USER MOD reduce.3.24.130724 H: found=0, std=0, add=1210, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1210 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 90 ASN : amide:sc= -0.421 X(o=-0.44,f=-0.59) USER MOD Set 1.2: A 111 THR OG1 : rot -150:sc= -0.0171 USER MOD Set 2.1: A 58 LYS NZ :NH3+ -140:sc= 0 (180deg=-0.0264) USER MOD Set 2.2: A 61 GLN : amide:sc= -0.0315 X(o=-0.031,f=-0.006) USER MOD Set 3.1: A 51 MET CE :methyl 158:sc= -2.58! (180deg=-4.55!) USER MOD Set 3.2: A 55 THR OG1 : rot 64:sc= -0.299 USER MOD Set 4.1: A 22 MET CE :methyl 152:sc= -0.596 (180deg=-0.679) USER MOD Set 4.2: A 142 CYS SG : rot 60:sc= -3.97! USER MOD Set 5.1: A 11 ASN : amide:sc= -1.03 X(o=-1.4,f=-1.3) USER MOD Set 5.2: A 15 SER OG : rot -70:sc= -0.511 USER MOD Set 5.3: A 39 SER OG : rot 19:sc= 0.135! USER MOD Set 6.1: A 8 CYS SG : rot 139:sc= -1.56 USER MOD Set 6.2: A 88 MET CE :methyl 172:sc= -1.58 (180deg=-0.57) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -109:sc= 0.00861 (180deg=-0.117) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 CYS SG : rot -179:sc= 0.0244 USER MOD Single : A 17 MET CE :methyl -133:sc= 0 (180deg=-0.266) USER MOD Single : A 23 LYS NZ :NH3+ 144:sc= -0.242 (180deg=-1.26!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -126:sc= -2.1! (180deg=-5.73!) USER MOD Single : A 30 ASN : amide:sc= -0.0202 X(o=-0.02,f=-0.025) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 ASN : amide:sc= -7.86! C(o=-7.9!,f=-10!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.125 USER MOD Single : A 43 SER OG : rot -62:sc= 0.0125 USER MOD Single : A 46 HIS : no HD1:sc= -0.0783 X(o=-0.078,f=-0.21) USER MOD Single : A 52 HIS : no HE2:sc= 0.0113 X(o=0.011,f=-0.16) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.381 X(o=-0.38,f=0) USER MOD Single : A 63 ASN : amide:sc= -2.76 X(o=-2.8,f=-2.8!) USER MOD Single : A 66 HIS :FLIP no HD1:sc= -0.0381 F(o=-0.7,f=-0.038) USER MOD Single : A 67 LYS NZ :NH3+ -156:sc= 0.0944 (180deg=-0.687) USER MOD Single : A 68 ASN :FLIP amide:sc= 0.792 F(o=-2.4!,f=0.79) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.207 USER MOD Single : A 71 SER OG : rot 180:sc= 0.109 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 CYS SG : rot -62:sc= 0.0916 USER MOD Single : A 82 SER OG : rot -52:sc= -1.33! USER MOD Single : A 87 THR OG1 : rot 52:sc= 0.394 USER MOD Single : A 91 SER OG : rot 180:sc= 0.153 USER MOD Single : A 92 ASN : amide:sc= -0.366 K(o=-0.37,f=-4.4!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -0.137 X(o=-0.14,f=0) USER MOD Single : A 101 THR OG1 : rot 83:sc= 0.0772 USER MOD Single : A 102 ASN : amide:sc= -0.455 K(o=-0.45,f=-3) USER MOD Single : A 103 THR OG1 : rot -42:sc= 0.709 USER MOD Single : A 104 GLN :FLIP amide:sc= -0.773 F(o=-1.7,f=-0.77) USER MOD Single : A 105 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.1) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ -158:sc= -0.0299 (180deg=-0.257) USER MOD Single : A 114 SER OG : rot -18:sc= 0.829! USER MOD Single : A 116 SER OG : rot -55:sc= 0.015 USER MOD Single : A 118 ASN : amide:sc= -0.25 X(o=-0.25,f=-0.0091) USER MOD Single : A 119 TYR OH : rot 30:sc= 0.0769 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 105:sc= 0.164 USER MOD Single : A 130 ASN :FLIP amide:sc= -2.18! C(o=-14!,f=-2.2!) USER MOD Single : A 134 THR OG1 : rot 80:sc= -0.342 USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ -163:sc= -0.0378 (180deg=-0.343) USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.283 -8.043 -8.276 1.00 0.00 N ATOM 2 CA MET A 1 16.381 -6.868 -8.166 1.00 0.00 C ATOM 3 C MET A 1 14.955 -7.296 -7.840 1.00 0.00 C ATOM 4 O MET A 1 14.475 -8.318 -8.330 1.00 0.00 O ATOM 5 CB MET A 1 16.413 -6.105 -9.490 1.00 0.00 C ATOM 6 CG MET A 1 17.720 -5.370 -9.739 1.00 0.00 C ATOM 7 SD MET A 1 18.269 -5.486 -11.452 1.00 0.00 S ATOM 8 CE MET A 1 17.491 -4.035 -12.155 1.00 0.00 C ATOM 0 H1 MET A 1 17.928 -8.063 -7.460 1.00 0.00 H new ATOM 0 H2 MET A 1 16.717 -8.915 -8.291 1.00 0.00 H new ATOM 0 H3 MET A 1 17.837 -7.974 -9.153 1.00 0.00 H new ATOM 0 HA MET A 1 16.725 -6.228 -7.354 1.00 0.00 H new ATOM 0 HB2 MET A 1 16.238 -6.805 -10.307 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.593 -5.386 -9.505 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.598 -4.320 -9.471 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.492 -5.778 -9.086 1.00 0.00 H new ATOM 0 HE1 MET A 1 17.737 -3.967 -13.215 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.410 -4.109 -12.038 1.00 0.00 H new ATOM 0 HE3 MET A 1 17.851 -3.144 -11.641 1.00 0.00 H new ATOM 20 N LYS A 2 14.281 -6.505 -7.011 1.00 0.00 N ATOM 21 CA LYS A 2 12.907 -6.797 -6.620 1.00 0.00 C ATOM 22 C LYS A 2 12.124 -5.510 -6.387 1.00 0.00 C ATOM 23 O LYS A 2 12.582 -4.611 -5.680 1.00 0.00 O ATOM 24 CB LYS A 2 12.883 -7.658 -5.355 1.00 0.00 C ATOM 25 CG LYS A 2 12.943 -9.150 -5.634 1.00 0.00 C ATOM 26 CD LYS A 2 12.715 -9.961 -4.370 1.00 0.00 C ATOM 27 CE LYS A 2 13.396 -11.317 -4.446 1.00 0.00 C ATOM 28 NZ LYS A 2 13.083 -12.164 -3.263 1.00 0.00 N ATOM 0 H LYS A 2 14.665 -5.656 -6.597 1.00 0.00 H new ATOM 0 HA LYS A 2 12.435 -7.348 -7.433 1.00 0.00 H new ATOM 0 HB2 LYS A 2 13.725 -7.381 -4.721 1.00 0.00 H new ATOM 0 HB3 LYS A 2 11.975 -7.438 -4.793 1.00 0.00 H new ATOM 0 HG2 LYS A 2 12.190 -9.413 -6.377 1.00 0.00 H new ATOM 0 HG3 LYS A 2 13.914 -9.403 -6.060 1.00 0.00 H new ATOM 0 HD2 LYS A 2 13.095 -9.410 -3.510 1.00 0.00 H new ATOM 0 HD3 LYS A 2 11.645 -10.099 -4.213 1.00 0.00 H new ATOM 0 HE2 LYS A 2 13.080 -11.831 -5.354 1.00 0.00 H new ATOM 0 HE3 LYS A 2 14.475 -11.178 -4.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 13.567 -13.080 -3.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 13.407 -11.686 -2.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 12.056 -12.319 -3.209 1.00 0.00 H new ATOM 42 N LYS A 3 10.941 -5.428 -6.986 1.00 0.00 N ATOM 43 CA LYS A 3 10.094 -4.251 -6.846 1.00 0.00 C ATOM 44 C LYS A 3 8.750 -4.623 -6.225 1.00 0.00 C ATOM 45 O LYS A 3 8.318 -5.774 -6.299 1.00 0.00 O ATOM 46 CB LYS A 3 9.882 -3.587 -8.206 1.00 0.00 C ATOM 47 CG LYS A 3 10.974 -2.601 -8.578 1.00 0.00 C ATOM 48 CD LYS A 3 10.387 -1.294 -9.078 1.00 0.00 C ATOM 49 CE LYS A 3 11.069 -0.825 -10.354 1.00 0.00 C ATOM 50 NZ LYS A 3 11.567 0.572 -10.235 1.00 0.00 N ATOM 0 H LYS A 3 10.547 -6.163 -7.573 1.00 0.00 H new ATOM 0 HA LYS A 3 10.595 -3.545 -6.183 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.825 -4.359 -8.973 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.923 -3.070 -8.203 1.00 0.00 H new ATOM 0 HG2 LYS A 3 11.606 -2.410 -7.711 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.612 -3.034 -9.348 1.00 0.00 H new ATOM 0 HD2 LYS A 3 9.320 -1.420 -9.261 1.00 0.00 H new ATOM 0 HD3 LYS A 3 10.490 -0.530 -8.308 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.902 -1.489 -10.586 1.00 0.00 H new ATOM 0 HE3 LYS A 3 10.368 -0.891 -11.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.025 0.854 -11.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 10.769 1.210 -10.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 12.255 0.630 -9.458 1.00 0.00 H new ATOM 64 N ILE A 4 8.098 -3.645 -5.600 1.00 0.00 N ATOM 65 CA ILE A 4 6.811 -3.879 -4.953 1.00 0.00 C ATOM 66 C ILE A 4 5.761 -2.857 -5.385 1.00 0.00 C ATOM 67 O ILE A 4 5.839 -1.685 -5.023 1.00 0.00 O ATOM 68 CB ILE A 4 6.949 -3.828 -3.420 1.00 0.00 C ATOM 69 CG1 ILE A 4 7.916 -4.906 -2.933 1.00 0.00 C ATOM 70 CG2 ILE A 4 5.592 -3.998 -2.757 1.00 0.00 C ATOM 71 CD1 ILE A 4 9.366 -4.474 -2.944 1.00 0.00 C ATOM 0 H ILE A 4 8.439 -2.686 -5.528 1.00 0.00 H new ATOM 0 HA ILE A 4 6.484 -4.872 -5.263 1.00 0.00 H new ATOM 0 HB ILE A 4 7.350 -2.853 -3.144 1.00 0.00 H new ATOM 0 HG12 ILE A 4 7.641 -5.197 -1.919 1.00 0.00 H new ATOM 0 HG13 ILE A 4 7.805 -5.791 -3.560 1.00 0.00 H new ATOM 0 HG21 ILE A 4 5.709 -3.959 -1.674 1.00 0.00 H new ATOM 0 HG22 ILE A 4 4.927 -3.197 -3.079 1.00 0.00 H new ATOM 0 HG23 ILE A 4 5.166 -4.960 -3.042 1.00 0.00 H new ATOM 0 HD11 ILE A 4 9.992 -5.291 -2.586 1.00 0.00 H new ATOM 0 HD12 ILE A 4 9.660 -4.211 -3.960 1.00 0.00 H new ATOM 0 HD13 ILE A 4 9.493 -3.608 -2.294 1.00 0.00 H new ATOM 83 N LEU A 5 4.775 -3.311 -6.154 1.00 0.00 N ATOM 84 CA LEU A 5 3.708 -2.433 -6.629 1.00 0.00 C ATOM 85 C LEU A 5 2.527 -2.405 -5.660 1.00 0.00 C ATOM 86 O LEU A 5 1.794 -3.387 -5.534 1.00 0.00 O ATOM 87 CB LEU A 5 3.220 -2.886 -8.005 1.00 0.00 C ATOM 88 CG LEU A 5 3.116 -1.778 -9.055 1.00 0.00 C ATOM 89 CD1 LEU A 5 3.051 -2.373 -10.454 1.00 0.00 C ATOM 90 CD2 LEU A 5 1.903 -0.900 -8.786 1.00 0.00 C ATOM 0 H LEU A 5 4.692 -4.280 -6.461 1.00 0.00 H new ATOM 0 HA LEU A 5 4.122 -1.427 -6.697 1.00 0.00 H new ATOM 0 HB2 LEU A 5 3.896 -3.656 -8.378 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.240 -3.350 -7.891 1.00 0.00 H new ATOM 0 HG LEU A 5 4.009 -1.156 -8.990 1.00 0.00 H new ATOM 0 HD11 LEU A 5 2.977 -1.570 -11.188 1.00 0.00 H new ATOM 0 HD12 LEU A 5 3.952 -2.956 -10.644 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.177 -3.019 -10.534 1.00 0.00 H new ATOM 0 HD21 LEU A 5 1.845 -0.118 -9.543 1.00 0.00 H new ATOM 0 HD22 LEU A 5 0.999 -1.508 -8.822 1.00 0.00 H new ATOM 0 HD23 LEU A 5 1.995 -0.445 -7.800 1.00 0.00 H new ATOM 102 N PHE A 6 2.328 -1.266 -5.001 1.00 0.00 N ATOM 103 CA PHE A 6 1.213 -1.102 -4.071 1.00 0.00 C ATOM 104 C PHE A 6 0.058 -0.399 -4.781 1.00 0.00 C ATOM 105 O PHE A 6 0.202 0.738 -5.229 1.00 0.00 O ATOM 106 CB PHE A 6 1.636 -0.285 -2.845 1.00 0.00 C ATOM 107 CG PHE A 6 2.569 -1.000 -1.900 1.00 0.00 C ATOM 108 CD1 PHE A 6 2.292 -2.285 -1.450 1.00 0.00 C ATOM 109 CD2 PHE A 6 3.720 -0.375 -1.451 1.00 0.00 C ATOM 110 CE1 PHE A 6 3.148 -2.925 -0.572 1.00 0.00 C ATOM 111 CE2 PHE A 6 4.576 -1.010 -0.572 1.00 0.00 C ATOM 112 CZ PHE A 6 4.290 -2.286 -0.133 1.00 0.00 C ATOM 0 H PHE A 6 2.924 -0.443 -5.093 1.00 0.00 H new ATOM 0 HA PHE A 6 0.896 -2.089 -3.733 1.00 0.00 H new ATOM 0 HB2 PHE A 6 2.118 0.631 -3.185 1.00 0.00 H new ATOM 0 HB3 PHE A 6 0.742 0.010 -2.296 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.399 -2.789 -1.789 1.00 0.00 H new ATOM 0 HD2 PHE A 6 3.952 0.623 -1.793 1.00 0.00 H new ATOM 0 HE1 PHE A 6 2.923 -3.924 -0.230 1.00 0.00 H new ATOM 0 HE2 PHE A 6 5.468 -0.508 -0.229 1.00 0.00 H new ATOM 0 HZ PHE A 6 4.959 -2.784 0.553 1.00 0.00 H new ATOM 122 N ILE A 7 -1.079 -1.078 -4.903 1.00 0.00 N ATOM 123 CA ILE A 7 -2.235 -0.505 -5.589 1.00 0.00 C ATOM 124 C ILE A 7 -3.296 0.003 -4.615 1.00 0.00 C ATOM 125 O ILE A 7 -3.715 -0.712 -3.707 1.00 0.00 O ATOM 126 CB ILE A 7 -2.885 -1.530 -6.538 1.00 0.00 C ATOM 127 CG1 ILE A 7 -1.850 -2.081 -7.520 1.00 0.00 C ATOM 128 CG2 ILE A 7 -4.046 -0.894 -7.288 1.00 0.00 C ATOM 129 CD1 ILE A 7 -2.154 -3.487 -7.994 1.00 0.00 C ATOM 0 H ILE A 7 -1.225 -2.019 -4.539 1.00 0.00 H new ATOM 0 HA ILE A 7 -1.855 0.341 -6.162 1.00 0.00 H new ATOM 0 HB ILE A 7 -3.270 -2.359 -5.943 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -1.793 -1.419 -8.384 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -0.869 -2.071 -7.045 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -4.495 -1.630 -7.955 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -4.793 -0.546 -6.575 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -3.682 -0.049 -7.873 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -1.379 -3.813 -8.687 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -2.182 -4.161 -7.138 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -3.120 -3.500 -8.498 1.00 0.00 H new ATOM 141 N CYS A 8 -3.735 1.244 -4.825 1.00 0.00 N ATOM 142 CA CYS A 8 -4.760 1.852 -3.986 1.00 0.00 C ATOM 143 C CYS A 8 -5.773 2.616 -4.831 1.00 0.00 C ATOM 144 O CYS A 8 -5.408 3.508 -5.598 1.00 0.00 O ATOM 145 CB CYS A 8 -4.125 2.786 -2.961 1.00 0.00 C ATOM 146 SG CYS A 8 -4.197 2.173 -1.262 1.00 0.00 S ATOM 0 H CYS A 8 -3.393 1.848 -5.573 1.00 0.00 H new ATOM 0 HA CYS A 8 -5.282 1.053 -3.460 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -3.082 2.951 -3.233 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -4.624 3.754 -3.008 1.00 0.00 H new ATOM 0 HG CYS A 8 -3.068 2.416 -0.665 1.00 0.00 H new ATOM 152 N LEU A 9 -7.049 2.263 -4.682 1.00 0.00 N ATOM 153 CA LEU A 9 -8.122 2.915 -5.428 1.00 0.00 C ATOM 154 C LEU A 9 -8.051 4.429 -5.257 1.00 0.00 C ATOM 155 O LEU A 9 -8.468 5.186 -6.133 1.00 0.00 O ATOM 156 CB LEU A 9 -9.485 2.399 -4.959 1.00 0.00 C ATOM 157 CG LEU A 9 -10.366 1.798 -6.057 1.00 0.00 C ATOM 158 CD1 LEU A 9 -11.535 1.039 -5.448 1.00 0.00 C ATOM 159 CD2 LEU A 9 -10.865 2.888 -6.994 1.00 0.00 C ATOM 0 H LEU A 9 -7.364 1.527 -4.050 1.00 0.00 H new ATOM 0 HA LEU A 9 -7.998 2.677 -6.485 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -9.325 1.644 -4.190 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.026 3.221 -4.491 1.00 0.00 H new ATOM 0 HG LEU A 9 -9.766 1.095 -6.635 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -12.150 0.619 -6.244 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -11.157 0.234 -4.818 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -12.136 1.720 -4.845 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -11.490 2.444 -7.769 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -11.449 3.614 -6.429 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.014 3.388 -7.457 1.00 0.00 H new ATOM 171 N GLY A 10 -7.507 4.856 -4.124 1.00 0.00 N ATOM 172 CA GLY A 10 -7.371 6.272 -3.845 1.00 0.00 C ATOM 173 C GLY A 10 -6.038 6.592 -3.201 1.00 0.00 C ATOM 174 O GLY A 10 -5.868 6.412 -1.995 1.00 0.00 O ATOM 0 H GLY A 10 -7.156 4.242 -3.389 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -7.472 6.837 -4.772 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -8.179 6.592 -3.187 1.00 0.00 H new ATOM 178 N ASN A 11 -5.087 7.057 -4.005 1.00 0.00 N ATOM 179 CA ASN A 11 -3.759 7.392 -3.503 1.00 0.00 C ATOM 180 C ASN A 11 -3.754 8.754 -2.816 1.00 0.00 C ATOM 181 O ASN A 11 -2.838 9.555 -3.006 1.00 0.00 O ATOM 182 CB ASN A 11 -2.737 7.373 -4.636 1.00 0.00 C ATOM 183 CG ASN A 11 -1.346 6.999 -4.163 1.00 0.00 C ATOM 184 OD1 ASN A 11 -0.813 7.598 -3.228 1.00 0.00 O ATOM 185 ND2 ASN A 11 -0.749 6.005 -4.810 1.00 0.00 N ATOM 0 H ASN A 11 -5.211 7.210 -5.006 1.00 0.00 H new ATOM 0 HA ASN A 11 -3.484 6.638 -2.766 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -3.060 6.665 -5.399 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -2.704 8.356 -5.107 1.00 0.00 H new ATOM 0 HD21 ASN A 11 0.189 5.710 -4.538 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -1.228 5.537 -5.579 1.00 0.00 H new ATOM 192 N ILE A 12 -4.780 9.004 -2.012 1.00 0.00 N ATOM 193 CA ILE A 12 -4.901 10.259 -1.286 1.00 0.00 C ATOM 194 C ILE A 12 -5.409 10.006 0.127 1.00 0.00 C ATOM 195 O ILE A 12 -6.013 10.878 0.753 1.00 0.00 O ATOM 196 CB ILE A 12 -5.851 11.238 -2.001 1.00 0.00 C ATOM 197 CG1 ILE A 12 -7.161 10.538 -2.361 1.00 0.00 C ATOM 198 CG2 ILE A 12 -5.187 11.809 -3.246 1.00 0.00 C ATOM 199 CD1 ILE A 12 -8.384 11.207 -1.772 1.00 0.00 C ATOM 0 H ILE A 12 -5.544 8.349 -1.847 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.909 10.709 -1.246 1.00 0.00 H new ATOM 0 HB ILE A 12 -6.076 12.063 -1.325 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -7.261 10.507 -3.446 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -7.119 9.505 -2.015 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -5.872 12.499 -3.740 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -4.278 12.340 -2.963 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -4.935 10.997 -3.929 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -9.277 10.657 -2.068 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -8.306 11.215 -0.685 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -8.450 12.231 -2.138 1.00 0.00 H new ATOM 211 N CYS A 13 -5.162 8.797 0.621 1.00 0.00 N ATOM 212 CA CYS A 13 -5.592 8.412 1.959 1.00 0.00 C ATOM 213 C CYS A 13 -4.619 7.408 2.577 1.00 0.00 C ATOM 214 O CYS A 13 -3.654 7.792 3.237 1.00 0.00 O ATOM 215 CB CYS A 13 -7.003 7.820 1.909 1.00 0.00 C ATOM 216 SG CYS A 13 -8.324 9.049 2.023 1.00 0.00 S ATOM 0 H CYS A 13 -4.665 8.066 0.113 1.00 0.00 H new ATOM 0 HA CYS A 13 -5.603 9.304 2.585 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -7.119 7.263 0.979 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -7.115 7.106 2.725 1.00 0.00 H new ATOM 0 HG CYS A 13 -9.478 8.450 1.991 1.00 0.00 H new ATOM 222 N ARG A 14 -4.882 6.123 2.362 1.00 0.00 N ATOM 223 CA ARG A 14 -4.032 5.069 2.904 1.00 0.00 C ATOM 224 C ARG A 14 -2.770 4.882 2.059 1.00 0.00 C ATOM 225 O ARG A 14 -1.688 4.633 2.595 1.00 0.00 O ATOM 226 CB ARG A 14 -4.825 3.756 3.006 1.00 0.00 C ATOM 227 CG ARG A 14 -4.280 2.617 2.156 1.00 0.00 C ATOM 228 CD ARG A 14 -3.214 1.828 2.900 1.00 0.00 C ATOM 229 NE ARG A 14 -3.405 0.388 2.768 1.00 0.00 N ATOM 230 CZ ARG A 14 -2.657 -0.515 3.395 1.00 0.00 C ATOM 231 NH1 ARG A 14 -1.671 -0.126 4.192 1.00 0.00 N ATOM 232 NH2 ARG A 14 -2.893 -1.809 3.225 1.00 0.00 N ATOM 0 H ARG A 14 -5.676 5.787 1.817 1.00 0.00 H new ATOM 0 HA ARG A 14 -3.713 5.365 3.903 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -4.842 3.438 4.048 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -5.858 3.947 2.714 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -5.095 1.951 1.872 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -3.860 3.018 1.234 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -2.230 2.099 2.518 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -3.232 2.100 3.955 1.00 0.00 H new ATOM 0 HE ARG A 14 -4.154 0.055 2.161 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -1.485 0.868 4.325 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -1.099 -0.821 4.672 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -3.650 -2.113 2.612 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -2.318 -2.500 3.707 1.00 0.00 H new ATOM 246 N SER A 15 -2.914 4.997 0.740 1.00 0.00 N ATOM 247 CA SER A 15 -1.783 4.834 -0.172 1.00 0.00 C ATOM 248 C SER A 15 -0.624 5.768 0.192 1.00 0.00 C ATOM 249 O SER A 15 0.518 5.321 0.312 1.00 0.00 O ATOM 250 CB SER A 15 -2.217 5.093 -1.612 1.00 0.00 C ATOM 251 OG SER A 15 -1.336 4.468 -2.530 1.00 0.00 O ATOM 0 H SER A 15 -3.801 5.202 0.279 1.00 0.00 H new ATOM 0 HA SER A 15 -1.435 3.806 -0.077 1.00 0.00 H new ATOM 0 HB2 SER A 15 -3.230 4.719 -1.763 1.00 0.00 H new ATOM 0 HB3 SER A 15 -2.242 6.166 -1.800 1.00 0.00 H new ATOM 0 HG SER A 15 -0.472 4.930 -2.521 1.00 0.00 H new ATOM 257 N PRO A 16 -0.889 7.082 0.370 1.00 0.00 N ATOM 258 CA PRO A 16 0.155 8.055 0.712 1.00 0.00 C ATOM 259 C PRO A 16 0.721 7.837 2.112 1.00 0.00 C ATOM 260 O PRO A 16 1.916 8.020 2.341 1.00 0.00 O ATOM 261 CB PRO A 16 -0.559 9.412 0.635 1.00 0.00 C ATOM 262 CG PRO A 16 -1.836 9.147 -0.086 1.00 0.00 C ATOM 263 CD PRO A 16 -2.204 7.732 0.244 1.00 0.00 C ATOM 0 HA PRO A 16 1.009 7.972 0.040 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -0.746 9.814 1.631 1.00 0.00 H new ATOM 0 HB3 PRO A 16 0.047 10.145 0.103 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -2.616 9.839 0.233 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -1.713 9.279 -1.161 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -2.779 7.667 1.168 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -2.808 7.276 -0.540 1.00 0.00 H new ATOM 271 N MET A 17 -0.143 7.449 3.048 1.00 0.00 N ATOM 272 CA MET A 17 0.284 7.213 4.422 1.00 0.00 C ATOM 273 C MET A 17 1.403 6.180 4.467 1.00 0.00 C ATOM 274 O MET A 17 2.496 6.455 4.962 1.00 0.00 O ATOM 275 CB MET A 17 -0.890 6.742 5.282 1.00 0.00 C ATOM 276 CG MET A 17 -0.560 6.673 6.765 1.00 0.00 C ATOM 277 SD MET A 17 -2.005 6.917 7.816 1.00 0.00 S ATOM 278 CE MET A 17 -1.232 7.510 9.319 1.00 0.00 C ATOM 0 H MET A 17 -1.137 7.293 2.880 1.00 0.00 H new ATOM 0 HA MET A 17 0.657 8.156 4.823 1.00 0.00 H new ATOM 0 HB2 MET A 17 -1.733 7.418 5.135 1.00 0.00 H new ATOM 0 HB3 MET A 17 -1.208 5.757 4.942 1.00 0.00 H new ATOM 0 HG2 MET A 17 -0.114 5.704 6.988 1.00 0.00 H new ATOM 0 HG3 MET A 17 0.187 7.430 7.002 1.00 0.00 H new ATOM 0 HE1 MET A 17 -1.644 6.976 10.175 1.00 0.00 H new ATOM 0 HE2 MET A 17 -0.157 7.339 9.267 1.00 0.00 H new ATOM 0 HE3 MET A 17 -1.424 8.577 9.431 1.00 0.00 H new ATOM 288 N ALA A 18 1.126 4.993 3.939 1.00 0.00 N ATOM 289 CA ALA A 18 2.115 3.925 3.912 1.00 0.00 C ATOM 290 C ALA A 18 3.280 4.287 3.002 1.00 0.00 C ATOM 291 O ALA A 18 4.403 3.848 3.218 1.00 0.00 O ATOM 292 CB ALA A 18 1.484 2.623 3.460 1.00 0.00 C ATOM 0 H ALA A 18 0.227 4.748 3.525 1.00 0.00 H new ATOM 0 HA ALA A 18 2.496 3.795 4.925 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.240 1.838 3.447 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.686 2.347 4.149 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.072 2.747 2.459 1.00 0.00 H new ATOM 298 N GLU A 19 3.005 5.090 1.983 1.00 0.00 N ATOM 299 CA GLU A 19 4.039 5.504 1.045 1.00 0.00 C ATOM 300 C GLU A 19 5.208 6.160 1.777 1.00 0.00 C ATOM 301 O GLU A 19 6.363 5.777 1.592 1.00 0.00 O ATOM 302 CB GLU A 19 3.460 6.474 0.013 1.00 0.00 C ATOM 303 CG GLU A 19 4.428 6.825 -1.105 1.00 0.00 C ATOM 304 CD GLU A 19 3.721 7.280 -2.368 1.00 0.00 C ATOM 305 OE1 GLU A 19 2.479 7.163 -2.428 1.00 0.00 O ATOM 306 OE2 GLU A 19 4.410 7.752 -3.296 1.00 0.00 O ATOM 0 H GLU A 19 2.078 5.466 1.785 1.00 0.00 H new ATOM 0 HA GLU A 19 4.408 4.615 0.533 1.00 0.00 H new ATOM 0 HB2 GLU A 19 2.561 6.036 -0.421 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.155 7.390 0.519 1.00 0.00 H new ATOM 0 HG2 GLU A 19 5.099 7.613 -0.765 1.00 0.00 H new ATOM 0 HG3 GLU A 19 5.046 5.956 -1.332 1.00 0.00 H new ATOM 313 N PHE A 20 4.897 7.152 2.606 1.00 0.00 N ATOM 314 CA PHE A 20 5.919 7.872 3.361 1.00 0.00 C ATOM 315 C PHE A 20 6.484 7.026 4.505 1.00 0.00 C ATOM 316 O PHE A 20 7.705 6.937 4.671 1.00 0.00 O ATOM 317 CB PHE A 20 5.344 9.184 3.908 1.00 0.00 C ATOM 318 CG PHE A 20 6.362 10.280 4.060 1.00 0.00 C ATOM 319 CD1 PHE A 20 7.504 10.087 4.821 1.00 0.00 C ATOM 320 CD2 PHE A 20 6.171 11.508 3.447 1.00 0.00 C ATOM 321 CE1 PHE A 20 8.437 11.097 4.966 1.00 0.00 C ATOM 322 CE2 PHE A 20 7.100 12.520 3.588 1.00 0.00 C ATOM 323 CZ PHE A 20 8.235 12.315 4.348 1.00 0.00 C ATOM 0 H PHE A 20 3.944 7.476 2.773 1.00 0.00 H new ATOM 0 HA PHE A 20 6.740 8.093 2.678 1.00 0.00 H new ATOM 0 HB2 PHE A 20 4.552 9.527 3.243 1.00 0.00 H new ATOM 0 HB3 PHE A 20 4.885 8.991 4.878 1.00 0.00 H new ATOM 0 HD1 PHE A 20 7.667 9.136 5.307 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.285 11.676 2.852 1.00 0.00 H new ATOM 0 HE1 PHE A 20 9.323 10.933 5.562 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.939 13.472 3.104 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.963 13.105 4.459 1.00 0.00 H new ATOM 333 N ILE A 21 5.606 6.413 5.301 1.00 0.00 N ATOM 334 CA ILE A 21 6.060 5.601 6.426 1.00 0.00 C ATOM 335 C ILE A 21 6.919 4.427 5.959 1.00 0.00 C ATOM 336 O ILE A 21 8.042 4.251 6.433 1.00 0.00 O ATOM 337 CB ILE A 21 4.892 5.103 7.312 1.00 0.00 C ATOM 338 CG1 ILE A 21 4.066 4.026 6.610 1.00 0.00 C ATOM 339 CG2 ILE A 21 4.003 6.271 7.711 1.00 0.00 C ATOM 340 CD1 ILE A 21 3.322 3.121 7.568 1.00 0.00 C ATOM 0 H ILE A 21 4.593 6.463 5.189 1.00 0.00 H new ATOM 0 HA ILE A 21 6.676 6.255 7.043 1.00 0.00 H new ATOM 0 HB ILE A 21 5.323 4.655 8.207 1.00 0.00 H new ATOM 0 HG12 ILE A 21 3.349 4.505 5.943 1.00 0.00 H new ATOM 0 HG13 ILE A 21 4.725 3.421 5.988 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.185 5.909 8.334 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.589 7.000 8.270 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.597 6.741 6.816 1.00 0.00 H new ATOM 0 HD11 ILE A 21 2.756 2.380 7.003 1.00 0.00 H new ATOM 0 HD12 ILE A 21 4.035 2.615 8.218 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.638 3.716 8.173 1.00 0.00 H new ATOM 352 N MET A 22 6.402 3.638 5.022 1.00 0.00 N ATOM 353 CA MET A 22 7.143 2.501 4.492 1.00 0.00 C ATOM 354 C MET A 22 8.467 2.961 3.899 1.00 0.00 C ATOM 355 O MET A 22 9.500 2.332 4.117 1.00 0.00 O ATOM 356 CB MET A 22 6.323 1.759 3.438 1.00 0.00 C ATOM 357 CG MET A 22 5.143 0.999 4.019 1.00 0.00 C ATOM 358 SD MET A 22 5.485 -0.758 4.235 1.00 0.00 S ATOM 359 CE MET A 22 4.051 -1.485 3.442 1.00 0.00 C ATOM 0 H MET A 22 5.475 3.765 4.616 1.00 0.00 H new ATOM 0 HA MET A 22 7.345 1.815 5.315 1.00 0.00 H new ATOM 0 HB2 MET A 22 5.958 2.475 2.702 1.00 0.00 H new ATOM 0 HB3 MET A 22 6.971 1.060 2.909 1.00 0.00 H new ATOM 0 HG2 MET A 22 4.875 1.434 4.982 1.00 0.00 H new ATOM 0 HG3 MET A 22 4.280 1.119 3.364 1.00 0.00 H new ATOM 0 HE1 MET A 22 4.312 -2.468 3.049 1.00 0.00 H new ATOM 0 HE2 MET A 22 3.246 -1.587 4.169 1.00 0.00 H new ATOM 0 HE3 MET A 22 3.722 -0.843 2.625 1.00 0.00 H new ATOM 369 N LYS A 23 8.429 4.066 3.152 1.00 0.00 N ATOM 370 CA LYS A 23 9.633 4.611 2.533 1.00 0.00 C ATOM 371 C LYS A 23 10.740 4.759 3.567 1.00 0.00 C ATOM 372 O LYS A 23 11.898 4.434 3.302 1.00 0.00 O ATOM 373 CB LYS A 23 9.340 5.968 1.890 1.00 0.00 C ATOM 374 CG LYS A 23 9.558 5.988 0.385 1.00 0.00 C ATOM 375 CD LYS A 23 11.036 6.063 0.035 1.00 0.00 C ATOM 376 CE LYS A 23 11.340 7.263 -0.847 1.00 0.00 C ATOM 377 NZ LYS A 23 10.748 8.517 -0.305 1.00 0.00 N ATOM 0 H LYS A 23 7.579 4.598 2.963 1.00 0.00 H new ATOM 0 HA LYS A 23 9.961 3.918 1.758 1.00 0.00 H new ATOM 0 HB2 LYS A 23 8.308 6.246 2.103 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.976 6.724 2.351 1.00 0.00 H new ATOM 0 HG2 LYS A 23 9.123 5.092 -0.058 1.00 0.00 H new ATOM 0 HG3 LYS A 23 9.037 6.842 -0.047 1.00 0.00 H new ATOM 0 HD2 LYS A 23 11.625 6.124 0.950 1.00 0.00 H new ATOM 0 HD3 LYS A 23 11.337 5.149 -0.477 1.00 0.00 H new ATOM 0 HE2 LYS A 23 12.420 7.382 -0.938 1.00 0.00 H new ATOM 0 HE3 LYS A 23 10.953 7.083 -1.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 11.391 9.313 -0.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 9.832 8.696 -0.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 10.607 8.419 0.721 1.00 0.00 H new ATOM 391 N ASP A 24 10.373 5.239 4.751 1.00 0.00 N ATOM 392 CA ASP A 24 11.337 5.413 5.831 1.00 0.00 C ATOM 393 C ASP A 24 11.791 4.055 6.355 1.00 0.00 C ATOM 394 O ASP A 24 12.973 3.839 6.623 1.00 0.00 O ATOM 395 CB ASP A 24 10.725 6.235 6.966 1.00 0.00 C ATOM 396 CG ASP A 24 11.777 6.861 7.860 1.00 0.00 C ATOM 397 OD1 ASP A 24 12.972 6.814 7.497 1.00 0.00 O ATOM 398 OD2 ASP A 24 11.406 7.400 8.924 1.00 0.00 O ATOM 0 H ASP A 24 9.419 5.513 4.986 1.00 0.00 H new ATOM 0 HA ASP A 24 12.202 5.948 5.440 1.00 0.00 H new ATOM 0 HB2 ASP A 24 10.097 7.020 6.544 1.00 0.00 H new ATOM 0 HB3 ASP A 24 10.077 5.595 7.565 1.00 0.00 H new ATOM 403 N LEU A 25 10.835 3.141 6.489 1.00 0.00 N ATOM 404 CA LEU A 25 11.112 1.793 6.970 1.00 0.00 C ATOM 405 C LEU A 25 11.975 1.023 5.971 1.00 0.00 C ATOM 406 O LEU A 25 12.615 0.034 6.319 1.00 0.00 O ATOM 407 CB LEU A 25 9.798 1.042 7.209 1.00 0.00 C ATOM 408 CG LEU A 25 9.735 0.204 8.493 1.00 0.00 C ATOM 409 CD1 LEU A 25 10.631 -1.018 8.377 1.00 0.00 C ATOM 410 CD2 LEU A 25 10.124 1.042 9.703 1.00 0.00 C ATOM 0 H LEU A 25 9.854 3.312 6.269 1.00 0.00 H new ATOM 0 HA LEU A 25 11.660 1.872 7.909 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.985 1.768 7.230 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.617 0.385 6.359 1.00 0.00 H new ATOM 0 HG LEU A 25 8.708 -0.135 8.630 1.00 0.00 H new ATOM 0 HD11 LEU A 25 10.573 -1.600 9.297 1.00 0.00 H new ATOM 0 HD12 LEU A 25 10.303 -1.632 7.538 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.661 -0.700 8.213 1.00 0.00 H new ATOM 0 HD21 LEU A 25 10.072 0.428 10.602 1.00 0.00 H new ATOM 0 HD22 LEU A 25 11.140 1.415 9.576 1.00 0.00 H new ATOM 0 HD23 LEU A 25 9.438 1.884 9.798 1.00 0.00 H new ATOM 422 N VAL A 26 11.969 1.477 4.723 1.00 0.00 N ATOM 423 CA VAL A 26 12.732 0.824 3.665 1.00 0.00 C ATOM 424 C VAL A 26 14.238 0.890 3.913 1.00 0.00 C ATOM 425 O VAL A 26 14.947 -0.095 3.726 1.00 0.00 O ATOM 426 CB VAL A 26 12.420 1.446 2.287 1.00 0.00 C ATOM 427 CG1 VAL A 26 13.454 1.025 1.252 1.00 0.00 C ATOM 428 CG2 VAL A 26 11.022 1.058 1.834 1.00 0.00 C ATOM 0 H VAL A 26 11.443 2.296 4.418 1.00 0.00 H new ATOM 0 HA VAL A 26 12.427 -0.222 3.671 1.00 0.00 H new ATOM 0 HB VAL A 26 12.465 2.531 2.386 1.00 0.00 H new ATOM 0 HG11 VAL A 26 13.211 1.477 0.290 1.00 0.00 H new ATOM 0 HG12 VAL A 26 14.443 1.357 1.569 1.00 0.00 H new ATOM 0 HG13 VAL A 26 13.450 -0.061 1.154 1.00 0.00 H new ATOM 0 HG21 VAL A 26 10.818 1.505 0.861 1.00 0.00 H new ATOM 0 HG22 VAL A 26 10.953 -0.027 1.757 1.00 0.00 H new ATOM 0 HG23 VAL A 26 10.292 1.418 2.559 1.00 0.00 H new ATOM 438 N LYS A 27 14.724 2.055 4.309 1.00 0.00 N ATOM 439 CA LYS A 27 16.151 2.241 4.550 1.00 0.00 C ATOM 440 C LYS A 27 16.679 1.326 5.658 1.00 0.00 C ATOM 441 O LYS A 27 17.832 0.896 5.615 1.00 0.00 O ATOM 442 CB LYS A 27 16.433 3.701 4.910 1.00 0.00 C ATOM 443 CG LYS A 27 17.913 4.041 4.962 1.00 0.00 C ATOM 444 CD LYS A 27 18.219 5.021 6.083 1.00 0.00 C ATOM 445 CE LYS A 27 19.238 6.062 5.649 1.00 0.00 C ATOM 446 NZ LYS A 27 20.220 6.359 6.730 1.00 0.00 N ATOM 0 H LYS A 27 14.155 2.886 4.471 1.00 0.00 H new ATOM 0 HA LYS A 27 16.671 1.975 3.630 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.946 4.347 4.179 1.00 0.00 H new ATOM 0 HB3 LYS A 27 15.984 3.921 5.879 1.00 0.00 H new ATOM 0 HG2 LYS A 27 18.492 3.129 5.106 1.00 0.00 H new ATOM 0 HG3 LYS A 27 18.223 4.468 4.008 1.00 0.00 H new ATOM 0 HD2 LYS A 27 17.300 5.517 6.395 1.00 0.00 H new ATOM 0 HD3 LYS A 27 18.598 4.478 6.949 1.00 0.00 H new ATOM 0 HE2 LYS A 27 19.767 5.706 4.765 1.00 0.00 H new ATOM 0 HE3 LYS A 27 18.722 6.979 5.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 20.898 7.073 6.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 19.718 6.722 7.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 20.730 5.489 6.984 1.00 0.00 H new ATOM 460 N LYS A 28 15.851 1.059 6.663 1.00 0.00 N ATOM 461 CA LYS A 28 16.268 0.228 7.792 1.00 0.00 C ATOM 462 C LYS A 28 16.517 -1.242 7.416 1.00 0.00 C ATOM 463 O LYS A 28 17.557 -1.795 7.771 1.00 0.00 O ATOM 464 CB LYS A 28 15.257 0.332 8.943 1.00 0.00 C ATOM 465 CG LYS A 28 14.024 -0.540 8.781 1.00 0.00 C ATOM 466 CD LYS A 28 14.089 -1.769 9.673 1.00 0.00 C ATOM 467 CE LYS A 28 13.198 -1.618 10.897 1.00 0.00 C ATOM 468 NZ LYS A 28 11.987 -2.480 10.816 1.00 0.00 N ATOM 0 H LYS A 28 14.892 1.403 6.721 1.00 0.00 H new ATOM 0 HA LYS A 28 17.230 0.622 8.120 1.00 0.00 H new ATOM 0 HB2 LYS A 28 15.757 0.063 9.874 1.00 0.00 H new ATOM 0 HB3 LYS A 28 14.941 1.371 9.039 1.00 0.00 H new ATOM 0 HG2 LYS A 28 13.133 0.040 9.023 1.00 0.00 H new ATOM 0 HG3 LYS A 28 13.930 -0.849 7.740 1.00 0.00 H new ATOM 0 HD2 LYS A 28 13.783 -2.648 9.106 1.00 0.00 H new ATOM 0 HD3 LYS A 28 15.119 -1.936 9.990 1.00 0.00 H new ATOM 0 HE2 LYS A 28 13.765 -1.873 11.792 1.00 0.00 H new ATOM 0 HE3 LYS A 28 12.895 -0.576 10.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 11.136 -1.897 10.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 11.949 -2.938 9.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 12.029 -3.208 11.558 1.00 0.00 H new ATOM 482 N ALA A 29 15.564 -1.893 6.741 1.00 0.00 N ATOM 483 CA ALA A 29 15.734 -3.309 6.396 1.00 0.00 C ATOM 484 C ALA A 29 15.443 -3.636 4.929 1.00 0.00 C ATOM 485 O ALA A 29 15.773 -4.728 4.467 1.00 0.00 O ATOM 486 CB ALA A 29 14.858 -4.167 7.296 1.00 0.00 C ATOM 0 H ALA A 29 14.687 -1.475 6.429 1.00 0.00 H new ATOM 0 HA ALA A 29 16.789 -3.533 6.553 1.00 0.00 H new ATOM 0 HB1 ALA A 29 14.988 -5.217 7.036 1.00 0.00 H new ATOM 0 HB2 ALA A 29 15.144 -4.013 8.336 1.00 0.00 H new ATOM 0 HB3 ALA A 29 13.813 -3.886 7.162 1.00 0.00 H new ATOM 492 N ASN A 30 14.826 -2.717 4.197 1.00 0.00 N ATOM 493 CA ASN A 30 14.511 -2.973 2.792 1.00 0.00 C ATOM 494 C ASN A 30 15.700 -2.645 1.903 1.00 0.00 C ATOM 495 O ASN A 30 15.819 -3.165 0.795 1.00 0.00 O ATOM 496 CB ASN A 30 13.289 -2.168 2.348 1.00 0.00 C ATOM 497 CG ASN A 30 11.981 -2.823 2.747 1.00 0.00 C ATOM 498 OD1 ASN A 30 11.576 -2.771 3.908 1.00 0.00 O ATOM 499 ND2 ASN A 30 11.311 -3.442 1.783 1.00 0.00 N ATOM 0 H ASN A 30 14.537 -1.802 4.542 1.00 0.00 H new ATOM 0 HA ASN A 30 14.282 -4.034 2.693 1.00 0.00 H new ATOM 0 HB2 ASN A 30 13.339 -1.170 2.783 1.00 0.00 H new ATOM 0 HB3 ASN A 30 13.314 -2.045 1.265 1.00 0.00 H new ATOM 0 HD21 ASN A 30 10.423 -3.899 1.991 1.00 0.00 H new ATOM 0 HD22 ASN A 30 11.684 -3.461 0.834 1.00 0.00 H new ATOM 506 N LEU A 31 16.572 -1.771 2.397 1.00 0.00 N ATOM 507 CA LEU A 31 17.754 -1.362 1.649 1.00 0.00 C ATOM 508 C LEU A 31 17.350 -0.599 0.396 1.00 0.00 C ATOM 509 O LEU A 31 17.410 -1.126 -0.712 1.00 0.00 O ATOM 510 CB LEU A 31 18.608 -2.578 1.276 1.00 0.00 C ATOM 511 CG LEU A 31 19.612 -3.016 2.342 1.00 0.00 C ATOM 512 CD1 LEU A 31 19.223 -4.371 2.916 1.00 0.00 C ATOM 513 CD2 LEU A 31 21.018 -3.064 1.763 1.00 0.00 C ATOM 0 H LEU A 31 16.481 -1.332 3.313 1.00 0.00 H new ATOM 0 HA LEU A 31 18.349 -0.705 2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 31 17.945 -3.415 1.058 1.00 0.00 H new ATOM 0 HB3 LEU A 31 19.151 -2.354 0.358 1.00 0.00 H new ATOM 0 HG LEU A 31 19.598 -2.284 3.150 1.00 0.00 H new ATOM 0 HD11 LEU A 31 19.949 -4.667 3.673 1.00 0.00 H new ATOM 0 HD12 LEU A 31 18.233 -4.304 3.368 1.00 0.00 H new ATOM 0 HD13 LEU A 31 19.208 -5.113 2.118 1.00 0.00 H new ATOM 0 HD21 LEU A 31 21.719 -3.378 2.536 1.00 0.00 H new ATOM 0 HD22 LEU A 31 21.047 -3.774 0.937 1.00 0.00 H new ATOM 0 HD23 LEU A 31 21.296 -2.074 1.401 1.00 0.00 H new ATOM 525 N GLU A 32 16.929 0.645 0.591 1.00 0.00 N ATOM 526 CA GLU A 32 16.501 1.502 -0.513 1.00 0.00 C ATOM 527 C GLU A 32 17.534 1.517 -1.639 1.00 0.00 C ATOM 528 O GLU A 32 17.198 1.758 -2.799 1.00 0.00 O ATOM 529 CB GLU A 32 16.260 2.928 -0.012 1.00 0.00 C ATOM 530 CG GLU A 32 14.978 3.554 -0.540 1.00 0.00 C ATOM 531 CD GLU A 32 14.878 3.496 -2.052 1.00 0.00 C ATOM 532 OE1 GLU A 32 15.566 4.292 -2.724 1.00 0.00 O ATOM 533 OE2 GLU A 32 14.111 2.653 -2.564 1.00 0.00 O ATOM 0 H GLU A 32 16.874 1.087 1.509 1.00 0.00 H new ATOM 0 HA GLU A 32 15.571 1.095 -0.909 1.00 0.00 H new ATOM 0 HB2 GLU A 32 16.228 2.920 1.077 1.00 0.00 H new ATOM 0 HB3 GLU A 32 17.105 3.553 -0.302 1.00 0.00 H new ATOM 0 HG2 GLU A 32 14.121 3.041 -0.103 1.00 0.00 H new ATOM 0 HG3 GLU A 32 14.926 4.593 -0.216 1.00 0.00 H new ATOM 540 N LYS A 33 18.790 1.257 -1.290 1.00 0.00 N ATOM 541 CA LYS A 33 19.874 1.239 -2.268 1.00 0.00 C ATOM 542 C LYS A 33 20.042 -0.156 -2.864 1.00 0.00 C ATOM 543 O LYS A 33 21.124 -0.520 -3.325 1.00 0.00 O ATOM 544 CB LYS A 33 21.185 1.691 -1.619 1.00 0.00 C ATOM 545 CG LYS A 33 21.346 1.223 -0.181 1.00 0.00 C ATOM 546 CD LYS A 33 22.810 1.037 0.185 1.00 0.00 C ATOM 547 CE LYS A 33 23.452 2.349 0.603 1.00 0.00 C ATOM 548 NZ LYS A 33 24.503 2.783 -0.357 1.00 0.00 N ATOM 0 H LYS A 33 19.084 1.055 -0.334 1.00 0.00 H new ATOM 0 HA LYS A 33 19.618 1.931 -3.070 1.00 0.00 H new ATOM 0 HB2 LYS A 33 22.021 1.317 -2.210 1.00 0.00 H new ATOM 0 HB3 LYS A 33 21.238 2.779 -1.646 1.00 0.00 H new ATOM 0 HG2 LYS A 33 20.891 1.950 0.492 1.00 0.00 H new ATOM 0 HG3 LYS A 33 20.813 0.283 -0.042 1.00 0.00 H new ATOM 0 HD2 LYS A 33 22.894 0.315 0.997 1.00 0.00 H new ATOM 0 HD3 LYS A 33 23.349 0.622 -0.667 1.00 0.00 H new ATOM 0 HE2 LYS A 33 22.686 3.121 0.676 1.00 0.00 H new ATOM 0 HE3 LYS A 33 23.890 2.239 1.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.916 3.682 -0.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.247 2.058 -0.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.081 2.913 -1.299 1.00 0.00 H new ATOM 562 N GLU A 34 18.963 -0.929 -2.850 1.00 0.00 N ATOM 563 CA GLU A 34 18.978 -2.287 -3.384 1.00 0.00 C ATOM 564 C GLU A 34 17.641 -2.628 -4.030 1.00 0.00 C ATOM 565 O GLU A 34 17.576 -2.964 -5.213 1.00 0.00 O ATOM 566 CB GLU A 34 19.286 -3.290 -2.270 1.00 0.00 C ATOM 567 CG GLU A 34 20.771 -3.473 -2.004 1.00 0.00 C ATOM 568 CD GLU A 34 21.464 -4.268 -3.093 1.00 0.00 C ATOM 569 OE1 GLU A 34 21.885 -3.656 -4.098 1.00 0.00 O ATOM 570 OE2 GLU A 34 21.586 -5.502 -2.942 1.00 0.00 O ATOM 0 H GLU A 34 18.061 -0.637 -2.473 1.00 0.00 H new ATOM 0 HA GLU A 34 19.757 -2.345 -4.144 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.800 -2.960 -1.352 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.852 -4.255 -2.532 1.00 0.00 H new ATOM 0 HG2 GLU A 34 21.244 -2.495 -1.916 1.00 0.00 H new ATOM 0 HG3 GLU A 34 20.906 -3.979 -1.048 1.00 0.00 H new ATOM 577 N PHE A 35 16.575 -2.542 -3.239 1.00 0.00 N ATOM 578 CA PHE A 35 15.232 -2.841 -3.720 1.00 0.00 C ATOM 579 C PHE A 35 14.471 -1.553 -4.021 1.00 0.00 C ATOM 580 O PHE A 35 14.949 -0.458 -3.725 1.00 0.00 O ATOM 581 CB PHE A 35 14.468 -3.666 -2.681 1.00 0.00 C ATOM 582 CG PHE A 35 15.134 -4.968 -2.330 1.00 0.00 C ATOM 583 CD1 PHE A 35 16.325 -4.989 -1.622 1.00 0.00 C ATOM 584 CD2 PHE A 35 14.562 -6.173 -2.704 1.00 0.00 C ATOM 585 CE1 PHE A 35 16.935 -6.186 -1.296 1.00 0.00 C ATOM 586 CE2 PHE A 35 15.167 -7.374 -2.382 1.00 0.00 C ATOM 587 CZ PHE A 35 16.355 -7.380 -1.677 1.00 0.00 C ATOM 0 H PHE A 35 16.617 -2.266 -2.258 1.00 0.00 H new ATOM 0 HA PHE A 35 15.318 -3.419 -4.640 1.00 0.00 H new ATOM 0 HB2 PHE A 35 14.351 -3.073 -1.774 1.00 0.00 H new ATOM 0 HB3 PHE A 35 13.466 -3.871 -3.059 1.00 0.00 H new ATOM 0 HD1 PHE A 35 16.783 -4.058 -1.321 1.00 0.00 H new ATOM 0 HD2 PHE A 35 13.632 -6.174 -3.254 1.00 0.00 H new ATOM 0 HE1 PHE A 35 17.863 -6.187 -0.744 1.00 0.00 H new ATOM 0 HE2 PHE A 35 14.711 -8.306 -2.681 1.00 0.00 H new ATOM 0 HZ PHE A 35 16.829 -8.317 -1.424 1.00 0.00 H new ATOM 597 N PHE A 36 13.286 -1.687 -4.608 1.00 0.00 N ATOM 598 CA PHE A 36 12.469 -0.524 -4.943 1.00 0.00 C ATOM 599 C PHE A 36 10.987 -0.803 -4.702 1.00 0.00 C ATOM 600 O PHE A 36 10.496 -1.898 -4.979 1.00 0.00 O ATOM 601 CB PHE A 36 12.695 -0.113 -6.399 1.00 0.00 C ATOM 602 CG PHE A 36 14.046 0.497 -6.648 1.00 0.00 C ATOM 603 CD1 PHE A 36 14.353 1.757 -6.158 1.00 0.00 C ATOM 604 CD2 PHE A 36 15.009 -0.190 -7.370 1.00 0.00 C ATOM 605 CE1 PHE A 36 15.596 2.319 -6.384 1.00 0.00 C ATOM 606 CE2 PHE A 36 16.253 0.367 -7.599 1.00 0.00 C ATOM 607 CZ PHE A 36 16.546 1.623 -7.105 1.00 0.00 C ATOM 0 H PHE A 36 12.871 -2.584 -4.861 1.00 0.00 H new ATOM 0 HA PHE A 36 12.773 0.296 -4.292 1.00 0.00 H new ATOM 0 HB2 PHE A 36 12.577 -0.988 -7.038 1.00 0.00 H new ATOM 0 HB3 PHE A 36 11.924 0.600 -6.691 1.00 0.00 H new ATOM 0 HD1 PHE A 36 13.613 2.306 -5.594 1.00 0.00 H new ATOM 0 HD2 PHE A 36 14.785 -1.172 -7.758 1.00 0.00 H new ATOM 0 HE1 PHE A 36 15.824 3.301 -5.997 1.00 0.00 H new ATOM 0 HE2 PHE A 36 16.995 -0.179 -8.163 1.00 0.00 H new ATOM 0 HZ PHE A 36 17.517 2.060 -7.282 1.00 0.00 H new ATOM 617 N ILE A 37 10.282 0.196 -4.183 1.00 0.00 N ATOM 618 CA ILE A 37 8.860 0.058 -3.902 1.00 0.00 C ATOM 619 C ILE A 37 8.045 1.133 -4.612 1.00 0.00 C ATOM 620 O ILE A 37 8.274 2.329 -4.430 1.00 0.00 O ATOM 621 CB ILE A 37 8.564 0.117 -2.387 1.00 0.00 C ATOM 622 CG1 ILE A 37 9.186 1.372 -1.754 1.00 0.00 C ATOM 623 CG2 ILE A 37 9.063 -1.148 -1.701 1.00 0.00 C ATOM 624 CD1 ILE A 37 10.685 1.288 -1.535 1.00 0.00 C ATOM 0 H ILE A 37 10.672 1.109 -3.949 1.00 0.00 H new ATOM 0 HA ILE A 37 8.567 -0.922 -4.279 1.00 0.00 H new ATOM 0 HB ILE A 37 7.485 0.178 -2.249 1.00 0.00 H new ATOM 0 HG12 ILE A 37 8.972 2.230 -2.392 1.00 0.00 H new ATOM 0 HG13 ILE A 37 8.701 1.559 -0.796 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.848 -1.092 -0.634 1.00 0.00 H new ATOM 0 HG22 ILE A 37 8.560 -2.016 -2.128 1.00 0.00 H new ATOM 0 HG23 ILE A 37 10.139 -1.242 -1.850 1.00 0.00 H new ATOM 0 HD11 ILE A 37 11.040 2.215 -1.085 1.00 0.00 H new ATOM 0 HD12 ILE A 37 10.909 0.453 -0.871 1.00 0.00 H new ATOM 0 HD13 ILE A 37 11.184 1.135 -2.492 1.00 0.00 H new ATOM 636 N ASN A 38 7.091 0.692 -5.423 1.00 0.00 N ATOM 637 CA ASN A 38 6.229 1.603 -6.168 1.00 0.00 C ATOM 638 C ASN A 38 4.815 1.580 -5.601 1.00 0.00 C ATOM 639 O ASN A 38 4.467 0.696 -4.818 1.00 0.00 O ATOM 640 CB ASN A 38 6.205 1.224 -7.653 1.00 0.00 C ATOM 641 CG ASN A 38 6.661 -0.204 -7.893 1.00 0.00 C ATOM 642 OD1 ASN A 38 5.882 -1.051 -8.328 1.00 0.00 O ATOM 643 ND2 ASN A 38 7.929 -0.478 -7.618 1.00 0.00 N ATOM 0 H ASN A 38 6.894 -0.296 -5.582 1.00 0.00 H new ATOM 0 HA ASN A 38 6.630 2.612 -6.070 1.00 0.00 H new ATOM 0 HB2 ASN A 38 5.194 1.350 -8.041 1.00 0.00 H new ATOM 0 HB3 ASN A 38 6.847 1.906 -8.210 1.00 0.00 H new ATOM 0 HD21 ASN A 38 8.291 -1.420 -7.766 1.00 0.00 H new ATOM 0 HD22 ASN A 38 8.542 0.253 -7.259 1.00 0.00 H new ATOM 650 N SER A 39 4.002 2.554 -5.998 1.00 0.00 N ATOM 651 CA SER A 39 2.627 2.635 -5.520 1.00 0.00 C ATOM 652 C SER A 39 1.786 3.552 -6.403 1.00 0.00 C ATOM 653 O SER A 39 2.175 4.684 -6.693 1.00 0.00 O ATOM 654 CB SER A 39 2.597 3.127 -4.072 1.00 0.00 C ATOM 655 OG SER A 39 2.818 4.525 -4.002 1.00 0.00 O ATOM 0 H SER A 39 4.270 3.295 -6.646 1.00 0.00 H new ATOM 0 HA SER A 39 2.197 1.634 -5.566 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.634 2.885 -3.623 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.359 2.606 -3.492 1.00 0.00 H new ATOM 0 HG SER A 39 2.645 4.928 -4.878 1.00 0.00 H new ATOM 661 N ALA A 40 0.630 3.052 -6.825 1.00 0.00 N ATOM 662 CA ALA A 40 -0.277 3.815 -7.673 1.00 0.00 C ATOM 663 C ALA A 40 -1.686 3.238 -7.614 1.00 0.00 C ATOM 664 O ALA A 40 -1.916 2.208 -6.982 1.00 0.00 O ATOM 665 CB ALA A 40 0.230 3.829 -9.108 1.00 0.00 C ATOM 0 H ALA A 40 0.298 2.116 -6.592 1.00 0.00 H new ATOM 0 HA ALA A 40 -0.312 4.840 -7.303 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -0.457 4.402 -9.731 1.00 0.00 H new ATOM 0 HB2 ALA A 40 1.218 4.288 -9.140 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.292 2.807 -9.482 1.00 0.00 H new ATOM 671 N GLY A 41 -2.626 3.903 -8.277 1.00 0.00 N ATOM 672 CA GLY A 41 -4.000 3.434 -8.286 1.00 0.00 C ATOM 673 C GLY A 41 -4.248 2.410 -9.376 1.00 0.00 C ATOM 674 O GLY A 41 -3.352 2.106 -10.163 1.00 0.00 O ATOM 0 H GLY A 41 -2.461 4.758 -8.808 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -4.239 2.996 -7.317 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -4.671 4.282 -8.427 1.00 0.00 H new ATOM 678 N THR A 42 -5.463 1.871 -9.421 1.00 0.00 N ATOM 679 CA THR A 42 -5.814 0.867 -10.421 1.00 0.00 C ATOM 680 C THR A 42 -5.872 1.469 -11.821 1.00 0.00 C ATOM 681 O THR A 42 -5.314 0.913 -12.768 1.00 0.00 O ATOM 682 CB THR A 42 -7.170 0.211 -10.102 1.00 0.00 C ATOM 683 OG1 THR A 42 -7.664 0.687 -8.845 1.00 0.00 O ATOM 684 CG2 THR A 42 -7.039 -1.304 -10.060 1.00 0.00 C ATOM 0 H THR A 42 -6.219 2.111 -8.779 1.00 0.00 H new ATOM 0 HA THR A 42 -5.031 0.109 -10.391 1.00 0.00 H new ATOM 0 HB THR A 42 -7.873 0.479 -10.891 1.00 0.00 H new ATOM 0 HG1 THR A 42 -8.527 0.265 -8.652 1.00 0.00 H new ATOM 0 HG21 THR A 42 -8.009 -1.747 -9.833 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.692 -1.666 -11.028 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.322 -1.586 -9.289 1.00 0.00 H new ATOM 692 N SER A 43 -6.551 2.605 -11.950 1.00 0.00 N ATOM 693 CA SER A 43 -6.682 3.274 -13.240 1.00 0.00 C ATOM 694 C SER A 43 -6.209 4.722 -13.159 1.00 0.00 C ATOM 695 O SER A 43 -6.463 5.518 -14.064 1.00 0.00 O ATOM 696 CB SER A 43 -8.136 3.228 -13.714 1.00 0.00 C ATOM 697 OG SER A 43 -8.992 3.886 -12.796 1.00 0.00 O ATOM 0 H SER A 43 -7.018 3.081 -11.178 1.00 0.00 H new ATOM 0 HA SER A 43 -6.053 2.747 -13.957 1.00 0.00 H new ATOM 0 HB2 SER A 43 -8.218 3.699 -14.694 1.00 0.00 H new ATOM 0 HB3 SER A 43 -8.451 2.191 -13.831 1.00 0.00 H new ATOM 0 HG SER A 43 -8.959 3.427 -11.931 1.00 0.00 H new ATOM 703 N GLY A 44 -5.523 5.057 -12.071 1.00 0.00 N ATOM 704 CA GLY A 44 -5.029 6.411 -11.894 1.00 0.00 C ATOM 705 C GLY A 44 -6.138 7.442 -11.945 1.00 0.00 C ATOM 706 O GLY A 44 -5.904 8.601 -12.288 1.00 0.00 O ATOM 0 H GLY A 44 -5.300 4.416 -11.309 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -4.512 6.484 -10.937 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.296 6.632 -12.670 1.00 0.00 H new ATOM 710 N GLU A 45 -7.352 7.017 -11.608 1.00 0.00 N ATOM 711 CA GLU A 45 -8.507 7.906 -11.618 1.00 0.00 C ATOM 712 C GLU A 45 -8.350 9.024 -10.593 1.00 0.00 C ATOM 713 O GLU A 45 -8.744 10.164 -10.840 1.00 0.00 O ATOM 714 CB GLU A 45 -9.788 7.118 -11.335 1.00 0.00 C ATOM 715 CG GLU A 45 -9.693 6.215 -10.115 1.00 0.00 C ATOM 716 CD GLU A 45 -10.579 4.990 -10.226 1.00 0.00 C ATOM 717 OE1 GLU A 45 -11.760 5.144 -10.603 1.00 0.00 O ATOM 718 OE2 GLU A 45 -10.092 3.876 -9.939 1.00 0.00 O ATOM 0 H GLU A 45 -7.561 6.060 -11.324 1.00 0.00 H new ATOM 0 HA GLU A 45 -8.574 8.355 -12.609 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -10.611 7.818 -11.195 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -10.031 6.511 -12.207 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.658 5.900 -9.981 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -9.972 6.781 -9.226 1.00 0.00 H new ATOM 725 N HIS A 46 -7.779 8.691 -9.440 1.00 0.00 N ATOM 726 CA HIS A 46 -7.578 9.671 -8.379 1.00 0.00 C ATOM 727 C HIS A 46 -6.150 9.623 -7.842 1.00 0.00 C ATOM 728 O HIS A 46 -5.634 10.629 -7.357 1.00 0.00 O ATOM 729 CB HIS A 46 -8.574 9.433 -7.244 1.00 0.00 C ATOM 730 CG HIS A 46 -9.967 9.872 -7.576 1.00 0.00 C ATOM 731 ND1 HIS A 46 -10.243 11.020 -8.288 1.00 0.00 N ATOM 732 CD2 HIS A 46 -11.166 9.307 -7.297 1.00 0.00 C ATOM 733 CE1 HIS A 46 -11.550 11.143 -8.431 1.00 0.00 C ATOM 734 NE2 HIS A 46 -12.132 10.117 -7.840 1.00 0.00 N ATOM 0 H HIS A 46 -7.448 7.752 -9.217 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.747 10.661 -8.802 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -8.584 8.372 -6.996 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -8.235 9.965 -6.355 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -11.331 8.391 -6.750 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -12.056 11.947 -8.944 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -13.138 9.952 -7.794 1.00 0.00 H new ATOM 743 N ASP A 47 -5.523 8.449 -7.927 1.00 0.00 N ATOM 744 CA ASP A 47 -4.153 8.271 -7.446 1.00 0.00 C ATOM 745 C ASP A 47 -3.268 9.449 -7.853 1.00 0.00 C ATOM 746 O ASP A 47 -3.006 9.663 -9.036 1.00 0.00 O ATOM 747 CB ASP A 47 -3.560 6.955 -7.970 1.00 0.00 C ATOM 748 CG ASP A 47 -2.040 6.975 -8.028 1.00 0.00 C ATOM 749 OD1 ASP A 47 -1.412 7.576 -7.133 1.00 0.00 O ATOM 750 OD2 ASP A 47 -1.477 6.387 -8.972 1.00 0.00 O ATOM 0 H ASP A 47 -5.942 7.608 -8.324 1.00 0.00 H new ATOM 0 HA ASP A 47 -4.186 8.230 -6.357 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -3.884 6.135 -7.329 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -3.954 6.755 -8.966 1.00 0.00 H new ATOM 755 N GLY A 48 -2.812 10.207 -6.859 1.00 0.00 N ATOM 756 CA GLY A 48 -1.958 11.351 -7.127 1.00 0.00 C ATOM 757 C GLY A 48 -2.724 12.661 -7.133 1.00 0.00 C ATOM 758 O GLY A 48 -3.012 13.213 -8.195 1.00 0.00 O ATOM 0 H GLY A 48 -3.019 10.049 -5.873 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -1.172 11.397 -6.374 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -1.468 11.216 -8.091 1.00 0.00 H new ATOM 762 N GLU A 49 -3.052 13.159 -5.944 1.00 0.00 N ATOM 763 CA GLU A 49 -3.786 14.413 -5.814 1.00 0.00 C ATOM 764 C GLU A 49 -3.536 15.053 -4.452 1.00 0.00 C ATOM 765 O GLU A 49 -4.060 16.125 -4.154 1.00 0.00 O ATOM 766 CB GLU A 49 -5.285 14.174 -6.009 1.00 0.00 C ATOM 767 CG GLU A 49 -5.776 14.516 -7.404 1.00 0.00 C ATOM 768 CD GLU A 49 -7.115 15.226 -7.394 1.00 0.00 C ATOM 769 OE1 GLU A 49 -7.187 16.349 -6.850 1.00 0.00 O ATOM 770 OE2 GLU A 49 -8.091 14.662 -7.930 1.00 0.00 O ATOM 0 H GLU A 49 -2.821 12.713 -5.057 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.429 15.094 -6.587 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.508 13.128 -5.800 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -5.837 14.769 -5.282 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.038 15.147 -7.900 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.859 13.601 -7.990 1.00 0.00 H new ATOM 777 N GLY A 50 -2.732 14.385 -3.629 1.00 0.00 N ATOM 778 CA GLY A 50 -2.428 14.902 -2.307 1.00 0.00 C ATOM 779 C GLY A 50 -2.798 13.927 -1.205 1.00 0.00 C ATOM 780 O GLY A 50 -2.172 12.877 -1.065 1.00 0.00 O ATOM 0 H GLY A 50 -2.286 13.496 -3.854 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -1.364 15.129 -2.245 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.964 15.839 -2.154 1.00 0.00 H new ATOM 784 N MET A 51 -3.816 14.275 -0.424 1.00 0.00 N ATOM 785 CA MET A 51 -4.266 13.417 0.669 1.00 0.00 C ATOM 786 C MET A 51 -5.661 13.813 1.143 1.00 0.00 C ATOM 787 O MET A 51 -6.319 14.658 0.535 1.00 0.00 O ATOM 788 CB MET A 51 -3.282 13.489 1.836 1.00 0.00 C ATOM 789 CG MET A 51 -3.054 12.152 2.521 1.00 0.00 C ATOM 790 SD MET A 51 -2.024 12.295 3.993 1.00 0.00 S ATOM 791 CE MET A 51 -0.603 11.324 3.502 1.00 0.00 C ATOM 0 H MET A 51 -4.344 15.142 -0.526 1.00 0.00 H new ATOM 0 HA MET A 51 -4.309 12.394 0.296 1.00 0.00 H new ATOM 0 HB2 MET A 51 -2.327 13.869 1.473 1.00 0.00 H new ATOM 0 HB3 MET A 51 -3.652 14.205 2.569 1.00 0.00 H new ATOM 0 HG2 MET A 51 -4.016 11.720 2.796 1.00 0.00 H new ATOM 0 HG3 MET A 51 -2.584 11.463 1.819 1.00 0.00 H new ATOM 0 HE1 MET A 51 0.261 11.617 4.098 1.00 0.00 H new ATOM 0 HE2 MET A 51 -0.812 10.266 3.662 1.00 0.00 H new ATOM 0 HE3 MET A 51 -0.392 11.496 2.447 1.00 0.00 H new ATOM 801 N HIS A 52 -6.103 13.197 2.236 1.00 0.00 N ATOM 802 CA HIS A 52 -7.418 13.480 2.800 1.00 0.00 C ATOM 803 C HIS A 52 -7.436 13.211 4.301 1.00 0.00 C ATOM 804 O HIS A 52 -6.409 12.879 4.893 1.00 0.00 O ATOM 805 CB HIS A 52 -8.489 12.638 2.104 1.00 0.00 C ATOM 806 CG HIS A 52 -9.640 13.446 1.588 1.00 0.00 C ATOM 807 ND1 HIS A 52 -9.503 14.418 0.617 1.00 0.00 N ATOM 808 CD2 HIS A 52 -10.955 13.425 1.912 1.00 0.00 C ATOM 809 CE1 HIS A 52 -10.682 14.960 0.370 1.00 0.00 C ATOM 810 NE2 HIS A 52 -11.579 14.373 1.141 1.00 0.00 N ATOM 0 H HIS A 52 -5.568 12.497 2.749 1.00 0.00 H new ATOM 0 HA HIS A 52 -7.635 14.536 2.637 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -8.033 12.098 1.274 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -8.864 11.891 2.803 1.00 0.00 H new ATOM 0 HD1 HIS A 52 -8.628 14.677 0.161 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -11.425 12.782 2.641 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -10.879 15.749 -0.341 1.00 0.00 H new ATOM 819 N TYR A 53 -8.611 13.364 4.909 1.00 0.00 N ATOM 820 CA TYR A 53 -8.785 13.143 6.342 1.00 0.00 C ATOM 821 C TYR A 53 -8.226 11.793 6.778 1.00 0.00 C ATOM 822 O TYR A 53 -7.749 11.005 5.961 1.00 0.00 O ATOM 823 CB TYR A 53 -10.265 13.237 6.717 1.00 0.00 C ATOM 824 CG TYR A 53 -10.978 14.421 6.099 1.00 0.00 C ATOM 825 CD1 TYR A 53 -10.433 15.698 6.163 1.00 0.00 C ATOM 826 CD2 TYR A 53 -12.196 14.259 5.451 1.00 0.00 C ATOM 827 CE1 TYR A 53 -11.082 16.779 5.599 1.00 0.00 C ATOM 828 CE2 TYR A 53 -12.850 15.336 4.883 1.00 0.00 C ATOM 829 CZ TYR A 53 -12.289 16.594 4.961 1.00 0.00 C ATOM 830 OH TYR A 53 -12.936 17.668 4.397 1.00 0.00 O ATOM 0 H TYR A 53 -9.464 13.643 4.425 1.00 0.00 H new ATOM 0 HA TYR A 53 -8.227 13.921 6.863 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -10.767 12.320 6.408 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -10.352 13.298 7.802 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -9.487 15.847 6.662 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -12.639 13.276 5.390 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -10.645 17.765 5.658 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -13.795 15.194 4.381 1.00 0.00 H new ATOM 0 HH TYR A 53 -13.773 17.367 3.986 1.00 0.00 H new ATOM 840 N GLY A 54 -8.307 11.527 8.077 1.00 0.00 N ATOM 841 CA GLY A 54 -7.825 10.269 8.609 1.00 0.00 C ATOM 842 C GLY A 54 -6.315 10.183 8.656 1.00 0.00 C ATOM 843 O GLY A 54 -5.708 10.414 9.701 1.00 0.00 O ATOM 0 H GLY A 54 -8.699 12.163 8.771 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -8.222 10.131 9.615 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -8.211 9.452 7.999 1.00 0.00 H new ATOM 847 N THR A 55 -5.708 9.833 7.529 1.00 0.00 N ATOM 848 CA THR A 55 -4.260 9.699 7.459 1.00 0.00 C ATOM 849 C THR A 55 -3.559 11.010 7.807 1.00 0.00 C ATOM 850 O THR A 55 -2.660 11.038 8.643 1.00 0.00 O ATOM 851 CB THR A 55 -3.804 9.249 6.057 1.00 0.00 C ATOM 852 OG1 THR A 55 -2.385 9.394 5.933 1.00 0.00 O ATOM 853 CG2 THR A 55 -4.496 10.060 4.973 1.00 0.00 C ATOM 0 H THR A 55 -6.195 9.638 6.654 1.00 0.00 H new ATOM 0 HA THR A 55 -3.984 8.939 8.190 1.00 0.00 H new ATOM 0 HB THR A 55 -4.076 8.201 5.933 1.00 0.00 H new ATOM 0 HG1 THR A 55 -1.938 8.796 6.568 1.00 0.00 H new ATOM 0 HG21 THR A 55 -4.157 9.723 3.994 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.575 9.924 5.050 1.00 0.00 H new ATOM 0 HG23 THR A 55 -4.253 11.115 5.097 1.00 0.00 H new ATOM 861 N LYS A 56 -3.978 12.093 7.157 1.00 0.00 N ATOM 862 CA LYS A 56 -3.390 13.410 7.391 1.00 0.00 C ATOM 863 C LYS A 56 -3.492 13.813 8.858 1.00 0.00 C ATOM 864 O LYS A 56 -2.564 14.394 9.414 1.00 0.00 O ATOM 865 CB LYS A 56 -4.071 14.460 6.511 1.00 0.00 C ATOM 866 CG LYS A 56 -3.597 15.881 6.775 1.00 0.00 C ATOM 867 CD LYS A 56 -4.137 16.850 5.736 1.00 0.00 C ATOM 868 CE LYS A 56 -4.309 18.245 6.312 1.00 0.00 C ATOM 869 NZ LYS A 56 -3.761 19.292 5.405 1.00 0.00 N ATOM 0 H LYS A 56 -4.725 12.084 6.462 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.333 13.353 7.129 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.891 14.215 5.464 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -5.148 14.411 6.670 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -3.919 16.194 7.768 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.507 15.909 6.769 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.457 16.888 4.885 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -5.095 16.488 5.363 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -5.367 18.436 6.490 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.808 18.303 7.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.898 20.229 5.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -2.746 19.125 5.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -4.257 19.254 4.491 1.00 0.00 H new ATOM 883 N ASN A 57 -4.628 13.513 9.473 1.00 0.00 N ATOM 884 CA ASN A 57 -4.849 13.854 10.874 1.00 0.00 C ATOM 885 C ASN A 57 -3.830 13.163 11.778 1.00 0.00 C ATOM 886 O ASN A 57 -3.212 13.796 12.636 1.00 0.00 O ATOM 887 CB ASN A 57 -6.274 13.471 11.288 1.00 0.00 C ATOM 888 CG ASN A 57 -6.371 13.054 12.743 1.00 0.00 C ATOM 889 OD1 ASN A 57 -6.546 13.889 13.630 1.00 0.00 O ATOM 890 ND2 ASN A 57 -6.260 11.754 12.994 1.00 0.00 N ATOM 0 H ASN A 57 -5.410 13.035 9.026 1.00 0.00 H new ATOM 0 HA ASN A 57 -4.721 14.931 10.987 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -6.938 14.317 11.112 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -6.624 12.654 10.657 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -6.319 11.413 13.953 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -6.116 11.097 12.227 1.00 0.00 H new ATOM 897 N LYS A 58 -3.660 11.860 11.579 1.00 0.00 N ATOM 898 CA LYS A 58 -2.720 11.082 12.375 1.00 0.00 C ATOM 899 C LYS A 58 -1.289 11.556 12.151 1.00 0.00 C ATOM 900 O LYS A 58 -0.501 11.648 13.093 1.00 0.00 O ATOM 901 CB LYS A 58 -2.839 9.595 12.036 1.00 0.00 C ATOM 902 CG LYS A 58 -3.973 8.888 12.764 1.00 0.00 C ATOM 903 CD LYS A 58 -3.868 9.054 14.274 1.00 0.00 C ATOM 904 CE LYS A 58 -2.709 8.255 14.850 1.00 0.00 C ATOM 905 NZ LYS A 58 -1.518 9.110 15.111 1.00 0.00 N ATOM 0 H LYS A 58 -4.162 11.321 10.873 1.00 0.00 H new ATOM 0 HA LYS A 58 -2.968 11.228 13.426 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.987 9.488 10.961 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -1.899 9.100 12.280 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.928 9.285 12.421 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.960 7.827 12.513 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.738 10.109 14.516 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.799 8.732 14.741 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.023 7.778 15.778 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.438 7.458 14.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -0.655 8.595 14.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -1.588 9.983 14.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -1.478 9.350 16.122 1.00 0.00 H new ATOM 919 N LEU A 59 -0.959 11.856 10.900 1.00 0.00 N ATOM 920 CA LEU A 59 0.378 12.320 10.557 1.00 0.00 C ATOM 921 C LEU A 59 0.656 13.679 11.189 1.00 0.00 C ATOM 922 O LEU A 59 1.678 13.872 11.847 1.00 0.00 O ATOM 923 CB LEU A 59 0.542 12.403 9.038 1.00 0.00 C ATOM 924 CG LEU A 59 0.250 11.106 8.284 1.00 0.00 C ATOM 925 CD1 LEU A 59 -0.002 11.391 6.813 1.00 0.00 C ATOM 926 CD2 LEU A 59 1.397 10.123 8.446 1.00 0.00 C ATOM 0 H LEU A 59 -1.598 11.786 10.108 1.00 0.00 H new ATOM 0 HA LEU A 59 1.098 11.602 10.949 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.119 13.183 8.659 1.00 0.00 H new ATOM 0 HB3 LEU A 59 1.563 12.713 8.814 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.649 10.658 8.708 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -0.208 10.456 6.291 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.858 12.059 6.713 1.00 0.00 H new ATOM 0 HD13 LEU A 59 0.879 11.863 6.378 1.00 0.00 H new ATOM 0 HD21 LEU A 59 1.170 9.206 7.902 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.312 10.563 8.050 1.00 0.00 H new ATOM 0 HD23 LEU A 59 1.533 9.894 9.503 1.00 0.00 H new ATOM 938 N ALA A 60 -0.265 14.616 10.992 1.00 0.00 N ATOM 939 CA ALA A 60 -0.127 15.955 11.549 1.00 0.00 C ATOM 940 C ALA A 60 0.053 15.893 13.060 1.00 0.00 C ATOM 941 O ALA A 60 0.720 16.741 13.653 1.00 0.00 O ATOM 942 CB ALA A 60 -1.338 16.805 11.190 1.00 0.00 C ATOM 0 H ALA A 60 -1.117 14.472 10.449 1.00 0.00 H new ATOM 0 HA ALA A 60 0.761 16.417 11.119 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -1.221 17.803 11.613 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.423 16.878 10.106 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.239 16.343 11.594 1.00 0.00 H new ATOM 948 N GLN A 61 -0.548 14.878 13.676 1.00 0.00 N ATOM 949 CA GLN A 61 -0.457 14.694 15.120 1.00 0.00 C ATOM 950 C GLN A 61 0.994 14.519 15.561 1.00 0.00 C ATOM 951 O GLN A 61 1.443 15.164 16.509 1.00 0.00 O ATOM 952 CB GLN A 61 -1.282 13.482 15.554 1.00 0.00 C ATOM 953 CG GLN A 61 -2.603 13.848 16.209 1.00 0.00 C ATOM 954 CD GLN A 61 -2.978 12.904 17.336 1.00 0.00 C ATOM 955 OE1 GLN A 61 -3.355 13.338 18.424 1.00 0.00 O ATOM 956 NE2 GLN A 61 -2.873 11.605 17.080 1.00 0.00 N ATOM 0 H GLN A 61 -1.104 14.170 13.196 1.00 0.00 H new ATOM 0 HA GLN A 61 -0.856 15.589 15.598 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -1.479 12.856 14.683 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -0.694 12.884 16.250 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -2.542 14.865 16.597 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -3.392 13.841 15.457 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -2.556 11.290 16.163 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -3.109 10.923 17.800 1.00 0.00 H new ATOM 965 N LEU A 62 1.724 13.642 14.874 1.00 0.00 N ATOM 966 CA LEU A 62 3.123 13.389 15.210 1.00 0.00 C ATOM 967 C LEU A 62 3.940 13.014 13.975 1.00 0.00 C ATOM 968 O LEU A 62 5.073 13.468 13.810 1.00 0.00 O ATOM 969 CB LEU A 62 3.227 12.278 16.259 1.00 0.00 C ATOM 970 CG LEU A 62 2.055 11.295 16.289 1.00 0.00 C ATOM 971 CD1 LEU A 62 2.448 9.976 15.644 1.00 0.00 C ATOM 972 CD2 LEU A 62 1.584 11.070 17.719 1.00 0.00 C ATOM 0 H LEU A 62 1.372 13.098 14.086 1.00 0.00 H new ATOM 0 HA LEU A 62 3.534 14.312 15.619 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.145 11.718 16.081 1.00 0.00 H new ATOM 0 HB3 LEU A 62 3.320 12.738 17.243 1.00 0.00 H new ATOM 0 HG LEU A 62 1.231 11.725 15.719 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.602 9.290 15.675 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.737 10.150 14.607 1.00 0.00 H new ATOM 0 HD13 LEU A 62 3.287 9.541 16.187 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.750 10.368 17.721 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.403 10.662 18.312 1.00 0.00 H new ATOM 0 HD23 LEU A 62 1.261 12.018 18.149 1.00 0.00 H new ATOM 984 N ASN A 63 3.366 12.177 13.116 1.00 0.00 N ATOM 985 CA ASN A 63 4.050 11.734 11.902 1.00 0.00 C ATOM 986 C ASN A 63 4.275 12.894 10.933 1.00 0.00 C ATOM 987 O ASN A 63 4.214 14.063 11.318 1.00 0.00 O ATOM 988 CB ASN A 63 3.247 10.629 11.212 1.00 0.00 C ATOM 989 CG ASN A 63 2.753 9.578 12.187 1.00 0.00 C ATOM 990 OD1 ASN A 63 3.538 8.979 12.921 1.00 0.00 O ATOM 991 ND2 ASN A 63 1.445 9.346 12.195 1.00 0.00 N ATOM 0 H ASN A 63 2.430 11.791 13.236 1.00 0.00 H new ATOM 0 HA ASN A 63 5.024 11.342 12.195 1.00 0.00 H new ATOM 0 HB2 ASN A 63 2.395 11.071 10.696 1.00 0.00 H new ATOM 0 HB3 ASN A 63 3.867 10.153 10.453 1.00 0.00 H new ATOM 0 HD21 ASN A 63 1.055 8.647 12.827 1.00 0.00 H new ATOM 0 HD22 ASN A 63 0.831 9.867 11.569 1.00 0.00 H new ATOM 998 N ILE A 64 4.540 12.561 9.674 1.00 0.00 N ATOM 999 CA ILE A 64 4.777 13.567 8.647 1.00 0.00 C ATOM 1000 C ILE A 64 3.564 13.709 7.730 1.00 0.00 C ATOM 1001 O ILE A 64 3.002 12.714 7.271 1.00 0.00 O ATOM 1002 CB ILE A 64 6.016 13.218 7.798 1.00 0.00 C ATOM 1003 CG1 ILE A 64 7.201 12.872 8.703 1.00 0.00 C ATOM 1004 CG2 ILE A 64 6.373 14.373 6.876 1.00 0.00 C ATOM 1005 CD1 ILE A 64 7.515 11.393 8.753 1.00 0.00 C ATOM 0 H ILE A 64 4.596 11.599 9.340 1.00 0.00 H new ATOM 0 HA ILE A 64 4.953 14.513 9.159 1.00 0.00 H new ATOM 0 HB ILE A 64 5.781 12.348 7.185 1.00 0.00 H new ATOM 0 HG12 ILE A 64 8.082 13.410 8.355 1.00 0.00 H new ATOM 0 HG13 ILE A 64 6.991 13.224 9.713 1.00 0.00 H new ATOM 0 HG21 ILE A 64 7.250 14.109 6.285 1.00 0.00 H new ATOM 0 HG22 ILE A 64 5.535 14.580 6.210 1.00 0.00 H new ATOM 0 HG23 ILE A 64 6.591 15.260 7.471 1.00 0.00 H new ATOM 0 HD11 ILE A 64 8.366 11.224 9.413 1.00 0.00 H new ATOM 0 HD12 ILE A 64 6.649 10.850 9.130 1.00 0.00 H new ATOM 0 HD13 ILE A 64 7.757 11.038 7.751 1.00 0.00 H new ATOM 1017 N GLU A 65 3.162 14.953 7.476 1.00 0.00 N ATOM 1018 CA GLU A 65 2.009 15.232 6.622 1.00 0.00 C ATOM 1019 C GLU A 65 2.207 14.673 5.214 1.00 0.00 C ATOM 1020 O GLU A 65 3.222 14.041 4.920 1.00 0.00 O ATOM 1021 CB GLU A 65 1.757 16.740 6.552 1.00 0.00 C ATOM 1022 CG GLU A 65 0.513 17.186 7.305 1.00 0.00 C ATOM 1023 CD GLU A 65 0.783 18.342 8.250 1.00 0.00 C ATOM 1024 OE1 GLU A 65 1.922 18.857 8.250 1.00 0.00 O ATOM 1025 OE2 GLU A 65 -0.143 18.734 8.990 1.00 0.00 O ATOM 0 H GLU A 65 3.618 15.785 7.850 1.00 0.00 H new ATOM 0 HA GLU A 65 1.142 14.739 7.062 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.623 17.264 6.956 1.00 0.00 H new ATOM 0 HB3 GLU A 65 1.665 17.036 5.507 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.254 17.479 6.589 1.00 0.00 H new ATOM 0 HG3 GLU A 65 0.115 16.344 7.872 1.00 0.00 H new ATOM 1032 N HIS A 66 1.225 14.912 4.346 1.00 0.00 N ATOM 1033 CA HIS A 66 1.283 14.434 2.971 1.00 0.00 C ATOM 1034 C HIS A 66 2.440 15.078 2.218 1.00 0.00 C ATOM 1035 O HIS A 66 2.642 16.290 2.281 1.00 0.00 O ATOM 1036 CB HIS A 66 -0.040 14.709 2.248 1.00 0.00 C ATOM 1037 CG HIS A 66 -0.361 16.164 2.085 1.00 0.00 C ATOM 1038 ND1 HIS A 66 -0.230 17.206 2.942 1.00 0.00 N flip ATOM 1039 CD2 HIS A 66 -0.892 16.690 0.926 1.00 0.00 C flip ATOM 1040 CE1 HIS A 66 -0.680 18.329 2.289 1.00 0.00 C flip ATOM 1041 NE2 HIS A 66 -1.073 17.990 1.075 1.00 0.00 N flip ATOM 0 H HIS A 66 0.379 15.435 4.574 1.00 0.00 H new ATOM 0 HA HIS A 66 1.449 13.357 2.997 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -0.006 14.243 1.263 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -0.849 14.230 2.800 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -1.124 16.126 0.034 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -0.708 19.327 2.702 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -1.452 18.624 0.372 1.00 0.00 H new ATOM 1050 N LYS A 67 3.192 14.249 1.504 1.00 0.00 N ATOM 1051 CA LYS A 67 4.338 14.713 0.728 1.00 0.00 C ATOM 1052 C LYS A 67 4.701 13.691 -0.338 1.00 0.00 C ATOM 1053 O LYS A 67 5.859 13.574 -0.741 1.00 0.00 O ATOM 1054 CB LYS A 67 5.541 14.962 1.641 1.00 0.00 C ATOM 1055 CG LYS A 67 5.561 16.347 2.265 1.00 0.00 C ATOM 1056 CD LYS A 67 5.299 16.284 3.761 1.00 0.00 C ATOM 1057 CE LYS A 67 6.483 16.817 4.549 1.00 0.00 C ATOM 1058 NZ LYS A 67 7.706 15.996 4.333 1.00 0.00 N ATOM 0 H LYS A 67 3.028 13.244 1.446 1.00 0.00 H new ATOM 0 HA LYS A 67 4.066 15.651 0.244 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.543 14.216 2.435 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.457 14.819 1.067 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.528 16.816 2.083 1.00 0.00 H new ATOM 0 HG3 LYS A 67 4.808 16.974 1.788 1.00 0.00 H new ATOM 0 HD2 LYS A 67 4.408 16.864 4.002 1.00 0.00 H new ATOM 0 HD3 LYS A 67 5.098 15.254 4.055 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.681 17.848 4.255 1.00 0.00 H new ATOM 0 HE3 LYS A 67 6.237 16.830 5.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.348 16.109 5.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.440 14.995 4.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.186 16.310 3.465 1.00 0.00 H new ATOM 1072 N ASN A 68 3.696 12.957 -0.786 1.00 0.00 N ATOM 1073 CA ASN A 68 3.881 11.934 -1.806 1.00 0.00 C ATOM 1074 C ASN A 68 2.851 12.100 -2.916 1.00 0.00 C ATOM 1075 O ASN A 68 2.287 11.124 -3.413 1.00 0.00 O ATOM 1076 CB ASN A 68 3.768 10.539 -1.185 1.00 0.00 C ATOM 1077 CG ASN A 68 4.292 10.496 0.237 1.00 0.00 C ATOM 1078 OD1 ASN A 68 3.388 10.354 1.198 1.00 0.00 O flip ATOM 1079 ND2 ASN A 68 5.498 10.590 0.468 1.00 0.00 N flip ATOM 0 H ASN A 68 2.735 13.051 -0.457 1.00 0.00 H new ATOM 0 HA ASN A 68 4.877 12.047 -2.234 1.00 0.00 H new ATOM 0 HB2 ASN A 68 2.725 10.223 -1.195 1.00 0.00 H new ATOM 0 HB3 ASN A 68 4.322 9.826 -1.796 1.00 0.00 H new ATOM 0 HD21 ASN A 68 6.158 10.698 -0.302 1.00 0.00 H new ATOM 0 HD22 ASN A 68 5.837 10.560 1.430 1.00 0.00 H new ATOM 1086 N PHE A 69 2.606 13.351 -3.297 1.00 0.00 N ATOM 1087 CA PHE A 69 1.638 13.657 -4.345 1.00 0.00 C ATOM 1088 C PHE A 69 2.237 13.421 -5.728 1.00 0.00 C ATOM 1089 O PHE A 69 3.095 14.178 -6.182 1.00 0.00 O ATOM 1090 CB PHE A 69 1.150 15.106 -4.231 1.00 0.00 C ATOM 1091 CG PHE A 69 2.035 15.986 -3.392 1.00 0.00 C ATOM 1092 CD1 PHE A 69 3.235 16.465 -3.892 1.00 0.00 C ATOM 1093 CD2 PHE A 69 1.666 16.333 -2.102 1.00 0.00 C ATOM 1094 CE1 PHE A 69 4.051 17.274 -3.123 1.00 0.00 C ATOM 1095 CE2 PHE A 69 2.477 17.140 -1.327 1.00 0.00 C ATOM 1096 CZ PHE A 69 3.671 17.611 -1.839 1.00 0.00 C ATOM 0 H PHE A 69 3.065 14.169 -2.895 1.00 0.00 H new ATOM 0 HA PHE A 69 0.788 12.988 -4.214 1.00 0.00 H new ATOM 0 HB2 PHE A 69 1.074 15.533 -5.231 1.00 0.00 H new ATOM 0 HB3 PHE A 69 0.146 15.108 -3.807 1.00 0.00 H new ATOM 0 HD1 PHE A 69 3.537 16.203 -4.895 1.00 0.00 H new ATOM 0 HD2 PHE A 69 0.733 15.968 -1.698 1.00 0.00 H new ATOM 0 HE1 PHE A 69 4.983 17.641 -3.526 1.00 0.00 H new ATOM 0 HE2 PHE A 69 2.178 17.402 -0.323 1.00 0.00 H new ATOM 0 HZ PHE A 69 4.306 18.242 -1.235 1.00 0.00 H new ATOM 1106 N THR A 70 1.777 12.364 -6.394 1.00 0.00 N ATOM 1107 CA THR A 70 2.265 12.027 -7.727 1.00 0.00 C ATOM 1108 C THR A 70 1.207 11.269 -8.524 1.00 0.00 C ATOM 1109 O THR A 70 0.932 10.099 -8.254 1.00 0.00 O ATOM 1110 CB THR A 70 3.548 11.177 -7.658 1.00 0.00 C ATOM 1111 OG1 THR A 70 4.321 11.546 -6.509 1.00 0.00 O ATOM 1112 CG2 THR A 70 4.385 11.354 -8.916 1.00 0.00 C ATOM 0 H THR A 70 1.067 11.727 -6.032 1.00 0.00 H new ATOM 0 HA THR A 70 2.489 12.968 -8.229 1.00 0.00 H new ATOM 0 HB THR A 70 3.257 10.129 -7.579 1.00 0.00 H new ATOM 0 HG1 THR A 70 5.134 11.000 -6.472 1.00 0.00 H new ATOM 0 HG21 THR A 70 5.285 10.744 -8.843 1.00 0.00 H new ATOM 0 HG22 THR A 70 3.806 11.043 -9.785 1.00 0.00 H new ATOM 0 HG23 THR A 70 4.665 12.402 -9.022 1.00 0.00 H new ATOM 1120 N SER A 71 0.612 11.943 -9.506 1.00 0.00 N ATOM 1121 CA SER A 71 -0.418 11.334 -10.342 1.00 0.00 C ATOM 1122 C SER A 71 0.141 10.146 -11.120 1.00 0.00 C ATOM 1123 O SER A 71 0.846 10.320 -12.115 1.00 0.00 O ATOM 1124 CB SER A 71 -0.997 12.365 -11.313 1.00 0.00 C ATOM 1125 OG SER A 71 -0.556 13.673 -10.991 1.00 0.00 O ATOM 0 H SER A 71 0.826 12.912 -9.742 1.00 0.00 H new ATOM 0 HA SER A 71 -1.212 10.976 -9.687 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.698 12.118 -12.332 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.086 12.327 -11.282 1.00 0.00 H new ATOM 0 HG SER A 71 -0.938 14.313 -11.627 1.00 0.00 H new ATOM 1131 N LYS A 72 -0.179 8.941 -10.661 1.00 0.00 N ATOM 1132 CA LYS A 72 0.290 7.722 -11.312 1.00 0.00 C ATOM 1133 C LYS A 72 -0.877 6.817 -11.689 1.00 0.00 C ATOM 1134 O LYS A 72 -2.031 7.112 -11.377 1.00 0.00 O ATOM 1135 CB LYS A 72 1.264 6.973 -10.402 1.00 0.00 C ATOM 1136 CG LYS A 72 2.554 7.732 -10.138 1.00 0.00 C ATOM 1137 CD LYS A 72 3.433 7.786 -11.377 1.00 0.00 C ATOM 1138 CE LYS A 72 4.380 6.599 -11.441 1.00 0.00 C ATOM 1139 NZ LYS A 72 5.692 6.899 -10.806 1.00 0.00 N ATOM 0 H LYS A 72 -0.762 8.782 -9.839 1.00 0.00 H new ATOM 0 HA LYS A 72 0.809 8.008 -12.227 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.773 6.765 -9.451 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.504 6.011 -10.854 1.00 0.00 H new ATOM 0 HG2 LYS A 72 2.321 8.746 -9.812 1.00 0.00 H new ATOM 0 HG3 LYS A 72 3.099 7.253 -9.325 1.00 0.00 H new ATOM 0 HD2 LYS A 72 2.806 7.801 -12.269 1.00 0.00 H new ATOM 0 HD3 LYS A 72 4.008 8.712 -11.376 1.00 0.00 H new ATOM 0 HE2 LYS A 72 3.923 5.743 -10.943 1.00 0.00 H new ATOM 0 HE3 LYS A 72 4.537 6.316 -12.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 6.308 6.064 -10.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 6.140 7.699 -11.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 5.546 7.144 -9.806 1.00 0.00 H new ATOM 1153 N LYS A 73 -0.569 5.714 -12.363 1.00 0.00 N ATOM 1154 CA LYS A 73 -1.590 4.761 -12.781 1.00 0.00 C ATOM 1155 C LYS A 73 -0.972 3.396 -13.068 1.00 0.00 C ATOM 1156 O LYS A 73 -0.317 3.202 -14.093 1.00 0.00 O ATOM 1157 CB LYS A 73 -2.320 5.277 -14.024 1.00 0.00 C ATOM 1158 CG LYS A 73 -1.387 5.748 -15.128 1.00 0.00 C ATOM 1159 CD LYS A 73 -1.316 7.264 -15.188 1.00 0.00 C ATOM 1160 CE LYS A 73 -0.526 7.739 -16.396 1.00 0.00 C ATOM 1161 NZ LYS A 73 -0.740 9.188 -16.663 1.00 0.00 N ATOM 0 H LYS A 73 0.381 5.458 -12.632 1.00 0.00 H new ATOM 0 HA LYS A 73 -2.307 4.652 -11.967 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -2.960 4.485 -14.414 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -2.973 6.101 -13.736 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -0.389 5.342 -14.960 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -1.732 5.361 -16.087 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -2.325 7.675 -15.228 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -0.853 7.644 -14.277 1.00 0.00 H new ATOM 0 HE2 LYS A 73 0.535 7.553 -16.232 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -0.820 7.161 -17.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -0.184 9.474 -17.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -1.749 9.362 -16.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -0.436 9.742 -15.837 1.00 0.00 H new ATOM 1175 N LEU A 74 -1.184 2.450 -12.158 1.00 0.00 N ATOM 1176 CA LEU A 74 -0.648 1.102 -12.319 1.00 0.00 C ATOM 1177 C LEU A 74 -1.113 0.501 -13.643 1.00 0.00 C ATOM 1178 O LEU A 74 -2.312 0.439 -13.920 1.00 0.00 O ATOM 1179 CB LEU A 74 -1.080 0.214 -11.144 1.00 0.00 C ATOM 1180 CG LEU A 74 -1.447 -1.231 -11.502 1.00 0.00 C ATOM 1181 CD1 LEU A 74 -0.405 -2.198 -10.963 1.00 0.00 C ATOM 1182 CD2 LEU A 74 -2.826 -1.577 -10.961 1.00 0.00 C ATOM 0 H LEU A 74 -1.722 2.591 -11.303 1.00 0.00 H new ATOM 0 HA LEU A 74 0.441 1.158 -12.329 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -0.273 0.194 -10.412 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -1.939 0.678 -10.659 1.00 0.00 H new ATOM 0 HG LEU A 74 -1.468 -1.322 -12.588 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.684 -3.218 -11.228 1.00 0.00 H new ATOM 0 HD12 LEU A 74 0.567 -1.964 -11.396 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.350 -2.107 -9.878 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -3.072 -2.606 -11.223 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -2.829 -1.468 -9.876 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -3.566 -0.905 -11.395 1.00 0.00 H new ATOM 1194 N THR A 75 -0.160 0.065 -14.459 1.00 0.00 N ATOM 1195 CA THR A 75 -0.476 -0.525 -15.753 1.00 0.00 C ATOM 1196 C THR A 75 0.375 -1.762 -16.016 1.00 0.00 C ATOM 1197 O THR A 75 1.051 -2.265 -15.118 1.00 0.00 O ATOM 1198 CB THR A 75 -0.263 0.485 -16.895 1.00 0.00 C ATOM 1199 OG1 THR A 75 0.944 1.226 -16.676 1.00 0.00 O ATOM 1200 CG2 THR A 75 -1.439 1.444 -16.993 1.00 0.00 C ATOM 0 H THR A 75 0.837 0.109 -14.247 1.00 0.00 H new ATOM 0 HA THR A 75 -1.527 -0.812 -15.723 1.00 0.00 H new ATOM 0 HB THR A 75 -0.185 -0.069 -17.830 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.073 1.865 -17.408 1.00 0.00 H new ATOM 0 HG21 THR A 75 -1.267 2.149 -17.807 1.00 0.00 H new ATOM 0 HG22 THR A 75 -2.352 0.881 -17.187 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.542 1.990 -16.055 1.00 0.00 H new ATOM 1208 N GLN A 76 0.335 -2.247 -17.253 1.00 0.00 N ATOM 1209 CA GLN A 76 1.103 -3.425 -17.640 1.00 0.00 C ATOM 1210 C GLN A 76 2.599 -3.157 -17.514 1.00 0.00 C ATOM 1211 O GLN A 76 3.335 -3.957 -16.935 1.00 0.00 O ATOM 1212 CB GLN A 76 0.762 -3.833 -19.075 1.00 0.00 C ATOM 1213 CG GLN A 76 -0.731 -3.874 -19.357 1.00 0.00 C ATOM 1214 CD GLN A 76 -1.276 -5.287 -19.407 1.00 0.00 C ATOM 1215 OE1 GLN A 76 -1.956 -5.734 -18.483 1.00 0.00 O ATOM 1216 NE2 GLN A 76 -0.981 -5.998 -20.488 1.00 0.00 N ATOM 0 H GLN A 76 -0.222 -1.842 -18.005 1.00 0.00 H new ATOM 0 HA GLN A 76 0.839 -4.242 -16.968 1.00 0.00 H new ATOM 0 HB2 GLN A 76 1.235 -3.134 -19.765 1.00 0.00 H new ATOM 0 HB3 GLN A 76 1.188 -4.816 -19.276 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -1.258 -3.312 -18.586 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -0.931 -3.377 -20.306 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -0.414 -5.587 -21.230 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -1.321 -6.955 -20.577 1.00 0.00 H new ATOM 1225 N LYS A 77 3.041 -2.026 -18.057 1.00 0.00 N ATOM 1226 CA LYS A 77 4.449 -1.649 -18.000 1.00 0.00 C ATOM 1227 C LYS A 77 4.916 -1.534 -16.554 1.00 0.00 C ATOM 1228 O LYS A 77 6.043 -1.906 -16.222 1.00 0.00 O ATOM 1229 CB LYS A 77 4.677 -0.325 -18.732 1.00 0.00 C ATOM 1230 CG LYS A 77 6.129 -0.081 -19.110 1.00 0.00 C ATOM 1231 CD LYS A 77 6.249 0.525 -20.499 1.00 0.00 C ATOM 1232 CE LYS A 77 6.877 1.908 -20.447 1.00 0.00 C ATOM 1233 NZ LYS A 77 8.185 1.952 -21.158 1.00 0.00 N ATOM 0 H LYS A 77 2.444 -1.355 -18.541 1.00 0.00 H new ATOM 0 HA LYS A 77 5.031 -2.428 -18.492 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.067 -0.309 -19.636 1.00 0.00 H new ATOM 0 HB3 LYS A 77 4.332 0.494 -18.101 1.00 0.00 H new ATOM 0 HG2 LYS A 77 6.589 0.585 -18.380 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.679 -1.022 -19.074 1.00 0.00 H new ATOM 0 HD2 LYS A 77 6.852 -0.127 -21.131 1.00 0.00 H new ATOM 0 HD3 LYS A 77 5.262 0.589 -20.957 1.00 0.00 H new ATOM 0 HE2 LYS A 77 6.196 2.633 -20.894 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.019 2.203 -19.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 8.580 2.912 -21.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 8.843 1.279 -20.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 8.046 1.695 -22.156 1.00 0.00 H new ATOM 1247 N LEU A 78 4.040 -1.019 -15.698 1.00 0.00 N ATOM 1248 CA LEU A 78 4.354 -0.855 -14.284 1.00 0.00 C ATOM 1249 C LEU A 78 4.535 -2.212 -13.613 1.00 0.00 C ATOM 1250 O LEU A 78 5.476 -2.416 -12.845 1.00 0.00 O ATOM 1251 CB LEU A 78 3.245 -0.071 -13.581 1.00 0.00 C ATOM 1252 CG LEU A 78 3.676 1.272 -12.992 1.00 0.00 C ATOM 1253 CD1 LEU A 78 2.970 2.416 -13.705 1.00 0.00 C ATOM 1254 CD2 LEU A 78 3.391 1.314 -11.499 1.00 0.00 C ATOM 0 H LEU A 78 3.105 -0.707 -15.960 1.00 0.00 H new ATOM 0 HA LEU A 78 5.288 -0.298 -14.204 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.438 0.104 -14.292 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.837 -0.687 -12.780 1.00 0.00 H new ATOM 0 HG LEU A 78 4.750 1.386 -13.139 1.00 0.00 H new ATOM 0 HD11 LEU A 78 3.288 3.365 -13.274 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.224 2.396 -14.765 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.892 2.307 -13.588 1.00 0.00 H new ATOM 0 HD21 LEU A 78 3.704 2.277 -11.096 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.323 1.179 -11.329 1.00 0.00 H new ATOM 0 HD23 LEU A 78 3.942 0.516 -11.001 1.00 0.00 H new ATOM 1266 N CYS A 79 3.629 -3.138 -13.913 1.00 0.00 N ATOM 1267 CA CYS A 79 3.689 -4.478 -13.343 1.00 0.00 C ATOM 1268 C CYS A 79 4.883 -5.246 -13.900 1.00 0.00 C ATOM 1269 O CYS A 79 5.399 -6.161 -13.261 1.00 0.00 O ATOM 1270 CB CYS A 79 2.390 -5.238 -13.631 1.00 0.00 C ATOM 1271 SG CYS A 79 2.535 -6.503 -14.917 1.00 0.00 S ATOM 0 H CYS A 79 2.845 -2.984 -14.547 1.00 0.00 H new ATOM 0 HA CYS A 79 3.810 -4.386 -12.264 1.00 0.00 H new ATOM 0 HB2 CYS A 79 2.048 -5.710 -12.710 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.622 -4.523 -13.927 1.00 0.00 H new ATOM 0 HG CYS A 79 2.870 -5.943 -16.041 1.00 0.00 H new ATOM 1277 N ASP A 80 5.319 -4.859 -15.097 1.00 0.00 N ATOM 1278 CA ASP A 80 6.456 -5.506 -15.741 1.00 0.00 C ATOM 1279 C ASP A 80 7.717 -5.342 -14.899 1.00 0.00 C ATOM 1280 O ASP A 80 8.658 -6.130 -15.009 1.00 0.00 O ATOM 1281 CB ASP A 80 6.682 -4.921 -17.137 1.00 0.00 C ATOM 1282 CG ASP A 80 7.018 -5.986 -18.163 1.00 0.00 C ATOM 1283 OD1 ASP A 80 6.084 -6.654 -18.654 1.00 0.00 O ATOM 1284 OD2 ASP A 80 8.217 -6.151 -18.476 1.00 0.00 O ATOM 0 H ASP A 80 4.902 -4.102 -15.638 1.00 0.00 H new ATOM 0 HA ASP A 80 6.234 -6.569 -15.834 1.00 0.00 H new ATOM 0 HB2 ASP A 80 5.787 -4.386 -17.453 1.00 0.00 H new ATOM 0 HB3 ASP A 80 7.491 -4.192 -17.096 1.00 0.00 H new ATOM 1289 N GLU A 81 7.725 -4.316 -14.055 1.00 0.00 N ATOM 1290 CA GLU A 81 8.864 -4.045 -13.187 1.00 0.00 C ATOM 1291 C GLU A 81 8.667 -4.694 -11.822 1.00 0.00 C ATOM 1292 O GLU A 81 9.490 -5.497 -11.381 1.00 0.00 O ATOM 1293 CB GLU A 81 9.057 -2.536 -13.020 1.00 0.00 C ATOM 1294 CG GLU A 81 9.480 -1.831 -14.298 1.00 0.00 C ATOM 1295 CD GLU A 81 10.726 -0.988 -14.112 1.00 0.00 C ATOM 1296 OE1 GLU A 81 10.591 0.197 -13.739 1.00 0.00 O ATOM 1297 OE2 GLU A 81 11.836 -1.513 -14.337 1.00 0.00 O ATOM 0 H GLU A 81 6.953 -3.657 -13.954 1.00 0.00 H new ATOM 0 HA GLU A 81 9.754 -4.470 -13.651 1.00 0.00 H new ATOM 0 HB2 GLU A 81 8.125 -2.096 -12.664 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.808 -2.357 -12.251 1.00 0.00 H new ATOM 0 HG2 GLU A 81 9.660 -2.573 -15.076 1.00 0.00 H new ATOM 0 HG3 GLU A 81 8.665 -1.197 -14.646 1.00 0.00 H new ATOM 1304 N SER A 82 7.573 -4.336 -11.158 1.00 0.00 N ATOM 1305 CA SER A 82 7.261 -4.877 -9.842 1.00 0.00 C ATOM 1306 C SER A 82 7.163 -6.398 -9.872 1.00 0.00 C ATOM 1307 O SER A 82 6.529 -6.973 -10.758 1.00 0.00 O ATOM 1308 CB SER A 82 5.952 -4.283 -9.326 1.00 0.00 C ATOM 1309 OG SER A 82 4.858 -5.140 -9.603 1.00 0.00 O ATOM 0 H SER A 82 6.886 -3.671 -11.512 1.00 0.00 H new ATOM 0 HA SER A 82 8.074 -4.604 -9.169 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.024 -4.116 -8.251 1.00 0.00 H new ATOM 0 HB3 SER A 82 5.783 -3.311 -9.789 1.00 0.00 H new ATOM 0 HG SER A 82 4.857 -5.372 -10.555 1.00 0.00 H new ATOM 1315 N ASP A 83 7.788 -7.041 -8.892 1.00 0.00 N ATOM 1316 CA ASP A 83 7.770 -8.495 -8.795 1.00 0.00 C ATOM 1317 C ASP A 83 6.642 -8.957 -7.878 1.00 0.00 C ATOM 1318 O ASP A 83 6.109 -10.054 -8.037 1.00 0.00 O ATOM 1319 CB ASP A 83 9.112 -9.010 -8.272 1.00 0.00 C ATOM 1320 CG ASP A 83 9.687 -10.108 -9.144 1.00 0.00 C ATOM 1321 OD1 ASP A 83 9.037 -11.167 -9.269 1.00 0.00 O ATOM 1322 OD2 ASP A 83 10.787 -9.910 -9.700 1.00 0.00 O ATOM 0 H ASP A 83 8.314 -6.577 -8.152 1.00 0.00 H new ATOM 0 HA ASP A 83 7.599 -8.902 -9.792 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.820 -8.183 -8.219 1.00 0.00 H new ATOM 0 HB3 ASP A 83 8.984 -9.385 -7.257 1.00 0.00 H new ATOM 1327 N PHE A 84 6.284 -8.107 -6.920 1.00 0.00 N ATOM 1328 CA PHE A 84 5.217 -8.420 -5.976 1.00 0.00 C ATOM 1329 C PHE A 84 4.090 -7.399 -6.077 1.00 0.00 C ATOM 1330 O PHE A 84 4.299 -6.206 -5.852 1.00 0.00 O ATOM 1331 CB PHE A 84 5.767 -8.456 -4.548 1.00 0.00 C ATOM 1332 CG PHE A 84 6.796 -9.528 -4.332 1.00 0.00 C ATOM 1333 CD1 PHE A 84 6.411 -10.823 -4.029 1.00 0.00 C ATOM 1334 CD2 PHE A 84 8.148 -9.239 -4.433 1.00 0.00 C ATOM 1335 CE1 PHE A 84 7.354 -11.812 -3.831 1.00 0.00 C ATOM 1336 CE2 PHE A 84 9.096 -10.224 -4.235 1.00 0.00 C ATOM 1337 CZ PHE A 84 8.699 -11.512 -3.933 1.00 0.00 C ATOM 0 H PHE A 84 6.718 -7.195 -6.777 1.00 0.00 H new ATOM 0 HA PHE A 84 4.816 -9.402 -6.226 1.00 0.00 H new ATOM 0 HB2 PHE A 84 6.207 -7.487 -4.312 1.00 0.00 H new ATOM 0 HB3 PHE A 84 4.942 -8.609 -3.853 1.00 0.00 H new ATOM 0 HD1 PHE A 84 5.361 -11.062 -3.947 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.463 -8.233 -4.669 1.00 0.00 H new ATOM 0 HE1 PHE A 84 7.041 -12.819 -3.597 1.00 0.00 H new ATOM 0 HE2 PHE A 84 10.147 -9.987 -4.316 1.00 0.00 H new ATOM 0 HZ PHE A 84 9.439 -12.283 -3.777 1.00 0.00 H new ATOM 1347 N LEU A 85 2.896 -7.872 -6.420 1.00 0.00 N ATOM 1348 CA LEU A 85 1.738 -6.994 -6.556 1.00 0.00 C ATOM 1349 C LEU A 85 0.839 -7.083 -5.327 1.00 0.00 C ATOM 1350 O LEU A 85 0.666 -8.154 -4.749 1.00 0.00 O ATOM 1351 CB LEU A 85 0.944 -7.360 -7.812 1.00 0.00 C ATOM 1352 CG LEU A 85 0.588 -6.182 -8.721 1.00 0.00 C ATOM 1353 CD1 LEU A 85 1.795 -5.752 -9.537 1.00 0.00 C ATOM 1354 CD2 LEU A 85 -0.574 -6.548 -9.633 1.00 0.00 C ATOM 0 H LEU A 85 2.705 -8.856 -6.609 1.00 0.00 H new ATOM 0 HA LEU A 85 2.097 -5.969 -6.645 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.520 -8.083 -8.389 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.022 -7.856 -7.509 1.00 0.00 H new ATOM 0 HG LEU A 85 0.284 -5.343 -8.095 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.521 -4.913 -10.177 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.599 -5.449 -8.866 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.132 -6.585 -10.154 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.815 -5.700 -10.273 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.296 -7.402 -10.251 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.444 -6.805 -9.029 1.00 0.00 H new ATOM 1366 N ILE A 86 0.269 -5.947 -4.934 1.00 0.00 N ATOM 1367 CA ILE A 86 -0.617 -5.892 -3.776 1.00 0.00 C ATOM 1368 C ILE A 86 -1.850 -5.045 -4.075 1.00 0.00 C ATOM 1369 O ILE A 86 -1.753 -3.998 -4.717 1.00 0.00 O ATOM 1370 CB ILE A 86 0.100 -5.321 -2.534 1.00 0.00 C ATOM 1371 CG1 ILE A 86 1.420 -6.054 -2.293 1.00 0.00 C ATOM 1372 CG2 ILE A 86 -0.797 -5.429 -1.310 1.00 0.00 C ATOM 1373 CD1 ILE A 86 2.596 -5.432 -3.012 1.00 0.00 C ATOM 0 H ILE A 86 0.406 -5.051 -5.402 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.921 -6.917 -3.562 1.00 0.00 H new ATOM 0 HB ILE A 86 0.318 -4.268 -2.714 1.00 0.00 H new ATOM 0 HG12 ILE A 86 1.627 -6.071 -1.223 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.315 -7.090 -2.614 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -0.278 -5.023 -0.442 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -1.715 -4.866 -1.481 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -1.042 -6.476 -1.129 1.00 0.00 H new ATOM 0 HD11 ILE A 86 3.499 -6.004 -2.796 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.411 -5.439 -4.086 1.00 0.00 H new ATOM 0 HD13 ILE A 86 2.727 -4.404 -2.673 1.00 0.00 H new ATOM 1385 N THR A 87 -3.008 -5.503 -3.611 1.00 0.00 N ATOM 1386 CA THR A 87 -4.259 -4.786 -3.832 1.00 0.00 C ATOM 1387 C THR A 87 -4.638 -3.945 -2.618 1.00 0.00 C ATOM 1388 O THR A 87 -4.899 -2.750 -2.744 1.00 0.00 O ATOM 1389 CB THR A 87 -5.415 -5.752 -4.151 1.00 0.00 C ATOM 1390 OG1 THR A 87 -4.994 -7.106 -3.947 1.00 0.00 O ATOM 1391 CG2 THR A 87 -5.887 -5.574 -5.587 1.00 0.00 C ATOM 0 H THR A 87 -3.106 -6.368 -3.079 1.00 0.00 H new ATOM 0 HA THR A 87 -4.095 -4.131 -4.688 1.00 0.00 H new ATOM 0 HB THR A 87 -6.244 -5.525 -3.481 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.602 -7.195 -3.053 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.704 -6.267 -5.790 1.00 0.00 H new ATOM 0 HG22 THR A 87 -6.234 -4.551 -5.732 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.061 -5.777 -6.269 1.00 0.00 H new ATOM 1399 N MET A 88 -4.669 -4.584 -1.445 1.00 0.00 N ATOM 1400 CA MET A 88 -5.018 -3.919 -0.189 1.00 0.00 C ATOM 1401 C MET A 88 -6.522 -3.690 -0.092 1.00 0.00 C ATOM 1402 O MET A 88 -7.129 -3.936 0.952 1.00 0.00 O ATOM 1403 CB MET A 88 -4.275 -2.587 -0.038 1.00 0.00 C ATOM 1404 CG MET A 88 -2.779 -2.692 -0.282 1.00 0.00 C ATOM 1405 SD MET A 88 -1.874 -1.250 0.312 1.00 0.00 S ATOM 1406 CE MET A 88 -1.735 -0.292 -1.195 1.00 0.00 C ATOM 0 H MET A 88 -4.453 -5.575 -1.341 1.00 0.00 H new ATOM 0 HA MET A 88 -4.711 -4.578 0.623 1.00 0.00 H new ATOM 0 HB2 MET A 88 -4.698 -1.864 -0.735 1.00 0.00 H new ATOM 0 HB3 MET A 88 -4.444 -2.198 0.966 1.00 0.00 H new ATOM 0 HG2 MET A 88 -2.396 -3.585 0.212 1.00 0.00 H new ATOM 0 HG3 MET A 88 -2.597 -2.816 -1.350 1.00 0.00 H new ATOM 0 HE1 MET A 88 -1.326 0.692 -0.964 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.074 -0.806 -1.893 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.721 -0.178 -1.646 1.00 0.00 H new ATOM 1416 N ASP A 89 -7.122 -3.235 -1.186 1.00 0.00 N ATOM 1417 CA ASP A 89 -8.556 -2.992 -1.221 1.00 0.00 C ATOM 1418 C ASP A 89 -9.291 -4.305 -1.457 1.00 0.00 C ATOM 1419 O ASP A 89 -8.776 -5.200 -2.128 1.00 0.00 O ATOM 1420 CB ASP A 89 -8.903 -1.986 -2.320 1.00 0.00 C ATOM 1421 CG ASP A 89 -7.980 -0.783 -2.319 1.00 0.00 C ATOM 1422 OD1 ASP A 89 -6.940 -0.832 -3.009 1.00 0.00 O ATOM 1423 OD2 ASP A 89 -8.298 0.210 -1.631 1.00 0.00 O ATOM 0 H ASP A 89 -6.637 -3.028 -2.059 1.00 0.00 H new ATOM 0 HA ASP A 89 -8.867 -2.573 -0.264 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -8.850 -2.480 -3.290 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.932 -1.651 -2.189 1.00 0.00 H new ATOM 1428 N ASN A 90 -10.483 -4.426 -0.890 1.00 0.00 N ATOM 1429 CA ASN A 90 -11.267 -5.648 -1.028 1.00 0.00 C ATOM 1430 C ASN A 90 -11.762 -5.846 -2.459 1.00 0.00 C ATOM 1431 O ASN A 90 -11.399 -6.817 -3.123 1.00 0.00 O ATOM 1432 CB ASN A 90 -12.456 -5.625 -0.065 1.00 0.00 C ATOM 1433 CG ASN A 90 -12.029 -5.777 1.381 1.00 0.00 C ATOM 1434 OD1 ASN A 90 -11.265 -4.967 1.903 1.00 0.00 O ATOM 1435 ND2 ASN A 90 -12.522 -6.821 2.036 1.00 0.00 N ATOM 0 H ASN A 90 -10.928 -3.697 -0.332 1.00 0.00 H new ATOM 0 HA ASN A 90 -10.614 -6.485 -0.781 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -12.999 -4.687 -0.184 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -13.146 -6.428 -0.324 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -12.270 -6.976 3.012 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -13.153 -7.468 1.563 1.00 0.00 H new ATOM 1442 N SER A 91 -12.607 -4.929 -2.922 1.00 0.00 N ATOM 1443 CA SER A 91 -13.170 -5.012 -4.269 1.00 0.00 C ATOM 1444 C SER A 91 -12.082 -5.008 -5.340 1.00 0.00 C ATOM 1445 O SER A 91 -12.246 -5.610 -6.401 1.00 0.00 O ATOM 1446 CB SER A 91 -14.139 -3.853 -4.510 1.00 0.00 C ATOM 1447 OG SER A 91 -14.094 -2.918 -3.447 1.00 0.00 O ATOM 0 H SER A 91 -12.918 -4.119 -2.385 1.00 0.00 H new ATOM 0 HA SER A 91 -13.707 -5.958 -4.341 1.00 0.00 H new ATOM 0 HB2 SER A 91 -13.889 -3.355 -5.447 1.00 0.00 H new ATOM 0 HB3 SER A 91 -15.153 -4.239 -4.615 1.00 0.00 H new ATOM 0 HG SER A 91 -14.722 -2.187 -3.627 1.00 0.00 H new ATOM 1453 N ASN A 92 -10.978 -4.322 -5.067 1.00 0.00 N ATOM 1454 CA ASN A 92 -9.876 -4.239 -6.022 1.00 0.00 C ATOM 1455 C ASN A 92 -9.315 -5.620 -6.352 1.00 0.00 C ATOM 1456 O ASN A 92 -8.722 -5.818 -7.412 1.00 0.00 O ATOM 1457 CB ASN A 92 -8.768 -3.339 -5.480 1.00 0.00 C ATOM 1458 CG ASN A 92 -8.957 -1.888 -5.885 1.00 0.00 C ATOM 1459 OD1 ASN A 92 -10.003 -1.512 -6.415 1.00 0.00 O ATOM 1460 ND2 ASN A 92 -7.945 -1.065 -5.639 1.00 0.00 N ATOM 0 H ASN A 92 -10.821 -3.816 -4.195 1.00 0.00 H new ATOM 0 HA ASN A 92 -10.269 -3.807 -6.942 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -8.744 -3.411 -4.393 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -7.804 -3.693 -5.844 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -8.016 -0.079 -5.891 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -7.096 -1.418 -5.198 1.00 0.00 H new ATOM 1467 N PHE A 93 -9.505 -6.572 -5.444 1.00 0.00 N ATOM 1468 CA PHE A 93 -9.015 -7.932 -5.648 1.00 0.00 C ATOM 1469 C PHE A 93 -9.717 -8.591 -6.832 1.00 0.00 C ATOM 1470 O PHE A 93 -9.067 -9.061 -7.767 1.00 0.00 O ATOM 1471 CB PHE A 93 -9.226 -8.770 -4.384 1.00 0.00 C ATOM 1472 CG PHE A 93 -8.626 -10.147 -4.462 1.00 0.00 C ATOM 1473 CD1 PHE A 93 -7.300 -10.324 -4.826 1.00 0.00 C ATOM 1474 CD2 PHE A 93 -9.391 -11.266 -4.169 1.00 0.00 C ATOM 1475 CE1 PHE A 93 -6.750 -11.591 -4.898 1.00 0.00 C ATOM 1476 CE2 PHE A 93 -8.845 -12.534 -4.239 1.00 0.00 C ATOM 1477 CZ PHE A 93 -7.523 -12.695 -4.603 1.00 0.00 C ATOM 0 H PHE A 93 -9.994 -6.428 -4.561 1.00 0.00 H new ATOM 0 HA PHE A 93 -7.948 -7.878 -5.864 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -8.794 -8.243 -3.533 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -10.295 -8.860 -4.193 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -6.690 -9.463 -5.056 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -10.425 -11.145 -3.883 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -5.716 -11.716 -5.185 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -9.452 -13.397 -4.009 1.00 0.00 H new ATOM 0 HZ PHE A 93 -7.094 -13.685 -4.657 1.00 0.00 H new ATOM 1487 N LYS A 94 -11.045 -8.620 -6.787 1.00 0.00 N ATOM 1488 CA LYS A 94 -11.831 -9.220 -7.858 1.00 0.00 C ATOM 1489 C LYS A 94 -11.705 -8.406 -9.142 1.00 0.00 C ATOM 1490 O LYS A 94 -11.821 -8.946 -10.243 1.00 0.00 O ATOM 1491 CB LYS A 94 -13.302 -9.321 -7.447 1.00 0.00 C ATOM 1492 CG LYS A 94 -13.927 -10.673 -7.748 1.00 0.00 C ATOM 1493 CD LYS A 94 -14.618 -10.679 -9.103 1.00 0.00 C ATOM 1494 CE LYS A 94 -16.111 -10.938 -8.970 1.00 0.00 C ATOM 1495 NZ LYS A 94 -16.691 -11.488 -10.227 1.00 0.00 N ATOM 0 H LYS A 94 -11.598 -8.235 -6.021 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.444 -10.222 -8.042 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -13.387 -9.121 -6.379 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -13.869 -8.545 -7.962 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.156 -11.444 -7.728 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -14.648 -10.923 -6.970 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -14.457 -9.721 -9.598 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -14.171 -11.445 -9.737 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -16.287 -11.637 -8.152 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -16.619 -10.009 -8.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -17.710 -11.651 -10.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -16.545 -10.810 -11.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -16.223 -12.387 -10.461 1.00 0.00 H new ATOM 1509 N ASN A 95 -11.468 -7.106 -8.992 1.00 0.00 N ATOM 1510 CA ASN A 95 -11.328 -6.215 -10.139 1.00 0.00 C ATOM 1511 C ASN A 95 -10.069 -6.540 -10.937 1.00 0.00 C ATOM 1512 O ASN A 95 -10.135 -6.794 -12.139 1.00 0.00 O ATOM 1513 CB ASN A 95 -11.288 -4.757 -9.678 1.00 0.00 C ATOM 1514 CG ASN A 95 -11.867 -3.809 -10.710 1.00 0.00 C ATOM 1515 OD1 ASN A 95 -12.975 -3.296 -10.546 1.00 0.00 O ATOM 1516 ND2 ASN A 95 -11.119 -3.571 -11.781 1.00 0.00 N ATOM 0 H ASN A 95 -11.369 -6.646 -8.087 1.00 0.00 H new ATOM 0 HA ASN A 95 -12.193 -6.363 -10.785 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -11.844 -4.658 -8.745 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -10.257 -4.474 -9.466 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -11.456 -2.941 -12.509 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -10.207 -4.018 -11.876 1.00 0.00 H new ATOM 1523 N VAL A 96 -8.924 -6.529 -10.262 1.00 0.00 N ATOM 1524 CA VAL A 96 -7.648 -6.819 -10.909 1.00 0.00 C ATOM 1525 C VAL A 96 -7.599 -8.256 -11.414 1.00 0.00 C ATOM 1526 O VAL A 96 -6.848 -8.573 -12.337 1.00 0.00 O ATOM 1527 CB VAL A 96 -6.464 -6.584 -9.952 1.00 0.00 C ATOM 1528 CG1 VAL A 96 -6.411 -5.130 -9.513 1.00 0.00 C ATOM 1529 CG2 VAL A 96 -6.554 -7.509 -8.747 1.00 0.00 C ATOM 0 H VAL A 96 -8.853 -6.322 -9.266 1.00 0.00 H new ATOM 0 HA VAL A 96 -7.563 -6.136 -11.755 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.542 -6.812 -10.486 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -5.568 -4.984 -8.838 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.290 -4.490 -10.387 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.337 -4.871 -8.999 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.708 -7.326 -8.084 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.483 -7.318 -8.210 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.535 -8.546 -9.082 1.00 0.00 H new ATOM 1539 N LEU A 97 -8.399 -9.122 -10.799 1.00 0.00 N ATOM 1540 CA LEU A 97 -8.444 -10.531 -11.182 1.00 0.00 C ATOM 1541 C LEU A 97 -8.748 -10.691 -12.671 1.00 0.00 C ATOM 1542 O LEU A 97 -8.156 -11.533 -13.347 1.00 0.00 O ATOM 1543 CB LEU A 97 -9.493 -11.273 -10.354 1.00 0.00 C ATOM 1544 CG LEU A 97 -8.961 -12.455 -9.543 1.00 0.00 C ATOM 1545 CD1 LEU A 97 -9.266 -12.268 -8.066 1.00 0.00 C ATOM 1546 CD2 LEU A 97 -9.555 -13.760 -10.054 1.00 0.00 C ATOM 0 H LEU A 97 -9.025 -8.874 -10.033 1.00 0.00 H new ATOM 0 HA LEU A 97 -7.462 -10.961 -10.986 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -9.962 -10.565 -9.671 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -10.274 -11.634 -11.024 1.00 0.00 H new ATOM 0 HG LEU A 97 -7.879 -12.500 -9.665 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -8.880 -13.119 -7.504 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -8.793 -11.353 -7.710 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -10.344 -12.198 -7.923 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -9.166 -14.592 -9.466 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -10.641 -13.726 -9.961 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -9.284 -13.898 -11.101 1.00 0.00 H new ATOM 1558 N LYS A 98 -9.676 -9.883 -13.175 1.00 0.00 N ATOM 1559 CA LYS A 98 -10.057 -9.942 -14.582 1.00 0.00 C ATOM 1560 C LYS A 98 -9.434 -8.792 -15.369 1.00 0.00 C ATOM 1561 O LYS A 98 -9.228 -8.896 -16.579 1.00 0.00 O ATOM 1562 CB LYS A 98 -11.581 -9.900 -14.723 1.00 0.00 C ATOM 1563 CG LYS A 98 -12.201 -11.249 -15.051 1.00 0.00 C ATOM 1564 CD LYS A 98 -13.720 -11.184 -15.039 1.00 0.00 C ATOM 1565 CE LYS A 98 -14.287 -11.141 -16.449 1.00 0.00 C ATOM 1566 NZ LYS A 98 -15.482 -10.258 -16.541 1.00 0.00 N ATOM 0 H LYS A 98 -10.177 -9.181 -12.631 1.00 0.00 H new ATOM 0 HA LYS A 98 -9.684 -10.881 -14.990 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -12.013 -9.528 -13.794 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -11.845 -9.189 -15.505 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -11.858 -11.579 -16.032 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -11.862 -11.991 -14.328 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -14.118 -12.051 -14.512 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -14.043 -10.300 -14.489 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -13.520 -10.787 -17.138 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -14.556 -12.150 -16.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -15.838 -10.256 -17.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -16.224 -10.610 -15.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -15.220 -9.290 -16.266 1.00 0.00 H new ATOM 1580 N ASN A 99 -9.142 -7.698 -14.675 1.00 0.00 N ATOM 1581 CA ASN A 99 -8.548 -6.523 -15.304 1.00 0.00 C ATOM 1582 C ASN A 99 -7.204 -6.858 -15.944 1.00 0.00 C ATOM 1583 O ASN A 99 -6.933 -6.466 -17.080 1.00 0.00 O ATOM 1584 CB ASN A 99 -8.368 -5.406 -14.275 1.00 0.00 C ATOM 1585 CG ASN A 99 -9.208 -4.186 -14.593 1.00 0.00 C ATOM 1586 OD1 ASN A 99 -8.711 -3.060 -14.604 1.00 0.00 O ATOM 1587 ND2 ASN A 99 -10.493 -4.404 -14.851 1.00 0.00 N ATOM 0 H ASN A 99 -9.307 -7.600 -13.673 1.00 0.00 H new ATOM 0 HA ASN A 99 -9.226 -6.186 -16.088 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -8.635 -5.780 -13.287 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -7.317 -5.119 -14.234 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -11.109 -3.621 -15.069 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -10.863 -5.354 -14.831 1.00 0.00 H new ATOM 1594 N PHE A 100 -6.365 -7.579 -15.208 1.00 0.00 N ATOM 1595 CA PHE A 100 -5.046 -7.958 -15.707 1.00 0.00 C ATOM 1596 C PHE A 100 -5.039 -9.401 -16.206 1.00 0.00 C ATOM 1597 O PHE A 100 -6.069 -10.074 -16.208 1.00 0.00 O ATOM 1598 CB PHE A 100 -3.994 -7.777 -14.612 1.00 0.00 C ATOM 1599 CG PHE A 100 -3.634 -6.339 -14.363 1.00 0.00 C ATOM 1600 CD1 PHE A 100 -4.371 -5.571 -13.477 1.00 0.00 C ATOM 1601 CD2 PHE A 100 -2.559 -5.757 -15.016 1.00 0.00 C ATOM 1602 CE1 PHE A 100 -4.043 -4.248 -13.246 1.00 0.00 C ATOM 1603 CE2 PHE A 100 -2.227 -4.436 -14.790 1.00 0.00 C ATOM 1604 CZ PHE A 100 -2.970 -3.680 -13.903 1.00 0.00 C ATOM 0 H PHE A 100 -6.573 -7.912 -14.267 1.00 0.00 H new ATOM 0 HA PHE A 100 -4.804 -7.306 -16.547 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -4.365 -8.217 -13.686 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -3.094 -8.327 -14.888 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -5.212 -6.011 -12.961 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.974 -6.343 -15.709 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -4.625 -3.660 -12.552 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -1.387 -3.994 -15.306 1.00 0.00 H new ATOM 0 HZ PHE A 100 -2.712 -2.647 -13.724 1.00 0.00 H new ATOM 1614 N THR A 101 -3.867 -9.865 -16.631 1.00 0.00 N ATOM 1615 CA THR A 101 -3.716 -11.224 -17.139 1.00 0.00 C ATOM 1616 C THR A 101 -3.774 -12.252 -16.014 1.00 0.00 C ATOM 1617 O THR A 101 -4.127 -11.930 -14.879 1.00 0.00 O ATOM 1618 CB THR A 101 -2.390 -11.394 -17.906 1.00 0.00 C ATOM 1619 OG1 THR A 101 -1.756 -10.122 -18.079 1.00 0.00 O ATOM 1620 CG2 THR A 101 -2.629 -12.035 -19.265 1.00 0.00 C ATOM 0 H THR A 101 -3.006 -9.318 -16.633 1.00 0.00 H new ATOM 0 HA THR A 101 -4.549 -11.395 -17.821 1.00 0.00 H new ATOM 0 HB THR A 101 -1.741 -12.047 -17.322 1.00 0.00 H new ATOM 0 HG1 THR A 101 -1.253 -9.894 -17.269 1.00 0.00 H new ATOM 0 HG21 THR A 101 -1.679 -12.145 -19.788 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.084 -13.016 -19.130 1.00 0.00 H new ATOM 0 HG23 THR A 101 -3.296 -11.404 -19.853 1.00 0.00 H new ATOM 1628 N ASN A 102 -3.427 -13.493 -16.343 1.00 0.00 N ATOM 1629 CA ASN A 102 -3.437 -14.588 -15.377 1.00 0.00 C ATOM 1630 C ASN A 102 -2.316 -14.446 -14.346 1.00 0.00 C ATOM 1631 O ASN A 102 -2.034 -15.382 -13.598 1.00 0.00 O ATOM 1632 CB ASN A 102 -3.309 -15.930 -16.099 1.00 0.00 C ATOM 1633 CG ASN A 102 -2.263 -15.902 -17.196 1.00 0.00 C ATOM 1634 OD1 ASN A 102 -1.335 -15.092 -17.165 1.00 0.00 O ATOM 1635 ND2 ASN A 102 -2.407 -16.788 -18.174 1.00 0.00 N ATOM 0 H ASN A 102 -3.133 -13.767 -17.280 1.00 0.00 H new ATOM 0 HA ASN A 102 -4.388 -14.548 -14.846 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -3.052 -16.705 -15.376 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -4.274 -16.201 -16.528 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -1.734 -16.816 -18.940 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -3.191 -17.441 -18.160 1.00 0.00 H new ATOM 1642 N THR A 103 -1.674 -13.282 -14.314 1.00 0.00 N ATOM 1643 CA THR A 103 -0.583 -13.039 -13.377 1.00 0.00 C ATOM 1644 C THR A 103 -1.105 -12.480 -12.057 1.00 0.00 C ATOM 1645 O THR A 103 -0.330 -12.056 -11.200 1.00 0.00 O ATOM 1646 CB THR A 103 0.457 -12.063 -13.962 1.00 0.00 C ATOM 1647 OG1 THR A 103 1.613 -12.010 -13.116 1.00 0.00 O ATOM 1648 CG2 THR A 103 -0.130 -10.667 -14.111 1.00 0.00 C ATOM 0 H THR A 103 -1.890 -12.494 -14.925 1.00 0.00 H new ATOM 0 HA THR A 103 -0.103 -14.001 -13.196 1.00 0.00 H new ATOM 0 HB THR A 103 0.744 -12.427 -14.949 1.00 0.00 H new ATOM 0 HG1 THR A 103 1.331 -11.991 -12.178 1.00 0.00 H new ATOM 0 HG21 THR A 103 0.624 -9.998 -14.526 1.00 0.00 H new ATOM 0 HG22 THR A 103 -0.990 -10.703 -14.780 1.00 0.00 H new ATOM 0 HG23 THR A 103 -0.445 -10.299 -13.135 1.00 0.00 H new ATOM 1656 N GLN A 104 -2.426 -12.489 -11.897 1.00 0.00 N ATOM 1657 CA GLN A 104 -3.055 -11.988 -10.679 1.00 0.00 C ATOM 1658 C GLN A 104 -2.743 -12.896 -9.492 1.00 0.00 C ATOM 1659 O GLN A 104 -3.054 -12.568 -8.348 1.00 0.00 O ATOM 1660 CB GLN A 104 -4.572 -11.878 -10.861 1.00 0.00 C ATOM 1661 CG GLN A 104 -5.169 -12.971 -11.734 1.00 0.00 C ATOM 1662 CD GLN A 104 -5.051 -14.348 -11.110 1.00 0.00 C ATOM 1663 OE1 GLN A 104 -4.045 -15.103 -11.535 1.00 0.00 O flip ATOM 1664 NE2 GLN A 104 -5.852 -14.726 -10.256 1.00 0.00 N flip ATOM 0 H GLN A 104 -3.081 -12.838 -12.596 1.00 0.00 H new ATOM 0 HA GLN A 104 -2.649 -10.997 -10.478 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -5.049 -11.908 -9.881 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -4.806 -10.908 -11.300 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -6.220 -12.749 -11.919 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -4.668 -12.971 -12.702 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -6.610 -14.111 -9.960 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -5.758 -15.654 -9.844 1.00 0.00 H new ATOM 1673 N ASN A 105 -2.128 -14.041 -9.773 1.00 0.00 N ATOM 1674 CA ASN A 105 -1.774 -14.998 -8.731 1.00 0.00 C ATOM 1675 C ASN A 105 -0.604 -14.487 -7.895 1.00 0.00 C ATOM 1676 O ASN A 105 -0.239 -15.093 -6.887 1.00 0.00 O ATOM 1677 CB ASN A 105 -1.422 -16.351 -9.353 1.00 0.00 C ATOM 1678 CG ASN A 105 -1.337 -17.460 -8.323 1.00 0.00 C ATOM 1679 OD1 ASN A 105 -0.249 -17.925 -7.983 1.00 0.00 O ATOM 1680 ND2 ASN A 105 -2.488 -17.892 -7.821 1.00 0.00 N ATOM 0 H ASN A 105 -1.864 -14.329 -10.715 1.00 0.00 H new ATOM 0 HA ASN A 105 -2.636 -15.120 -8.076 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -2.173 -16.610 -10.100 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -0.468 -16.270 -9.874 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -2.493 -18.638 -7.125 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -3.367 -17.478 -8.131 1.00 0.00 H new ATOM 1687 N LYS A 106 -0.020 -13.370 -8.319 1.00 0.00 N ATOM 1688 CA LYS A 106 1.108 -12.778 -7.607 1.00 0.00 C ATOM 1689 C LYS A 106 0.682 -11.517 -6.863 1.00 0.00 C ATOM 1690 O LYS A 106 1.511 -10.668 -6.528 1.00 0.00 O ATOM 1691 CB LYS A 106 2.239 -12.454 -8.585 1.00 0.00 C ATOM 1692 CG LYS A 106 3.226 -13.595 -8.772 1.00 0.00 C ATOM 1693 CD LYS A 106 4.531 -13.109 -9.384 1.00 0.00 C ATOM 1694 CE LYS A 106 5.315 -14.255 -10.002 1.00 0.00 C ATOM 1695 NZ LYS A 106 6.634 -13.805 -10.527 1.00 0.00 N ATOM 0 H LYS A 106 -0.309 -12.857 -9.152 1.00 0.00 H new ATOM 0 HA LYS A 106 1.466 -13.502 -6.876 1.00 0.00 H new ATOM 0 HB2 LYS A 106 1.809 -12.194 -9.552 1.00 0.00 H new ATOM 0 HB3 LYS A 106 2.776 -11.575 -8.229 1.00 0.00 H new ATOM 0 HG2 LYS A 106 3.427 -14.065 -7.809 1.00 0.00 H new ATOM 0 HG3 LYS A 106 2.784 -14.358 -9.413 1.00 0.00 H new ATOM 0 HD2 LYS A 106 4.320 -12.358 -10.146 1.00 0.00 H new ATOM 0 HD3 LYS A 106 5.136 -12.624 -8.618 1.00 0.00 H new ATOM 0 HE2 LYS A 106 5.468 -15.034 -9.256 1.00 0.00 H new ATOM 0 HE3 LYS A 106 4.734 -14.698 -10.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 7.138 -14.615 -10.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 6.488 -13.079 -11.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 7.199 -13.406 -9.750 1.00 0.00 H new ATOM 1709 N VAL A 107 -0.619 -11.403 -6.609 1.00 0.00 N ATOM 1710 CA VAL A 107 -1.162 -10.249 -5.904 1.00 0.00 C ATOM 1711 C VAL A 107 -1.624 -10.629 -4.500 1.00 0.00 C ATOM 1712 O VAL A 107 -2.242 -11.675 -4.301 1.00 0.00 O ATOM 1713 CB VAL A 107 -2.345 -9.628 -6.671 1.00 0.00 C ATOM 1714 CG1 VAL A 107 -2.705 -8.269 -6.090 1.00 0.00 C ATOM 1715 CG2 VAL A 107 -2.020 -9.513 -8.153 1.00 0.00 C ATOM 0 H VAL A 107 -1.316 -12.097 -6.882 1.00 0.00 H new ATOM 0 HA VAL A 107 -0.359 -9.515 -5.833 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.209 -10.284 -6.562 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -3.543 -7.846 -6.645 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.984 -8.384 -5.043 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -1.846 -7.602 -6.166 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -2.867 -9.072 -8.678 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -1.142 -8.880 -8.285 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -1.817 -10.504 -8.559 1.00 0.00 H new ATOM 1725 N LEU A 108 -1.323 -9.771 -3.530 1.00 0.00 N ATOM 1726 CA LEU A 108 -1.707 -10.014 -2.145 1.00 0.00 C ATOM 1727 C LEU A 108 -2.908 -9.156 -1.758 1.00 0.00 C ATOM 1728 O LEU A 108 -3.143 -8.103 -2.346 1.00 0.00 O ATOM 1729 CB LEU A 108 -0.533 -9.723 -1.205 1.00 0.00 C ATOM 1730 CG LEU A 108 0.856 -9.936 -1.813 1.00 0.00 C ATOM 1731 CD1 LEU A 108 1.919 -9.254 -0.967 1.00 0.00 C ATOM 1732 CD2 LEU A 108 1.153 -11.423 -1.951 1.00 0.00 C ATOM 0 H LEU A 108 -0.813 -8.900 -3.679 1.00 0.00 H new ATOM 0 HA LEU A 108 -1.984 -11.064 -2.050 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -0.609 -8.690 -0.864 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -0.628 -10.358 -0.324 1.00 0.00 H new ATOM 0 HG LEU A 108 0.871 -9.488 -2.807 1.00 0.00 H new ATOM 0 HD11 LEU A 108 2.900 -9.416 -1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.715 -8.184 -0.919 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.906 -9.672 0.040 1.00 0.00 H new ATOM 0 HD21 LEU A 108 2.144 -11.557 -2.385 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.120 -11.893 -0.968 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.408 -11.884 -2.599 1.00 0.00 H new ATOM 1744 N LYS A 109 -3.667 -9.614 -0.768 1.00 0.00 N ATOM 1745 CA LYS A 109 -4.845 -8.889 -0.308 1.00 0.00 C ATOM 1746 C LYS A 109 -4.742 -8.572 1.180 1.00 0.00 C ATOM 1747 O LYS A 109 -4.669 -9.476 2.014 1.00 0.00 O ATOM 1748 CB LYS A 109 -6.114 -9.700 -0.583 1.00 0.00 C ATOM 1749 CG LYS A 109 -5.905 -10.862 -1.542 1.00 0.00 C ATOM 1750 CD LYS A 109 -6.803 -12.039 -1.201 1.00 0.00 C ATOM 1751 CE LYS A 109 -6.055 -13.102 -0.413 1.00 0.00 C ATOM 1752 NZ LYS A 109 -5.025 -13.788 -1.242 1.00 0.00 N ATOM 0 H LYS A 109 -3.487 -10.485 -0.269 1.00 0.00 H new ATOM 0 HA LYS A 109 -4.899 -7.950 -0.859 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -6.499 -10.085 0.361 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -6.876 -9.037 -0.992 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -6.107 -10.533 -2.562 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -4.862 -11.178 -1.509 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -7.658 -11.690 -0.622 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -7.197 -12.475 -2.119 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -5.577 -12.643 0.452 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -6.764 -13.838 -0.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -4.805 -14.715 -0.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -5.388 -13.920 -2.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -4.162 -13.209 -1.273 1.00 0.00 H new ATOM 1766 N ILE A 110 -4.746 -7.284 1.510 1.00 0.00 N ATOM 1767 CA ILE A 110 -4.660 -6.850 2.898 1.00 0.00 C ATOM 1768 C ILE A 110 -5.886 -7.310 3.682 1.00 0.00 C ATOM 1769 O ILE A 110 -5.799 -7.600 4.876 1.00 0.00 O ATOM 1770 CB ILE A 110 -4.524 -5.314 2.996 1.00 0.00 C ATOM 1771 CG1 ILE A 110 -3.135 -4.875 2.522 1.00 0.00 C ATOM 1772 CG2 ILE A 110 -4.782 -4.831 4.419 1.00 0.00 C ATOM 1773 CD1 ILE A 110 -2.003 -5.362 3.404 1.00 0.00 C ATOM 0 H ILE A 110 -4.808 -6.523 0.834 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.769 -7.304 3.330 1.00 0.00 H new ATOM 0 HB ILE A 110 -5.275 -4.862 2.348 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -2.976 -5.241 1.508 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -3.105 -3.786 2.477 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -4.680 -3.747 4.459 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -5.791 -5.112 4.721 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -4.060 -5.289 5.095 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -1.052 -5.011 3.003 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -2.136 -4.975 4.414 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -2.005 -6.452 3.430 1.00 0.00 H new ATOM 1785 N THR A 111 -7.024 -7.384 2.998 1.00 0.00 N ATOM 1786 CA THR A 111 -8.264 -7.818 3.630 1.00 0.00 C ATOM 1787 C THR A 111 -8.112 -9.221 4.205 1.00 0.00 C ATOM 1788 O THR A 111 -8.743 -9.565 5.206 1.00 0.00 O ATOM 1789 CB THR A 111 -9.445 -7.803 2.640 1.00 0.00 C ATOM 1790 OG1 THR A 111 -10.517 -8.610 3.143 1.00 0.00 O ATOM 1791 CG2 THR A 111 -9.019 -8.317 1.272 1.00 0.00 C ATOM 0 H THR A 111 -7.112 -7.150 2.009 1.00 0.00 H new ATOM 0 HA THR A 111 -8.476 -7.113 4.434 1.00 0.00 H new ATOM 0 HB THR A 111 -9.782 -6.772 2.533 1.00 0.00 H new ATOM 0 HG1 THR A 111 -11.021 -8.989 2.393 1.00 0.00 H new ATOM 0 HG21 THR A 111 -9.872 -8.295 0.593 1.00 0.00 H new ATOM 0 HG22 THR A 111 -8.225 -7.684 0.877 1.00 0.00 H new ATOM 0 HG23 THR A 111 -8.655 -9.340 1.365 1.00 0.00 H new ATOM 1799 N ASP A 112 -7.263 -10.024 3.571 1.00 0.00 N ATOM 1800 CA ASP A 112 -7.017 -11.387 4.024 1.00 0.00 C ATOM 1801 C ASP A 112 -6.022 -11.395 5.178 1.00 0.00 C ATOM 1802 O ASP A 112 -6.037 -12.294 6.018 1.00 0.00 O ATOM 1803 CB ASP A 112 -6.487 -12.244 2.873 1.00 0.00 C ATOM 1804 CG ASP A 112 -6.762 -13.721 3.077 1.00 0.00 C ATOM 1805 OD1 ASP A 112 -7.879 -14.060 3.522 1.00 0.00 O ATOM 1806 OD2 ASP A 112 -5.862 -14.538 2.792 1.00 0.00 O ATOM 0 H ASP A 112 -6.734 -9.753 2.742 1.00 0.00 H new ATOM 0 HA ASP A 112 -7.961 -11.807 4.372 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -6.946 -11.917 1.940 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.413 -12.088 2.772 1.00 0.00 H new ATOM 1811 N PHE A 113 -5.161 -10.383 5.211 1.00 0.00 N ATOM 1812 CA PHE A 113 -4.159 -10.266 6.264 1.00 0.00 C ATOM 1813 C PHE A 113 -4.695 -9.434 7.423 1.00 0.00 C ATOM 1814 O PHE A 113 -3.990 -9.183 8.400 1.00 0.00 O ATOM 1815 CB PHE A 113 -2.875 -9.639 5.714 1.00 0.00 C ATOM 1816 CG PHE A 113 -2.214 -10.457 4.639 1.00 0.00 C ATOM 1817 CD1 PHE A 113 -1.903 -11.791 4.855 1.00 0.00 C ATOM 1818 CD2 PHE A 113 -1.902 -9.892 3.414 1.00 0.00 C ATOM 1819 CE1 PHE A 113 -1.294 -12.544 3.869 1.00 0.00 C ATOM 1820 CE2 PHE A 113 -1.293 -10.639 2.424 1.00 0.00 C ATOM 1821 CZ PHE A 113 -0.990 -11.967 2.651 1.00 0.00 C ATOM 0 H PHE A 113 -5.137 -9.632 4.521 1.00 0.00 H new ATOM 0 HA PHE A 113 -3.930 -11.267 6.631 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -3.106 -8.651 5.316 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -2.171 -9.496 6.534 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -2.139 -12.247 5.805 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -2.138 -8.854 3.230 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -1.056 -13.582 4.050 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -1.054 -10.185 1.474 1.00 0.00 H new ATOM 0 HZ PHE A 113 -0.516 -12.554 1.878 1.00 0.00 H new ATOM 1831 N SER A 114 -5.951 -9.012 7.306 1.00 0.00 N ATOM 1832 CA SER A 114 -6.590 -8.212 8.342 1.00 0.00 C ATOM 1833 C SER A 114 -7.535 -9.074 9.181 1.00 0.00 C ATOM 1834 O SER A 114 -8.514 -9.618 8.667 1.00 0.00 O ATOM 1835 CB SER A 114 -7.354 -7.041 7.717 1.00 0.00 C ATOM 1836 OG SER A 114 -8.718 -7.364 7.508 1.00 0.00 O ATOM 0 H SER A 114 -6.546 -9.212 6.502 1.00 0.00 H new ATOM 0 HA SER A 114 -5.814 -7.813 8.995 1.00 0.00 H new ATOM 0 HB2 SER A 114 -7.281 -6.169 8.367 1.00 0.00 H new ATOM 0 HB3 SER A 114 -6.893 -6.770 6.767 1.00 0.00 H new ATOM 0 HG SER A 114 -8.832 -8.337 7.539 1.00 0.00 H new ATOM 1842 N PRO A 115 -7.245 -9.226 10.487 1.00 0.00 N ATOM 1843 CA PRO A 115 -8.065 -10.040 11.390 1.00 0.00 C ATOM 1844 C PRO A 115 -9.438 -9.416 11.655 1.00 0.00 C ATOM 1845 O PRO A 115 -10.329 -9.481 10.807 1.00 0.00 O ATOM 1846 CB PRO A 115 -7.235 -10.107 12.685 1.00 0.00 C ATOM 1847 CG PRO A 115 -5.883 -9.588 12.324 1.00 0.00 C ATOM 1848 CD PRO A 115 -6.094 -8.638 11.184 1.00 0.00 C ATOM 0 HA PRO A 115 -8.280 -11.020 10.965 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -7.688 -9.505 13.472 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -7.175 -11.129 13.060 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -5.420 -9.083 13.172 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -5.217 -10.402 12.035 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -6.304 -7.627 11.532 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -5.217 -8.577 10.539 1.00 0.00 H new ATOM 1856 N SER A 116 -9.606 -8.817 12.833 1.00 0.00 N ATOM 1857 CA SER A 116 -10.870 -8.190 13.203 1.00 0.00 C ATOM 1858 C SER A 116 -10.889 -6.718 12.804 1.00 0.00 C ATOM 1859 O SER A 116 -11.615 -5.915 13.392 1.00 0.00 O ATOM 1860 CB SER A 116 -11.110 -8.330 14.708 1.00 0.00 C ATOM 1861 OG SER A 116 -12.492 -8.260 15.014 1.00 0.00 O ATOM 0 H SER A 116 -8.880 -8.754 13.547 1.00 0.00 H new ATOM 0 HA SER A 116 -11.670 -8.699 12.666 1.00 0.00 H new ATOM 0 HB2 SER A 116 -10.705 -9.280 15.057 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.577 -7.542 15.239 1.00 0.00 H new ATOM 0 HG SER A 116 -12.866 -7.429 14.652 1.00 0.00 H new ATOM 1867 N LEU A 117 -10.084 -6.369 11.806 1.00 0.00 N ATOM 1868 CA LEU A 117 -10.003 -4.991 11.335 1.00 0.00 C ATOM 1869 C LEU A 117 -11.278 -4.587 10.600 1.00 0.00 C ATOM 1870 O LEU A 117 -11.801 -3.493 10.813 1.00 0.00 O ATOM 1871 CB LEU A 117 -8.794 -4.813 10.411 1.00 0.00 C ATOM 1872 CG LEU A 117 -7.507 -4.346 11.097 1.00 0.00 C ATOM 1873 CD1 LEU A 117 -6.418 -4.091 10.067 1.00 0.00 C ATOM 1874 CD2 LEU A 117 -7.761 -3.093 11.923 1.00 0.00 C ATOM 0 H LEU A 117 -9.478 -7.021 11.308 1.00 0.00 H new ATOM 0 HA LEU A 117 -9.887 -4.346 12.206 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -8.596 -5.762 9.912 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.054 -4.093 9.635 1.00 0.00 H new ATOM 0 HG LEU A 117 -7.172 -5.136 11.768 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -5.510 -3.760 10.572 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -6.213 -5.010 9.519 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -6.749 -3.320 9.371 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -6.834 -2.779 12.402 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -8.122 -2.296 11.273 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -8.509 -3.306 12.687 1.00 0.00 H new ATOM 1886 N ASN A 118 -11.769 -5.473 9.735 1.00 0.00 N ATOM 1887 CA ASN A 118 -12.981 -5.200 8.968 1.00 0.00 C ATOM 1888 C ASN A 118 -12.885 -3.839 8.287 1.00 0.00 C ATOM 1889 O ASN A 118 -13.506 -2.870 8.724 1.00 0.00 O ATOM 1890 CB ASN A 118 -14.209 -5.244 9.879 1.00 0.00 C ATOM 1891 CG ASN A 118 -15.504 -5.366 9.101 1.00 0.00 C ATOM 1892 OD1 ASN A 118 -16.425 -4.567 9.275 1.00 0.00 O ATOM 1893 ND2 ASN A 118 -15.583 -6.371 8.237 1.00 0.00 N ATOM 0 H ASN A 118 -11.347 -6.383 9.549 1.00 0.00 H new ATOM 0 HA ASN A 118 -13.084 -5.969 8.202 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -14.119 -6.087 10.564 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -14.238 -4.340 10.488 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -16.431 -6.504 7.686 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -14.796 -7.010 8.124 1.00 0.00 H new ATOM 1900 N TYR A 119 -12.088 -3.766 7.227 1.00 0.00 N ATOM 1901 CA TYR A 119 -11.897 -2.516 6.503 1.00 0.00 C ATOM 1902 C TYR A 119 -12.096 -2.709 4.998 1.00 0.00 C ATOM 1903 O TYR A 119 -11.810 -3.774 4.453 1.00 0.00 O ATOM 1904 CB TYR A 119 -10.506 -1.950 6.826 1.00 0.00 C ATOM 1905 CG TYR A 119 -9.606 -1.719 5.629 1.00 0.00 C ATOM 1906 CD1 TYR A 119 -8.873 -2.761 5.067 1.00 0.00 C ATOM 1907 CD2 TYR A 119 -9.479 -0.454 5.074 1.00 0.00 C ATOM 1908 CE1 TYR A 119 -8.040 -2.543 3.985 1.00 0.00 C ATOM 1909 CE2 TYR A 119 -8.652 -0.229 3.992 1.00 0.00 C ATOM 1910 CZ TYR A 119 -7.933 -1.276 3.451 1.00 0.00 C ATOM 1911 OH TYR A 119 -7.106 -1.055 2.374 1.00 0.00 O ATOM 0 H TYR A 119 -11.565 -4.557 6.851 1.00 0.00 H new ATOM 0 HA TYR A 119 -12.650 -1.797 6.826 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.630 -1.004 7.354 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -10.004 -2.634 7.511 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -8.956 -3.754 5.482 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -10.037 0.369 5.496 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -7.476 -3.361 3.560 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -8.568 0.762 3.570 1.00 0.00 H new ATOM 0 HH TYR A 119 -7.054 -1.868 1.829 1.00 0.00 H new ATOM 1921 N ASP A 120 -12.595 -1.664 4.340 1.00 0.00 N ATOM 1922 CA ASP A 120 -12.847 -1.701 2.902 1.00 0.00 C ATOM 1923 C ASP A 120 -11.641 -1.181 2.127 1.00 0.00 C ATOM 1924 O ASP A 120 -10.535 -1.693 2.271 1.00 0.00 O ATOM 1925 CB ASP A 120 -14.098 -0.882 2.567 1.00 0.00 C ATOM 1926 CG ASP A 120 -14.992 -0.664 3.773 1.00 0.00 C ATOM 1927 OD1 ASP A 120 -15.586 -1.649 4.257 1.00 0.00 O ATOM 1928 OD2 ASP A 120 -15.098 0.494 4.232 1.00 0.00 O ATOM 0 H ASP A 120 -12.834 -0.777 4.784 1.00 0.00 H new ATOM 0 HA ASP A 120 -13.016 -2.736 2.606 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -13.798 0.085 2.162 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -14.664 -1.392 1.787 1.00 0.00 H new ATOM 1933 N GLU A 121 -11.864 -0.167 1.305 1.00 0.00 N ATOM 1934 CA GLU A 121 -10.796 0.426 0.506 1.00 0.00 C ATOM 1935 C GLU A 121 -10.309 1.725 1.148 1.00 0.00 C ATOM 1936 O GLU A 121 -10.999 2.740 1.097 1.00 0.00 O ATOM 1937 CB GLU A 121 -11.281 0.693 -0.921 1.00 0.00 C ATOM 1938 CG GLU A 121 -12.154 -0.416 -1.484 1.00 0.00 C ATOM 1939 CD GLU A 121 -13.625 -0.215 -1.177 1.00 0.00 C ATOM 1940 OE1 GLU A 121 -14.034 0.947 -0.966 1.00 0.00 O ATOM 1941 OE2 GLU A 121 -14.369 -1.218 -1.147 1.00 0.00 O ATOM 0 H GLU A 121 -12.778 0.266 1.172 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.965 -0.278 0.466 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -11.841 1.628 -0.937 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -10.416 0.828 -1.570 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -12.016 -0.468 -2.564 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -11.829 -1.372 -1.074 1.00 0.00 H new ATOM 1948 N VAL A 122 -9.120 1.661 1.756 1.00 0.00 N ATOM 1949 CA VAL A 122 -8.493 2.801 2.439 1.00 0.00 C ATOM 1950 C VAL A 122 -9.415 3.427 3.499 1.00 0.00 C ATOM 1951 O VAL A 122 -10.606 3.634 3.272 1.00 0.00 O ATOM 1952 CB VAL A 122 -7.985 3.878 1.451 1.00 0.00 C ATOM 1953 CG1 VAL A 122 -7.248 3.229 0.290 1.00 0.00 C ATOM 1954 CG2 VAL A 122 -9.114 4.752 0.941 1.00 0.00 C ATOM 0 H VAL A 122 -8.559 0.809 1.789 1.00 0.00 H new ATOM 0 HA VAL A 122 -7.624 2.393 2.955 1.00 0.00 H new ATOM 0 HB VAL A 122 -7.293 4.521 1.994 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -6.897 4.001 -0.395 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -6.395 2.666 0.669 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -7.922 2.554 -0.238 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -8.715 5.495 0.250 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -9.848 4.134 0.425 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -9.591 5.257 1.781 1.00 0.00 H new ATOM 1964 N PRO A 123 -8.865 3.705 4.696 1.00 0.00 N ATOM 1965 CA PRO A 123 -9.619 4.274 5.826 1.00 0.00 C ATOM 1966 C PRO A 123 -10.021 5.739 5.630 1.00 0.00 C ATOM 1967 O PRO A 123 -10.456 6.132 4.546 1.00 0.00 O ATOM 1968 CB PRO A 123 -8.648 4.146 7.010 1.00 0.00 C ATOM 1969 CG PRO A 123 -7.552 3.250 6.541 1.00 0.00 C ATOM 1970 CD PRO A 123 -7.466 3.454 5.062 1.00 0.00 C ATOM 0 HA PRO A 123 -10.566 3.751 5.960 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -8.258 5.121 7.303 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -9.149 3.727 7.883 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -6.608 3.499 7.026 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -7.768 2.209 6.781 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -6.822 4.295 4.805 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -7.064 2.577 4.554 1.00 0.00 H new ATOM 1978 N ASP A 124 -9.891 6.530 6.707 1.00 0.00 N ATOM 1979 CA ASP A 124 -10.250 7.949 6.702 1.00 0.00 C ATOM 1980 C ASP A 124 -11.772 8.118 6.754 1.00 0.00 C ATOM 1981 O ASP A 124 -12.514 7.287 6.235 1.00 0.00 O ATOM 1982 CB ASP A 124 -9.661 8.663 5.478 1.00 0.00 C ATOM 1983 CG ASP A 124 -10.703 9.418 4.679 1.00 0.00 C ATOM 1984 OD1 ASP A 124 -11.516 8.760 3.998 1.00 0.00 O ATOM 1985 OD2 ASP A 124 -10.705 10.665 4.733 1.00 0.00 O ATOM 0 H ASP A 124 -9.534 6.200 7.603 1.00 0.00 H new ATOM 0 HA ASP A 124 -9.823 8.410 7.593 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -8.888 9.358 5.806 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -9.177 7.929 4.833 1.00 0.00 H new ATOM 1990 N PRO A 125 -12.251 9.196 7.402 1.00 0.00 N ATOM 1991 CA PRO A 125 -13.689 9.470 7.550 1.00 0.00 C ATOM 1992 C PRO A 125 -14.461 9.445 6.232 1.00 0.00 C ATOM 1993 O PRO A 125 -15.648 9.115 6.209 1.00 0.00 O ATOM 1994 CB PRO A 125 -13.721 10.879 8.148 1.00 0.00 C ATOM 1995 CG PRO A 125 -12.421 11.019 8.861 1.00 0.00 C ATOM 1996 CD PRO A 125 -11.424 10.224 8.065 1.00 0.00 C ATOM 0 HA PRO A 125 -14.170 8.705 8.160 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -13.830 11.636 7.371 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -14.562 11.000 8.831 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -12.123 12.065 8.926 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -12.493 10.644 9.882 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -10.901 10.847 7.340 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -10.665 9.776 8.706 1.00 0.00 H new ATOM 2004 N TRP A 126 -13.798 9.808 5.141 1.00 0.00 N ATOM 2005 CA TRP A 126 -14.443 9.839 3.832 1.00 0.00 C ATOM 2006 C TRP A 126 -14.823 8.434 3.356 1.00 0.00 C ATOM 2007 O TRP A 126 -15.685 8.279 2.490 1.00 0.00 O ATOM 2008 CB TRP A 126 -13.519 10.521 2.813 1.00 0.00 C ATOM 2009 CG TRP A 126 -13.990 10.421 1.392 1.00 0.00 C ATOM 2010 CD1 TRP A 126 -13.726 9.411 0.513 1.00 0.00 C ATOM 2011 CD2 TRP A 126 -14.799 11.368 0.683 1.00 0.00 C ATOM 2012 NE1 TRP A 126 -14.322 9.668 -0.696 1.00 0.00 N ATOM 2013 CE2 TRP A 126 -14.986 10.862 -0.618 1.00 0.00 C ATOM 2014 CE3 TRP A 126 -15.385 12.592 1.020 1.00 0.00 C ATOM 2015 CZ2 TRP A 126 -15.732 11.536 -1.579 1.00 0.00 C ATOM 2016 CZ3 TRP A 126 -16.127 13.261 0.064 1.00 0.00 C ATOM 2017 CH2 TRP A 126 -16.294 12.732 -1.223 1.00 0.00 C ATOM 0 H TRP A 126 -12.816 10.085 5.135 1.00 0.00 H new ATOM 0 HA TRP A 126 -15.366 10.412 3.922 1.00 0.00 H new ATOM 0 HB2 TRP A 126 -13.419 11.574 3.078 1.00 0.00 H new ATOM 0 HB3 TRP A 126 -12.526 10.078 2.887 1.00 0.00 H new ATOM 0 HD1 TRP A 126 -13.134 8.536 0.737 1.00 0.00 H new ATOM 0 HE1 TRP A 126 -14.277 9.067 -1.519 1.00 0.00 H new ATOM 0 HE3 TRP A 126 -15.260 13.007 2.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 -15.863 11.130 -2.571 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 -16.585 14.207 0.313 1.00 0.00 H new ATOM 0 HH2 TRP A 126 -16.878 13.279 -1.948 1.00 0.00 H new ATOM 2028 N TYR A 127 -14.173 7.414 3.911 1.00 0.00 N ATOM 2029 CA TYR A 127 -14.450 6.036 3.509 1.00 0.00 C ATOM 2030 C TYR A 127 -15.194 5.246 4.587 1.00 0.00 C ATOM 2031 O TYR A 127 -16.116 4.492 4.274 1.00 0.00 O ATOM 2032 CB TYR A 127 -13.148 5.328 3.129 1.00 0.00 C ATOM 2033 CG TYR A 127 -12.620 5.754 1.778 1.00 0.00 C ATOM 2034 CD1 TYR A 127 -13.099 5.174 0.611 1.00 0.00 C ATOM 2035 CD2 TYR A 127 -11.661 6.754 1.668 1.00 0.00 C ATOM 2036 CE1 TYR A 127 -12.639 5.577 -0.628 1.00 0.00 C ATOM 2037 CE2 TYR A 127 -11.193 7.160 0.431 1.00 0.00 C ATOM 2038 CZ TYR A 127 -11.687 6.570 -0.712 1.00 0.00 C ATOM 2039 OH TYR A 127 -11.227 6.973 -1.944 1.00 0.00 O ATOM 0 H TYR A 127 -13.459 7.512 4.632 1.00 0.00 H new ATOM 0 HA TYR A 127 -15.108 6.079 2.641 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -12.394 5.532 3.889 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -13.314 4.251 3.126 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -13.844 4.394 0.673 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -11.275 7.221 2.562 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -13.023 5.116 -1.526 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -10.444 7.935 0.362 1.00 0.00 H new ATOM 0 HH TYR A 127 -10.560 7.682 -1.828 1.00 0.00 H new ATOM 2049 N SER A 128 -14.798 5.402 5.849 1.00 0.00 N ATOM 2050 CA SER A 128 -15.453 4.673 6.933 1.00 0.00 C ATOM 2051 C SER A 128 -16.248 5.607 7.843 1.00 0.00 C ATOM 2052 O SER A 128 -17.456 5.432 8.010 1.00 0.00 O ATOM 2053 CB SER A 128 -14.427 3.892 7.754 1.00 0.00 C ATOM 2054 OG SER A 128 -13.520 3.200 6.911 1.00 0.00 O ATOM 0 H SER A 128 -14.039 6.017 6.143 1.00 0.00 H new ATOM 0 HA SER A 128 -16.152 3.973 6.476 1.00 0.00 H new ATOM 0 HB2 SER A 128 -13.878 4.576 8.401 1.00 0.00 H new ATOM 0 HB3 SER A 128 -14.940 3.182 8.403 1.00 0.00 H new ATOM 0 HG SER A 128 -12.657 3.664 6.909 1.00 0.00 H new ATOM 2060 N GLY A 129 -15.578 6.599 8.427 1.00 0.00 N ATOM 2061 CA GLY A 129 -16.276 7.526 9.302 1.00 0.00 C ATOM 2062 C GLY A 129 -15.358 8.342 10.196 1.00 0.00 C ATOM 2063 O GLY A 129 -15.536 9.554 10.318 1.00 0.00 O ATOM 0 H GLY A 129 -14.580 6.776 8.313 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -16.872 8.206 8.693 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -16.971 6.966 9.927 1.00 0.00 H new ATOM 2067 N ASN A 130 -14.390 7.691 10.838 1.00 0.00 N ATOM 2068 CA ASN A 130 -13.478 8.394 11.733 1.00 0.00 C ATOM 2069 C ASN A 130 -12.094 8.557 11.092 1.00 0.00 C ATOM 2070 O ASN A 130 -11.813 7.969 10.048 1.00 0.00 O ATOM 2071 CB ASN A 130 -13.396 7.650 13.071 1.00 0.00 C ATOM 2072 CG ASN A 130 -12.066 7.830 13.761 1.00 0.00 C ATOM 2073 OD1 ASN A 130 -11.079 7.081 13.306 1.00 0.00 O flip ATOM 2074 ND2 ASN A 130 -11.929 8.630 14.686 1.00 0.00 N flip ATOM 0 H ASN A 130 -14.219 6.689 10.756 1.00 0.00 H new ATOM 0 HA ASN A 130 -13.863 9.397 11.918 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -14.191 8.004 13.727 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -13.571 6.588 12.902 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -12.724 9.186 15.001 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -11.021 8.737 15.138 1.00 0.00 H new ATOM 2081 N PHE A 131 -11.243 9.378 11.711 1.00 0.00 N ATOM 2082 CA PHE A 131 -9.899 9.642 11.188 1.00 0.00 C ATOM 2083 C PHE A 131 -8.855 8.666 11.740 1.00 0.00 C ATOM 2084 O PHE A 131 -8.089 8.074 10.981 1.00 0.00 O ATOM 2085 CB PHE A 131 -9.477 11.080 11.510 1.00 0.00 C ATOM 2086 CG PHE A 131 -10.160 11.658 12.718 1.00 0.00 C ATOM 2087 CD1 PHE A 131 -9.651 11.443 13.989 1.00 0.00 C ATOM 2088 CD2 PHE A 131 -11.313 12.414 12.581 1.00 0.00 C ATOM 2089 CE1 PHE A 131 -10.281 11.971 15.101 1.00 0.00 C ATOM 2090 CE2 PHE A 131 -11.947 12.944 13.689 1.00 0.00 C ATOM 2091 CZ PHE A 131 -11.430 12.722 14.950 1.00 0.00 C ATOM 0 H PHE A 131 -11.460 9.873 12.576 1.00 0.00 H new ATOM 0 HA PHE A 131 -9.946 9.501 10.108 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -8.399 11.105 11.667 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -9.688 11.712 10.648 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -8.752 10.857 14.112 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -11.721 12.591 11.597 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -9.875 11.796 16.086 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -12.846 13.531 13.569 1.00 0.00 H new ATOM 0 HZ PHE A 131 -11.924 13.135 15.817 1.00 0.00 H new ATOM 2101 N ASP A 132 -8.823 8.518 13.060 1.00 0.00 N ATOM 2102 CA ASP A 132 -7.869 7.626 13.726 1.00 0.00 C ATOM 2103 C ASP A 132 -7.875 6.224 13.112 1.00 0.00 C ATOM 2104 O ASP A 132 -6.912 5.463 13.253 1.00 0.00 O ATOM 2105 CB ASP A 132 -8.187 7.536 15.220 1.00 0.00 C ATOM 2106 CG ASP A 132 -8.191 8.896 15.892 1.00 0.00 C ATOM 2107 OD1 ASP A 132 -7.244 9.676 15.657 1.00 0.00 O ATOM 2108 OD2 ASP A 132 -9.140 9.180 16.652 1.00 0.00 O ATOM 0 H ASP A 132 -9.451 9.007 13.698 1.00 0.00 H new ATOM 0 HA ASP A 132 -6.874 8.049 13.586 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -9.161 7.064 15.354 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -7.452 6.895 15.707 1.00 0.00 H new ATOM 2113 N GLU A 133 -8.969 5.885 12.441 1.00 0.00 N ATOM 2114 CA GLU A 133 -9.112 4.580 11.819 1.00 0.00 C ATOM 2115 C GLU A 133 -7.976 4.326 10.834 1.00 0.00 C ATOM 2116 O GLU A 133 -7.519 3.197 10.682 1.00 0.00 O ATOM 2117 CB GLU A 133 -10.474 4.469 11.123 1.00 0.00 C ATOM 2118 CG GLU A 133 -10.463 4.892 9.667 1.00 0.00 C ATOM 2119 CD GLU A 133 -11.837 5.277 9.162 1.00 0.00 C ATOM 2120 OE1 GLU A 133 -12.765 5.394 9.991 1.00 0.00 O ATOM 2121 OE2 GLU A 133 -11.986 5.461 7.938 1.00 0.00 O ATOM 0 H GLU A 133 -9.772 6.501 12.315 1.00 0.00 H new ATOM 0 HA GLU A 133 -9.060 3.817 12.596 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -10.820 3.437 11.188 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -11.196 5.082 11.662 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -9.785 5.736 9.543 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -10.072 4.077 9.059 1.00 0.00 H new ATOM 2128 N THR A 134 -7.514 5.391 10.181 1.00 0.00 N ATOM 2129 CA THR A 134 -6.421 5.282 9.223 1.00 0.00 C ATOM 2130 C THR A 134 -5.178 4.705 9.882 1.00 0.00 C ATOM 2131 O THR A 134 -4.485 3.879 9.295 1.00 0.00 O ATOM 2132 CB THR A 134 -6.079 6.641 8.591 1.00 0.00 C ATOM 2133 OG1 THR A 134 -7.281 7.368 8.320 1.00 0.00 O ATOM 2134 CG2 THR A 134 -5.299 6.449 7.300 1.00 0.00 C ATOM 0 H THR A 134 -7.880 6.336 10.299 1.00 0.00 H new ATOM 0 HA THR A 134 -6.758 4.609 8.434 1.00 0.00 H new ATOM 0 HB THR A 134 -5.464 7.203 9.293 1.00 0.00 H new ATOM 0 HG1 THR A 134 -7.606 7.783 9.146 1.00 0.00 H new ATOM 0 HG21 THR A 134 -5.066 7.422 6.867 1.00 0.00 H new ATOM 0 HG22 THR A 134 -4.373 5.914 7.511 1.00 0.00 H new ATOM 0 HG23 THR A 134 -5.898 5.873 6.595 1.00 0.00 H new ATOM 2142 N TYR A 135 -4.906 5.136 11.110 1.00 0.00 N ATOM 2143 CA TYR A 135 -3.747 4.648 11.846 1.00 0.00 C ATOM 2144 C TYR A 135 -3.928 3.181 12.206 1.00 0.00 C ATOM 2145 O TYR A 135 -2.990 2.393 12.119 1.00 0.00 O ATOM 2146 CB TYR A 135 -3.530 5.467 13.117 1.00 0.00 C ATOM 2147 CG TYR A 135 -2.392 4.959 13.975 1.00 0.00 C ATOM 2148 CD1 TYR A 135 -1.072 5.255 13.658 1.00 0.00 C ATOM 2149 CD2 TYR A 135 -2.637 4.184 15.101 1.00 0.00 C ATOM 2150 CE1 TYR A 135 -0.030 4.791 14.437 1.00 0.00 C ATOM 2151 CE2 TYR A 135 -1.600 3.716 15.886 1.00 0.00 C ATOM 2152 CZ TYR A 135 -0.298 4.022 15.549 1.00 0.00 C ATOM 2153 OH TYR A 135 0.737 3.558 16.328 1.00 0.00 O ATOM 0 H TYR A 135 -5.471 5.820 11.614 1.00 0.00 H new ATOM 0 HA TYR A 135 -2.871 4.754 11.207 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -3.333 6.503 12.843 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -4.448 5.462 13.705 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -0.857 5.858 12.788 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -3.655 3.943 15.368 1.00 0.00 H new ATOM 0 HE1 TYR A 135 0.990 5.030 14.176 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -1.808 3.114 16.758 1.00 0.00 H new ATOM 0 HH TYR A 135 0.376 3.033 17.073 1.00 0.00 H new ATOM 2163 N LYS A 136 -5.139 2.823 12.617 1.00 0.00 N ATOM 2164 CA LYS A 136 -5.439 1.446 12.993 1.00 0.00 C ATOM 2165 C LYS A 136 -5.137 0.488 11.842 1.00 0.00 C ATOM 2166 O LYS A 136 -4.360 -0.460 11.992 1.00 0.00 O ATOM 2167 CB LYS A 136 -6.907 1.320 13.405 1.00 0.00 C ATOM 2168 CG LYS A 136 -7.319 -0.098 13.770 1.00 0.00 C ATOM 2169 CD LYS A 136 -8.831 -0.255 13.770 1.00 0.00 C ATOM 2170 CE LYS A 136 -9.282 -1.316 14.761 1.00 0.00 C ATOM 2171 NZ LYS A 136 -9.281 -0.804 16.159 1.00 0.00 N ATOM 0 H LYS A 136 -5.927 3.465 12.698 1.00 0.00 H new ATOM 0 HA LYS A 136 -4.805 1.179 13.839 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -7.094 1.974 14.257 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -7.536 1.673 12.588 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -6.879 -0.800 13.061 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -6.926 -0.350 14.755 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -9.297 0.698 14.019 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -9.170 -0.523 12.769 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -10.284 -1.655 14.499 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -8.624 -2.182 14.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -9.594 -1.557 16.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -8.320 -0.504 16.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -9.928 0.007 16.232 1.00 0.00 H new ATOM 2185 N ILE A 137 -5.758 0.742 10.695 1.00 0.00 N ATOM 2186 CA ILE A 137 -5.569 -0.094 9.514 1.00 0.00 C ATOM 2187 C ILE A 137 -4.136 -0.024 8.997 1.00 0.00 C ATOM 2188 O ILE A 137 -3.515 -1.050 8.739 1.00 0.00 O ATOM 2189 CB ILE A 137 -6.523 0.307 8.370 1.00 0.00 C ATOM 2190 CG1 ILE A 137 -7.851 0.835 8.927 1.00 0.00 C ATOM 2191 CG2 ILE A 137 -6.752 -0.873 7.435 1.00 0.00 C ATOM 2192 CD1 ILE A 137 -8.785 -0.242 9.439 1.00 0.00 C ATOM 0 H ILE A 137 -6.399 1.523 10.558 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.791 -1.114 9.829 1.00 0.00 H new ATOM 0 HB ILE A 137 -6.060 1.111 7.798 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -7.640 1.532 9.738 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -8.360 1.400 8.146 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -7.427 -0.576 6.633 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -5.800 -1.190 7.009 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -7.193 -1.699 7.993 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -9.699 0.218 9.815 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -9.030 -0.927 8.627 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -8.299 -0.793 10.244 1.00 0.00 H new ATOM 2204 N LEU A 138 -3.622 1.190 8.831 1.00 0.00 N ATOM 2205 CA LEU A 138 -2.265 1.383 8.323 1.00 0.00 C ATOM 2206 C LEU A 138 -1.232 0.666 9.184 1.00 0.00 C ATOM 2207 O LEU A 138 -0.412 -0.091 8.675 1.00 0.00 O ATOM 2208 CB LEU A 138 -1.925 2.872 8.249 1.00 0.00 C ATOM 2209 CG LEU A 138 -1.756 3.432 6.836 1.00 0.00 C ATOM 2210 CD1 LEU A 138 -0.685 2.663 6.078 1.00 0.00 C ATOM 2211 CD2 LEU A 138 -3.077 3.392 6.082 1.00 0.00 C ATOM 0 H LEU A 138 -4.122 2.054 9.040 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.232 0.953 7.322 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.712 3.433 8.753 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -1.003 3.046 8.804 1.00 0.00 H new ATOM 0 HG LEU A 138 -1.438 4.472 6.917 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -0.581 3.077 5.075 1.00 0.00 H new ATOM 0 HD12 LEU A 138 0.265 2.746 6.606 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -0.971 1.613 6.009 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -2.936 3.795 5.079 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.426 2.362 6.014 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -3.817 3.991 6.613 1.00 0.00 H new ATOM 2223 N SER A 139 -1.267 0.919 10.486 1.00 0.00 N ATOM 2224 CA SER A 139 -0.320 0.305 11.410 1.00 0.00 C ATOM 2225 C SER A 139 -0.311 -1.217 11.274 1.00 0.00 C ATOM 2226 O SER A 139 0.740 -1.822 11.053 1.00 0.00 O ATOM 2227 CB SER A 139 -0.654 0.700 12.850 1.00 0.00 C ATOM 2228 OG SER A 139 0.504 0.679 13.667 1.00 0.00 O ATOM 0 H SER A 139 -1.941 1.545 10.927 1.00 0.00 H new ATOM 0 HA SER A 139 0.675 0.671 11.157 1.00 0.00 H new ATOM 0 HB2 SER A 139 -1.095 1.697 12.864 1.00 0.00 H new ATOM 0 HB3 SER A 139 -1.400 0.016 13.254 1.00 0.00 H new ATOM 0 HG SER A 139 0.264 0.937 14.581 1.00 0.00 H new ATOM 2234 N LEU A 140 -1.482 -1.833 11.415 1.00 0.00 N ATOM 2235 CA LEU A 140 -1.598 -3.287 11.317 1.00 0.00 C ATOM 2236 C LEU A 140 -1.253 -3.794 9.917 1.00 0.00 C ATOM 2237 O LEU A 140 -0.379 -4.644 9.755 1.00 0.00 O ATOM 2238 CB LEU A 140 -3.014 -3.729 11.695 1.00 0.00 C ATOM 2239 CG LEU A 140 -3.089 -4.956 12.606 1.00 0.00 C ATOM 2240 CD1 LEU A 140 -2.466 -4.658 13.960 1.00 0.00 C ATOM 2241 CD2 LEU A 140 -4.532 -5.408 12.770 1.00 0.00 C ATOM 0 H LEU A 140 -2.362 -1.350 11.597 1.00 0.00 H new ATOM 0 HA LEU A 140 -0.880 -3.720 12.014 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -3.518 -2.898 12.189 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -3.568 -3.940 10.781 1.00 0.00 H new ATOM 0 HG LEU A 140 -2.524 -5.764 12.141 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -2.530 -5.543 14.593 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -1.420 -4.382 13.826 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -3.001 -3.835 14.433 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -4.568 -6.282 13.421 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -5.118 -4.602 13.212 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -4.946 -5.665 11.795 1.00 0.00 H new ATOM 2253 N ALA A 141 -1.957 -3.279 8.915 1.00 0.00 N ATOM 2254 CA ALA A 141 -1.746 -3.688 7.527 1.00 0.00 C ATOM 2255 C ALA A 141 -0.285 -3.564 7.104 1.00 0.00 C ATOM 2256 O ALA A 141 0.276 -4.495 6.532 1.00 0.00 O ATOM 2257 CB ALA A 141 -2.630 -2.874 6.596 1.00 0.00 C ATOM 0 H ALA A 141 -2.683 -2.573 9.037 1.00 0.00 H new ATOM 0 HA ALA A 141 -2.018 -4.741 7.457 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -2.462 -3.190 5.566 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -3.676 -3.032 6.858 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -2.386 -1.816 6.696 1.00 0.00 H new ATOM 2263 N CYS A 142 0.325 -2.413 7.377 1.00 0.00 N ATOM 2264 CA CYS A 142 1.721 -2.181 7.006 1.00 0.00 C ATOM 2265 C CYS A 142 2.641 -3.204 7.666 1.00 0.00 C ATOM 2266 O CYS A 142 3.545 -3.740 7.025 1.00 0.00 O ATOM 2267 CB CYS A 142 2.157 -0.770 7.395 1.00 0.00 C ATOM 2268 SG CYS A 142 2.167 0.399 6.017 1.00 0.00 S ATOM 0 H CYS A 142 -0.122 -1.629 7.852 1.00 0.00 H new ATOM 0 HA CYS A 142 1.797 -2.290 5.924 1.00 0.00 H new ATOM 0 HB2 CYS A 142 1.490 -0.395 8.172 1.00 0.00 H new ATOM 0 HB3 CYS A 142 3.156 -0.815 7.828 1.00 0.00 H new ATOM 0 HG CYS A 142 0.971 0.489 5.516 1.00 0.00 H new ATOM 2274 N LYS A 143 2.408 -3.472 8.950 1.00 0.00 N ATOM 2275 CA LYS A 143 3.221 -4.435 9.687 1.00 0.00 C ATOM 2276 C LYS A 143 3.125 -5.820 9.054 1.00 0.00 C ATOM 2277 O LYS A 143 4.129 -6.387 8.614 1.00 0.00 O ATOM 2278 CB LYS A 143 2.777 -4.501 11.150 1.00 0.00 C ATOM 2279 CG LYS A 143 3.323 -3.367 12.003 1.00 0.00 C ATOM 2280 CD LYS A 143 2.809 -3.448 13.431 1.00 0.00 C ATOM 2281 CE LYS A 143 3.443 -2.383 14.311 1.00 0.00 C ATOM 2282 NZ LYS A 143 4.919 -2.551 14.411 1.00 0.00 N ATOM 0 H LYS A 143 1.666 -3.037 9.499 1.00 0.00 H new ATOM 0 HA LYS A 143 4.258 -4.103 9.646 1.00 0.00 H new ATOM 0 HB2 LYS A 143 1.688 -4.484 11.192 1.00 0.00 H new ATOM 0 HB3 LYS A 143 3.098 -5.452 11.576 1.00 0.00 H new ATOM 0 HG2 LYS A 143 4.412 -3.403 12.005 1.00 0.00 H new ATOM 0 HG3 LYS A 143 3.037 -2.411 11.566 1.00 0.00 H new ATOM 0 HD2 LYS A 143 1.726 -3.329 13.436 1.00 0.00 H new ATOM 0 HD3 LYS A 143 3.023 -4.435 13.841 1.00 0.00 H new ATOM 0 HE2 LYS A 143 3.217 -1.396 13.907 1.00 0.00 H new ATOM 0 HE3 LYS A 143 3.004 -2.428 15.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 5.276 -2.008 15.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 5.146 -3.558 14.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 5.368 -2.205 13.539 1.00 0.00 H new ATOM 2296 N ASN A 144 1.909 -6.357 9.008 1.00 0.00 N ATOM 2297 CA ASN A 144 1.674 -7.671 8.425 1.00 0.00 C ATOM 2298 C ASN A 144 2.191 -7.720 6.993 1.00 0.00 C ATOM 2299 O ASN A 144 2.711 -8.741 6.543 1.00 0.00 O ATOM 2300 CB ASN A 144 0.181 -8.007 8.454 1.00 0.00 C ATOM 2301 CG ASN A 144 -0.163 -9.020 9.527 1.00 0.00 C ATOM 2302 OD1 ASN A 144 0.015 -10.223 9.342 1.00 0.00 O ATOM 2303 ND2 ASN A 144 -0.662 -8.536 10.659 1.00 0.00 N ATOM 0 H ASN A 144 1.071 -5.900 9.368 1.00 0.00 H new ATOM 0 HA ASN A 144 2.214 -8.410 9.017 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -0.391 -7.094 8.623 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -0.120 -8.396 7.481 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -0.914 -9.170 11.417 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -0.793 -7.531 10.770 1.00 0.00 H new ATOM 2310 N LEU A 145 2.055 -6.602 6.284 1.00 0.00 N ATOM 2311 CA LEU A 145 2.519 -6.511 4.906 1.00 0.00 C ATOM 2312 C LEU A 145 4.027 -6.705 4.843 1.00 0.00 C ATOM 2313 O LEU A 145 4.528 -7.455 4.012 1.00 0.00 O ATOM 2314 CB LEU A 145 2.144 -5.157 4.298 1.00 0.00 C ATOM 2315 CG LEU A 145 1.653 -5.202 2.847 1.00 0.00 C ATOM 2316 CD1 LEU A 145 1.438 -3.793 2.318 1.00 0.00 C ATOM 2317 CD2 LEU A 145 2.637 -5.955 1.963 1.00 0.00 C ATOM 0 H LEU A 145 1.627 -5.748 6.642 1.00 0.00 H new ATOM 0 HA LEU A 145 2.034 -7.299 4.330 1.00 0.00 H new ATOM 0 HB2 LEU A 145 1.366 -4.704 4.913 1.00 0.00 H new ATOM 0 HB3 LEU A 145 3.013 -4.501 4.350 1.00 0.00 H new ATOM 0 HG LEU A 145 0.702 -5.734 2.826 1.00 0.00 H new ATOM 0 HD11 LEU A 145 1.089 -3.841 1.286 1.00 0.00 H new ATOM 0 HD12 LEU A 145 0.693 -3.284 2.930 1.00 0.00 H new ATOM 0 HD13 LEU A 145 2.378 -3.242 2.358 1.00 0.00 H new ATOM 0 HD21 LEU A 145 2.266 -5.973 0.938 1.00 0.00 H new ATOM 0 HD22 LEU A 145 3.606 -5.456 1.989 1.00 0.00 H new ATOM 0 HD23 LEU A 145 2.745 -6.977 2.327 1.00 0.00 H new ATOM 2329 N LEU A 146 4.744 -6.026 5.731 1.00 0.00 N ATOM 2330 CA LEU A 146 6.196 -6.128 5.779 1.00 0.00 C ATOM 2331 C LEU A 146 6.626 -7.581 5.938 1.00 0.00 C ATOM 2332 O LEU A 146 7.563 -8.037 5.282 1.00 0.00 O ATOM 2333 CB LEU A 146 6.749 -5.293 6.935 1.00 0.00 C ATOM 2334 CG LEU A 146 6.871 -3.794 6.653 1.00 0.00 C ATOM 2335 CD1 LEU A 146 7.012 -3.017 7.953 1.00 0.00 C ATOM 2336 CD2 LEU A 146 8.052 -3.519 5.734 1.00 0.00 C ATOM 0 H LEU A 146 4.342 -5.399 6.428 1.00 0.00 H new ATOM 0 HA LEU A 146 6.597 -5.745 4.841 1.00 0.00 H new ATOM 0 HB2 LEU A 146 6.105 -5.432 7.804 1.00 0.00 H new ATOM 0 HB3 LEU A 146 7.733 -5.678 7.202 1.00 0.00 H new ATOM 0 HG LEU A 146 5.962 -3.462 6.152 1.00 0.00 H new ATOM 0 HD11 LEU A 146 7.098 -1.953 7.733 1.00 0.00 H new ATOM 0 HD12 LEU A 146 6.135 -3.189 8.577 1.00 0.00 H new ATOM 0 HD13 LEU A 146 7.905 -3.351 8.482 1.00 0.00 H new ATOM 0 HD21 LEU A 146 8.124 -2.448 5.544 1.00 0.00 H new ATOM 0 HD22 LEU A 146 8.970 -3.866 6.208 1.00 0.00 H new ATOM 0 HD23 LEU A 146 7.909 -4.046 4.791 1.00 0.00 H new ATOM 2348 N VAL A 147 5.935 -8.302 6.815 1.00 0.00 N ATOM 2349 CA VAL A 147 6.238 -9.706 7.071 1.00 0.00 C ATOM 2350 C VAL A 147 6.083 -10.556 5.811 1.00 0.00 C ATOM 2351 O VAL A 147 7.021 -11.234 5.389 1.00 0.00 O ATOM 2352 CB VAL A 147 5.331 -10.280 8.175 1.00 0.00 C ATOM 2353 CG1 VAL A 147 5.814 -11.658 8.603 1.00 0.00 C ATOM 2354 CG2 VAL A 147 5.273 -9.334 9.365 1.00 0.00 C ATOM 0 H VAL A 147 5.157 -7.935 7.363 1.00 0.00 H new ATOM 0 HA VAL A 147 7.277 -9.744 7.399 1.00 0.00 H new ATOM 0 HB VAL A 147 4.323 -10.383 7.773 1.00 0.00 H new ATOM 0 HG11 VAL A 147 5.160 -12.046 9.384 1.00 0.00 H new ATOM 0 HG12 VAL A 147 5.797 -12.332 7.746 1.00 0.00 H new ATOM 0 HG13 VAL A 147 6.832 -11.584 8.986 1.00 0.00 H new ATOM 0 HG21 VAL A 147 4.627 -9.757 10.135 1.00 0.00 H new ATOM 0 HG22 VAL A 147 6.276 -9.195 9.769 1.00 0.00 H new ATOM 0 HG23 VAL A 147 4.874 -8.371 9.045 1.00 0.00 H new ATOM 2364 N PHE A 148 4.892 -10.525 5.225 1.00 0.00 N ATOM 2365 CA PHE A 148 4.606 -11.303 4.021 1.00 0.00 C ATOM 2366 C PHE A 148 5.457 -10.840 2.840 1.00 0.00 C ATOM 2367 O PHE A 148 6.160 -11.640 2.222 1.00 0.00 O ATOM 2368 CB PHE A 148 3.121 -11.190 3.668 1.00 0.00 C ATOM 2369 CG PHE A 148 2.555 -12.430 3.038 1.00 0.00 C ATOM 2370 CD1 PHE A 148 2.134 -13.492 3.822 1.00 0.00 C ATOM 2371 CD2 PHE A 148 2.444 -12.533 1.661 1.00 0.00 C ATOM 2372 CE1 PHE A 148 1.612 -14.633 3.244 1.00 0.00 C ATOM 2373 CE2 PHE A 148 1.923 -13.672 1.077 1.00 0.00 C ATOM 2374 CZ PHE A 148 1.507 -14.723 1.871 1.00 0.00 C ATOM 0 H PHE A 148 4.106 -9.969 5.563 1.00 0.00 H new ATOM 0 HA PHE A 148 4.855 -12.344 4.227 1.00 0.00 H new ATOM 0 HB2 PHE A 148 2.558 -10.963 4.573 1.00 0.00 H new ATOM 0 HB3 PHE A 148 2.981 -10.351 2.987 1.00 0.00 H new ATOM 0 HD1 PHE A 148 2.215 -13.427 4.897 1.00 0.00 H new ATOM 0 HD2 PHE A 148 2.768 -11.714 1.037 1.00 0.00 H new ATOM 0 HE1 PHE A 148 1.286 -15.454 3.866 1.00 0.00 H new ATOM 0 HE2 PHE A 148 1.841 -13.740 0.002 1.00 0.00 H new ATOM 0 HZ PHE A 148 1.100 -15.615 1.418 1.00 0.00 H new ATOM 2384 N LEU A 149 5.379 -9.551 2.531 1.00 0.00 N ATOM 2385 CA LEU A 149 6.130 -8.973 1.421 1.00 0.00 C ATOM 2386 C LEU A 149 7.617 -9.330 1.515 1.00 0.00 C ATOM 2387 O LEU A 149 8.214 -9.772 0.532 1.00 0.00 O ATOM 2388 CB LEU A 149 5.919 -7.448 1.384 1.00 0.00 C ATOM 2389 CG LEU A 149 7.186 -6.590 1.452 1.00 0.00 C ATOM 2390 CD1 LEU A 149 7.833 -6.484 0.081 1.00 0.00 C ATOM 2391 CD2 LEU A 149 6.861 -5.209 1.999 1.00 0.00 C ATOM 0 H LEU A 149 4.799 -8.882 3.037 1.00 0.00 H new ATOM 0 HA LEU A 149 5.757 -9.395 0.488 1.00 0.00 H new ATOM 0 HB2 LEU A 149 5.384 -7.198 0.468 1.00 0.00 H new ATOM 0 HB3 LEU A 149 5.272 -7.171 2.216 1.00 0.00 H new ATOM 0 HG LEU A 149 7.894 -7.071 2.127 1.00 0.00 H new ATOM 0 HD11 LEU A 149 8.732 -5.871 0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 149 8.099 -7.480 -0.274 1.00 0.00 H new ATOM 0 HD13 LEU A 149 7.133 -6.025 -0.617 1.00 0.00 H new ATOM 0 HD21 LEU A 149 7.771 -4.611 2.041 1.00 0.00 H new ATOM 0 HD22 LEU A 149 6.136 -4.721 1.347 1.00 0.00 H new ATOM 0 HD23 LEU A 149 6.442 -5.304 3.001 1.00 0.00 H new ATOM 2403 N SER A 150 8.207 -9.147 2.700 1.00 0.00 N ATOM 2404 CA SER A 150 9.624 -9.461 2.907 1.00 0.00 C ATOM 2405 C SER A 150 10.063 -9.160 4.339 1.00 0.00 C ATOM 2406 O SER A 150 10.496 -8.047 4.642 1.00 0.00 O ATOM 2407 CB SER A 150 10.498 -8.671 1.929 1.00 0.00 C ATOM 2408 OG SER A 150 11.823 -9.173 1.911 1.00 0.00 O ATOM 0 H SER A 150 7.729 -8.786 3.526 1.00 0.00 H new ATOM 0 HA SER A 150 9.749 -10.529 2.726 1.00 0.00 H new ATOM 0 HB2 SER A 150 10.071 -8.727 0.928 1.00 0.00 H new ATOM 0 HB3 SER A 150 10.508 -7.619 2.213 1.00 0.00 H new ATOM 0 HG SER A 150 12.361 -8.653 1.278 1.00 0.00 H new