N ASP A 42 11.225 5.007 10.475 1.00 0.00 N ATOM 113 CA ASP A 42 11.864 3.752 10.912 1.00 0.00 C ATOM 114 C ASP A 42 11.668 2.560 9.959 1.00 0.00 C ATOM 115 O ASP A 42 11.554 1.415 10.391 1.00 0.00 O ATOM 116 CB ASP A 42 11.275 3.485 12.302 1.00 0.00 C ATOM 117 CG ASP A 42 11.915 4.436 13.324 1.00 0.00 C ATOM 118 OD1 ASP A 42 11.371 5.555 13.443 1.00 0.00 O ATOM 119 OD2 ASP A 42 12.972 4.055 13.876 1.00 0.00 O ATOM 0 H ASP A 42 10.312 5.138 10.911 1.00 0.00 H new ATOM 0 HA ASP A 42 12.948 3.864 10.922 1.00 0.00 H new ATOM 0 HB2 ASP A 42 10.195 3.628 12.284 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.455 2.450 12.591 1.00 0.00 H new ATOM 120 N GLY A 43 11.461 2.876 8.674 1.00 0.00 N ATOM 121 CA GLY A 43 11.300 1.904 7.568 1.00 0.00 C ATOM 122 C GLY A 43 10.241 0.822 7.817 1.00 0.00 C ATOM 123 O GLY A 43 10.388 -0.316 7.373 1.00 0.00 O ATOM 0 H GLY A 43 11.398 3.844 8.358 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.039 2.447 6.660 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.259 1.420 7.385 1.00 0.00 H new ATOM 124 N THR A 44 9.153 1.224 8.455 1.00 0.00 N ATOM 125 CA THR A 44 8.047 0.327 8.863 1.00 0.00 C ATOM 126 C THR A 44 6.779 0.838 8.173 1.00 0.00 C ATOM 127 O THR A 44 6.634 2.036 7.973 1.00 0.00 O ATOM 128 CB THR A 44 7.935 0.374 10.394 1.00 0.00 C ATOM 129 OG1 THR A 44 9.137 -0.155 10.971 1.00 0.00 O ATOM 130 CG2 THR A 44 6.721 -0.361 10.966 1.00 0.00 C ATOM 0 H THR A 44 8.997 2.198 8.715 1.00 0.00 H new ATOM 0 HA THR A 44 8.212 -0.711 8.573 1.00 0.00 H new ATOM 0 HB THR A 44 7.795 1.422 10.657 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.894 0.419 10.733 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.723 -0.276 12.053 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.807 0.081 10.569 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.767 -1.413 10.685 1.00 0.00 H new ATOM 131 N VAL A 45 5.899 -0.064 7.768 1.00 0.00 N ATOM 132 CA VAL A 45 4.684 0.347 7.027 1.00 0.00 C ATOM 133 C VAL A 45 3.437 0.021 7.854 1.00 0.00 C ATOM 134 O VAL A 45 3.146 -1.140 8.147 1.00 0.00 O ATOM 135 CB VAL A 45 4.726 -0.290 5.627 1.00 0.00 C ATOM 136 CG1 VAL A 45 3.501 0.038 4.786 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.934 0.256 4.868 1.00 0.00 C ATOM 0 H VAL A 45 5.986 -1.068 7.928 1.00 0.00 H new ATOM 0 HA VAL A 45 4.644 1.425 6.872 1.00 0.00 H new ATOM 0 HB VAL A 45 4.771 -1.368 5.780 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.591 -0.440 3.811 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.606 -0.328 5.289 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.428 1.118 4.655 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.972 -0.190 3.874 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.847 1.339 4.776 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.847 0.010 5.411 1.00 0.00 H new ATOM 138 N ASP A 46 2.819 1.087 8.350 1.00 0.00 N ATOM 139 CA ASP A 46 1.638 0.997 9.221 1.00 0.00 C ATOM 140 C ASP A 46 0.509 1.970 8.838 1.00 0.00 C ATOM 141 O ASP A 46 0.763 3.125 8.527 1.00 0.00 O ATOM 142 CB ASP A 46 2.006 1.266 10.688 1.00 0.00 C ATOM 143 CG ASP A 46 2.891 0.226 11.380 1.00 0.00 C ATOM 144 OD1 ASP A 46 2.922 -0.948 10.958 1.00 0.00 O ATOM 145 OD2 ASP A 46 3.507 0.624 12.395 1.00 0.00 O ATOM 0 H ASP A 46 3.119 2.044 8.163 1.00 0.00 H new ATOM 0 HA ASP A 46 1.275 -0.022 9.088 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.511 2.230 10.740 1.00 0.00 H new ATOM 0 HB3 ASP A 46 1.082 1.359 11.258 1.00 0.00 H new ATOM 146 N GLY A 47 -0.682 1.408 8.663 1.00 0.00 N ATOM 147 CA GLY A 47 -1.936 2.186 8.748 1.00 0.00 C ATOM 148 C GLY A 47 -2.181 2.538 10.219 1.00 0.00 C ATOM 149 O GLY A 47 -1.508 2.007 11.117 1.00 0.00 O ATOM 0 H GLY A 47 -0.817 0.417 8.461 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.863 3.092 8.147 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.770 1.607 8.351 1.00 0.00 H new ATOM 150 N THR A 48 -3.291 3.218 10.483 1.00 0.00 N ATOM 151 CA THR A 48 -3.448 3.913 11.769 1.00 0.00 C ATOM 152 C THR A 48 -4.772 4.664 11.956 1.00 0.00 C ATOM 153 O THR A 48 -5.285 5.276 11.032 1.00 0.00 O ATOM 154 CB THR A 48 -2.311 4.935 11.933 1.00 0.00 C ATOM 155 OG1 THR A 48 -2.368 5.419 13.273 1.00 0.00 O ATOM 156 CG2 THR A 48 -2.351 6.037 10.854 1.00 0.00 C ATOM 0 H THR A 48 -4.082 3.306 9.845 1.00 0.00 H new ATOM 0 HA THR A 48 -3.428 3.122 12.519 1.00 0.00 H new ATOM 0 HB THR A 48 -1.340 4.466 11.772 1.00 0.00 H new ATOM 0 HG1 THR A 48 -1.672 6.096 13.406 1.00 0.00 H new ATOM 0 HG21 THR A 48 -1.528 6.733 11.014 1.00 0.00 H new ATOM 0 HG22 THR A 48 -2.256 5.584 9.867 1.00 0.00 H new ATOM 0 HG23 THR A 48 -3.298 6.574 10.917 1.00 0.00 H new ATOM 157 N ARG A 49 -5.258 4.611 13.195 1.00 0.00 N ATOM 158 CA ARG A 49 -6.300 5.543 13.650 1.00 0.00 C ATOM 159 C ARG A 49 -5.787 6.889 14.196 1.00 0.00 C ATOM 160 O ARG A 49 -6.579 7.766 14.540 1.00 0.00 O ATOM 161 CB ARG A 49 -7.270 4.858 14.620 1.00 0.00 C ATOM 162 CG ARG A 49 -8.311 4.145 13.767 1.00 0.00 C ATOM 163 CD ARG A 49 -9.432 3.511 14.583 1.00 0.00 C ATOM 164 NE ARG A 49 -10.401 2.926 13.639 1.00 0.00 N ATOM 165 CZ ARG A 49 -10.519 1.635 13.344 1.00 0.00 C ATOM 166 NH1 ARG A 49 -9.756 0.715 13.924 1.00 0.00 N ATOM 167 NH2 ARG A 49 -11.446 1.201 12.497 1.00 0.00 N ATOM 0 H ARG A 49 -4.953 3.940 13.900 1.00 0.00 H new ATOM 0 HA ARG A 49 -6.845 5.819 12.747 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -6.743 4.150 15.259 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -7.742 5.589 15.276 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -8.742 4.857 13.063 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -7.819 3.372 13.177 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -9.034 2.743 15.247 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -9.915 4.258 15.213 1.00 0.00 H new ATOM 0 HE ARG A 49 -11.038 3.569 13.170 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -9.058 0.992 14.615 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -9.868 -0.269 13.679 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -12.086 1.863 12.058 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -11.518 0.206 12.286 1.00 0.00 H new ATOM 168 N ASP A 50 -4.466 7.039 14.294 1.00 0.00 N ATOM 169 CA ASP A 50 -3.800 8.300 14.691 1.00 0.00 C ATOM 170 C ASP A 50 -2.461 8.478 13.964 1.00 0.00 C ATOM 171 O ASP A 50 -1.528 7.689 14.130 1.00 0.00 O ATOM 172 CB ASP A 50 -3.549 8.281 16.196 1.00 0.00 C ATOM 173 CG ASP A 50 -4.837 8.413 17.008 1.00 0.00 C ATOM 174 OD1 ASP A 50 -5.332 9.556 17.105 1.00 0.00 O ATOM 175 OD2 ASP A 50 -5.271 7.372 17.541 1.00 0.00 O ATOM 0 H ASP A 50 -3.810 6.282 14.099 1.00 0.00 H new ATOM 0 HA ASP A 50 -4.452 9.130 14.420 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -3.048 7.351 16.465 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -2.873 9.095 16.458 1.00 0.00 H new ATOM 176 N ARG A 51 -2.397 9.499 13.120 1.00 0.00 N ATOM 177 CA ARG A 51 -1.127 9.870 12.448 1.00 0.00 C ATOM 178 C ARG A 51 -0.099 10.441 13.447 1.00 0.00 C ATOM 179 O ARG A 51 -0.123 11.609 13.794 1.00 0.00 O ATOM 180 CB ARG A 51 -1.343 10.827 11.268 1.00 0.00 C ATOM 181 CG ARG A 51 -2.213 10.192 10.178 1.00 0.00 C ATOM 182 CD ARG A 51 -3.591 10.822 10.213 1.00 0.00 C ATOM 183 NE ARG A 51 -4.596 9.748 10.342 1.00 0.00 N ATOM 184 CZ ARG A 51 -5.415 9.563 11.372 1.00 0.00 C ATOM 185 NH1 ARG A 51 -5.892 10.580 12.063 1.00 0.00 N ATOM 186 NH2 ARG A 51 -6.162 8.474 11.424 1.00 0.00 N ATOM 0 H ARG A 51 -3.193 10.089 12.876 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.717 8.947 12.037 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -1.815 11.743 11.623 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -0.378 11.109 10.846 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.757 10.340 9.199 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.287 9.116 10.336 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -3.669 11.516 11.050 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -3.767 11.398 9.304 1.00 0.00 H new ATOM 0 HE ARG A 51 -4.668 9.087 9.569 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -5.634 11.534 11.811 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.519 10.413 12.850 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -6.108 7.782 10.677 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -6.793 8.325 12.212 1.00 0.00 H new ATOM 187 N SER A 52 0.814 9.543 13.820 1.00 0.00 N ATOM 188 CA SER A 52 1.867 9.789 14.823 1.00 0.00 C ATOM 189 C SER A 52 2.715 11.019 14.422 1.00 0.00 C ATOM 190 O SER A 52 2.868 11.975 15.183 1.00 0.00 O ATOM 191 CB SER A 52 2.742 8.531 14.954 1.00 0.00 C ATOM 192 OG SER A 52 3.307 8.171 13.689 1.00 0.00 O ATOM 0 H SER A 52 0.848 8.602 13.428 1.00 0.00 H new ATOM 0 HA SER A 52 1.411 10.004 15.789 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.539 8.710 15.676 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.144 7.705 15.339 1.00 0.00 H new ATOM 0 HG SER A 52 3.861 7.370 13.794 1.00 0.00 H new ATOM 193 N ASP A 53 3.283 10.905 13.234 1.00 0.00 N ATOM 194 CA ASP A 53 3.945 11.979 12.477 1.00 0.00 C ATOM 195 C ASP A 53 3.864 11.656 10.999 1.00 0.00 C ATOM 196 O ASP A 53 3.856 10.479 10.625 1.00 0.00 O ATOM 197 CB ASP A 53 5.420 12.116 12.898 1.00 0.00 C ATOM 198 CG ASP A 53 5.628 12.663 14.305 1.00 0.00 C ATOM 199 OD1 ASP A 53 5.576 13.906 14.445 1.00 0.00 O ATOM 200 OD2 ASP A 53 5.980 11.846 15.177 1.00 0.00 O ATOM 0 H ASP A 53 3.301 10.015 12.735 1.00 0.00 H new ATOM 0 HA ASP A 53 3.442 12.924 12.685 1.00 0.00 H new ATOM 0 HB2 ASP A 53 5.897 11.138 12.828 1.00 0.00 H new ATOM 0 HB3 ASP A 53 5.928 12.770 12.189 1.00 0.00 H new ATOM 201 N GLN A 54 3.414 12.684 10.302 1.00 0.00 N ATOM 202 CA GLN A 54 3.263 12.803 8.840 1.00 0.00 C ATOM 203 C GLN A 54 4.394 12.204 7.985 1.00 0.00 C ATOM 204 O GLN A 54 5.294 12.890 7.501 1.00 0.00 O ATOM 205 CB GLN A 54 3.033 14.301 8.595 1.00 0.00 C ATOM 206 CG GLN A 54 2.485 14.632 7.204 1.00 0.00 C ATOM 207 CD GLN A 54 2.136 16.121 7.113 1.00 0.00 C ATOM 208 OE1 GLN A 54 1.029 16.559 7.395 1.00 0.00 O ATOM 209 NE2 GLN A 54 3.104 16.937 6.777 1.00 0.00 N ATOM 0 H GLN A 54 3.116 13.538 10.774 1.00 0.00 H new ATOM 0 HA GLN A 54 2.428 12.188 8.504 1.00 0.00 H new ATOM 0 HB2 GLN A 54 2.339 14.678 9.346 1.00 0.00 H new ATOM 0 HB3 GLN A 54 3.975 14.830 8.737 1.00 0.00 H new ATOM 0 HG2 GLN A 54 3.224 14.377 6.444 1.00 0.00 H new ATOM 0 HG3 GLN A 54 1.599 14.030 7.002 1.00 0.00 H new ATOM 0 HE21 GLN A 54 4.025 16.567 6.543 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.937 17.943 6.750 1.00 0.00 H new ATOM 210 N HIS A 55 4.452 10.880 8.073 1.00 0.00 N ATOM 211 CA HIS A 55 5.206 9.982 7.186 1.00 0.00 C ATOM 212 C HIS A 55 4.270 9.143 6.289 1.00 0.00 C ATOM 213 O HIS A 55 4.625 8.097 5.752 1.00 0.00 O ATOM 214 CB HIS A 55 6.120 9.130 8.090 1.00 0.00 C ATOM 215 CG HIS A 55 7.117 10.044 8.806 1.00 0.00 C ATOM 216 ND1 HIS A 55 7.045 10.386 10.086 1.00 0.00 N ATOM 217 CD2 HIS A 55 8.019 10.836 8.232 1.00 0.00 C ATOM 218 CE1 HIS A 55 7.890 11.394 10.300 1.00 0.00 C ATOM 219 NE2 HIS A 55 8.478 11.682 9.147 1.00 0.00 N ATOM 0 H HIS A 55 3.950 10.371 8.801 1.00 0.00 H new ATOM 0 HA HIS A 55 5.817 10.545 6.480 1.00 0.00 H new ATOM 0 HB2 HIS A 55 5.522 8.583 8.819 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.652 8.389 7.494 1.00 0.00 H new ATOM 0 HD2 HIS A 55 8.326 10.797 7.197 1.00 0.00 H new ATOM 0 HE1 HIS A 55 8.065 11.888 11.244 1.00 0.00 H new ATOM 0 HE2 HIS A 55 9.162 12.422 8.990 1.00 0.00 H new ATOM 220 N ILE A 56 2.988 9.502 6.394 1.00 0.00 N ATOM 221 CA ILE A 56 1.887 9.164 5.444 1.00 0.00 C ATOM 222 C ILE A 56 2.268 9.453 3.997 1.00 0.00 C ATOM 223 O ILE A 56 2.779 10.503 3.618 1.00 0.00 O ATOM 224 CB ILE A 56 0.541 9.712 5.950 1.00 0.00 C ATOM 225 CG1 ILE A 56 0.583 11.172 6.436 1.00 0.00 C ATOM 226 CG2 ILE A 56 -0.040 8.804 7.028 1.00 0.00 C ATOM 227 CD1 ILE A 56 0.260 12.154 5.310 1.00 0.00 C ATOM 0 H ILE A 56 2.657 10.065 7.178 1.00 0.00 H new ATOM 0 HA ILE A 56 1.729 8.086 5.422 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.113 9.716 5.078 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.130 11.305 7.250 1.00 0.00 H new ATOM 0 HG13 ILE A 56 1.572 11.393 6.839 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.991 9.210 7.372 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.198 7.807 6.617 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.654 8.745 7.867 1.00 0.00 H new ATOM 0 HD11 ILE A 56 0.300 13.173 5.694 1.00 0.00 H new ATOM 0 HD12 ILE A 56 0.988 12.040 4.507 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.739 11.950 4.925 1.00 0.00 H new ATOM 228 N GLN A 57 2.304 8.298 3.359 1.00 0.00 N ATOM 229 CA GLN A 57 2.974 8.026 2.084 1.00 0.00 C ATOM 230 C GLN A 57 2.292 8.550 0.805 1.00 0.00 C ATOM 231 O GLN A 57 2.643 9.624 0.303 1.00 0.00 O ATOM 232 CB GLN A 57 3.198 6.506 2.043 1.00 0.00 C ATOM 233 CG GLN A 57 3.876 6.030 0.761 1.00 0.00 C ATOM 234 CD GLN A 57 3.923 4.517 0.648 1.00 0.00 C ATOM 235 OE1 GLN A 57 2.924 3.850 0.439 1.00 0.00 O ATOM 236 NE2 GLN A 57 5.118 3.976 0.733 1.00 0.00 N ATOM 0 H GLN A 57 1.841 7.470 3.733 1.00 0.00 H new ATOM 0 HA GLN A 57 3.902 8.597 2.068 1.00 0.00 H new ATOM 0 HB2 GLN A 57 3.807 6.212 2.898 1.00 0.00 H new ATOM 0 HB3 GLN A 57 2.238 6.001 2.147 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.344 6.438 -0.099 1.00 0.00 H new ATOM 0 HG3 GLN A 57 4.891 6.424 0.724 1.00 0.00 H new ATOM 0 HE21 GLN A 57 5.933 4.564 0.909 1.00 0.00 H new ATOM 0 HE22 GLN A 57 5.231 2.968 0.623 1.00 0.00 H new ATOM 237 N LEU A 58 1.200 7.869 0.491 1.00 0.00 N ATOM 238 CA LEU A 58 0.729 7.597 -0.871 1.00 0.00 C ATOM 239 C LEU A 58 0.665 8.746 -1.877 1.00 0.00 C ATOM 240 O LEU A 58 -0.167 9.654 -1.831 1.00 0.00 O ATOM 241 CB LEU A 58 -0.482 6.678 -0.755 1.00 0.00 C ATOM 242 CG LEU A 58 -1.363 6.481 -2.003 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.592 5.997 -3.246 1.00 0.00 C ATOM 244 CD2 LEU A 58 -2.477 5.490 -1.679 1.00 0.00 C ATOM 0 H LEU A 58 0.588 7.472 1.204 1.00 0.00 H new ATOM 0 HA LEU A 58 1.525 7.080 -1.407 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.128 5.697 -0.438 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -1.116 7.061 0.044 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.765 7.462 -2.256 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.283 5.883 -4.081 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.174 6.727 -3.506 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.121 5.038 -3.031 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -3.104 5.347 -2.559 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.041 4.535 -1.385 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -3.083 5.879 -0.861 1.00 0.00 H new ATOM 245 N GLN A 59 1.754 8.702 -2.623 1.00 0.00 N ATOM 246 CA GLN A 59 1.958 9.413 -3.881 1.00 0.00 C ATOM 247 C GLN A 59 2.648 8.477 -4.866 1.00 0.00 C ATOM 248 O GLN A 59 3.359 7.555 -4.462 1.00 0.00 O ATOM 249 CB GLN A 59 2.822 10.646 -3.579 1.00 0.00 C ATOM 250 CG GLN A 59 3.069 11.588 -4.772 1.00 0.00 C ATOM 251 CD GLN A 59 1.798 11.882 -5.576 1.00 0.00 C ATOM 252 OE1 GLN A 59 1.505 11.273 -6.588 1.00 0.00 O ATOM 253 NE2 GLN A 59 1.013 12.843 -5.146 1.00 0.00 N ATOM 0 H GLN A 59 2.564 8.142 -2.358 1.00 0.00 H new ATOM 0 HA GLN A 59 1.016 9.734 -4.325 1.00 0.00 H new ATOM 0 HB2 GLN A 59 2.346 11.215 -2.781 1.00 0.00 H new ATOM 0 HB3 GLN A 59 3.786 10.309 -3.199 1.00 0.00 H new ATOM 0 HG2 GLN A 59 3.486 12.526 -4.407 1.00 0.00 H new ATOM 0 HG3 GLN A 59 3.814 11.143 -5.431 1.00 0.00 H new ATOM 0 HE21 GLN A 59 1.253 13.357 -4.298 1.00 0.00 H new ATOM 0 HE22 GLN A 59 0.163 13.075 -5.660 1.00 0.00 H new ATOM 254 N LEU A 60 2.304 8.619 -6.137 1.00 0.00 N ATOM 255 CA LEU A 60 2.646 7.536 -7.053 1.00 0.00 C ATOM 256 C LEU A 60 3.225 7.915 -8.426 1.00 0.00 C ATOM 257 O LEU A 60 2.780 8.833 -9.109 1.00 0.00 O ATOM 258 CB LEU A 60 1.522 6.537 -7.132 1.00 0.00 C ATOM 259 CG LEU A 60 0.210 6.984 -7.793 1.00 0.00 C ATOM 260 CD1 LEU A 60 -0.606 5.704 -7.711 1.00 0.00 C ATOM 261 CD2 LEU A 60 -0.564 8.089 -7.066 1.00 0.00 C ATOM 0 H LEU A 60 1.819 9.419 -6.542 1.00 0.00 H new ATOM 0 HA LEU A 60 3.517 7.067 -6.595 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.888 5.664 -7.672 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.292 6.211 -6.118 1.00 0.00 H new ATOM 0 HG LEU A 60 0.403 7.408 -8.779 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.589 5.870 -8.153 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.093 4.910 -8.254 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.722 5.413 -6.667 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.472 8.324 -7.622 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.830 7.749 -6.065 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.058 8.981 -6.993 1.00 0.00 H new ATOM 262 N SER A 61 4.127 7.042 -8.826 1.00 0.00 N ATOM 263 CA SER A 61 4.934 7.180 -10.050 1.00 0.00 C ATOM 264 C SER A 61 4.878 5.887 -10.859 1.00 0.00 C ATOM 265 O SER A 61 5.366 4.831 -10.446 1.00 0.00 O ATOM 266 CB SER A 61 6.399 7.406 -9.679 1.00 0.00 C ATOM 267 OG SER A 61 6.491 8.228 -8.514 1.00 0.00 O ATOM 0 H SER A 61 4.334 6.190 -8.304 1.00 0.00 H new ATOM 0 HA SER A 61 4.539 8.018 -10.625 1.00 0.00 H new ATOM 0 HB2 SER A 61 6.888 6.449 -9.497 1.00 0.00 H new ATOM 0 HB3 SER A 61 6.923 7.879 -10.509 1.00 0.00 H new ATOM 0 HG SER A 61 7.434 8.365 -8.284 1.00 0.00 H new ATOM 268 N ALA A 62 4.111 5.937 -11.937 1.00 0.00 N ATOM 269 CA ALA A 62 3.968 4.791 -12.854 1.00 0.00 C ATOM 270 C ALA A 62 5.069 4.690 -13.905 1.00 0.00 C ATOM 271 O ALA A 62 5.274 5.573 -14.738 1.00 0.00 O ATOM 272 CB ALA A 62 2.559 4.778 -13.458 1.00 0.00 C ATOM 0 H ALA A 62 3.571 6.758 -12.209 1.00 0.00 H new ATOM 0 HA ALA A 62 4.097 3.886 -12.260 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.461 3.929 -14.134 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.822 4.693 -12.660 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.391 5.703 -14.010 1.00 0.00 H new ATOM 273 N GLU A 63 5.772 3.573 -13.792 1.00 0.00 N ATOM 274 CA GLU A 63 6.900 3.176 -14.648 1.00 0.00 C ATOM 275 C GLU A 63 6.452 2.738 -16.059 1.00 0.00 C ATOM 276 O GLU A 63 7.191 2.916 -17.028 1.00 0.00 O ATOM 277 CB GLU A 63 7.608 2.006 -13.945 1.00 0.00 C ATOM 278 CG GLU A 63 8.922 1.566 -14.605 1.00 0.00 C ATOM 279 CD GLU A 63 10.042 2.600 -14.429 1.00 0.00 C ATOM 280 OE1 GLU A 63 10.657 2.559 -13.343 1.00 0.00 O ATOM 281 OE2 GLU A 63 10.329 3.336 -15.395 1.00 0.00 O ATOM 0 H GLU A 63 5.569 2.881 -13.071 1.00 0.00 H new ATOM 0 HA GLU A 63 7.560 4.032 -14.787 1.00 0.00 H new ATOM 0 HB2 GLU A 63 7.812 2.289 -12.913 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.929 1.154 -13.913 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.239 0.615 -14.177 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.752 1.396 -15.668 1.00 0.00 H new ATOM 282 N SER A 64 5.282 2.118 -16.114 1.00 0.00 N ATOM 283 CA SER A 64 4.720 1.461 -17.333 1.00 0.00 C ATOM 284 C SER A 64 3.199 1.269 -17.134 1.00 0.00 C ATOM 285 O SER A 64 2.653 1.715 -16.120 1.00 0.00 O ATOM 286 CB SER A 64 5.448 0.126 -17.512 1.00 0.00 C ATOM 287 OG SER A 64 5.013 -0.555 -18.695 1.00 0.00 O ATOM 0 H SER A 64 4.666 2.044 -15.304 1.00 0.00 H new ATOM 0 HA SER A 64 4.863 2.064 -18.230 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.523 0.301 -17.566 1.00 0.00 H new ATOM 0 HB3 SER A 64 5.271 -0.506 -16.641 1.00 0.00 H new ATOM 0 HG SER A 64 4.920 0.089 -19.428 1.00 0.00 H new ATOM 288 N VAL A 65 2.587 0.473 -18.011 1.00 0.00 N ATOM 289 CA VAL A 65 1.151 0.128 -18.058 1.00 0.00 C ATOM 290 C VAL A 65 0.625 -0.380 -16.698 1.00 0.00 C ATOM 291 O VAL A 65 0.986 -1.458 -16.225 1.00 0.00 O ATOM 292 CB VAL A 65 0.943 -0.871 -19.208 1.00 0.00 C ATOM 293 CG1 VAL A 65 1.695 -2.201 -19.011 1.00 0.00 C ATOM 294 CG2 VAL A 65 -0.546 -1.120 -19.476 1.00 0.00 C ATOM 0 H VAL A 65 3.109 0.018 -18.760 1.00 0.00 H new ATOM 0 HA VAL A 65 0.557 1.021 -18.255 1.00 0.00 H new ATOM 0 HB VAL A 65 1.380 -0.399 -20.088 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.503 -2.857 -19.860 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.765 -2.007 -18.938 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.350 -2.682 -18.096 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.654 -1.831 -20.295 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.014 -1.525 -18.579 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.029 -0.181 -19.745 1.00 0.00 H new ATOM 295 N GLY A 66 0.011 0.555 -15.980 1.00 0.00 N ATOM 296 CA GLY A 66 -0.551 0.354 -14.629 1.00 0.00 C ATOM 297 C GLY A 66 0.494 0.223 -13.507 1.00 0.00 C ATOM 298 O GLY A 66 0.206 0.465 -12.332 1.00 0.00 O ATOM 0 H GLY A 66 -0.118 1.506 -16.324 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.209 1.191 -14.397 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.168 -0.544 -14.638 1.00 0.00 H new ATOM 299 N GLU A 67 1.721 -0.103 -13.885 1.00 0.00 N ATOM 300 CA GLU A 67 2.849 -0.407 -13.008 1.00 0.00 C ATOM 301 C GLU A 67 3.432 0.790 -12.260 1.00 0.00 C ATOM 302 O GLU A 67 4.214 1.568 -12.806 1.00 0.00 O ATOM 303 CB GLU A 67 3.912 -1.088 -13.856 1.00 0.00 C ATOM 304 CG GLU A 67 3.414 -2.399 -14.466 1.00 0.00 C ATOM 305 CD GLU A 67 4.293 -2.921 -15.601 1.00 0.00 C ATOM 306 OE1 GLU A 67 5.541 -2.812 -15.481 1.00 0.00 O ATOM 307 OE2 GLU A 67 3.711 -3.414 -16.587 1.00 0.00 O ATOM 0 H GLU A 67 1.974 -0.167 -14.871 1.00 0.00 H new ATOM 0 HA GLU A 67 2.482 -1.055 -12.212 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.224 -0.414 -14.654 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.791 -1.286 -13.243 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.359 -3.156 -13.683 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.401 -2.253 -14.840 1.00 0.00 H new ATOM 308 N VAL A 68 3.222 0.767 -10.957 1.00 0.00 N ATOM 309 CA VAL A 68 3.469 1.909 -10.063 1.00 0.00 C ATOM 310 C VAL A 68 4.330 1.716 -8.805 1.00 0.00 C ATOM 311 O VAL A 68 4.031 0.979 -7.880 1.00 0.00 O ATOM 312 CB VAL A 68 2.138 2.568 -9.732 1.00 0.00 C ATOM 313 CG1 VAL A 68 1.128 1.600 -9.094 1.00 0.00 C ATOM 314 CG2 VAL A 68 2.199 3.744 -8.806 1.00 0.00 C ATOM 0 H VAL A 68 2.868 -0.057 -10.470 1.00 0.00 H new ATOM 0 HA VAL A 68 4.128 2.550 -10.649 1.00 0.00 H new ATOM 0 HB VAL A 68 1.825 2.904 -10.720 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.200 2.130 -8.882 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.927 0.778 -9.781 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.540 1.204 -8.166 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.193 4.131 -8.643 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.628 3.435 -7.853 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.820 4.523 -9.248 1.00 0.00 H new ATOM 315 N TYR A 69 5.205 2.693 -8.754 1.00 0.00 N ATOM 316 CA TYR A 69 6.131 2.928 -7.647 1.00 0.00 C ATOM 317 C TYR A 69 5.529 3.896 -6.630 1.00 0.00 C ATOM 318 O TYR A 69 5.285 5.070 -6.926 1.00 0.00 O ATOM 319 CB TYR A 69 7.403 3.587 -8.190 1.00 0.00 C ATOM 320 CG TYR A 69 8.437 2.619 -8.783 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.696 1.367 -8.173 1.00 0.00 C ATOM 322 CD2 TYR A 69 9.082 3.010 -9.962 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.572 0.467 -8.800 1.00 0.00 C ATOM 324 CE2 TYR A 69 9.994 2.116 -10.571 1.00 0.00 C ATOM 325 CZ TYR A 69 10.213 0.847 -9.993 1.00 0.00 C ATOM 326 OH TYR A 69 10.978 -0.053 -10.668 1.00 0.00 O ATOM 0 H TYR A 69 5.303 3.376 -9.505 1.00 0.00 H new ATOM 0 HA TYR A 69 6.340 1.969 -7.174 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.121 4.307 -8.958 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.875 4.149 -7.384 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.225 1.108 -7.236 1.00 0.00 H new ATOM 0 HD2 TYR A 69 8.887 3.978 -10.400 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.752 -0.508 -8.371 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.518 2.402 -11.471 1.00 0.00 H new ATOM 0 HH TYR A 69 11.348 0.369 -11.471 1.00 0.00 H new ATOM 327 N ILE A 70 5.132 3.312 -5.500 1.00 0.00 N ATOM 328 CA ILE A 70 4.465 4.117 -4.454 1.00 0.00 C ATOM 329 C ILE A 70 5.477 4.797 -3.533 1.00 0.00 C ATOM 330 O ILE A 70 5.956 4.263 -2.533 1.00 0.00 O ATOM 331 CB ILE A 70 3.297 3.391 -3.779 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.308 3.042 -4.896 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.602 4.300 -2.748 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.227 2.040 -4.508 1.00 0.00 C ATOM 0 H ILE A 70 5.250 2.323 -5.281 1.00 0.00 H new ATOM 0 HA ILE A 70 3.956 4.948 -4.941 1.00 0.00 H new ATOM 0 HB ILE A 70 3.651 2.506 -3.250 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.827 3.960 -5.235 1.00 0.00 H new ATOM 0 HG13 ILE A 70 2.866 2.643 -5.743 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.777 3.760 -2.284 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.319 4.595 -1.982 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.218 5.189 -3.248 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.577 1.857 -5.363 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.692 1.104 -4.199 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.638 2.441 -3.683 1.00 0.00 H new ATOM 335 N LYS A 71 5.570 6.059 -3.886 1.00 0.00 N ATOM 336 CA LYS A 71 6.482 7.058 -3.293 1.00 0.00 C ATOM 337 C LYS A 71 5.739 7.785 -2.165 1.00 0.00 C ATOM 338 O LYS A 71 4.503 7.807 -2.054 1.00 0.00 O ATOM 339 CB LYS A 71 6.851 8.029 -4.412 1.00 0.00 C ATOM 340 CG LYS A 71 8.104 8.853 -4.096 1.00 0.00 C ATOM 341 CD LYS A 71 8.218 10.044 -5.045 1.00 0.00 C ATOM 342 CE LYS A 71 7.356 11.236 -4.603 1.00 0.00 C ATOM 343 NZ LYS A 71 8.057 11.960 -3.545 1.00 0.00 N ATOM 0 H LYS A 71 4.992 6.453 -4.628 1.00 0.00 H new ATOM 0 HA LYS A 71 7.381 6.605 -2.876 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.013 7.469 -5.333 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.014 8.704 -4.592 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.064 9.205 -3.065 1.00 0.00 H new ATOM 0 HG3 LYS A 71 8.991 8.225 -4.184 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.260 10.357 -5.106 1.00 0.00 H new ATOM 0 HD3 LYS A 71 7.919 9.736 -6.047 1.00 0.00 H new ATOM 0 HE2 LYS A 71 7.164 11.897 -5.449 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.387 10.888 -4.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.734 12.949 -3.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.855 11.514 -2.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.081 11.933 -3.726 1.00 0.00 H new ATOM 344 N SER A 72 6.553 8.335 -1.300 1.00 0.00 N ATOM 345 CA SER A 72 6.056 9.026 -0.105 1.00 0.00 C ATOM 346 C SER A 72 6.345 10.524 -0.106 1.00 0.00 C ATOM 347 O SER A 72 7.469 10.974 -0.330 1.00 0.00 O ATOM 348 CB SER A 72 6.565 8.278 1.118 1.00 0.00 C ATOM 349 OG SER A 72 6.568 9.139 2.265 1.00 0.00 O ATOM 0 H SER A 72 7.569 8.325 -1.389 1.00 0.00 H new ATOM 0 HA SER A 72 4.966 9.002 -0.091 1.00 0.00 H new ATOM 0 HB2 SER A 72 5.935 7.409 1.309 1.00 0.00 H new ATOM 0 HB3 SER A 72 7.573 7.906 0.932 1.00 0.00 H new ATOM 0 HG SER A 72 6.751 8.611 3.070 1.00 0.00 H new ATOM 350 N THR A 73 5.249 11.257 0.057 1.00 0.00 N ATOM 351 CA THR A 73 5.235 12.735 0.146 1.00 0.00 C ATOM 352 C THR A 73 6.179 13.299 1.215 1.00 0.00 C ATOM 353 O THR A 73 6.728 14.395 1.045 1.00 0.00 O ATOM 354 CB THR A 73 3.820 13.252 0.460 1.00 0.00 C ATOM 355 OG1 THR A 73 3.357 12.701 1.698 1.00 0.00 O ATOM 356 CG2 THR A 73 2.850 13.009 -0.694 1.00 0.00 C ATOM 0 H THR A 73 4.320 10.843 0.134 1.00 0.00 H new ATOM 0 HA THR A 73 5.577 13.077 -0.831 1.00 0.00 H new ATOM 0 HB THR A 73 3.868 14.335 0.577 1.00 0.00 H new ATOM 0 HG1 THR A 73 2.457 13.037 1.889 1.00 0.00 H new ATOM 0 HG21 THR A 73 1.864 13.390 -0.427 1.00 0.00 H new ATOM 0 HG22 THR A 73 3.209 13.523 -1.585 1.00 0.00 H new ATOM 0 HG23 THR A 73 2.783 11.940 -0.894 1.00 0.00 H new ATOM 357 N GLU A 74 6.341 12.546 2.298 1.00 0.00 N ATOM 358 CA GLU A 74 7.237 12.945 3.383 1.00 0.00 C ATOM 359 C GLU A 74 8.518 12.137 3.601 1.00 0.00 C ATOM 360 O GLU A 74 9.593 12.701 3.737 1.00 0.00 O ATOM 361 CB GLU A 74 6.487 13.157 4.690 1.00 0.00 C ATOM 362 CG GLU A 74 6.586 14.682 4.767 1.00 0.00 C ATOM 363 CD GLU A 74 6.601 15.261 6.157 1.00 0.00 C ATOM 364 OE1 GLU A 74 7.661 15.197 6.823 1.00 0.00 O ATOM 365 OE2 GLU A 74 5.612 15.977 6.437 1.00 0.00 O ATOM 0 H GLU A 74 5.865 11.657 2.450 1.00 0.00 H new ATOM 0 HA GLU A 74 7.622 13.894 3.011 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.457 12.802 4.649 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.962 12.659 5.535 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.493 14.996 4.251 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.745 15.111 4.222 1.00 0.00 H new ATOM 366 N THR A 75 8.324 10.837 3.756 1.00 0.00 N ATOM 367 CA THR A 75 9.401 9.860 3.940 1.00 0.00 C ATOM 368 C THR A 75 10.136 9.409 2.663 1.00 0.00 C ATOM 369 O THR A 75 11.198 8.784 2.789 1.00 0.00 O ATOM 370 CB THR A 75 8.865 8.618 4.670 1.00 0.00 C ATOM 371 OG1 THR A 75 7.438 8.610 4.728 1.00 0.00 O ATOM 372 CG2 THR A 75 9.491 8.530 6.063 1.00 0.00 C ATOM 0 H THR A 75 7.395 10.416 3.758 1.00 0.00 H new ATOM 0 HA THR A 75 10.147 10.394 4.529 1.00 0.00 H new ATOM 0 HB THR A 75 9.152 7.732 4.103 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.142 7.973 5.412 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.109 7.649 6.578 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.575 8.456 5.971 1.00 0.00 H new ATOM 0 HG23 THR A 75 9.236 9.423 6.634 1.00 0.00 H new ATOM 373 N GLY A 76 9.555 9.633 1.484 1.00 0.00 N ATOM 374 CA GLY A 76 10.086 9.165 0.179 1.00 0.00 C ATOM 375 C GLY A 76 9.921 7.651 -0.048 1.00 0.00 C ATOM 376 O GLY A 76 9.318 7.251 -1.044 1.00 0.00 O ATOM 0 H GLY A 76 8.683 10.155 1.395 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.579 9.701 -0.623 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.144 9.420 0.114 1.00 0.00 H new ATOM 377 N GLN A 77 10.559 6.902 0.833 1.00 0.00 N ATOM 378 CA GLN A 77 10.572 5.422 0.915 1.00 0.00 C ATOM 379 C GLN A 77 9.359 4.729 0.275 1.00 0.00 C ATOM 380 O GLN A 77 8.197 5.012 0.567 1.00 0.00 O ATOM 381 CB GLN A 77 10.755 4.996 2.371 1.00 0.00 C ATOM 382 CG GLN A 77 12.169 5.325 2.852 1.00 0.00 C ATOM 383 CD GLN A 77 12.321 5.157 4.365 1.00 0.00 C ATOM 384 OE1 GLN A 77 12.150 4.096 4.939 1.00 0.00 O ATOM 385 NE2 GLN A 77 12.721 6.230 5.030 1.00 0.00 N ATOM 0 H GLN A 77 11.126 7.325 1.568 1.00 0.00 H new ATOM 0 HA GLN A 77 11.418 5.087 0.315 1.00 0.00 H new ATOM 0 HB2 GLN A 77 10.023 5.504 2.999 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.571 3.926 2.469 1.00 0.00 H new ATOM 0 HG2 GLN A 77 12.883 4.678 2.343 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.415 6.350 2.576 1.00 0.00 H new ATOM 0 HE21 GLN A 77 12.861 7.112 4.538 1.00 0.00 H new ATOM 0 HE22 GLN A 77 12.890 6.174 6.034 1.00 0.00 H new ATOM 386 N TYR A 78 9.729 3.845 -0.637 1.00 0.00 N ATOM 387 CA TYR A 78 8.810 3.125 -1.527 1.00 0.00 C ATOM 388 C TYR A 78 8.113 1.972 -0.802 1.00 0.00 C ATOM 389 O TYR A 78 8.710 1.222 -0.034 1.00 0.00 O ATOM 390 CB TYR A 78 9.601 2.560 -2.716 1.00 0.00 C ATOM 391 CG TYR A 78 10.165 3.692 -3.578 1.00 0.00 C ATOM 392 CD1 TYR A 78 9.372 4.231 -4.609 1.00 0.00 C ATOM 393 CD2 TYR A 78 11.441 4.210 -3.272 1.00 0.00 C ATOM 394 CE1 TYR A 78 9.864 5.326 -5.346 1.00 0.00 C ATOM 395 CE2 TYR A 78 11.923 5.307 -3.991 1.00 0.00 C ATOM 396 CZ TYR A 78 11.132 5.856 -5.023 1.00 0.00 C ATOM 397 OH TYR A 78 11.530 7.000 -5.621 1.00 0.00 O ATOM 0 H TYR A 78 10.706 3.595 -0.789 1.00 0.00 H new ATOM 0 HA TYR A 78 8.048 3.826 -1.867 1.00 0.00 H new ATOM 0 HB2 TYR A 78 10.415 1.933 -2.352 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.954 1.924 -3.320 1.00 0.00 H new ATOM 0 HD1 TYR A 78 8.402 3.812 -4.831 1.00 0.00 H new ATOM 0 HD2 TYR A 78 12.039 3.764 -2.491 1.00 0.00 H new ATOM 0 HE1 TYR A 78 9.279 5.754 -6.147 1.00 0.00 H new ATOM 0 HE2 TYR A 78 12.890 5.730 -3.760 1.00 0.00 H new ATOM 0 HH TYR A 78 12.423 7.244 -5.299 1.00 0.00 H new ATOM 398 N LEU A 79 6.799 1.968 -0.992 1.00 0.00 N ATOM 399 CA LEU A 79 5.979 0.839 -0.519 1.00 0.00 C ATOM 400 C LEU A 79 6.431 -0.457 -1.192 1.00 0.00 C ATOM 401 O LEU A 79 6.504 -0.545 -2.408 1.00 0.00 O ATOM 402 CB LEU A 79 4.503 1.070 -0.833 1.00 0.00 C ATOM 403 CG LEU A 79 3.573 0.352 0.162 1.00 0.00 C ATOM 404 CD1 LEU A 79 3.829 0.843 1.578 1.00 0.00 C ATOM 405 CD2 LEU A 79 2.156 0.701 -0.282 1.00 0.00 C ATOM 0 H LEU A 79 6.280 2.712 -1.458 1.00 0.00 H new ATOM 0 HA LEU A 79 6.107 0.761 0.561 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.293 2.140 -0.815 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.290 0.720 -1.843 1.00 0.00 H new ATOM 0 HG LEU A 79 3.739 -0.725 0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.163 0.325 2.269 1.00 0.00 H new ATOM 0 HD12 LEU A 79 4.864 0.641 1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 79 3.643 1.916 1.630 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.438 0.222 0.384 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.019 1.782 -0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.997 0.349 -1.301 1.00 0.00 H new ATOM 406 N ALA A 80 6.828 -1.391 -0.339 1.00 0.00 N ATOM 407 CA ALA A 80 7.421 -2.654 -0.804 1.00 0.00 C ATOM 408 C ALA A 80 6.782 -3.877 -0.154 1.00 0.00 C ATOM 409 O ALA A 80 6.455 -3.852 1.036 1.00 0.00 O ATOM 410 CB ALA A 80 8.901 -2.653 -0.479 1.00 0.00 C ATOM 0 H ALA A 80 6.754 -1.307 0.675 1.00 0.00 H new ATOM 0 HA ALA A 80 7.247 -2.719 -1.878 1.00 0.00 H new ATOM 0 HB1 ALA A 80 9.349 -3.586 -0.820 1.00 0.00 H new ATOM 0 HB2 ALA A 80 9.383 -1.814 -0.981 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.037 -2.558 0.598 1.00 0.00 H new ATOM 411 N MET A 81 6.864 -4.971 -0.889 1.00 0.00 N ATOM 412 CA MET A 81 6.340 -6.256 -0.399 1.00 0.00 C ATOM 413 C MET A 81 7.374 -7.378 -0.620 1.00 0.00 C ATOM 414 O MET A 81 8.106 -7.381 -1.607 1.00 0.00 O ATOM 415 CB MET A 81 5.015 -6.614 -1.068 1.00 0.00 C ATOM 416 CG MET A 81 4.331 -7.703 -0.252 1.00 0.00 C ATOM 417 SD MET A 81 2.649 -8.214 -0.776 1.00 0.00 S ATOM 418 CE MET A 81 1.800 -6.700 -1.161 1.00 0.00 C ATOM 0 H MET A 81 7.282 -5.008 -1.819 1.00 0.00 H new ATOM 0 HA MET A 81 6.154 -6.152 0.670 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.375 -5.734 -1.134 1.00 0.00 H new ATOM 0 HB3 MET A 81 5.188 -6.959 -2.087 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.971 -8.585 -0.263 1.00 0.00 H new ATOM 0 HG3 MET A 81 4.274 -7.364 0.782 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.795 -6.729 -0.739 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.348 -5.858 -0.738 1.00 0.00 H new ATOM 0 HE3 MET A 81 1.736 -6.584 -2.243 1.00 0.00 H new ATOM 419 N ASP A 82 7.495 -8.231 0.395 1.00 0.00 N ATOM 420 CA ASP A 82 8.416 -9.381 0.355 1.00 0.00 C ATOM 421 C ASP A 82 7.665 -10.709 0.227 1.00 0.00 C ATOM 422 O ASP A 82 6.549 -10.855 0.718 1.00 0.00 O ATOM 423 CB ASP A 82 9.260 -9.410 1.631 1.00 0.00 C ATOM 424 CG ASP A 82 10.759 -9.402 1.316 1.00 0.00 C ATOM 425 OD1 ASP A 82 11.239 -10.469 0.860 1.00 0.00 O ATOM 426 OD2 ASP A 82 11.384 -8.346 1.544 1.00 0.00 O ATOM 0 H ASP A 82 6.966 -8.152 1.264 1.00 0.00 H new ATOM 0 HA ASP A 82 9.052 -9.261 -0.522 1.00 0.00 H new ATOM 0 HB2 ASP A 82 9.013 -8.548 2.251 1.00 0.00 H new ATOM 0 HB3 ASP A 82 9.014 -10.300 2.210 1.00 0.00 H new ATOM 427 N THR A 83 8.497 -11.700 -0.083 1.00 0.00 N ATOM 428 CA THR A 83 8.110 -13.124 -0.245 1.00 0.00 C ATOM 429 C THR A 83 7.317 -13.699 0.922 1.00 0.00 C ATOM 430 O THR A 83 6.361 -14.452 0.723 1.00 0.00 O ATOM 431 CB THR A 83 9.350 -14.005 -0.405 1.00 0.00 C ATOM 432 OG1 THR A 83 10.414 -13.459 0.377 1.00 0.00 O ATOM 433 CG2 THR A 83 9.734 -14.202 -1.876 1.00 0.00 C ATOM 0 H THR A 83 9.493 -11.543 -0.236 1.00 0.00 H new ATOM 0 HA THR A 83 7.476 -13.131 -1.132 1.00 0.00 H new ATOM 0 HB THR A 83 9.128 -15.005 -0.034 1.00 0.00 H new ATOM 0 HG1 THR A 83 11.212 -14.020 0.280 1.00 0.00 H new ATOM 0 HG21 THR A 83 10.620 -14.834 -1.939 1.00 0.00 H new ATOM 0 HG22 THR A 83 8.910 -14.678 -2.407 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.946 -13.234 -2.330 1.00 0.00 H new ATOM 434 N ASP A 84 7.700 -13.293 2.131 1.00 0.00 N ATOM 435 CA ASP A 84 7.007 -13.645 3.383 1.00 0.00 C ATOM 436 C ASP A 84 5.536 -13.253 3.487 1.00 0.00 C ATOM 437 O ASP A 84 4.825 -13.793 4.341 1.00 0.00 O ATOM 438 CB ASP A 84 7.786 -13.066 4.568 1.00 0.00 C ATOM 439 CG ASP A 84 9.144 -13.763 4.746 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.159 -14.834 5.375 1.00 0.00 O ATOM 441 OD2 ASP A 84 10.117 -13.200 4.190 1.00 0.00 O ATOM 0 H ASP A 84 8.516 -12.698 2.278 1.00 0.00 H new ATOM 0 HA ASP A 84 6.989 -14.735 3.393 1.00 0.00 H new ATOM 0 HB2 ASP A 84 7.942 -11.998 4.415 1.00 0.00 H new ATOM 0 HB3 ASP A 84 7.198 -13.175 5.479 1.00 0.00 H new ATOM 442 N GLY A 85 5.107 -12.314 2.651 1.00 0.00 N ATOM 443 CA GLY A 85 3.723 -11.798 2.616 1.00 0.00 C ATOM 444 C GLY A 85 3.469 -10.672 3.608 1.00 0.00 C ATOM 445 O GLY A 85 2.543 -10.765 4.410 1.00 0.00 O ATOM 0 H GLY A 85 5.716 -11.875 1.961 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.502 -11.442 1.610 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.033 -12.616 2.823 1.00 0.00 H new ATOM 446 N LEU A 86 4.204 -9.579 3.411 1.00 0.00 N ATOM 447 CA LEU A 86 4.177 -8.394 4.290 1.00 0.00 C ATOM 448 C LEU A 86 4.784 -7.148 3.621 1.00 0.00 C ATOM 449 O LEU A 86 5.585 -7.278 2.697 1.00 0.00 O ATOM 450 CB LEU A 86 4.838 -8.731 5.639 1.00 0.00 C ATOM 451 CG LEU A 86 6.256 -9.262 5.443 1.00 0.00 C ATOM 452 CD1 LEU A 86 7.234 -8.096 5.483 1.00 0.00 C ATOM 453 CD2 LEU A 86 6.589 -10.277 6.545 1.00 0.00 C ATOM 0 H LEU A 86 4.848 -9.483 2.626 1.00 0.00 H new ATOM 0 HA LEU A 86 3.136 -8.132 4.481 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.864 -7.840 6.266 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.238 -9.474 6.165 1.00 0.00 H new ATOM 0 HG LEU A 86 6.333 -9.762 4.478 1.00 0.00 H new ATOM 0 HD11 LEU A 86 8.249 -8.468 5.344 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.993 -7.392 4.687 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.161 -7.593 6.447 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.602 -10.652 6.400 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.517 -9.793 7.519 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.884 -11.107 6.500 1.00 0.00 H new ATOM 454 N LEU A 87 4.507 -5.987 4.221 1.00 0.00 N ATOM 455 CA LEU A 87 4.918 -4.692 3.646 1.00 0.00 C ATOM 456 C LEU A 87 6.047 -4.041 4.474 1.00 0.00 C ATOM 457 O LEU A 87 6.028 -4.030 5.705 1.00 0.00 O ATOM 458 CB LEU A 87 3.733 -3.702 3.494 1.00 0.00 C ATOM 459 CG LEU A 87 2.365 -4.382 3.350 1.00 0.00 C ATOM 460 CD1 LEU A 87 1.177 -3.436 3.532 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.223 -5.174 2.052 1.00 0.00 C ATOM 0 H LEU A 87 4.001 -5.912 5.103 1.00 0.00 H new ATOM 0 HA LEU A 87 5.294 -4.912 2.647 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.710 -3.043 4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.908 -3.073 2.621 1.00 0.00 H new ATOM 0 HG LEU A 87 2.337 -5.089 4.179 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.247 -3.993 3.415 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.213 -2.994 4.528 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.223 -2.646 2.783 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.234 -5.630 2.011 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.349 -4.504 1.201 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.984 -5.953 2.016 1.00 0.00 H new ATOM 462 N TYR A 88 7.039 -3.559 3.743 1.00 0.00 N ATOM 463 CA TYR A 88 8.256 -2.931 4.302 1.00 0.00 C ATOM 464 C TYR A 88 8.642 -1.597 3.653 1.00 0.00 C ATOM 465 O TYR A 88 8.398 -1.383 2.461 1.00 0.00 O ATOM 466 CB TYR A 88 9.453 -3.900 4.310 1.00 0.00 C ATOM 467 CG TYR A 88 9.948 -4.388 2.943 1.00 0.00 C ATOM 468 CD1 TYR A 88 9.198 -5.323 2.190 1.00 0.00 C ATOM 469 CD2 TYR A 88 11.228 -3.964 2.555 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.761 -5.830 1.009 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.794 -4.481 1.388 1.00 0.00 C ATOM 472 CZ TYR A 88 11.049 -5.407 0.626 1.00 0.00 C ATOM 473 OH TYR A 88 11.576 -5.729 -0.583 1.00 0.00 O ATOM 0 H TYR A 88 7.034 -3.587 2.723 1.00 0.00 H new ATOM 0 HA TYR A 88 7.989 -2.694 5.332 1.00 0.00 H new ATOM 0 HB2 TYR A 88 10.284 -3.412 4.819 1.00 0.00 H new ATOM 0 HB3 TYR A 88 9.182 -4.772 4.906 1.00 0.00 H new ATOM 0 HD1 TYR A 88 8.218 -5.638 2.516 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.770 -3.246 3.153 1.00 0.00 H new ATOM 0 HE1 TYR A 88 9.214 -6.536 0.401 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.782 -4.178 1.074 1.00 0.00 H new ATOM 0 HH TYR A 88 11.220 -6.594 -0.875 1.00 0.00 H new ATOM 474 N GLY A 89 9.323 -0.783 4.450 1.00 0.00 N ATOM 475 CA GLY A 89 9.732 0.593 4.082 1.00 0.00 C ATOM 476 C GLY A 89 11.008 0.662 3.242 1.00 0.00 C ATOM 477 O GLY A 89 12.004 1.250 3.675 1.00 0.00 O ATOM 0 H GLY A 89 9.618 -1.052 5.389 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.920 1.066 3.530 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.878 1.173 4.993 1.00 0.00 H new ATOM 478 N SER A 90 10.962 0.066 2.053 1.00 0.00 N ATOM 479 CA SER A 90 12.111 0.026 1.134 1.00 0.00 C ATOM 480 C SER A 90 12.463 1.364 0.466 1.00 0.00 C ATOM 481 O SER A 90 11.731 1.905 -0.363 1.00 0.00 O ATOM 482 CB SER A 90 11.944 -1.121 0.135 1.00 0.00 C ATOM 483 OG SER A 90 12.997 -1.111 -0.829 1.00 0.00 O ATOM 0 H SER A 90 10.131 -0.404 1.694 1.00 0.00 H new ATOM 0 HA SER A 90 12.989 -0.171 1.749 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.939 -2.073 0.665 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.982 -1.033 -0.370 1.00 0.00 H new ATOM 0 HG SER A 90 12.824 -0.414 -1.495 1.00 0.00 H new ATOM 484 N GLN A 91 13.637 1.847 0.847 1.00 0.00 N ATOM 485 CA GLN A 91 14.260 3.089 0.335 1.00 0.00 C ATOM 486 C GLN A 91 14.439 3.126 -1.181 1.00 0.00 C ATOM 487 O GLN A 91 14.425 4.197 -1.810 1.00 0.00 O ATOM 488 CB GLN A 91 15.654 3.245 0.949 1.00 0.00 C ATOM 489 CG GLN A 91 15.654 3.609 2.436 1.00 0.00 C ATOM 490 CD GLN A 91 15.568 2.383 3.348 1.00 0.00 C ATOM 491 OE1 GLN A 91 16.260 1.394 3.168 1.00 0.00 O ATOM 492 NE2 GLN A 91 14.634 2.377 4.262 1.00 0.00 N ATOM 0 H GLN A 91 14.214 1.378 1.546 1.00 0.00 H new ATOM 0 HA GLN A 91 13.576 3.892 0.612 1.00 0.00 H new ATOM 0 HB2 GLN A 91 16.203 2.313 0.816 1.00 0.00 H new ATOM 0 HB3 GLN A 91 16.196 4.015 0.399 1.00 0.00 H new ATOM 0 HG2 GLN A 91 16.562 4.166 2.669 1.00 0.00 H new ATOM 0 HG3 GLN A 91 14.812 4.270 2.643 1.00 0.00 H new ATOM 0 HE21 GLN A 91 14.058 3.206 4.408 1.00 0.00 H new ATOM 0 HE22 GLN A 91 14.481 1.543 4.829 1.00 0.00 H new ATOM 493 N THR A 92 14.780 1.961 -1.711 1.00 0.00 N ATOM 494 CA THR A 92 15.018 1.753 -3.145 1.00 0.00 C ATOM 495 C THR A 92 13.829 1.027 -3.792 1.00 0.00 C ATOM 496 O THR A 92 13.135 0.275 -3.110 1.00 0.00 O ATOM 497 CB THR A 92 16.362 1.019 -3.346 1.00 0.00 C ATOM 498 OG1 THR A 92 16.792 1.328 -4.667 1.00 0.00 O ATOM 499 CG2 THR A 92 16.308 -0.509 -3.171 1.00 0.00 C ATOM 0 H THR A 92 14.903 1.115 -1.154 1.00 0.00 H new ATOM 0 HA THR A 92 15.097 2.715 -3.652 1.00 0.00 H new ATOM 0 HB THR A 92 17.046 1.360 -2.569 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.648 0.884 -4.845 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.301 -0.929 -3.333 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.973 -0.748 -2.162 1.00 0.00 H new ATOM 0 HG23 THR A 92 15.612 -0.934 -3.895 1.00 0.00 H new ATOM 500 N PRO A 93 13.584 1.246 -5.087 1.00 0.00 N ATOM 501 CA PRO A 93 12.537 0.519 -5.805 1.00 0.00 C ATOM 502 C PRO A 93 13.029 -0.734 -6.542 1.00 0.00 C ATOM 503 O PRO A 93 14.215 -0.919 -6.821 1.00 0.00 O ATOM 504 CB PRO A 93 11.930 1.555 -6.736 1.00 0.00 C ATOM 505 CG PRO A 93 13.083 2.479 -7.100 1.00 0.00 C ATOM 506 CD PRO A 93 14.059 2.359 -5.914 1.00 0.00 C ATOM 0 HA PRO A 93 11.805 0.103 -5.113 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.504 1.087 -7.623 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.125 2.102 -6.246 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.555 2.177 -8.035 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.743 3.506 -7.232 1.00 0.00 H new ATOM 0 HD2 PRO A 93 15.074 2.174 -6.266 1.00 0.00 H new ATOM 0 HD3 PRO A 93 14.085 3.285 -5.339 1.00 0.00 H new ATOM 507 N ASN A 94 12.105 -1.675 -6.601 1.00 0.00 N ATOM 508 CA ASN A 94 12.234 -2.946 -7.347 1.00 0.00 C ATOM 509 C ASN A 94 10.836 -3.338 -7.847 1.00 0.00 C ATOM 510 O ASN A 94 9.855 -2.680 -7.488 1.00 0.00 O ATOM 511 CB ASN A 94 12.785 -3.983 -6.355 1.00 0.00 C ATOM 512 CG ASN A 94 13.202 -5.276 -7.047 1.00 0.00 C ATOM 513 OD1 ASN A 94 12.461 -6.240 -7.131 1.00 0.00 O ATOM 514 ND2 ASN A 94 14.359 -5.242 -7.674 1.00 0.00 N ATOM 0 H ASN A 94 11.209 -1.588 -6.121 1.00 0.00 H new ATOM 0 HA ASN A 94 12.901 -2.872 -8.206 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.642 -3.561 -5.830 1.00 0.00 H new ATOM 0 HB3 ASN A 94 12.027 -4.203 -5.603 1.00 0.00 H new ATOM 0 HD21 ASN A 94 14.653 -6.034 -8.246 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.962 -4.424 -7.588 1.00 0.00 H new ATOM 515 N GLU A 95 10.713 -4.494 -8.489 1.00 0.00 N ATOM 516 CA GLU A 95 9.405 -5.128 -8.777 1.00 0.00 C ATOM 517 C GLU A 95 8.588 -5.332 -7.482 1.00 0.00 C ATOM 518 O GLU A 95 7.377 -5.206 -7.461 1.00 0.00 O ATOM 519 CB GLU A 95 9.606 -6.539 -9.321 1.00 0.00 C ATOM 520 CG GLU A 95 10.435 -6.579 -10.617 1.00 0.00 C ATOM 521 CD GLU A 95 10.742 -8.026 -11.008 1.00 0.00 C ATOM 522 OE1 GLU A 95 11.689 -8.574 -10.406 1.00 0.00 O ATOM 523 OE2 GLU A 95 10.015 -8.536 -11.877 1.00 0.00 O ATOM 0 H GLU A 95 11.511 -5.029 -8.831 1.00 0.00 H new ATOM 0 HA GLU A 95 8.898 -4.471 -9.483 1.00 0.00 H new ATOM 0 HB2 GLU A 95 10.100 -7.146 -8.563 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.632 -6.992 -9.507 1.00 0.00 H new ATOM 0 HG2 GLU A 95 9.889 -6.086 -11.421 1.00 0.00 H new ATOM 0 HG3 GLU A 95 11.365 -6.028 -10.479 1.00 0.00 H new ATOM 524 N GLU A 96 9.313 -5.669 -6.418 1.00 0.00 N ATOM 525 CA GLU A 96 8.765 -5.750 -5.049 1.00 0.00 C ATOM 526 C GLU A 96 8.085 -4.456 -4.567 1.00 0.00 C ATOM 527 O GLU A 96 7.084 -4.485 -3.868 1.00 0.00 O ATOM 528 CB GLU A 96 9.873 -6.077 -4.078 1.00 0.00 C ATOM 529 CG GLU A 96 10.105 -7.594 -4.217 1.00 0.00 C ATOM 530 CD GLU A 96 10.621 -8.362 -2.989 1.00 0.00 C ATOM 531 OE1 GLU A 96 11.141 -7.724 -2.052 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.544 -9.605 -3.017 1.00 0.00 O ATOM 0 H GLU A 96 10.306 -5.897 -6.473 1.00 0.00 H new ATOM 0 HA GLU A 96 8.004 -6.529 -5.083 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.779 -5.518 -4.313 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.592 -5.814 -3.058 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.163 -8.049 -4.523 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.814 -7.750 -5.030 1.00 0.00 H new ATOM 533 N CYS A 97 8.694 -3.338 -4.970 1.00 0.00 N ATOM 534 CA CYS A 97 8.228 -1.985 -4.618 1.00 0.00 C ATOM 535 C CYS A 97 7.283 -1.369 -5.672 1.00 0.00 C ATOM 536 O CYS A 97 6.749 -0.269 -5.511 1.00 0.00 O ATOM 537 CB CYS A 97 9.428 -1.070 -4.420 1.00 0.00 C ATOM 538 SG CYS A 97 10.610 -1.551 -3.107 1.00 0.00 S ATOM 0 H CYS A 97 9.530 -3.341 -5.554 1.00 0.00 H new ATOM 0 HA CYS A 97 7.654 -2.081 -3.696 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.971 -1.010 -5.363 1.00 0.00 H new ATOM 0 HB3 CYS A 97 9.061 -0.068 -4.199 1.00 0.00 H new ATOM 0 HG CYS A 97 11.655 -0.780 -3.160 1.00 0.00 H new ATOM 539 N LEU A 98 7.141 -2.100 -6.772 1.00 0.00 N ATOM 540 CA LEU A 98 6.290 -1.742 -7.917 1.00 0.00 C ATOM 541 C LEU A 98 4.984 -2.507 -7.790 1.00 0.00 C ATOM 542 O LEU A 98 4.918 -3.681 -7.409 1.00 0.00 O ATOM 543 CB LEU A 98 7.008 -2.111 -9.212 1.00 0.00 C ATOM 544 CG LEU A 98 6.336 -1.444 -10.422 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.446 0.048 -10.370 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.154 -1.752 -11.659 1.00 0.00 C ATOM 0 H LEU A 98 7.627 -2.987 -6.902 1.00 0.00 H new ATOM 0 HA LEU A 98 6.085 -0.672 -7.932 1.00 0.00 H new ATOM 0 HB2 LEU A 98 8.052 -1.802 -9.155 1.00 0.00 H new ATOM 0 HB3 LEU A 98 7.003 -3.194 -9.339 1.00 0.00 H new ATOM 0 HG LEU A 98 5.305 -1.797 -10.427 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.958 0.479 -11.244 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.963 0.417 -9.465 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.497 0.335 -10.363 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.690 -1.285 -12.528 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.164 -1.362 -11.534 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.198 -2.831 -11.807 1.00 0.00 H new ATOM 547 N PHE A 99 3.928 -1.760 -8.074 1.00 0.00 N ATOM 548 CA PHE A 99 2.564 -2.270 -8.006 1.00 0.00 C ATOM 549 C PHE A 99 1.776 -2.107 -9.301 1.00 0.00 C ATOM 550 O PHE A 99 2.324 -1.604 -10.260 1.00 0.00 O ATOM 551 CB PHE A 99 1.814 -1.532 -6.883 1.00 0.00 C ATOM 552 CG PHE A 99 2.339 -1.860 -5.494 1.00 0.00 C ATOM 553 CD1 PHE A 99 1.837 -2.988 -4.827 1.00 0.00 C ATOM 554 CD2 PHE A 99 3.296 -1.017 -4.882 1.00 0.00 C ATOM 555 CE1 PHE A 99 2.299 -3.304 -3.530 1.00 0.00 C ATOM 556 CE2 PHE A 99 3.755 -1.322 -3.576 1.00 0.00 C ATOM 557 CZ PHE A 99 3.256 -2.461 -2.918 1.00 0.00 C ATOM 0 H PHE A 99 3.991 -0.782 -8.358 1.00 0.00 H new ATOM 0 HA PHE A 99 2.642 -3.340 -7.816 1.00 0.00 H new ATOM 0 HB2 PHE A 99 1.891 -0.457 -7.049 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.755 -1.787 -6.934 1.00 0.00 H new ATOM 0 HD1 PHE A 99 1.098 -3.614 -5.305 1.00 0.00 H new ATOM 0 HD2 PHE A 99 3.673 -0.150 -5.404 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.927 -4.176 -3.013 1.00 0.00 H new ATOM 0 HE2 PHE A 99 4.481 -0.686 -3.091 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.611 -2.697 -1.926 1.00 0.00 H new ATOM 558 N LEU A 100 0.647 -2.774 -9.397 1.00 0.00 N ATOM 559 CA LEU A 100 -0.301 -2.461 -10.476 1.00 0.00 C ATOM 560 C LEU A 100 -1.490 -1.632 -10.020 1.00 0.00 C ATOM 561 O LEU A 100 -2.124 -1.931 -9.015 1.00 0.00 O ATOM 562 CB LEU A 100 -0.830 -3.721 -11.165 1.00 0.00 C ATOM 563 CG LEU A 100 -0.018 -4.079 -12.400 1.00 0.00 C ATOM 564 CD1 LEU A 100 1.328 -4.694 -11.998 1.00 0.00 C ATOM 565 CD2 LEU A 100 -0.801 -5.085 -13.254 1.00 0.00 C ATOM 0 H LEU A 100 0.356 -3.520 -8.765 1.00 0.00 H new ATOM 0 HA LEU A 100 0.282 -1.869 -11.181 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.808 -4.554 -10.463 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.872 -3.569 -11.448 1.00 0.00 H new ATOM 0 HG LEU A 100 0.166 -3.170 -12.973 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.896 -4.944 -12.894 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.891 -3.978 -11.400 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.155 -5.598 -11.414 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.219 -5.342 -14.139 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.992 -5.986 -12.671 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.749 -4.643 -13.559 1.00 0.00 H new ATOM 566 N GLU A 101 -1.737 -0.591 -10.793 1.00 0.00 N ATOM 567 CA GLU A 101 -2.912 0.273 -10.629 1.00 0.00 C ATOM 568 C GLU A 101 -4.196 -0.404 -11.115 1.00 0.00 C ATOM 569 O GLU A 101 -4.586 -0.353 -12.276 1.00 0.00 O ATOM 570 CB GLU A 101 -2.739 1.620 -11.325 1.00 0.00 C ATOM 571 CG GLU A 101 -1.919 2.601 -10.483 1.00 0.00 C ATOM 572 CD GLU A 101 -1.815 3.980 -11.129 1.00 0.00 C ATOM 573 OE1 GLU A 101 -2.821 4.717 -11.066 1.00 0.00 O ATOM 574 OE2 GLU A 101 -0.727 4.258 -11.672 1.00 0.00 O ATOM 0 H GLU A 101 -1.128 -0.311 -11.562 1.00 0.00 H new ATOM 0 HA GLU A 101 -3.003 0.452 -9.558 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -2.249 1.470 -12.287 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.719 2.050 -11.530 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.375 2.698 -9.498 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -0.918 2.197 -10.333 1.00 0.00 H new ATOM 575 N ARG A 102 -4.739 -1.182 -10.191 1.00 0.00 N ATOM 576 CA ARG A 102 -6.021 -1.875 -10.367 1.00 0.00 C ATOM 577 C ARG A 102 -7.100 -0.906 -9.879 1.00 0.00 C ATOM 578 O ARG A 102 -7.064 -0.482 -8.721 1.00 0.00 O ATOM 579 CB ARG A 102 -6.018 -3.060 -9.423 1.00 0.00 C ATOM 580 CG ARG A 102 -4.927 -4.117 -9.633 1.00 0.00 C ATOM 581 CD ARG A 102 -5.208 -4.891 -10.905 1.00 0.00 C ATOM 582 NE ARG A 102 -6.445 -5.673 -10.739 1.00 0.00 N ATOM 583 CZ ARG A 102 -6.658 -6.873 -11.266 1.00 0.00 C ATOM 584 NH1 ARG A 102 -5.856 -7.347 -12.208 1.00 0.00 N ATOM 585 NH2 ARG A 102 -7.765 -7.545 -10.985 1.00 0.00 N ATOM 0 H ARG A 102 -4.303 -1.356 -9.286 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.186 -2.189 -11.398 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.931 -2.681 -8.405 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -6.987 -3.554 -9.497 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.950 -3.638 -9.695 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -4.896 -4.796 -8.781 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.308 -4.205 -11.746 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.373 -5.554 -11.132 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.192 -5.263 -10.179 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -5.067 -6.789 -12.534 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -6.028 -8.270 -12.607 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -8.462 -7.141 -10.359 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -7.920 -8.466 -11.394 1.00 0.00 H new ATOM 586 N LEU A 103 -8.123 -0.682 -10.690 1.00 0.00 N ATOM 587 CA LEU A 103 -9.114 0.339 -10.355 1.00 0.00 C ATOM 588 C LEU A 103 -10.535 -0.211 -10.211 1.00 0.00 C ATOM 589 O LEU A 103 -11.186 -0.593 -11.178 1.00 0.00 O ATOM 590 CB LEU A 103 -9.039 1.470 -11.388 1.00 0.00 C ATOM 591 CG LEU A 103 -9.871 2.723 -11.095 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.596 3.360 -9.731 1.00 0.00 C ATOM 593 CD2 LEU A 103 -9.650 3.742 -12.208 1.00 0.00 C ATOM 0 H LEU A 103 -8.291 -1.178 -11.565 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.868 0.730 -9.368 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.996 1.770 -11.490 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -9.352 1.071 -12.353 1.00 0.00 H new ATOM 0 HG LEU A 103 -10.912 2.403 -11.059 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.227 4.240 -9.607 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.817 2.641 -8.942 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.548 3.654 -9.671 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -10.240 4.636 -12.005 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.594 4.007 -12.254 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -9.959 3.312 -13.161 1.00 0.00 H new ATOM 594 N GLU A 104 -11.064 0.160 -9.054 1.00 0.00 N ATOM 595 CA GLU A 104 -12.454 -0.118 -8.627 1.00 0.00 C ATOM 596 C GLU A 104 -13.512 0.804 -9.274 1.00 0.00 C ATOM 597 O GLU A 104 -14.678 0.769 -8.903 1.00 0.00 O ATOM 598 CB GLU A 104 -12.571 0.100 -7.118 1.00 0.00 C ATOM 599 CG GLU A 104 -11.946 -0.992 -6.251 1.00 0.00 C ATOM 600 CD GLU A 104 -12.857 -2.203 -6.023 1.00 0.00 C ATOM 601 OE1 GLU A 104 -13.499 -2.667 -6.998 1.00 0.00 O ATOM 602 OE2 GLU A 104 -12.883 -2.648 -4.858 1.00 0.00 O ATOM 0 H GLU A 104 -10.533 0.680 -8.355 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.651 -1.144 -8.937 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.103 1.052 -6.868 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.627 0.186 -6.861 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.021 -1.329 -6.719 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -11.677 -0.565 -5.285 1.00 0.00 H new ATOM 603 N GLU A 105 -13.068 1.612 -10.243 1.00 0.00 N ATOM 604 CA GLU A 105 -13.789 2.790 -10.795 1.00 0.00 C ATOM 605 C GLU A 105 -14.052 3.947 -9.823 1.00 0.00 C ATOM 606 O GLU A 105 -13.788 5.100 -10.153 1.00 0.00 O ATOM 607 CB GLU A 105 -15.102 2.419 -11.491 1.00 0.00 C ATOM 608 CG GLU A 105 -14.849 1.958 -12.911 1.00 0.00 C ATOM 609 CD GLU A 105 -16.191 1.553 -13.538 1.00 0.00 C ATOM 610 OE1 GLU A 105 -16.640 0.433 -13.220 1.00 0.00 O ATOM 611 OE2 GLU A 105 -16.741 2.401 -14.270 1.00 0.00 O ATOM 0 H GLU A 105 -12.162 1.467 -10.689 1.00 0.00 H new ATOM 0 HA GLU A 105 -13.069 3.161 -11.524 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -15.604 1.629 -10.932 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -15.771 3.280 -11.497 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -14.385 2.756 -13.491 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -14.158 1.115 -12.918 1.00 0.00 H new ATOM 612 N ASN A 106 -14.487 3.593 -8.626 1.00 0.00 N ATOM 613 CA ASN A 106 -14.867 4.545 -7.579 1.00 0.00 C ATOM 614 C ASN A 106 -13.690 5.198 -6.817 1.00 0.00 C ATOM 615 O ASN A 106 -13.609 5.146 -5.594 1.00 0.00 O ATOM 616 CB ASN A 106 -15.759 3.749 -6.646 1.00 0.00 C ATOM 617 CG ASN A 106 -16.696 4.674 -5.860 1.00 0.00 C ATOM 618 OD1 ASN A 106 -16.519 5.880 -5.729 1.00 0.00 O ATOM 619 ND2 ASN A 106 -17.639 4.063 -5.180 1.00 0.00 N ATOM 0 H ASN A 106 -14.590 2.619 -8.342 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.361 5.406 -8.029 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.347 3.034 -7.221 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.145 3.173 -5.953 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.229 4.592 -4.538 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.781 3.059 -5.294 1.00 0.00 H new ATOM 620 N HIS A 107 -12.756 5.745 -7.598 1.00 0.00 N ATOM 621 CA HIS A 107 -11.504 6.413 -7.162 1.00 0.00 C ATOM 622 C HIS A 107 -10.463 5.440 -6.575 1.00 0.00 C ATOM 623 O HIS A 107 -9.247 5.621 -6.720 1.00 0.00 O ATOM 624 CB HIS A 107 -11.735 7.548 -6.147 1.00 0.00 C ATOM 625 CG HIS A 107 -12.836 8.515 -6.583 1.00 0.00 C ATOM 626 ND1 HIS A 107 -14.131 8.338 -6.356 1.00 0.00 N ATOM 627 CD2 HIS A 107 -12.713 9.550 -7.407 1.00 0.00 C ATOM 628 CE1 HIS A 107 -14.812 9.231 -7.071 1.00 0.00 C ATOM 629 NE2 HIS A 107 -13.927 9.982 -7.707 1.00 0.00 N ATOM 0 H HIS A 107 -12.848 5.739 -8.614 1.00 0.00 H new ATOM 0 HA HIS A 107 -11.111 6.839 -8.085 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -11.997 7.118 -5.180 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -10.806 8.101 -6.008 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -11.784 9.966 -7.769 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -15.887 9.325 -7.122 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -14.145 10.763 -8.325 1.00 0.00 H new ATOM 630 N TYR A 108 -10.975 4.360 -5.988 1.00 0.00 N ATOM 631 CA TYR A 108 -10.230 3.317 -5.290 1.00 0.00 C ATOM 632 C TYR A 108 -9.216 2.560 -6.145 1.00 0.00 C ATOM 633 O TYR A 108 -9.537 1.788 -7.050 1.00 0.00 O ATOM 634 CB TYR A 108 -11.205 2.346 -4.610 1.00 0.00 C ATOM 635 CG TYR A 108 -12.005 3.009 -3.493 1.00 0.00 C ATOM 636 CD1 TYR A 108 -11.321 3.780 -2.541 1.00 0.00 C ATOM 637 CD2 TYR A 108 -13.424 2.896 -3.488 1.00 0.00 C ATOM 638 CE1 TYR A 108 -12.055 4.489 -1.577 1.00 0.00 C ATOM 639 CE2 TYR A 108 -14.163 3.606 -2.515 1.00 0.00 C ATOM 640 CZ TYR A 108 -13.459 4.394 -1.577 1.00 0.00 C ATOM 641 OH TYR A 108 -14.105 5.024 -0.557 1.00 0.00 O ATOM 0 H TYR A 108 -11.979 4.180 -5.987 1.00 0.00 H new ATOM 0 HA TYR A 108 -9.627 3.835 -4.545 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -11.892 1.944 -5.355 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -10.648 1.503 -4.202 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -10.242 3.827 -2.550 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -13.928 2.278 -4.216 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -11.548 5.100 -0.844 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -15.241 3.548 -2.489 1.00 0.00 H new ATOM 0 HH TYR A 108 -15.072 4.896 -0.654 1.00 0.00 H new ATOM 642 N ASN A 109 -7.984 2.747 -5.711 1.00 0.00 N ATOM 643 CA ASN A 109 -6.784 2.161 -6.314 1.00 0.00 C ATOM 644 C ASN A 109 -6.284 0.993 -5.460 1.00 0.00 C ATOM 645 O ASN A 109 -5.907 1.135 -4.305 1.00 0.00 O ATOM 646 CB ASN A 109 -5.749 3.274 -6.408 1.00 0.00 C ATOM 647 CG ASN A 109 -5.751 3.913 -7.803 1.00 0.00 C ATOM 648 OD1 ASN A 109 -4.873 3.668 -8.616 1.00 0.00 O ATOM 649 ND2 ASN A 109 -6.728 4.751 -8.089 1.00 0.00 N ATOM 0 H ASN A 109 -7.775 3.330 -4.901 1.00 0.00 H new ATOM 0 HA ASN A 109 -6.989 1.759 -7.306 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -5.959 4.034 -5.656 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -4.759 2.874 -6.189 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -6.759 5.206 -9.001 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -7.453 4.944 -7.398 1.00 0.00 H new ATOM 650 N THR A 110 -6.626 -0.161 -5.992 1.00 0.00 N ATOM 651 CA THR A 110 -6.135 -1.465 -5.481 1.00 0.00 C ATOM 652 C THR A 110 -4.805 -1.749 -6.207 1.00 0.00 C ATOM 653 O THR A 110 -4.626 -1.331 -7.344 1.00 0.00 O ATOM 654 CB THR A 110 -7.212 -2.538 -5.721 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.607 -2.547 -7.094 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.457 -2.298 -4.865 1.00 0.00 C ATOM 0 H THR A 110 -7.252 -0.243 -6.793 1.00 0.00 H new ATOM 0 HA THR A 110 -5.949 -1.462 -4.407 1.00 0.00 H new ATOM 0 HB THR A 110 -6.771 -3.495 -5.444 1.00 0.00 H new ATOM 0 HG1 THR A 110 -7.228 -1.766 -7.549 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.192 -3.078 -5.065 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.183 -2.320 -3.810 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.884 -1.325 -5.109 1.00 0.00 H new ATOM 657 N TYR A 111 -3.884 -2.463 -5.566 1.00 0.00 N ATOM 658 CA TYR A 111 -2.484 -2.502 -6.043 1.00 0.00 C ATOM 659 C TYR A 111 -1.749 -3.844 -5.922 1.00 0.00 C ATOM 660 O TYR A 111 -1.121 -4.101 -4.896 1.00 0.00 O ATOM 661 CB TYR A 111 -1.651 -1.417 -5.332 1.00 0.00 C ATOM 662 CG TYR A 111 -2.139 0.012 -5.536 1.00 0.00 C ATOM 663 CD1 TYR A 111 -2.028 0.613 -6.809 1.00 0.00 C ATOM 664 CD2 TYR A 111 -2.425 0.757 -4.382 1.00 0.00 C ATOM 665 CE1 TYR A 111 -2.180 2.007 -6.921 1.00 0.00 C ATOM 666 CE2 TYR A 111 -2.568 2.150 -4.489 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.439 2.760 -5.753 1.00 0.00 C ATOM 668 OH TYR A 111 -2.657 4.090 -5.882 1.00 0.00 O ATOM 0 H TYR A 111 -4.066 -3.017 -4.729 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.575 -2.323 -7.114 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.641 -1.631 -4.263 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.621 -1.486 -5.681 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.829 0.011 -7.684 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.534 0.267 -3.426 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.100 2.493 -7.882 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -2.774 2.747 -3.613 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.823 4.481 -4.999 1.00 0.00 H new ATOM 669 N ILE A 112 -1.756 -4.640 -6.987 1.00 0.00 N ATOM 670 CA ILE A 112 -1.010 -5.917 -6.958 1.00 0.00 C ATOM 671 C ILE A 112 0.497 -5.629 -7.073 1.00 0.00 C ATOM 672 O ILE A 112 0.949 -5.106 -8.086 1.00 0.00 O ATOM 673 CB ILE A 112 -1.302 -6.993 -8.031 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.765 -6.973 -8.509 1.00 0.00 C ATOM 675 CG2 ILE A 112 -0.747 -8.347 -7.560 1.00 0.00 C ATOM 676 CD1 ILE A 112 -3.588 -8.277 -8.542 1.00 0.00 C ATOM 0 H ILE A 112 -2.249 -4.444 -7.858 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.353 -6.342 -6.015 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.767 -6.763 -8.952 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.302 -6.268 -7.875 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.770 -6.562 -9.519 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.952 -9.106 -8.315 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.329 -8.266 -7.409 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -1.225 -8.630 -6.622 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.593 -8.064 -8.906 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -3.106 -8.995 -9.206 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.647 -8.695 -7.537 1.00 0.00 H new ATOM 677 N SER A 113 1.222 -6.194 -6.132 1.00 0.00 N ATOM 678 CA SER A 113 2.696 -6.177 -6.108 1.00 0.00 C ATOM 679 C SER A 113 3.265 -6.947 -7.302 1.00 0.00 C ATOM 680 O SER A 113 2.980 -8.122 -7.482 1.00 0.00 O ATOM 681 CB SER A 113 3.242 -6.692 -4.766 1.00 0.00 C ATOM 682 OG SER A 113 2.775 -8.002 -4.448 1.00 0.00 O ATOM 0 H SER A 113 0.811 -6.691 -5.342 1.00 0.00 H new ATOM 0 HA SER A 113 3.028 -5.143 -6.201 1.00 0.00 H new ATOM 0 HB2 SER A 113 4.331 -6.697 -4.800 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.951 -6.004 -3.972 1.00 0.00 H new ATOM 0 HG SER A 113 1.809 -7.975 -4.286 1.00 0.00 H new ATOM 683 N LYS A 114 3.942 -6.192 -8.163 1.00 0.00 N ATOM 684 CA LYS A 114 4.524 -6.686 -9.438 1.00 0.00 C ATOM 685 C LYS A 114 5.179 -8.060 -9.344 1.00 0.00 C ATOM 686 O LYS A 114 4.804 -8.977 -10.069 1.00 0.00 O ATOM 687 CB LYS A 114 5.557 -5.674 -9.944 1.00 0.00 C ATOM 688 CG LYS A 114 5.170 -5.108 -11.297 1.00 0.00 C ATOM 689 CD LYS A 114 5.317 -6.147 -12.413 1.00 0.00 C ATOM 690 CE LYS A 114 4.434 -5.724 -13.571 1.00 0.00 C ATOM 691 NZ LYS A 114 4.608 -6.646 -14.697 1.00 0.00 N ATOM 0 H LYS A 114 4.113 -5.199 -8.004 1.00 0.00 H new ATOM 0 HA LYS A 114 3.688 -6.794 -10.130 1.00 0.00 H new ATOM 0 HB2 LYS A 114 5.654 -4.862 -9.224 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.533 -6.155 -10.016 1.00 0.00 H new ATOM 0 HG2 LYS A 114 4.139 -4.756 -11.262 1.00 0.00 H new ATOM 0 HG3 LYS A 114 5.795 -4.243 -11.521 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.357 -6.217 -12.733 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.027 -7.134 -12.054 1.00 0.00 H new ATOM 0 HE2 LYS A 114 3.390 -5.713 -13.258 1.00 0.00 H new ATOM 0 HE3 LYS A 114 4.686 -4.709 -13.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 3.999 -6.349 -15.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.602 -6.636 -15.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.346 -7.608 -14.401 1.00 0.00 H new ATOM 692 N LYS A 115 6.025 -8.223 -8.325 1.00 0.00 N ATOM 693 CA LYS A 115 6.680 -9.507 -8.048 1.00 0.00 C ATOM 694 C LYS A 115 5.640 -10.598 -7.730 1.00 0.00 C ATOM 695 O LYS A 115 5.493 -11.573 -8.464 1.00 0.00 O ATOM 696 CB LYS A 115 7.692 -9.340 -6.898 1.00 0.00 C ATOM 697 CG LYS A 115 8.399 -10.678 -6.746 1.00 0.00 C ATOM 698 CD LYS A 115 8.826 -11.033 -5.327 1.00 0.00 C ATOM 699 CE LYS A 115 8.583 -12.520 -5.177 1.00 0.00 C ATOM 700 NZ LYS A 115 9.573 -13.347 -5.876 1.00 0.00 N ATOM 0 H LYS A 115 6.275 -7.479 -7.674 1.00 0.00 H new ATOM 0 HA LYS A 115 7.221 -9.827 -8.938 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.406 -8.547 -7.122 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.186 -9.062 -5.974 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.739 -11.463 -7.116 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.283 -10.678 -7.384 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.876 -10.791 -5.164 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.251 -10.468 -4.594 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.590 -12.776 -4.118 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.589 -12.758 -5.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.349 -14.352 -5.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.552 -13.129 -6.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.521 -13.147 -5.499 1.00 0.00 H new ATOM 701 N HIS A 116 4.837 -10.342 -6.696 1.00 0.00 N ATOM 702 CA HIS A 116 3.820 -11.285 -6.189 1.00 0.00 C ATOM 703 C HIS A 116 2.481 -11.253 -6.955 1.00 0.00 C ATOM 704 O HIS A 116 1.445 -11.669 -6.426 1.00 0.00 O ATOM 705 CB HIS A 116 3.556 -10.952 -4.726 1.00 0.00 C ATOM 706 CG HIS A 116 4.801 -10.727 -3.891 1.00 0.00 C ATOM 707 ND1 HIS A 116 5.183 -9.531 -3.444 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.706 -11.624 -3.523 1.00 0.00 C ATOM 709 CE1 HIS A 116 6.327 -9.687 -2.803 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.661 -10.969 -2.857 1.00 0.00 N ATOM 0 H HIS A 116 4.869 -9.465 -6.176 1.00 0.00 H new ATOM 0 HA HIS A 116 4.223 -12.288 -6.327 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.936 -10.057 -4.678 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.979 -11.763 -4.282 1.00 0.00 H new ATOM 0 HD1 HIS A 116 4.681 -8.652 -3.574 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.676 -12.685 -3.724 1.00 0.00 H new ATOM 0 HE1 HIS A 116 6.893 -8.905 -2.318 1.00 0.00 H new ATOM 711 N ALA A 117 2.543 -10.919 -8.247 1.00 0.00 N ATOM 712 CA ALA A 117 1.400 -11.099 -9.158 1.00 0.00 C ATOM 713 C ALA A 117 1.044 -12.595 -9.284 1.00 0.00 C ATOM 714 O ALA A 117 -0.126 -12.957 -9.232 1.00 0.00 O ATOM 715 CB ALA A 117 1.713 -10.496 -10.528 1.00 0.00 C ATOM 0 H ALA A 117 3.372 -10.522 -8.690 1.00 0.00 H new ATOM 0 HA ALA A 117 0.537 -10.578 -8.745 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.859 -10.636 -11.191 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.916 -9.431 -10.419 1.00 0.00 H new ATOM 0 HB3 ALA A 117 2.587 -10.990 -10.952 1.00 0.00 H new ATOM 716 N GLU A 118 2.087 -13.418 -9.135 1.00 0.00 N ATOM 717 CA GLU A 118 1.953 -14.893 -9.099 1.00 0.00 C ATOM 718 C GLU A 118 1.222 -15.452 -7.855 1.00 0.00 C ATOM 719 O GLU A 118 0.978 -16.658 -7.759 1.00 0.00 O ATOM 720 CB GLU A 118 3.301 -15.580 -9.360 1.00 0.00 C ATOM 721 CG GLU A 118 4.410 -15.171 -8.391 1.00 0.00 C ATOM 722 CD GLU A 118 5.766 -15.803 -8.722 1.00 0.00 C ATOM 723 OE1 GLU A 118 5.891 -17.041 -8.597 1.00 0.00 O ATOM 724 OE2 GLU A 118 6.669 -15.009 -9.068 1.00 0.00 O ATOM 0 H GLU A 118 3.048 -13.090 -9.036 1.00 0.00 H new ATOM 0 HA GLU A 118 1.284 -15.145 -9.922 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.163 -16.660 -9.302 1.00 0.00 H new ATOM 0 HB3 GLU A 118 3.621 -15.354 -10.377 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.510 -14.086 -8.401 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.122 -15.455 -7.379 1.00 0.00 H new ATOM 725 N LYS A 119 0.990 -14.570 -6.881 1.00 0.00 N ATOM 726 CA LYS A 119 0.207 -14.811 -5.655 1.00 0.00 C ATOM 727 C LYS A 119 -0.967 -13.844 -5.434 1.00 0.00 C ATOM 728 O LYS A 119 -1.708 -13.992 -4.457 1.00 0.00 O ATOM 729 CB LYS A 119 1.190 -14.681 -4.482 1.00 0.00 C ATOM 730 CG LYS A 119 1.954 -15.981 -4.258 1.00 0.00 C ATOM 731 CD LYS A 119 3.370 -15.702 -3.748 1.00 0.00 C ATOM 732 CE LYS A 119 4.256 -15.207 -4.890 1.00 0.00 C ATOM 733 NZ LYS A 119 5.631 -14.985 -4.418 1.00 0.00 N ATOM 0 H LYS A 119 1.359 -13.620 -6.922 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.250 -15.797 -5.740 1.00 0.00 H new ATOM 0 HB2 LYS A 119 1.893 -13.872 -4.681 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.646 -14.415 -3.576 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.420 -16.602 -3.539 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.003 -16.544 -5.190 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.338 -14.956 -2.954 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.794 -16.609 -3.316 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.257 -15.937 -5.700 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.851 -14.280 -5.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 6.087 -14.259 -5.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.611 -14.666 -3.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.169 -15.873 -4.485 1.00 0.00 H new ATOM 734 N ASN A 120 -1.185 -12.916 -6.384 1.00 0.00 N ATOM 735 CA ASN A 120 -2.210 -11.844 -6.334 1.00 0.00 C ATOM 736 C ASN A 120 -2.244 -10.982 -5.058 1.00 0.00 C ATOM 737 O ASN A 120 -3.287 -10.465 -4.649 1.00 0.00 O ATOM 738 CB ASN A 120 -3.606 -12.416 -6.596 1.00 0.00 C ATOM 739 CG ASN A 120 -3.678 -12.921 -8.037 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.941 -12.178 -8.979 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.448 -14.197 -8.215 1.00 0.00 N ATOM 0 H ASN A 120 -0.634 -12.887 -7.242 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.901 -11.162 -7.127 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.815 -13.230 -5.902 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.364 -11.651 -6.428 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.485 -14.596 -9.153 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -3.232 -14.793 -7.416 1.00 0.00 H new ATOM 742 N TRP A 121 -1.053 -10.649 -4.606 1.00 0.00 N ATOM 743 CA TRP A 121 -0.894 -9.853 -3.379 1.00 0.00 C ATOM 744 C TRP A 121 -0.953 -8.355 -3.624 1.00 0.00 C ATOM 745 O TRP A 121 -0.088 -7.785 -4.296 1.00 0.00 O ATOM 746 CB TRP A 121 0.411 -10.186 -2.666 1.00 0.00 C ATOM 747 CG TRP A 121 0.491 -11.611 -2.133 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.519 -12.462 -1.997 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.618 -12.213 -1.577 1.00 0.00 C ATOM 750 NE1 TRP A 121 -0.098 -13.573 -1.408 1.00 0.00 N ATOM 751 CE2 TRP A 121 1.192 -13.471 -1.117 1.00 0.00 C ATOM 752 CE3 TRP A 121 2.948 -11.798 -1.389 1.00 0.00 C ATOM 753 CZ2 TRP A 121 2.085 -14.342 -0.450 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.860 -12.672 -0.758 1.00 0.00 C ATOM 755 CH2 TRP A 121 3.422 -13.918 -0.272 1.00 0.00 C ATOM 0 H TRP A 121 -0.177 -10.910 -5.058 1.00 0.00 H new ATOM 0 HA TRP A 121 -1.741 -10.124 -2.749 1.00 0.00 H new ATOM 0 HB2 TRP A 121 1.239 -10.022 -3.355 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.545 -9.492 -1.836 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.533 -12.277 -2.318 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -0.680 -14.386 -1.208 1.00 0.00 H new ATOM 0 HE3 TRP A 121 3.268 -10.822 -1.723 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 1.755 -15.304 -0.087 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.895 -12.384 -0.648 1.00 0.00 H new ATOM 0 HH2 TRP A 121 4.119 -14.561 0.245 1.00 0.00 H new ATOM 756 N PHE A 122 -2.006 -7.760 -3.080 1.00 0.00 N ATOM 757 CA PHE A 122 -2.143 -6.300 -3.043 1.00 0.00 C ATOM 758 C PHE A 122 -1.674 -5.776 -1.676 1.00 0.00 C ATOM 759 O PHE A 122 -1.513 -6.547 -0.740 1.00 0.00 O ATOM 760 CB PHE A 122 -3.600 -5.874 -3.232 1.00 0.00 C ATOM 761 CG PHE A 122 -4.324 -6.421 -4.470 1.00 0.00 C ATOM 762 CD1 PHE A 122 -4.791 -7.758 -4.491 1.00 0.00 C ATOM 763 CD2 PHE A 122 -4.758 -5.499 -5.444 1.00 0.00 C ATOM 764 CE1 PHE A 122 -5.723 -8.158 -5.469 1.00 0.00 C ATOM 765 CE2 PHE A 122 -5.684 -5.890 -6.432 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.165 -7.224 -6.426 1.00 0.00 C ATOM 0 H PHE A 122 -2.784 -8.264 -2.655 1.00 0.00 H new ATOM 0 HA PHE A 122 -1.538 -5.889 -3.852 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.161 -6.178 -2.348 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -3.634 -4.785 -3.272 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.434 -8.468 -3.760 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.379 -4.488 -5.433 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.095 -9.172 -5.485 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.021 -5.187 -7.179 1.00 0.00 H new ATOM 0 HZ PHE A 122 -6.885 -7.530 -7.171 1.00 0.00 H new ATOM 767 N VAL A 123 -1.335 -4.483 -1.616 1.00 0.00 N ATOM 768 CA VAL A 123 -1.174 -3.833 -0.292 1.00 0.00 C ATOM 769 C VAL A 123 -2.548 -3.639 0.352 1.00 0.00 C ATOM 770 O VAL A 123 -3.555 -3.562 -0.344 1.00 0.00 O ATOM 771 CB VAL A 123 -0.390 -2.513 -0.248 1.00 0.00 C ATOM 772 CG1 VAL A 123 1.102 -2.795 -0.307 1.00 0.00 C ATOM 773 CG2 VAL A 123 -0.843 -1.449 -1.248 1.00 0.00 C ATOM 0 H VAL A 123 -1.171 -3.881 -2.423 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.546 -4.526 0.268 1.00 0.00 H new ATOM 0 HB VAL A 123 -0.623 -2.049 0.711 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.652 -1.854 -0.275 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.390 -3.412 0.544 1.00 0.00 H new ATOM 0 HG13 VAL A 123 1.337 -3.321 -1.232 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.226 -0.557 -1.135 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -0.740 -1.835 -2.262 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -1.886 -1.195 -1.061 1.00 0.00 H new ATOM 774 N GLY A 124 -2.541 -3.536 1.678 1.00 0.00 N ATOM 775 CA GLY A 124 -3.794 -3.380 2.449 1.00 0.00 C ATOM 776 C GLY A 124 -3.580 -3.013 3.901 1.00 0.00 C ATOM 777 O GLY A 124 -2.492 -3.096 4.448 1.00 0.00 O ATOM 0 H GLY A 124 -1.695 -3.556 2.247 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.406 -2.612 1.977 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -4.358 -4.312 2.399 1.00 0.00 H new ATOM 778 N LEU A 125 -4.601 -2.296 4.323 1.00 0.00 N ATOM 779 CA LEU A 125 -4.730 -1.792 5.691 1.00 0.00 C ATOM 780 C LEU A 125 -5.640 -2.662 6.520 1.00 0.00 C ATOM 781 O LEU A 125 -6.771 -2.997 6.169 1.00 0.00 O ATOM 782 CB LEU A 125 -5.212 -0.344 5.670 1.00 0.00 C ATOM 783 CG LEU A 125 -4.025 0.600 5.812 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.006 0.436 4.712 1.00 0.00 C ATOM 785 CD2 LEU A 125 -4.503 2.048 5.805 1.00 0.00 C ATOM 0 H LEU A 125 -5.383 -2.038 3.721 1.00 0.00 H new ATOM 0 HA LEU A 125 -3.748 -1.824 6.162 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.740 -0.141 4.738 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -5.921 -0.176 6.481 1.00 0.00 H new ATOM 0 HG LEU A 125 -3.548 0.347 6.759 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -2.185 1.136 4.869 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.621 -0.584 4.722 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -3.475 0.637 3.749 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -3.646 2.714 5.907 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.016 2.257 4.866 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.189 2.209 6.637 1.00 0.00 H new ATOM 786 N LYS A 126 -5.053 -3.041 7.641 1.00 0.00 N ATOM 787 CA LYS A 126 -5.733 -3.913 8.571 1.00 0.00 C ATOM 788 C LYS A 126 -6.869 -3.139 9.278 1.00 0.00 C ATOM 789 O LYS A 126 -6.754 -1.931 9.524 1.00 0.00 O ATOM 790 CB LYS A 126 -4.694 -4.402 9.581 1.00 0.00 C ATOM 791 CG LYS A 126 -5.086 -5.605 10.429 1.00 0.00 C ATOM 792 CD LYS A 126 -4.161 -5.727 11.644 1.00 0.00 C ATOM 793 CE LYS A 126 -4.127 -4.432 12.452 1.00 0.00 C ATOM 794 NZ LYS A 126 -3.367 -4.615 13.689 1.00 0.00 N ATOM 0 H LYS A 126 -4.115 -2.759 7.925 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.183 -4.763 8.057 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -3.781 -4.649 9.039 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -4.454 -3.576 10.251 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -6.120 -5.503 10.760 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -5.031 -6.514 9.830 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -4.499 -6.545 12.280 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -3.153 -5.977 11.312 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -3.677 -3.638 11.857 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -5.144 -4.117 12.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -3.355 -3.723 14.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -3.813 -5.358 14.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -2.392 -4.894 13.459 1.00 0.00 H new ATOM 795 N LYS A 127 -7.971 -3.842 9.542 1.00 0.00 N ATOM 796 CA LYS A 127 -9.228 -3.291 10.118 1.00 0.00 C ATOM 797 C LYS A 127 -9.150 -2.668 11.526 1.00 0.00 C ATOM 798 O LYS A 127 -10.165 -2.238 12.098 1.00 0.00 O ATOM 799 CB LYS A 127 -10.272 -4.427 10.120 1.00 0.00 C ATOM 800 CG LYS A 127 -10.540 -5.046 8.746 1.00 0.00 C ATOM 801 CD LYS A 127 -11.319 -4.131 7.816 1.00 0.00 C ATOM 802 CE LYS A 127 -11.493 -4.791 6.452 1.00 0.00 C ATOM 803 NZ LYS A 127 -12.574 -4.123 5.719 1.00 0.00 N ATOM 0 H LYS A 127 -8.029 -4.844 9.360 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.491 -2.445 9.483 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.936 -5.211 10.798 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -11.210 -4.041 10.519 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.589 -5.303 8.279 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -11.093 -5.976 8.876 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -12.295 -3.908 8.247 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.795 -3.182 7.705 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -10.564 -4.730 5.886 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -11.723 -5.849 6.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -12.704 -4.584 4.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -13.456 -4.188 6.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -12.329 -3.123 5.575 1.00 0.00 H new ATOM 804 N ASN A 128 -7.925 -2.391 11.946 1.00 0.00 N ATOM 805 CA ASN A 128 -7.542 -1.849 13.264 1.00 0.00 C ATOM 806 C ASN A 128 -6.586 -0.648 13.141 1.00 0.00 C ATOM 807 O ASN A 128 -6.576 0.229 14.005 1.00 0.00 O ATOM 808 CB ASN A 128 -6.762 -2.924 14.019 1.00 0.00 C ATOM 809 CG ASN A 128 -7.536 -4.172 14.450 1.00 0.00 C ATOM 810 OD1 ASN A 128 -7.028 -5.279 14.504 1.00 0.00 O ATOM 811 ND2 ASN A 128 -8.792 -4.015 14.809 1.00 0.00 N ATOM 0 H ASN A 128 -7.114 -2.544 11.347 1.00 0.00 H new ATOM 0 HA ASN A 128 -8.459 -1.543 13.768 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.930 -3.242 13.391 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -6.333 -2.467 14.911 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -9.335 -4.817 15.130 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -9.223 -3.092 14.766 1.00 0.00 H new ATOM 812 N GLY A 129 -5.765 -0.685 12.091 1.00 0.00 N ATOM 813 CA GLY A 129 -4.668 0.274 11.899 1.00 0.00 C ATOM 814 C GLY A 129 -3.705 -0.176 10.812 1.00 0.00 C ATOM 815 O GLY A 129 -4.048 -0.111 9.629 1.00 0.00 O ATOM 0 H GLY A 129 -5.839 -1.379 11.348 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -5.080 1.249 11.638 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -4.125 0.397 12.836 1.00 0.00 H new ATOM 816 N SER A 130 -2.751 -0.973 11.275 1.00 0.00 N ATOM 817 CA SER A 130 -1.488 -1.277 10.583 1.00 0.00 C ATOM 818 C SER A 130 -1.607 -1.836 9.157 1.00 0.00 C ATOM 819 O SER A 130 -2.658 -2.315 8.739 1.00 0.00 O ATOM 820 CB SER A 130 -0.620 -2.175 11.479 1.00 0.00 C ATOM 821 OG SER A 130 0.647 -2.356 10.844 1.00 0.00 O ATOM 0 H SER A 130 -2.830 -1.447 12.175 1.00 0.00 H new ATOM 0 HA SER A 130 -1.006 -0.313 10.421 1.00 0.00 H new ATOM 0 HB2 SER A 130 -0.491 -1.719 12.461 1.00 0.00 H new ATOM 0 HB3 SER A 130 -1.106 -3.138 11.636 1.00 0.00 H new ATOM 0 HG SER A 130 1.284 -1.697 11.191 1.00 0.00 H new ATOM 822 N CYS A 131 -0.512 -1.750 8.400 1.00 0.00 N ATOM 823 CA CYS A 131 -0.503 -2.172 6.993 1.00 0.00 C ATOM 824 C CYS A 131 -0.206 -3.664 6.886 1.00 0.00 C ATOM 825 O CYS A 131 0.935 -4.117 7.000 1.00 0.00 O ATOM 826 CB CYS A 131 0.548 -1.397 6.204 1.00 0.00 C ATOM 827 SG CYS A 131 0.162 0.344 5.825 1.00 0.00 S ATOM 0 H CYS A 131 0.382 -1.392 8.735 1.00 0.00 H new ATOM 0 HA CYS A 131 -1.489 -1.966 6.577 1.00 0.00 H new ATOM 0 HB2 CYS A 131 1.483 -1.425 6.763 1.00 0.00 H new ATOM 0 HB3 CYS A 131 0.723 -1.920 5.264 1.00 0.00 H new ATOM 0 HG CYS A 131 0.735 0.683 4.709 1.00 0.00 H new ATOM 828 N LYS A 132 -1.260 -4.412 6.553 1.00 0.00 N ATOM 829 CA LYS A 132 -1.172 -5.861 6.626 1.00 0.00 C ATOM 830 C LYS A 132 -1.271 -6.735 5.382 1.00 0.00 C ATOM 831 O LYS A 132 -2.325 -6.911 4.770 1.00 0.00 O ATOM 832 CB LYS A 132 -1.994 -6.464 7.758 1.00 0.00 C ATOM 833 CG LYS A 132 -1.345 -6.145 9.095 1.00 0.00 C ATOM 834 CD LYS A 132 0.056 -6.730 9.193 1.00 0.00 C ATOM 835 CE LYS A 132 0.657 -6.285 10.513 1.00 0.00 C ATOM 836 NZ LYS A 132 1.683 -7.292 10.765 1.00 0.00 N ATOM 0 H LYS A 132 -2.159 -4.046 6.239 1.00 0.00 H new ATOM 0 HA LYS A 132 -0.101 -5.905 6.825 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -3.009 -6.068 7.733 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -2.070 -7.544 7.629 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -1.298 -5.064 9.228 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -1.962 -6.540 9.902 1.00 0.00 H new ATOM 0 HD2 LYS A 132 0.020 -7.818 9.138 1.00 0.00 H new ATOM 0 HD3 LYS A 132 0.671 -6.389 8.360 1.00 0.00 H new ATOM 0 HE2 LYS A 132 1.083 -5.284 10.445 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -0.088 -6.261 11.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 2.166 -7.079 11.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 1.240 -8.231 10.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 2.375 -7.284 9.989 1.00 0.00 H new ATOM 837 N ARG A 133 -0.069 -7.215 5.088 1.00 0.00 N ATOM 838 CA ARG A 133 0.205 -8.519 4.446 1.00 0.00 C ATOM 839 C ARG A 133 0.082 -8.678 2.928 1.00 0.00 C ATOM 840 O ARG A 133 0.190 -7.708 2.182 1.00 0.00 O ATOM 841 CB ARG A 133 -0.577 -9.630 5.189 1.00 0.00 C ATOM 842 CG ARG A 133 0.065 -9.934 6.536 1.00 0.00 C ATOM 843 CD ARG A 133 -0.863 -10.737 7.451 1.00 0.00 C ATOM 844 NE ARG A 133 -2.052 -9.944 7.796 1.00 0.00 N ATOM 845 CZ ARG A 133 -2.708 -9.962 8.952 1.00 0.00 C ATOM 846 NH1 ARG A 133 -2.201 -10.544 10.041 1.00 0.00 N ATOM 847 NH2 ARG A 133 -3.819 -9.259 9.076 1.00 0.00 N ATOM 0 H ARG A 133 0.784 -6.695 5.294 1.00 0.00 H new ATOM 0 HA ARG A 133 1.286 -8.604 4.555 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.611 -9.317 5.336 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -0.601 -10.534 4.580 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.989 -10.491 6.379 1.00 0.00 H new ATOM 0 HG3 ARG A 133 0.336 -8.999 7.027 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -1.164 -11.660 6.955 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -0.332 -11.022 8.359 1.00 0.00 H new ATOM 0 HE ARG A 133 -2.410 -9.317 7.076 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -1.285 -10.992 10.001 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -2.729 -10.541 10.914 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -4.165 -8.710 8.289 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -4.331 -9.265 9.958 1.00 0.00 H new ATOM 848 N GLY A 134 0.385 -9.920 2.579 1.00 0.00 N ATOM 849 CA GLY A 134 0.265 -10.505 1.235 1.00 0.00 C ATOM 850 C GLY A 134 -0.877 -11.542 1.161 1.00 0.00 C ATOM 851 O GLY A 134 -1.898 -11.249 0.525 1.00 0.00 O ATOM 0 H GLY A 134 0.742 -10.591 3.259 1.00 0.00 H new ATOM 0 HA2 GLY A 134 0.084 -9.713 0.509 1.00 0.00 H new ATOM 0 HA3 GLY A 134 1.206 -10.981 0.960 1.00 0.00 H new ATOM 852 N PRO A 135 -0.741 -12.740 1.756 1.00 0.00 N ATOM 853 CA PRO A 135 -1.728 -13.830 1.577 1.00 0.00 C ATOM 854 C PRO A 135 -2.910 -13.663 2.556 1.00 0.00 C ATOM 855 O PRO A 135 -3.122 -14.418 3.507 1.00 0.00 O ATOM 856 CB PRO A 135 -0.878 -15.093 1.752 1.00 0.00 C ATOM 857 CG PRO A 135 0.108 -14.694 2.839 1.00 0.00 C ATOM 858 CD PRO A 135 0.382 -13.206 2.592 1.00 0.00 C ATOM 0 HA PRO A 135 -2.234 -13.852 0.612 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -1.483 -15.949 2.051 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.370 -15.369 0.828 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -0.310 -14.860 3.832 1.00 0.00 H new ATOM 0 HG3 PRO A 135 1.024 -15.281 2.777 1.00 0.00 H new ATOM 0 HD2 PRO A 135 0.430 -12.653 3.530 1.00 0.00 H new ATOM 0 HD3 PRO A 135 1.337 -13.060 2.086 1.00 0.00 H new ATOM 859 N ARG A 136 -3.680 -12.662 2.168 1.00 0.00 N ATOM 860 CA ARG A 136 -4.839 -12.076 2.884 1.00 0.00 C ATOM 861 C ARG A 136 -5.483 -10.993 2.008 1.00 0.00 C ATOM 862 O ARG A 136 -6.691 -10.981 1.793 1.00 0.00 O ATOM 863 CB ARG A 136 -4.328 -11.439 4.192 1.00 0.00 C ATOM 864 CG ARG A 136 -5.464 -10.880 5.049 1.00 0.00 C ATOM 865 CD ARG A 136 -4.955 -9.635 5.775 1.00 0.00 C ATOM 866 NE ARG A 136 -6.075 -8.841 6.306 1.00 0.00 N ATOM 867 CZ ARG A 136 -6.102 -7.513 6.394 1.00 0.00 C ATOM 868 NH1 ARG A 136 -5.148 -6.753 5.885 1.00 0.00 N ATOM 869 NH2 ARG A 136 -7.133 -6.879 6.945 1.00 0.00 N ATOM 0 H ARG A 136 -3.513 -12.190 1.279 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.578 -12.847 3.103 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.777 -12.184 4.765 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.628 -10.638 3.954 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.322 -10.630 4.425 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -5.799 -11.627 5.768 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -4.294 -9.929 6.590 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -4.365 -9.026 5.090 1.00 0.00 H new ATOM 0 HE ARG A 136 -6.897 -9.349 6.633 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.356 -7.181 5.405 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.203 -5.738 5.972 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.923 -7.411 7.310 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -7.134 -5.861 7.003 1.00 0.00 H new ATOM 870 N THR A 137 -4.621 -10.145 1.452 1.00 0.00 N ATOM 871 CA THR A 137 -4.961 -8.942 0.668 1.00 0.00 C ATOM 872 C THR A 137 -5.198 -9.177 -0.823 1.00 0.00 C ATOM 873 O THR A 137 -4.329 -9.009 -1.676 1.00 0.00 O ATOM 874 CB THR A 137 -3.852 -7.903 0.906 1.00 0.00 C ATOM 875 OG1 THR A 137 -2.588 -8.571 1.053 1.00 0.00 O ATOM 876 CG2 THR A 137 -4.208 -7.018 2.087 1.00 0.00 C ATOM 0 H THR A 137 -3.613 -10.278 1.536 1.00 0.00 H new ATOM 0 HA THR A 137 -5.929 -8.585 1.020 1.00 0.00 H new ATOM 0 HB THR A 137 -3.762 -7.241 0.045 1.00 0.00 H new ATOM 0 HG1 THR A 137 -1.909 -8.107 0.521 1.00 0.00 H new ATOM 0 HG21 THR A 137 -3.415 -6.287 2.246 1.00 0.00 H new ATOM 0 HG22 THR A 137 -5.145 -6.499 1.884 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.320 -7.632 2.981 1.00 0.00 H new ATOM 877 N HIS A 138 -6.456 -9.523 -1.070 1.00 0.00 N ATOM 878 CA HIS A 138 -7.009 -9.723 -2.416 1.00 0.00 C ATOM 879 C HIS A 138 -8.333 -8.970 -2.605 1.00 0.00 C ATOM 880 O HIS A 138 -8.978 -8.534 -1.642 1.00 0.00 O ATOM 881 CB HIS A 138 -7.163 -11.213 -2.742 1.00 0.00 C ATOM 882 CG HIS A 138 -8.149 -11.928 -1.811 1.00 0.00 C ATOM 883 ND1 HIS A 138 -9.465 -11.782 -1.825 1.00 0.00 N ATOM 884 CD2 HIS A 138 -7.828 -12.724 -0.797 1.00 0.00 C ATOM 885 CE1 HIS A 138 -9.979 -12.478 -0.814 1.00 0.00 C ATOM 886 NE2 HIS A 138 -8.962 -13.063 -0.181 1.00 0.00 N ATOM 0 H HIS A 138 -7.139 -9.677 -0.329 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.294 -9.302 -3.123 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.500 -11.321 -3.773 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.189 -11.698 -2.673 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -9.996 -11.229 -2.498 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -6.832 -13.039 -0.522 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -11.025 -12.555 -0.555 1.00 0.00 H new ATOM 887 N TYR A 139 -8.632 -8.672 -3.870 1.00 0.00 N ATOM 888 CA TYR A 139 -9.943 -8.144 -4.311 1.00 0.00 C ATOM 889 C TYR A 139 -11.131 -8.753 -3.557 1.00 0.00 C ATOM 890 O TYR A 139 -11.169 -9.968 -3.338 1.00 0.00 O ATOM 891 CB TYR A 139 -10.106 -8.338 -5.824 1.00 0.00 C ATOM 892 CG TYR A 139 -10.113 -7.015 -6.614 1.00 0.00 C ATOM 893 CD1 TYR A 139 -10.985 -5.965 -6.241 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.193 -6.862 -7.666 1.00 0.00 C ATOM 895 CE1 TYR A 139 -10.901 -4.727 -6.916 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.101 -5.625 -8.336 1.00 0.00 C ATOM 897 CZ TYR A 139 -9.950 -4.567 -7.940 1.00 0.00 C ATOM 898 OH TYR A 139 -9.764 -3.335 -8.491 1.00 0.00 O ATOM 0 H TYR A 139 -7.967 -8.789 -4.635 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.948 -7.080 -4.073 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.296 -8.968 -6.191 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -11.037 -8.872 -6.016 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.706 -6.108 -5.450 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -8.561 -7.687 -7.959 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -11.559 -3.913 -6.649 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -8.393 -5.488 -9.140 1.00 0.00 H new ATOM 0 HH TYR A 139 -9.051 -2.865 -8.009 1.00 0.00 H new ATOM 899 N GLY A 140 -11.862 -7.849 -2.921 1.00 0.00 N ATOM 900 CA GLY A 140 -13.022 -8.184 -2.068 1.00 0.00 C ATOM 901 C GLY A 140 -12.839 -7.554 -0.684 1.00 0.00 C ATOM 902 O GLY A 140 -13.737 -6.879 -0.180 1.00 0.00 O ATOM 0 H GLY A 140 -11.675 -6.848 -2.975 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -13.941 -7.819 -2.526 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -13.119 -9.266 -1.977 1.00 0.00 H new ATOM 903 N GLN A 141 -11.612 -7.626 -0.179 1.00 0.00 N ATOM 904 CA GLN A 141 -11.219 -6.938 1.060 1.00 0.00 C ATOM 905 C GLN A 141 -11.147 -5.447 0.784 1.00 0.00 C ATOM 906 O GLN A 141 -10.385 -4.963 -0.048 1.00 0.00 O ATOM 907 CB GLN A 141 -9.801 -7.370 1.446 1.00 0.00 C ATOM 908 CG GLN A 141 -9.599 -8.874 1.699 1.00 0.00 C ATOM 909 CD GLN A 141 -10.004 -9.344 3.096 1.00 0.00 C ATOM 910 OE1 GLN A 141 -10.853 -8.805 3.801 1.00 0.00 O ATOM 911 NE2 GLN A 141 -9.336 -10.379 3.559 1.00 0.00 N ATOM 0 H GLN A 141 -10.858 -8.160 -0.611 1.00 0.00 H new ATOM 0 HA GLN A 141 -11.937 -7.174 1.845 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -9.120 -7.061 0.653 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -9.510 -6.828 2.346 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -10.174 -9.434 0.961 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -8.549 -9.118 1.538 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -8.630 -10.831 2.979 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -9.525 -10.729 4.498 1.00 0.00 H new ATOM 912 N LYS A 142 -11.899 -4.743 1.613 1.00 0.00 N ATOM 913 CA LYS A 142 -11.818 -3.268 1.674 1.00 0.00 C ATOM 914 C LYS A 142 -10.423 -2.751 2.032 1.00 0.00 C ATOM 915 O LYS A 142 -10.003 -1.683 1.591 1.00 0.00 O ATOM 916 CB LYS A 142 -12.852 -2.754 2.670 1.00 0.00 C ATOM 917 CG LYS A 142 -14.228 -2.883 2.028 1.00 0.00 C ATOM 918 CD LYS A 142 -15.239 -2.106 2.881 1.00 0.00 C ATOM 919 CE LYS A 142 -16.622 -2.073 2.239 1.00 0.00 C ATOM 920 NZ LYS A 142 -17.208 -3.427 2.203 1.00 0.00 N ATOM 0 H LYS A 142 -12.575 -5.154 2.257 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.029 -2.887 0.675 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -12.808 -3.328 3.596 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -12.648 -1.715 2.929 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.210 -2.491 1.011 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.517 -3.932 1.960 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -15.308 -2.564 3.868 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -14.883 -1.086 3.027 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -17.274 -1.403 2.800 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -16.550 -1.674 1.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -18.187 -3.372 1.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -16.649 -4.030 1.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -17.201 -3.834 3.160 1.00 0.00 H new ATOM 921 N ALA A 143 -9.672 -3.646 2.683 1.00 0.00 N ATOM 922 CA ALA A 143 -8.242 -3.539 2.992 1.00 0.00 C ATOM 923 C ALA A 143 -7.392 -2.970 1.845 1.00 0.00 C ATOM 924 O ALA A 143 -6.552 -2.111 2.084 1.00 0.00 O ATOM 925 CB ALA A 143 -7.702 -4.915 3.401 1.00 0.00 C ATOM 0 H ALA A 143 -10.071 -4.518 3.030 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.159 -2.826 3.812 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.639 -4.835 3.631 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.238 -5.269 4.282 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -7.844 -5.620 2.582 1.00 0.00 H new ATOM 926 N ILE A 144 -7.709 -3.384 0.616 1.00 0.00 N ATOM 927 CA ILE A 144 -6.919 -3.001 -0.577 1.00 0.00 C ATOM 928 C ILE A 144 -7.388 -1.731 -1.324 1.00 0.00 C ATOM 929 O ILE A 144 -6.762 -1.328 -2.299 1.00 0.00 O ATOM 930 CB ILE A 144 -6.776 -4.214 -1.528 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.114 -4.628 -2.141 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.041 -5.335 -0.804 1.00 0.00 C ATOM 933 CD1 ILE A 144 -7.883 -5.481 -3.380 1.00 0.00 C ATOM 0 H ILE A 144 -8.507 -3.986 0.411 1.00 0.00 H new ATOM 0 HA ILE A 144 -5.941 -2.711 -0.193 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.169 -3.935 -2.389 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -8.700 -5.186 -1.411 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -8.692 -3.742 -2.403 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -5.938 -6.192 -1.470 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.052 -4.987 -0.504 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -6.606 -5.629 0.080 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -8.843 -5.769 -3.807 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.316 -4.909 -4.115 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -7.324 -6.376 -3.107 1.00 0.00 H new ATOM 934 N LEU A 145 -8.435 -1.058 -0.820 1.00 0.00 N ATOM 935 CA LEU A 145 -9.050 0.102 -1.484 1.00 0.00 C ATOM 936 C LEU A 145 -8.420 1.449 -1.069 1.00 0.00 C ATOM 937 O LEU A 145 -8.913 2.154 -0.193 1.00 0.00 O ATOM 938 CB LEU A 145 -10.558 0.124 -1.211 1.00 0.00 C ATOM 939 CG LEU A 145 -11.384 -0.752 -2.171 1.00 0.00 C ATOM 940 CD1 LEU A 145 -11.143 -2.254 -1.988 1.00 0.00 C ATOM 941 CD2 LEU A 145 -12.864 -0.463 -1.924 1.00 0.00 C ATOM 0 H LEU A 145 -8.881 -1.305 0.064 1.00 0.00 H new ATOM 0 HA LEU A 145 -8.862 -0.015 -2.551 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -10.736 -0.209 -0.188 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -10.913 1.152 -1.278 1.00 0.00 H new ATOM 0 HG LEU A 145 -11.075 -0.502 -3.186 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -11.757 -2.810 -2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -10.091 -2.478 -2.166 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -11.409 -2.544 -0.972 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -13.470 -1.073 -2.594 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -13.114 -0.701 -0.890 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -13.065 0.592 -2.112 1.00 0.00 H new ATOM 942 N PHE A 146 -7.319 1.769 -1.735 1.00 0.00 N ATOM 943 CA PHE A 146 -6.574 3.014 -1.464 1.00 0.00 C ATOM 944 C PHE A 146 -7.007 4.216 -2.286 1.00 0.00 C ATOM 945 O PHE A 146 -7.537 4.095 -3.389 1.00 0.00 O ATOM 946 CB PHE A 146 -5.070 2.797 -1.638 1.00 0.00 C ATOM 947 CG PHE A 146 -4.547 1.806 -0.608 1.00 0.00 C ATOM 948 CD1 PHE A 146 -4.544 0.429 -0.932 1.00 0.00 C ATOM 949 CD2 PHE A 146 -4.056 2.281 0.627 1.00 0.00 C ATOM 950 CE1 PHE A 146 -4.045 -0.493 0.008 1.00 0.00 C ATOM 951 CE2 PHE A 146 -3.553 1.358 1.558 1.00 0.00 C ATOM 952 CZ PHE A 146 -3.550 -0.019 1.235 1.00 0.00 C ATOM 0 H PHE A 146 -6.913 1.190 -2.470 1.00 0.00 H new ATOM 0 HA PHE A 146 -6.813 3.254 -0.428 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -4.865 2.427 -2.643 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -4.546 3.747 -1.535 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.919 0.090 -1.886 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -4.067 3.337 0.852 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.043 -1.551 -0.211 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -3.172 1.696 2.511 1.00 0.00 H new ATOM 0 HZ PHE A 146 -3.157 -0.726 1.951 1.00 0.00 H new ATOM 953 N LEU A 147 -6.830 5.375 -1.660 1.00 0.00 N ATOM 954 CA LEU A 147 -7.143 6.684 -2.247 1.00 0.00 C ATOM 955 C LEU A 147 -5.847 7.476 -2.497 1.00 0.00 C ATOM 956 O LEU A 147 -5.056 7.658 -1.569 1.00 0.00 O ATOM 957 CB LEU A 147 -8.049 7.521 -1.344 1.00 0.00 C ATOM 958 CG LEU A 147 -9.401 6.869 -1.072 1.00 0.00 C ATOM 959 CD1 LEU A 147 -9.305 5.832 0.041 1.00 0.00 C ATOM 960 CD2 LEU A 147 -10.396 7.936 -0.618 1.00 0.00 C ATOM 0 H LEU A 147 -6.458 5.438 -0.712 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.666 6.491 -3.184 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.542 7.697 -0.396 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.210 8.495 -1.806 1.00 0.00 H new ATOM 0 HG LEU A 147 -9.725 6.385 -1.994 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -10.286 5.387 0.209 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.598 5.054 -0.247 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.963 6.313 0.957 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -11.363 7.472 -0.423 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -10.031 8.410 0.293 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -10.505 8.688 -1.400 1.00 0.00 H new ATOM 961 N PRO A 148 -5.561 7.683 -3.781 1.00 0.00 N ATOM 962 CA PRO A 148 -4.807 8.861 -4.249 1.00 0.00 C ATOM 963 C PRO A 148 -5.761 10.074 -4.223 1.00 0.00 C ATOM 964 O PRO A 148 -5.462 11.106 -3.631 1.00 0.00 O ATOM 965 CB PRO A 148 -4.416 8.543 -5.691 1.00 0.00 C ATOM 966 CG PRO A 148 -4.514 7.028 -5.791 1.00 0.00 C ATOM 967 CD PRO A 148 -5.638 6.643 -4.822 1.00 0.00 C ATOM 0 HA PRO A 148 -3.932 9.082 -3.638 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -5.085 9.031 -6.400 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.407 8.890 -5.914 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.744 6.713 -6.809 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.573 6.552 -5.515 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.610 6.639 -5.315 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -5.487 5.647 -4.407 1.00 0.00 H new