USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1288 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 57 LYS NZ :NH3+ -105:sc= 0.166 (180deg=0.353) USER MOD Set 1.2: B 64 TYR OH : rot 180:sc= -0.0344 USER MOD Set 2.1: A 33 ASN : amide:sc= -0.766 K(o=-0.77,f=-5.2!) USER MOD Set 2.2: A 82 HIS : no HD1:sc= 0 X(o=-0.77,f=-0.77) USER MOD Set 3.1: A 18 ASN : amide:sc= -2.09! K(o=-2.1!,f=0.11) USER MOD Set 3.2: A 72 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 57 LYS NZ :NH3+ 162:sc= -0.832 (180deg=-1.08) USER MOD Set 4.2: A 64 TYR OH : rot 50:sc= 0.386 USER MOD Single : A 1 MET CE :methyl -162:sc= -0.0289 (180deg=-0.347) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 169:sc= 0.0191 (180deg=-0.176) USER MOD Single : A 4 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.013) USER MOD Single : A 9 ASN : amide:sc= -0.892 K(o=-0.89,f=-7.1!) USER MOD Single : A 12 LYS NZ :NH3+ -136:sc= 0 (180deg=-0.985) USER MOD Single : A 15 HIS : no HD1:sc= 0.164 K(o=0.16,f=-0.87) USER MOD Single : A 24 SER OG : rot 34:sc= -0.0723 USER MOD Single : A 31 LYS NZ :NH3+ 151:sc= 0.395 (180deg=-0.33) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 69:sc= -0.0305 USER MOD Single : A 50 ASN : amide:sc= -0.332 K(o=-0.33,f=-4.5!) USER MOD Single : A 51 LYS NZ :NH3+ -173:sc= 0.106 (180deg=0.0475) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 ASN : amide:sc= -0.591! C(o=-0.59!,f=-2.8!) USER MOD Single : A 68 HIS : no HE2:sc= -0.607 K(o=-0.61,f=-2.1) USER MOD Single : A 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 79 HIS : no HD1:sc= -0.56 K(o=-0.56,f=-1.2) USER MOD Single : A 80 HIS : no HE2:sc= 0.0615 X(o=0.062,f=-0.4) USER MOD Single : A 81 HIS : no HD1:sc= -0.0106 X(o=-0.011,f=-0.19) USER MOD Single : B 1 MET CE :methyl -174:sc= 0 (180deg=-0.0169) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ 154:sc= -0.501 (180deg=-1.54!) USER MOD Single : B 4 LYS NZ :NH3+ 153:sc= -0.94 (180deg=-2.15!) USER MOD Single : B 9 ASN : amide:sc=-0.00431 X(o=-0.0043,f=-0.44) USER MOD Single : B 12 LYS NZ :NH3+ 165:sc= -0.431 (180deg=-0.66) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 24 SER OG : rot 180:sc= 0 USER MOD Single : B 31 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00582) USER MOD Single : B 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 35 SER OG : rot 180:sc= -0.0905 USER MOD Single : B 38 SER OG : rot 180:sc= -0.264 USER MOD Single : B 39 THR OG1 : rot 81:sc= -0.393 USER MOD Single : B 50 ASN : amide:sc= -0.0111 X(o=-0.011,f=-0.026) USER MOD Single : B 51 LYS NZ :NH3+ -109:sc= -0.149 (180deg=-1.89!) USER MOD Single : B 58 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : B 65 ASN : amide:sc= -0.0512 K(o=-0.051,f=-1.8!) USER MOD Single : B 68 HIS : no HD1:sc= -0.105 K(o=-0.11,f=-2.4!) USER MOD Single : B 72 SER OG : rot 160:sc= 0 USER MOD Single : B 77 HIS : no HD1:sc= 0 X(o=0,f=-0.22) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 79 HIS : no HE2:sc= 0.295 K(o=0.3,f=-1.1) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HD1:sc= -0.166 X(o=-0.17,f=-0.1) USER MOD Single : B 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.252 18.564 2.101 1.00 33.05 N ATOM 2 CA MET A 1 0.214 17.955 2.973 1.00 41.41 C ATOM 3 C MET A 1 -0.195 16.575 2.408 1.00 60.50 C ATOM 4 O MET A 1 -0.731 16.488 1.298 1.00 61.13 O ATOM 5 CB MET A 1 -0.988 18.934 3.108 1.00 4.20 C ATOM 6 CG MET A 1 -2.038 18.562 4.172 1.00 14.22 C ATOM 7 SD MET A 1 -3.196 17.285 3.635 1.00 51.53 S ATOM 8 CE MET A 1 -4.160 18.166 2.397 1.00 52.30 C ATOM 0 H1 MET A 1 1.525 19.492 2.483 1.00 33.05 H new ATOM 0 H2 MET A 1 2.086 17.943 2.069 1.00 33.05 H new ATOM 0 H3 MET A 1 0.872 18.683 1.140 1.00 33.05 H new ATOM 0 HA MET A 1 0.606 17.785 3.976 1.00 41.41 H new ATOM 0 HB2 MET A 1 -0.600 19.926 3.339 1.00 4.20 H new ATOM 0 HB3 MET A 1 -1.486 19.003 2.141 1.00 4.20 H new ATOM 0 HG2 MET A 1 -1.526 18.220 5.071 1.00 14.22 H new ATOM 0 HG3 MET A 1 -2.598 19.456 4.445 1.00 14.22 H new ATOM 0 HE1 MET A 1 -5.092 17.631 2.213 1.00 52.30 H new ATOM 0 HE2 MET A 1 -4.383 19.171 2.757 1.00 52.30 H new ATOM 0 HE3 MET A 1 -3.590 18.231 1.470 1.00 52.30 H new ATOM 20 N ASP A 2 0.094 15.505 3.176 1.00 2.52 N ATOM 21 CA ASP A 2 -0.090 14.100 2.734 1.00 13.04 C ATOM 22 C ASP A 2 -0.565 13.192 3.899 1.00 75.43 C ATOM 23 O ASP A 2 -1.487 12.396 3.734 1.00 35.00 O ATOM 24 CB ASP A 2 1.235 13.567 2.101 1.00 43.44 C ATOM 25 CG ASP A 2 2.475 13.781 3.001 1.00 3.43 C ATOM 26 OD1 ASP A 2 2.993 14.921 3.046 1.00 70.11 O ATOM 27 OD2 ASP A 2 2.915 12.833 3.682 1.00 41.22 O ATOM 0 H ASP A 2 0.463 15.587 4.123 1.00 2.52 H new ATOM 0 HA ASP A 2 -0.874 14.076 1.977 1.00 13.04 H new ATOM 0 HB2 ASP A 2 1.127 12.503 1.891 1.00 43.44 H new ATOM 0 HB3 ASP A 2 1.399 14.065 1.145 1.00 43.44 H new ATOM 32 N LYS A 3 0.060 13.346 5.086 1.00 71.44 N ATOM 33 CA LYS A 3 -0.240 12.518 6.289 1.00 22.31 C ATOM 34 C LYS A 3 -1.658 12.761 6.859 1.00 40.45 C ATOM 35 O LYS A 3 -2.206 11.901 7.558 1.00 62.21 O ATOM 36 CB LYS A 3 0.842 12.760 7.368 1.00 0.44 C ATOM 37 CG LYS A 3 2.251 12.324 6.912 1.00 63.45 C ATOM 38 CD LYS A 3 3.382 12.757 7.867 1.00 51.12 C ATOM 39 CE LYS A 3 4.773 12.459 7.277 1.00 44.52 C ATOM 40 NZ LYS A 3 4.965 13.089 5.932 1.00 45.22 N ATOM 0 H LYS A 3 0.786 14.044 5.244 1.00 71.44 H new ATOM 0 HA LYS A 3 -0.221 11.474 5.978 1.00 22.31 H new ATOM 0 HB2 LYS A 3 0.860 13.819 7.626 1.00 0.44 H new ATOM 0 HB3 LYS A 3 0.574 12.216 8.273 1.00 0.44 H new ATOM 0 HG2 LYS A 3 2.270 11.239 6.812 1.00 63.45 H new ATOM 0 HG3 LYS A 3 2.446 12.739 5.923 1.00 63.45 H new ATOM 0 HD2 LYS A 3 3.295 13.824 8.073 1.00 51.12 H new ATOM 0 HD3 LYS A 3 3.272 12.238 8.819 1.00 51.12 H new ATOM 0 HE2 LYS A 3 5.541 12.823 7.960 1.00 44.52 H new ATOM 0 HE3 LYS A 3 4.907 11.380 7.193 1.00 44.52 H new ATOM 0 HZ1 LYS A 3 5.966 13.022 5.657 1.00 45.22 H new ATOM 0 HZ2 LYS A 3 4.379 12.594 5.230 1.00 45.22 H new ATOM 0 HZ3 LYS A 3 4.683 14.089 5.974 1.00 45.22 H new ATOM 54 N LYS A 4 -2.234 13.935 6.559 1.00 41.33 N ATOM 55 CA LYS A 4 -3.635 14.264 6.910 1.00 3.41 C ATOM 56 C LYS A 4 -4.635 13.544 5.962 1.00 12.02 C ATOM 57 O LYS A 4 -5.693 13.080 6.398 1.00 3.43 O ATOM 58 CB LYS A 4 -3.840 15.802 6.873 1.00 44.31 C ATOM 59 CG LYS A 4 -2.956 16.578 7.882 1.00 63.31 C ATOM 60 CD LYS A 4 -3.084 18.118 7.759 1.00 41.35 C ATOM 61 CE LYS A 4 -4.503 18.635 8.057 1.00 73.14 C ATOM 62 NZ LYS A 4 -4.931 18.360 9.456 1.00 40.41 N ATOM 0 H LYS A 4 -1.748 14.685 6.068 1.00 41.33 H new ATOM 0 HA LYS A 4 -3.833 13.909 7.921 1.00 3.41 H new ATOM 0 HB2 LYS A 4 -3.628 16.163 5.867 1.00 44.31 H new ATOM 0 HB3 LYS A 4 -4.887 16.024 7.077 1.00 44.31 H new ATOM 0 HG2 LYS A 4 -3.226 16.279 8.895 1.00 63.31 H new ATOM 0 HG3 LYS A 4 -1.914 16.295 7.733 1.00 63.31 H new ATOM 0 HD2 LYS A 4 -2.381 18.590 8.445 1.00 41.35 H new ATOM 0 HD3 LYS A 4 -2.798 18.420 6.751 1.00 41.35 H new ATOM 0 HE2 LYS A 4 -4.540 19.709 7.874 1.00 73.14 H new ATOM 0 HE3 LYS A 4 -5.207 18.170 7.367 1.00 73.14 H new ATOM 0 HZ1 LYS A 4 -5.864 18.787 9.624 1.00 40.41 H new ATOM 0 HZ2 LYS A 4 -4.989 17.332 9.606 1.00 40.41 H new ATOM 0 HZ3 LYS A 4 -4.240 18.768 10.117 1.00 40.41 H new ATOM 76 N ILE A 5 -4.280 13.462 4.665 1.00 74.20 N ATOM 77 CA ILE A 5 -5.087 12.751 3.638 1.00 71.34 C ATOM 78 C ILE A 5 -5.130 11.232 3.925 1.00 1.44 C ATOM 79 O ILE A 5 -6.205 10.635 4.069 1.00 5.10 O ATOM 80 CB ILE A 5 -4.487 12.983 2.199 1.00 43.33 C ATOM 81 CG1 ILE A 5 -4.330 14.506 1.909 1.00 51.30 C ATOM 82 CG2 ILE A 5 -5.339 12.286 1.102 1.00 13.03 C ATOM 83 CD1 ILE A 5 -3.546 14.838 0.650 1.00 72.01 C ATOM 0 H ILE A 5 -3.429 13.884 4.294 1.00 74.20 H new ATOM 0 HA ILE A 5 -6.099 13.154 3.680 1.00 71.34 H new ATOM 0 HB ILE A 5 -3.497 12.527 2.174 1.00 43.33 H new ATOM 0 HG12 ILE A 5 -5.322 14.951 1.830 1.00 51.30 H new ATOM 0 HG13 ILE A 5 -3.838 14.975 2.761 1.00 51.30 H new ATOM 0 HG21 ILE A 5 -4.893 12.469 0.124 1.00 13.03 H new ATOM 0 HG22 ILE A 5 -5.369 11.213 1.292 1.00 13.03 H new ATOM 0 HG23 ILE A 5 -6.353 12.686 1.119 1.00 13.03 H new ATOM 0 HD11 ILE A 5 -3.489 15.920 0.531 1.00 72.01 H new ATOM 0 HD12 ILE A 5 -2.539 14.428 0.730 1.00 72.01 H new ATOM 0 HD13 ILE A 5 -4.047 14.404 -0.215 1.00 72.01 H new ATOM 95 N VAL A 6 -3.928 10.636 4.022 1.00 74.41 N ATOM 96 CA VAL A 6 -3.747 9.192 4.261 1.00 24.24 C ATOM 97 C VAL A 6 -4.181 8.803 5.693 1.00 21.01 C ATOM 98 O VAL A 6 -4.554 7.662 5.939 1.00 74.35 O ATOM 99 CB VAL A 6 -2.267 8.745 3.962 1.00 11.32 C ATOM 100 CG1 VAL A 6 -1.851 9.213 2.551 1.00 32.31 C ATOM 101 CG2 VAL A 6 -1.277 9.262 5.029 1.00 62.22 C ATOM 0 H VAL A 6 -3.049 11.146 3.936 1.00 74.41 H new ATOM 0 HA VAL A 6 -4.395 8.656 3.567 1.00 24.24 H new ATOM 0 HB VAL A 6 -2.232 7.656 4.001 1.00 11.32 H new ATOM 0 HG11 VAL A 6 -0.826 8.900 2.351 1.00 32.31 H new ATOM 0 HG12 VAL A 6 -2.516 8.770 1.810 1.00 32.31 H new ATOM 0 HG13 VAL A 6 -1.916 10.300 2.494 1.00 32.31 H new ATOM 0 HG21 VAL A 6 -0.269 8.929 4.782 1.00 62.22 H new ATOM 0 HG22 VAL A 6 -1.304 10.351 5.053 1.00 62.22 H new ATOM 0 HG23 VAL A 6 -1.559 8.871 6.007 1.00 62.22 H new ATOM 111 N GLY A 7 -4.115 9.775 6.627 1.00 1.12 N ATOM 112 CA GLY A 7 -4.681 9.612 7.971 1.00 14.41 C ATOM 113 C GLY A 7 -6.209 9.486 7.970 1.00 42.04 C ATOM 114 O GLY A 7 -6.774 8.672 8.711 1.00 14.20 O ATOM 0 H GLY A 7 -3.673 10.681 6.469 1.00 1.12 H new ATOM 0 HA2 GLY A 7 -4.250 8.725 8.435 1.00 14.41 H new ATOM 0 HA3 GLY A 7 -4.393 10.465 8.586 1.00 14.41 H new ATOM 118 N ALA A 8 -6.870 10.290 7.119 1.00 53.32 N ATOM 119 CA ALA A 8 -8.346 10.320 6.998 1.00 70.04 C ATOM 120 C ALA A 8 -8.916 9.030 6.348 1.00 24.40 C ATOM 121 O ALA A 8 -9.784 8.360 6.930 1.00 15.32 O ATOM 122 CB ALA A 8 -8.773 11.565 6.199 1.00 14.43 C ATOM 0 H ALA A 8 -6.398 10.941 6.492 1.00 53.32 H new ATOM 0 HA ALA A 8 -8.760 10.370 8.005 1.00 70.04 H new ATOM 0 HB1 ALA A 8 -9.859 11.586 6.111 1.00 14.43 H new ATOM 0 HB2 ALA A 8 -8.434 12.463 6.716 1.00 14.43 H new ATOM 0 HB3 ALA A 8 -8.329 11.529 5.204 1.00 14.43 H new ATOM 128 N ASN A 9 -8.410 8.680 5.149 1.00 42.12 N ATOM 129 CA ASN A 9 -8.931 7.536 4.348 1.00 52.44 C ATOM 130 C ASN A 9 -8.565 6.148 4.952 1.00 61.14 C ATOM 131 O ASN A 9 -9.235 5.140 4.669 1.00 31.01 O ATOM 132 CB ASN A 9 -8.465 7.656 2.866 1.00 33.14 C ATOM 133 CG ASN A 9 -6.943 7.769 2.678 1.00 54.44 C ATOM 134 OD1 ASN A 9 -6.162 7.239 3.449 1.00 32.04 O ATOM 135 ND2 ASN A 9 -6.507 8.465 1.645 1.00 10.14 N ATOM 0 H ASN A 9 -7.635 9.173 4.705 1.00 42.12 H new ATOM 0 HA ASN A 9 -10.019 7.594 4.380 1.00 52.44 H new ATOM 0 HB2 ASN A 9 -8.822 6.785 2.316 1.00 33.14 H new ATOM 0 HB3 ASN A 9 -8.938 8.531 2.420 1.00 33.14 H new ATOM 0 HD21 ASN A 9 -5.505 8.565 1.484 1.00 10.14 H new ATOM 0 HD22 ASN A 9 -7.172 8.903 1.008 1.00 10.14 H new ATOM 142 N ALA A 10 -7.516 6.117 5.801 1.00 73.05 N ATOM 143 CA ALA A 10 -7.079 4.895 6.515 1.00 73.04 C ATOM 144 C ALA A 10 -8.127 4.429 7.550 1.00 74.30 C ATOM 145 O ALA A 10 -8.252 3.232 7.817 1.00 53.01 O ATOM 146 CB ALA A 10 -5.736 5.145 7.199 1.00 53.40 C ATOM 0 H ALA A 10 -6.947 6.937 6.012 1.00 73.05 H new ATOM 0 HA ALA A 10 -6.970 4.099 5.778 1.00 73.04 H new ATOM 0 HB1 ALA A 10 -5.421 4.242 7.722 1.00 53.40 H new ATOM 0 HB2 ALA A 10 -4.990 5.410 6.450 1.00 53.40 H new ATOM 0 HB3 ALA A 10 -5.838 5.962 7.914 1.00 53.40 H new ATOM 152 N GLY A 11 -8.876 5.394 8.114 1.00 22.13 N ATOM 153 CA GLY A 11 -9.963 5.092 9.055 1.00 20.41 C ATOM 154 C GLY A 11 -11.137 4.356 8.400 1.00 62.31 C ATOM 155 O GLY A 11 -11.746 3.473 9.006 1.00 62.32 O ATOM 0 H GLY A 11 -8.746 6.389 7.932 1.00 22.13 H new ATOM 0 HA2 GLY A 11 -9.571 4.485 9.871 1.00 20.41 H new ATOM 0 HA3 GLY A 11 -10.324 6.022 9.494 1.00 20.41 H new ATOM 159 N LYS A 12 -11.424 4.713 7.134 1.00 13.42 N ATOM 160 CA LYS A 12 -12.547 4.144 6.359 1.00 31.01 C ATOM 161 C LYS A 12 -12.252 2.692 5.899 1.00 1.43 C ATOM 162 O LYS A 12 -13.124 1.817 5.989 1.00 23.42 O ATOM 163 CB LYS A 12 -12.860 5.071 5.153 1.00 52.53 C ATOM 164 CG LYS A 12 -14.102 4.667 4.316 1.00 32.14 C ATOM 165 CD LYS A 12 -14.524 5.758 3.298 1.00 2.50 C ATOM 166 CE LYS A 12 -13.420 6.105 2.277 1.00 42.35 C ATOM 167 NZ LYS A 12 -13.818 7.234 1.395 1.00 31.44 N ATOM 0 H LYS A 12 -10.883 5.406 6.617 1.00 13.42 H new ATOM 0 HA LYS A 12 -13.425 4.090 7.003 1.00 31.01 H new ATOM 0 HB2 LYS A 12 -13.005 6.086 5.523 1.00 52.53 H new ATOM 0 HB3 LYS A 12 -11.990 5.093 4.496 1.00 52.53 H new ATOM 0 HG2 LYS A 12 -13.888 3.741 3.781 1.00 32.14 H new ATOM 0 HG3 LYS A 12 -14.936 4.462 4.988 1.00 32.14 H new ATOM 0 HD2 LYS A 12 -15.411 5.420 2.762 1.00 2.50 H new ATOM 0 HD3 LYS A 12 -14.804 6.661 3.840 1.00 2.50 H new ATOM 0 HE2 LYS A 12 -12.503 6.364 2.807 1.00 42.35 H new ATOM 0 HE3 LYS A 12 -13.200 5.228 1.668 1.00 42.35 H new ATOM 0 HZ1 LYS A 12 -13.563 7.013 0.411 1.00 31.44 H new ATOM 0 HZ2 LYS A 12 -14.845 7.381 1.461 1.00 31.44 H new ATOM 0 HZ3 LYS A 12 -13.325 8.099 1.695 1.00 31.44 H new ATOM 181 N VAL A 13 -11.012 2.435 5.422 1.00 22.30 N ATOM 182 CA VAL A 13 -10.587 1.071 5.008 1.00 75.30 C ATOM 183 C VAL A 13 -10.473 0.115 6.228 1.00 65.23 C ATOM 184 O VAL A 13 -10.871 -1.053 6.151 1.00 1.25 O ATOM 185 CB VAL A 13 -9.244 1.083 4.168 1.00 55.30 C ATOM 186 CG1 VAL A 13 -9.416 1.884 2.858 1.00 13.11 C ATOM 187 CG2 VAL A 13 -8.048 1.629 4.979 1.00 62.31 C ATOM 0 H VAL A 13 -10.290 3.147 5.313 1.00 22.30 H new ATOM 0 HA VAL A 13 -11.369 0.690 4.352 1.00 75.30 H new ATOM 0 HB VAL A 13 -9.022 0.045 3.919 1.00 55.30 H new ATOM 0 HG11 VAL A 13 -8.479 1.876 2.301 1.00 13.11 H new ATOM 0 HG12 VAL A 13 -10.201 1.429 2.254 1.00 13.11 H new ATOM 0 HG13 VAL A 13 -9.689 2.913 3.094 1.00 13.11 H new ATOM 0 HG21 VAL A 13 -7.152 1.616 4.359 1.00 62.31 H new ATOM 0 HG22 VAL A 13 -8.258 2.652 5.293 1.00 62.31 H new ATOM 0 HG23 VAL A 13 -7.889 1.005 5.858 1.00 62.31 H new ATOM 197 N TRP A 14 -9.965 0.653 7.359 1.00 24.31 N ATOM 198 CA TRP A 14 -9.848 -0.079 8.647 1.00 42.32 C ATOM 199 C TRP A 14 -11.242 -0.461 9.215 1.00 72.23 C ATOM 200 O TRP A 14 -11.420 -1.529 9.816 1.00 5.01 O ATOM 201 CB TRP A 14 -9.064 0.786 9.669 1.00 70.53 C ATOM 202 CG TRP A 14 -8.647 0.060 10.932 1.00 41.41 C ATOM 203 CD1 TRP A 14 -7.521 -0.688 11.126 1.00 2.21 C ATOM 204 CD2 TRP A 14 -9.364 0.022 12.168 1.00 51.22 C ATOM 205 NE1 TRP A 14 -7.493 -1.171 12.412 1.00 64.14 N ATOM 206 CE2 TRP A 14 -8.614 -0.744 13.072 1.00 42.12 C ATOM 207 CE3 TRP A 14 -10.567 0.580 12.585 1.00 24.13 C ATOM 208 CZ2 TRP A 14 -9.039 -0.978 14.378 1.00 73.24 C ATOM 209 CZ3 TRP A 14 -10.997 0.352 13.878 1.00 72.25 C ATOM 210 CH2 TRP A 14 -10.230 -0.416 14.768 1.00 1.21 C ATOM 0 H TRP A 14 -9.622 1.612 7.408 1.00 24.31 H new ATOM 0 HA TRP A 14 -9.305 -1.006 8.465 1.00 42.32 H new ATOM 0 HB2 TRP A 14 -8.172 1.179 9.182 1.00 70.53 H new ATOM 0 HB3 TRP A 14 -9.679 1.642 9.946 1.00 70.53 H new ATOM 0 HD1 TRP A 14 -6.764 -0.873 10.378 1.00 2.21 H new ATOM 0 HE1 TRP A 14 -6.756 -1.753 12.810 1.00 64.14 H new ATOM 0 HE3 TRP A 14 -11.156 1.182 11.909 1.00 24.13 H new ATOM 0 HZ2 TRP A 14 -8.454 -1.579 15.058 1.00 73.24 H new ATOM 0 HZ3 TRP A 14 -11.936 0.770 14.209 1.00 72.25 H new ATOM 0 HH2 TRP A 14 -10.583 -0.568 15.777 1.00 1.21 H new ATOM 221 N HIS A 15 -12.215 0.442 9.016 1.00 12.11 N ATOM 222 CA HIS A 15 -13.621 0.250 9.440 1.00 35.34 C ATOM 223 C HIS A 15 -14.274 -0.954 8.702 1.00 51.10 C ATOM 224 O HIS A 15 -15.013 -1.741 9.303 1.00 70.11 O ATOM 225 CB HIS A 15 -14.403 1.565 9.174 1.00 40.53 C ATOM 226 CG HIS A 15 -15.802 1.608 9.736 1.00 22.41 C ATOM 227 ND1 HIS A 15 -16.151 2.391 10.811 1.00 41.23 N ATOM 228 CD2 HIS A 15 -16.942 0.982 9.354 1.00 22.34 C ATOM 229 CE1 HIS A 15 -17.429 2.240 11.066 1.00 62.24 C ATOM 230 NE2 HIS A 15 -17.935 1.389 10.202 1.00 61.13 N ATOM 0 H HIS A 15 -12.052 1.336 8.552 1.00 12.11 H new ATOM 0 HA HIS A 15 -13.651 0.019 10.505 1.00 35.34 H new ATOM 0 HB2 HIS A 15 -13.836 2.397 9.592 1.00 40.53 H new ATOM 0 HB3 HIS A 15 -14.457 1.725 8.097 1.00 40.53 H new ATOM 0 HD2 HIS A 15 -17.047 0.290 8.532 1.00 22.34 H new ATOM 0 HE1 HIS A 15 -17.975 2.734 11.856 1.00 62.24 H new ATOM 0 HE2 HIS A 15 -18.907 1.083 10.169 1.00 61.13 H new ATOM 239 N ALA A 16 -13.979 -1.078 7.399 1.00 51.11 N ATOM 240 CA ALA A 16 -14.482 -2.187 6.549 1.00 72.52 C ATOM 241 C ALA A 16 -13.862 -3.562 6.933 1.00 65.05 C ATOM 242 O ALA A 16 -14.436 -4.620 6.634 1.00 24.34 O ATOM 243 CB ALA A 16 -14.215 -1.859 5.075 1.00 54.15 C ATOM 0 H ALA A 16 -13.386 -0.417 6.898 1.00 51.11 H new ATOM 0 HA ALA A 16 -15.555 -2.278 6.716 1.00 72.52 H new ATOM 0 HB1 ALA A 16 -14.583 -2.672 4.449 1.00 54.15 H new ATOM 0 HB2 ALA A 16 -14.728 -0.935 4.809 1.00 54.15 H new ATOM 0 HB3 ALA A 16 -13.143 -1.737 4.918 1.00 54.15 H new ATOM 249 N LEU A 17 -12.669 -3.527 7.555 1.00 12.44 N ATOM 250 CA LEU A 17 -11.996 -4.724 8.121 1.00 63.13 C ATOM 251 C LEU A 17 -12.679 -5.215 9.427 1.00 53.21 C ATOM 252 O LEU A 17 -12.700 -6.418 9.702 1.00 43.32 O ATOM 253 CB LEU A 17 -10.516 -4.391 8.410 1.00 62.14 C ATOM 254 CG LEU A 17 -9.663 -3.908 7.201 1.00 62.55 C ATOM 255 CD1 LEU A 17 -8.305 -3.350 7.678 1.00 51.42 C ATOM 256 CD2 LEU A 17 -9.483 -5.033 6.159 1.00 3.02 C ATOM 0 H LEU A 17 -12.137 -2.666 7.683 1.00 12.44 H new ATOM 0 HA LEU A 17 -12.071 -5.526 7.386 1.00 63.13 H new ATOM 0 HB2 LEU A 17 -10.484 -3.620 9.180 1.00 62.14 H new ATOM 0 HB3 LEU A 17 -10.042 -5.279 8.829 1.00 62.14 H new ATOM 0 HG LEU A 17 -10.200 -3.097 6.709 1.00 62.55 H new ATOM 0 HD11 LEU A 17 -7.725 -3.018 6.817 1.00 51.42 H new ATOM 0 HD12 LEU A 17 -8.473 -2.507 8.349 1.00 51.42 H new ATOM 0 HD13 LEU A 17 -7.756 -4.130 8.206 1.00 51.42 H new ATOM 0 HD21 LEU A 17 -8.883 -4.665 5.327 1.00 3.02 H new ATOM 0 HD22 LEU A 17 -8.979 -5.881 6.623 1.00 3.02 H new ATOM 0 HD23 LEU A 17 -10.460 -5.348 5.791 1.00 3.02 H new ATOM 268 N ASN A 18 -13.214 -4.266 10.235 1.00 31.44 N ATOM 269 CA ASN A 18 -13.963 -4.575 11.490 1.00 52.33 C ATOM 270 C ASN A 18 -15.223 -5.439 11.189 1.00 25.01 C ATOM 271 O ASN A 18 -15.599 -6.310 11.983 1.00 41.21 O ATOM 272 CB ASN A 18 -14.360 -3.249 12.198 1.00 74.12 C ATOM 273 CG ASN A 18 -15.112 -3.410 13.530 1.00 23.14 C ATOM 274 OD1 ASN A 18 -15.975 -2.609 13.863 1.00 13.42 O ATOM 275 ND2 ASN A 18 -14.781 -4.417 14.320 1.00 2.53 N ATOM 0 H ASN A 18 -13.142 -3.267 10.041 1.00 31.44 H new ATOM 0 HA ASN A 18 -13.318 -5.153 12.152 1.00 52.33 H new ATOM 0 HB2 ASN A 18 -13.455 -2.669 12.379 1.00 74.12 H new ATOM 0 HB3 ASN A 18 -14.981 -2.666 11.518 1.00 74.12 H new ATOM 0 HD21 ASN A 18 -15.247 -4.534 15.220 1.00 2.53 H new ATOM 0 HD22 ASN A 18 -14.060 -5.077 14.030 1.00 2.53 H new ATOM 282 N GLU A 19 -15.864 -5.149 10.039 1.00 52.21 N ATOM 283 CA GLU A 19 -16.932 -5.988 9.440 1.00 14.00 C ATOM 284 C GLU A 19 -16.446 -7.445 9.203 1.00 21.31 C ATOM 285 O GLU A 19 -17.018 -8.402 9.745 1.00 11.14 O ATOM 286 CB GLU A 19 -17.354 -5.360 8.085 1.00 2.32 C ATOM 287 CG GLU A 19 -18.384 -6.170 7.257 1.00 55.01 C ATOM 288 CD GLU A 19 -18.392 -5.773 5.770 1.00 0.13 C ATOM 289 OE1 GLU A 19 -18.557 -4.577 5.467 1.00 1.25 O ATOM 290 OE2 GLU A 19 -18.167 -6.644 4.902 1.00 71.31 O ATOM 0 H GLU A 19 -15.655 -4.315 9.490 1.00 52.21 H new ATOM 0 HA GLU A 19 -17.775 -6.024 10.130 1.00 14.00 H new ATOM 0 HB2 GLU A 19 -17.769 -4.371 8.278 1.00 2.32 H new ATOM 0 HB3 GLU A 19 -16.460 -5.218 7.478 1.00 2.32 H new ATOM 0 HG2 GLU A 19 -18.159 -7.233 7.344 1.00 55.01 H new ATOM 0 HG3 GLU A 19 -19.379 -6.019 7.675 1.00 55.01 H new ATOM 297 N ALA A 20 -15.383 -7.574 8.377 1.00 10.15 N ATOM 298 CA ALA A 20 -14.784 -8.872 7.987 1.00 54.11 C ATOM 299 C ALA A 20 -13.411 -8.646 7.301 1.00 31.12 C ATOM 300 O ALA A 20 -13.335 -8.059 6.213 1.00 40.20 O ATOM 301 CB ALA A 20 -15.733 -9.668 7.062 1.00 61.44 C ATOM 0 H ALA A 20 -14.912 -6.772 7.958 1.00 10.15 H new ATOM 0 HA ALA A 20 -14.629 -9.461 8.891 1.00 54.11 H new ATOM 0 HB1 ALA A 20 -15.267 -10.616 6.792 1.00 61.44 H new ATOM 0 HB2 ALA A 20 -16.672 -9.860 7.582 1.00 61.44 H new ATOM 0 HB3 ALA A 20 -15.930 -9.090 6.159 1.00 61.44 H new ATOM 307 N ASP A 21 -12.334 -9.109 7.955 1.00 75.54 N ATOM 308 CA ASP A 21 -10.942 -8.937 7.475 1.00 30.34 C ATOM 309 C ASP A 21 -10.428 -10.203 6.737 1.00 74.33 C ATOM 310 O ASP A 21 -11.152 -11.193 6.592 1.00 61.30 O ATOM 311 CB ASP A 21 -10.022 -8.549 8.664 1.00 25.13 C ATOM 312 CG ASP A 21 -9.905 -9.639 9.745 1.00 14.32 C ATOM 313 OD1 ASP A 21 -10.942 -10.047 10.302 1.00 73.35 O ATOM 314 OD2 ASP A 21 -8.776 -10.092 10.042 1.00 35.35 O ATOM 0 H ASP A 21 -12.398 -9.617 8.837 1.00 75.54 H new ATOM 0 HA ASP A 21 -10.924 -8.128 6.745 1.00 30.34 H new ATOM 0 HB2 ASP A 21 -9.027 -8.322 8.281 1.00 25.13 H new ATOM 0 HB3 ASP A 21 -10.403 -7.636 9.122 1.00 25.13 H new ATOM 319 N GLY A 22 -9.167 -10.150 6.278 1.00 71.13 N ATOM 320 CA GLY A 22 -8.598 -11.174 5.385 1.00 5.03 C ATOM 321 C GLY A 22 -8.967 -10.947 3.923 1.00 74.41 C ATOM 322 O GLY A 22 -8.995 -11.887 3.122 1.00 20.25 O ATOM 0 H GLY A 22 -8.516 -9.401 6.513 1.00 71.13 H new ATOM 0 HA2 GLY A 22 -7.513 -11.176 5.486 1.00 5.03 H new ATOM 0 HA3 GLY A 22 -8.949 -12.158 5.696 1.00 5.03 H new ATOM 326 N ILE A 23 -9.232 -9.677 3.575 1.00 44.02 N ATOM 327 CA ILE A 23 -9.763 -9.284 2.254 1.00 63.03 C ATOM 328 C ILE A 23 -8.656 -8.650 1.364 1.00 43.14 C ATOM 329 O ILE A 23 -7.717 -8.020 1.868 1.00 74.31 O ATOM 330 CB ILE A 23 -10.996 -8.309 2.442 1.00 33.34 C ATOM 331 CG1 ILE A 23 -11.734 -8.024 1.090 1.00 0.33 C ATOM 332 CG2 ILE A 23 -10.581 -6.993 3.145 1.00 32.23 C ATOM 333 CD1 ILE A 23 -13.034 -7.232 1.223 1.00 10.34 C ATOM 0 H ILE A 23 -9.084 -8.888 4.204 1.00 44.02 H new ATOM 0 HA ILE A 23 -10.108 -10.178 1.734 1.00 63.03 H new ATOM 0 HB ILE A 23 -11.705 -8.821 3.092 1.00 33.34 H new ATOM 0 HG12 ILE A 23 -11.058 -7.478 0.432 1.00 0.33 H new ATOM 0 HG13 ILE A 23 -11.953 -8.975 0.604 1.00 0.33 H new ATOM 0 HG21 ILE A 23 -11.453 -6.349 3.256 1.00 32.23 H new ATOM 0 HG22 ILE A 23 -10.169 -7.220 4.128 1.00 32.23 H new ATOM 0 HG23 ILE A 23 -9.827 -6.482 2.545 1.00 32.23 H new ATOM 0 HD11 ILE A 23 -13.472 -7.084 0.236 1.00 10.34 H new ATOM 0 HD12 ILE A 23 -13.733 -7.783 1.852 1.00 10.34 H new ATOM 0 HD13 ILE A 23 -12.825 -6.263 1.676 1.00 10.34 H new ATOM 345 N SER A 24 -8.771 -8.869 0.037 1.00 55.31 N ATOM 346 CA SER A 24 -7.832 -8.330 -0.986 1.00 21.22 C ATOM 347 C SER A 24 -8.079 -6.822 -1.263 1.00 73.24 C ATOM 348 O SER A 24 -9.175 -6.309 -0.996 1.00 13.52 O ATOM 349 CB SER A 24 -7.983 -9.157 -2.289 1.00 40.54 C ATOM 350 OG SER A 24 -7.111 -8.722 -3.321 1.00 30.11 O ATOM 0 H SER A 24 -9.523 -9.429 -0.364 1.00 55.31 H new ATOM 0 HA SER A 24 -6.814 -8.417 -0.605 1.00 21.22 H new ATOM 0 HB2 SER A 24 -7.787 -10.207 -2.072 1.00 40.54 H new ATOM 0 HB3 SER A 24 -9.013 -9.091 -2.638 1.00 40.54 H new ATOM 0 HG SER A 24 -6.268 -8.412 -2.928 1.00 30.11 H new ATOM 356 N ILE A 25 -7.055 -6.131 -1.836 1.00 1.30 N ATOM 357 CA ILE A 25 -7.077 -4.655 -2.074 1.00 4.04 C ATOM 358 C ILE A 25 -8.311 -4.174 -2.927 1.00 33.12 C ATOM 359 O ILE A 25 -9.064 -3.326 -2.443 1.00 22.01 O ATOM 360 CB ILE A 25 -5.739 -4.132 -2.753 1.00 52.14 C ATOM 361 CG1 ILE A 25 -4.479 -4.479 -1.898 1.00 60.24 C ATOM 362 CG2 ILE A 25 -5.804 -2.603 -3.039 1.00 74.33 C ATOM 363 CD1 ILE A 25 -4.402 -3.771 -0.573 1.00 34.22 C ATOM 0 H ILE A 25 -6.192 -6.578 -2.146 1.00 1.30 H new ATOM 0 HA ILE A 25 -7.167 -4.221 -1.078 1.00 4.04 H new ATOM 0 HB ILE A 25 -5.646 -4.651 -3.707 1.00 52.14 H new ATOM 0 HG12 ILE A 25 -4.462 -5.554 -1.721 1.00 60.24 H new ATOM 0 HG13 ILE A 25 -3.587 -4.237 -2.476 1.00 60.24 H new ATOM 0 HG21 ILE A 25 -4.872 -2.280 -3.503 1.00 74.33 H new ATOM 0 HG22 ILE A 25 -6.636 -2.394 -3.711 1.00 74.33 H new ATOM 0 HG23 ILE A 25 -5.949 -2.064 -2.103 1.00 74.33 H new ATOM 0 HD11 ILE A 25 -3.495 -4.074 -0.051 1.00 34.22 H new ATOM 0 HD12 ILE A 25 -4.383 -2.694 -0.737 1.00 34.22 H new ATOM 0 HD13 ILE A 25 -5.272 -4.031 0.030 1.00 34.22 H new ATOM 375 N PRO A 26 -8.564 -4.699 -4.195 1.00 51.12 N ATOM 376 CA PRO A 26 -9.632 -4.142 -5.075 1.00 33.12 C ATOM 377 C PRO A 26 -11.076 -4.450 -4.586 1.00 30.13 C ATOM 378 O PRO A 26 -12.009 -3.720 -4.914 1.00 4.43 O ATOM 379 CB PRO A 26 -9.328 -4.793 -6.454 1.00 14.11 C ATOM 380 CG PRO A 26 -8.694 -6.108 -6.113 1.00 61.21 C ATOM 381 CD PRO A 26 -7.873 -5.854 -4.859 1.00 21.15 C ATOM 0 HA PRO A 26 -9.613 -3.052 -5.094 1.00 33.12 H new ATOM 0 HB2 PRO A 26 -10.238 -4.930 -7.038 1.00 14.11 H new ATOM 0 HB3 PRO A 26 -8.658 -4.171 -7.048 1.00 14.11 H new ATOM 0 HG2 PRO A 26 -9.450 -6.874 -5.938 1.00 61.21 H new ATOM 0 HG3 PRO A 26 -8.064 -6.462 -6.929 1.00 61.21 H new ATOM 0 HD2 PRO A 26 -7.852 -6.731 -4.212 1.00 21.15 H new ATOM 0 HD3 PRO A 26 -6.838 -5.613 -5.102 1.00 21.15 H new ATOM 389 N GLU A 27 -11.230 -5.505 -3.772 1.00 73.45 N ATOM 390 CA GLU A 27 -12.537 -5.920 -3.208 1.00 42.22 C ATOM 391 C GLU A 27 -12.946 -4.977 -2.064 1.00 44.52 C ATOM 392 O GLU A 27 -14.082 -4.489 -1.983 1.00 54.43 O ATOM 393 CB GLU A 27 -12.430 -7.373 -2.687 1.00 4.23 C ATOM 394 CG GLU A 27 -11.904 -8.386 -3.726 1.00 20.31 C ATOM 395 CD GLU A 27 -12.650 -8.331 -5.077 1.00 13.11 C ATOM 396 OE1 GLU A 27 -13.828 -8.746 -5.133 1.00 61.24 O ATOM 397 OE2 GLU A 27 -12.057 -7.874 -6.085 1.00 2.14 O ATOM 0 H GLU A 27 -10.454 -6.100 -3.482 1.00 73.45 H new ATOM 0 HA GLU A 27 -13.298 -5.869 -3.986 1.00 42.22 H new ATOM 0 HB2 GLU A 27 -11.772 -7.387 -1.818 1.00 4.23 H new ATOM 0 HB3 GLU A 27 -13.413 -7.697 -2.347 1.00 4.23 H new ATOM 0 HG2 GLU A 27 -10.844 -8.200 -3.898 1.00 20.31 H new ATOM 0 HG3 GLU A 27 -11.988 -9.392 -3.315 1.00 20.31 H new ATOM 404 N LEU A 28 -11.973 -4.758 -1.183 1.00 24.53 N ATOM 405 CA LEU A 28 -12.015 -3.763 -0.104 1.00 34.13 C ATOM 406 C LEU A 28 -12.254 -2.333 -0.664 1.00 52.03 C ATOM 407 O LEU A 28 -13.049 -1.557 -0.114 1.00 62.31 O ATOM 408 CB LEU A 28 -10.657 -3.866 0.633 1.00 1.11 C ATOM 409 CG LEU A 28 -10.364 -2.853 1.769 1.00 71.20 C ATOM 410 CD1 LEU A 28 -11.366 -2.981 2.935 1.00 32.32 C ATOM 411 CD2 LEU A 28 -8.905 -3.015 2.247 1.00 53.23 C ATOM 0 H LEU A 28 -11.100 -5.286 -1.198 1.00 24.53 H new ATOM 0 HA LEU A 28 -12.843 -3.957 0.578 1.00 34.13 H new ATOM 0 HB2 LEU A 28 -10.581 -4.869 1.053 1.00 1.11 H new ATOM 0 HB3 LEU A 28 -9.866 -3.771 -0.111 1.00 1.11 H new ATOM 0 HG LEU A 28 -10.491 -1.846 1.371 1.00 71.20 H new ATOM 0 HD11 LEU A 28 -11.121 -2.252 3.707 1.00 32.32 H new ATOM 0 HD12 LEU A 28 -12.376 -2.797 2.569 1.00 32.32 H new ATOM 0 HD13 LEU A 28 -11.310 -3.986 3.354 1.00 32.32 H new ATOM 0 HD21 LEU A 28 -8.702 -2.301 3.046 1.00 53.23 H new ATOM 0 HD22 LEU A 28 -8.754 -4.028 2.619 1.00 53.23 H new ATOM 0 HD23 LEU A 28 -8.227 -2.830 1.414 1.00 53.23 H new ATOM 423 N ALA A 29 -11.588 -2.039 -1.799 1.00 52.20 N ATOM 424 CA ALA A 29 -11.669 -0.735 -2.501 1.00 2.11 C ATOM 425 C ALA A 29 -13.096 -0.409 -3.013 1.00 10.21 C ATOM 426 O ALA A 29 -13.462 0.760 -3.126 1.00 45.32 O ATOM 427 CB ALA A 29 -10.670 -0.708 -3.669 1.00 0.34 C ATOM 0 H ALA A 29 -10.971 -2.706 -2.262 1.00 52.20 H new ATOM 0 HA ALA A 29 -11.414 0.035 -1.772 1.00 2.11 H new ATOM 0 HB1 ALA A 29 -10.734 0.252 -4.181 1.00 0.34 H new ATOM 0 HB2 ALA A 29 -9.659 -0.848 -3.286 1.00 0.34 H new ATOM 0 HB3 ALA A 29 -10.907 -1.509 -4.369 1.00 0.34 H new ATOM 433 N ARG A 30 -13.885 -1.453 -3.328 1.00 73.24 N ATOM 434 CA ARG A 30 -15.289 -1.303 -3.799 1.00 5.02 C ATOM 435 C ARG A 30 -16.250 -0.901 -2.658 1.00 54.52 C ATOM 436 O ARG A 30 -17.196 -0.138 -2.886 1.00 50.42 O ATOM 437 CB ARG A 30 -15.762 -2.612 -4.484 1.00 34.00 C ATOM 438 CG ARG A 30 -14.987 -2.942 -5.776 1.00 63.52 C ATOM 439 CD ARG A 30 -15.363 -4.303 -6.384 1.00 50.20 C ATOM 440 NE ARG A 30 -14.520 -4.626 -7.547 1.00 54.14 N ATOM 441 CZ ARG A 30 -14.217 -5.837 -7.964 1.00 33.25 C ATOM 442 NH1 ARG A 30 -14.666 -6.891 -7.348 1.00 25.02 N ATOM 443 NH2 ARG A 30 -13.449 -5.976 -8.994 1.00 2.34 N ATOM 0 H ARG A 30 -13.576 -2.423 -3.266 1.00 73.24 H new ATOM 0 HA ARG A 30 -15.308 -0.491 -4.526 1.00 5.02 H new ATOM 0 HB2 ARG A 30 -15.654 -3.440 -3.783 1.00 34.00 H new ATOM 0 HB3 ARG A 30 -16.823 -2.528 -4.717 1.00 34.00 H new ATOM 0 HG2 ARG A 30 -15.173 -2.160 -6.512 1.00 63.52 H new ATOM 0 HG3 ARG A 30 -13.918 -2.931 -5.562 1.00 63.52 H new ATOM 0 HD2 ARG A 30 -15.257 -5.082 -5.629 1.00 50.20 H new ATOM 0 HD3 ARG A 30 -16.411 -4.291 -6.685 1.00 50.20 H new ATOM 0 HE ARG A 30 -14.137 -3.842 -8.076 1.00 54.14 H new ATOM 0 HH11 ARG A 30 -15.263 -6.787 -6.528 1.00 25.02 H new ATOM 0 HH12 ARG A 30 -14.421 -7.822 -7.685 1.00 25.02 H new ATOM 0 HH21 ARG A 30 -13.085 -5.153 -9.474 1.00 2.34 H new ATOM 0 HH22 ARG A 30 -13.207 -6.909 -9.327 1.00 2.34 H new ATOM 457 N LYS A 31 -16.010 -1.423 -1.434 1.00 2.24 N ATOM 458 CA LYS A 31 -16.821 -1.068 -0.241 1.00 32.13 C ATOM 459 C LYS A 31 -16.523 0.378 0.231 1.00 45.33 C ATOM 460 O LYS A 31 -17.438 1.142 0.549 1.00 72.20 O ATOM 461 CB LYS A 31 -16.572 -2.064 0.927 1.00 11.52 C ATOM 462 CG LYS A 31 -16.931 -3.541 0.620 1.00 23.22 C ATOM 463 CD LYS A 31 -17.015 -4.418 1.900 1.00 50.42 C ATOM 464 CE LYS A 31 -15.705 -4.452 2.715 1.00 13.15 C ATOM 465 NZ LYS A 31 -15.881 -5.135 4.026 1.00 54.21 N ATOM 0 H LYS A 31 -15.263 -2.091 -1.244 1.00 2.24 H new ATOM 0 HA LYS A 31 -17.869 -1.130 -0.536 1.00 32.13 H new ATOM 0 HB2 LYS A 31 -15.520 -2.013 1.209 1.00 11.52 H new ATOM 0 HB3 LYS A 31 -17.150 -1.738 1.791 1.00 11.52 H new ATOM 0 HG2 LYS A 31 -17.887 -3.577 0.097 1.00 23.22 H new ATOM 0 HG3 LYS A 31 -16.183 -3.960 -0.053 1.00 23.22 H new ATOM 0 HD2 LYS A 31 -17.818 -4.043 2.535 1.00 50.42 H new ATOM 0 HD3 LYS A 31 -17.282 -5.436 1.616 1.00 50.42 H new ATOM 0 HE2 LYS A 31 -14.934 -4.964 2.140 1.00 13.15 H new ATOM 0 HE3 LYS A 31 -15.355 -3.433 2.881 1.00 13.15 H new ATOM 0 HZ1 LYS A 31 -14.982 -5.571 4.314 1.00 54.21 H new ATOM 0 HZ2 LYS A 31 -16.174 -4.441 4.743 1.00 54.21 H new ATOM 0 HZ3 LYS A 31 -16.610 -5.871 3.939 1.00 54.21 H new ATOM 479 N VAL A 32 -15.230 0.736 0.266 1.00 35.34 N ATOM 480 CA VAL A 32 -14.771 2.067 0.738 1.00 12.23 C ATOM 481 C VAL A 32 -14.767 3.125 -0.397 1.00 5.13 C ATOM 482 O VAL A 32 -14.611 4.324 -0.131 1.00 30.21 O ATOM 483 CB VAL A 32 -13.346 1.960 1.390 1.00 63.35 C ATOM 484 CG1 VAL A 32 -13.353 0.926 2.544 1.00 45.32 C ATOM 485 CG2 VAL A 32 -12.259 1.621 0.339 1.00 25.45 C ATOM 0 H VAL A 32 -14.472 0.121 -0.028 1.00 35.34 H new ATOM 0 HA VAL A 32 -15.484 2.403 1.491 1.00 12.23 H new ATOM 0 HB VAL A 32 -13.095 2.936 1.806 1.00 63.35 H new ATOM 0 HG11 VAL A 32 -12.358 0.865 2.984 1.00 45.32 H new ATOM 0 HG12 VAL A 32 -14.068 1.236 3.306 1.00 45.32 H new ATOM 0 HG13 VAL A 32 -13.638 -0.051 2.155 1.00 45.32 H new ATOM 0 HG21 VAL A 32 -11.287 1.556 0.829 1.00 25.45 H new ATOM 0 HG22 VAL A 32 -12.493 0.666 -0.132 1.00 25.45 H new ATOM 0 HG23 VAL A 32 -12.231 2.403 -0.420 1.00 25.45 H new ATOM 495 N ASN A 33 -14.932 2.655 -1.655 1.00 73.15 N ATOM 496 CA ASN A 33 -15.015 3.504 -2.872 1.00 31.34 C ATOM 497 C ASN A 33 -13.734 4.353 -3.113 1.00 42.34 C ATOM 498 O ASN A 33 -13.804 5.500 -3.570 1.00 51.02 O ATOM 499 CB ASN A 33 -16.305 4.377 -2.834 1.00 12.34 C ATOM 500 CG ASN A 33 -17.568 3.526 -2.970 1.00 12.33 C ATOM 501 OD1 ASN A 33 -18.078 3.336 -4.068 1.00 15.11 O ATOM 502 ND2 ASN A 33 -18.069 2.987 -1.871 1.00 70.21 N ATOM 0 H ASN A 33 -15.013 1.659 -1.859 1.00 73.15 H new ATOM 0 HA ASN A 33 -15.079 2.836 -3.731 1.00 31.34 H new ATOM 0 HB2 ASN A 33 -16.340 4.934 -1.897 1.00 12.34 H new ATOM 0 HB3 ASN A 33 -16.272 5.110 -3.640 1.00 12.34 H new ATOM 0 HD21 ASN A 33 -18.899 2.397 -1.925 1.00 70.21 H new ATOM 0 HD22 ASN A 33 -17.625 3.161 -0.969 1.00 70.21 H new ATOM 509 N LEU A 34 -12.561 3.760 -2.822 1.00 12.52 N ATOM 510 CA LEU A 34 -11.237 4.369 -3.115 1.00 72.24 C ATOM 511 C LEU A 34 -10.560 3.651 -4.303 1.00 13.25 C ATOM 512 O LEU A 34 -10.887 2.499 -4.619 1.00 14.21 O ATOM 513 CB LEU A 34 -10.301 4.304 -1.866 1.00 65.42 C ATOM 514 CG LEU A 34 -10.802 5.031 -0.576 1.00 32.11 C ATOM 515 CD1 LEU A 34 -9.802 4.850 0.590 1.00 25.55 C ATOM 516 CD2 LEU A 34 -11.072 6.526 -0.844 1.00 12.11 C ATOM 0 H LEU A 34 -12.498 2.844 -2.377 1.00 12.52 H new ATOM 0 HA LEU A 34 -11.405 5.414 -3.374 1.00 72.24 H new ATOM 0 HB2 LEU A 34 -10.132 3.255 -1.622 1.00 65.42 H new ATOM 0 HB3 LEU A 34 -9.335 4.727 -2.142 1.00 65.42 H new ATOM 0 HG LEU A 34 -11.746 4.570 -0.284 1.00 32.11 H new ATOM 0 HD11 LEU A 34 -10.177 5.366 1.474 1.00 25.55 H new ATOM 0 HD12 LEU A 34 -9.688 3.789 0.810 1.00 25.55 H new ATOM 0 HD13 LEU A 34 -8.835 5.268 0.308 1.00 25.55 H new ATOM 0 HD21 LEU A 34 -11.419 7.003 0.073 1.00 12.11 H new ATOM 0 HD22 LEU A 34 -10.153 7.007 -1.178 1.00 12.11 H new ATOM 0 HD23 LEU A 34 -11.835 6.625 -1.616 1.00 12.11 H new ATOM 528 N SER A 35 -9.627 4.357 -4.965 1.00 33.54 N ATOM 529 CA SER A 35 -8.737 3.764 -5.996 1.00 31.40 C ATOM 530 C SER A 35 -7.856 2.634 -5.400 1.00 63.14 C ATOM 531 O SER A 35 -7.528 2.685 -4.223 1.00 42.34 O ATOM 532 CB SER A 35 -7.833 4.867 -6.594 1.00 51.14 C ATOM 533 OG SER A 35 -8.598 5.918 -7.158 1.00 64.10 O ATOM 0 H SER A 35 -9.464 5.351 -4.806 1.00 33.54 H new ATOM 0 HA SER A 35 -9.362 3.330 -6.777 1.00 31.40 H new ATOM 0 HB2 SER A 35 -7.182 5.266 -5.816 1.00 51.14 H new ATOM 0 HB3 SER A 35 -7.188 4.435 -7.359 1.00 51.14 H new ATOM 0 HG SER A 35 -7.997 6.599 -7.526 1.00 64.10 H new ATOM 539 N VAL A 36 -7.481 1.629 -6.215 1.00 44.31 N ATOM 540 CA VAL A 36 -6.636 0.477 -5.772 1.00 45.31 C ATOM 541 C VAL A 36 -5.293 0.937 -5.124 1.00 71.23 C ATOM 542 O VAL A 36 -4.941 0.485 -4.026 1.00 53.02 O ATOM 543 CB VAL A 36 -6.373 -0.511 -6.974 1.00 44.34 C ATOM 544 CG1 VAL A 36 -5.399 -1.664 -6.605 1.00 31.00 C ATOM 545 CG2 VAL A 36 -7.715 -1.079 -7.509 1.00 52.40 C ATOM 0 H VAL A 36 -7.749 1.583 -7.198 1.00 44.31 H new ATOM 0 HA VAL A 36 -7.193 -0.051 -4.998 1.00 45.31 H new ATOM 0 HB VAL A 36 -5.888 0.068 -7.760 1.00 44.34 H new ATOM 0 HG11 VAL A 36 -5.256 -2.311 -7.471 1.00 31.00 H new ATOM 0 HG12 VAL A 36 -4.439 -1.246 -6.302 1.00 31.00 H new ATOM 0 HG13 VAL A 36 -5.818 -2.245 -5.783 1.00 31.00 H new ATOM 0 HG21 VAL A 36 -7.518 -1.759 -8.338 1.00 52.40 H new ATOM 0 HG22 VAL A 36 -8.226 -1.618 -6.711 1.00 52.40 H new ATOM 0 HG23 VAL A 36 -8.345 -0.259 -7.854 1.00 52.40 H new ATOM 555 N GLU A 37 -4.573 1.853 -5.805 1.00 31.12 N ATOM 556 CA GLU A 37 -3.334 2.485 -5.262 1.00 2.02 C ATOM 557 C GLU A 37 -3.613 3.256 -3.936 1.00 42.30 C ATOM 558 O GLU A 37 -2.823 3.184 -2.995 1.00 30.32 O ATOM 559 CB GLU A 37 -2.687 3.432 -6.318 1.00 14.22 C ATOM 560 CG GLU A 37 -2.232 2.730 -7.619 1.00 10.42 C ATOM 561 CD GLU A 37 -1.645 3.687 -8.694 1.00 44.30 C ATOM 562 OE1 GLU A 37 -2.326 4.676 -9.062 1.00 71.20 O ATOM 563 OE2 GLU A 37 -0.534 3.427 -9.219 1.00 75.42 O ATOM 0 H GLU A 37 -4.824 2.179 -6.739 1.00 31.12 H new ATOM 0 HA GLU A 37 -2.632 1.682 -5.037 1.00 2.02 H new ATOM 0 HB2 GLU A 37 -3.403 4.213 -6.573 1.00 14.22 H new ATOM 0 HB3 GLU A 37 -1.826 3.924 -5.866 1.00 14.22 H new ATOM 0 HG2 GLU A 37 -1.482 1.980 -7.369 1.00 10.42 H new ATOM 0 HG3 GLU A 37 -3.082 2.200 -8.048 1.00 10.42 H new ATOM 570 N SER A 38 -4.765 3.957 -3.871 1.00 64.20 N ATOM 571 CA SER A 38 -5.189 4.740 -2.669 1.00 2.40 C ATOM 572 C SER A 38 -5.554 3.841 -1.466 1.00 44.23 C ATOM 573 O SER A 38 -5.275 4.198 -0.324 1.00 53.41 O ATOM 574 CB SER A 38 -6.397 5.644 -3.017 1.00 10.33 C ATOM 575 OG SER A 38 -6.857 6.406 -1.900 1.00 10.01 O ATOM 0 H SER A 38 -5.431 4.002 -4.642 1.00 64.20 H new ATOM 0 HA SER A 38 -4.333 5.349 -2.377 1.00 2.40 H new ATOM 0 HB2 SER A 38 -6.117 6.322 -3.823 1.00 10.33 H new ATOM 0 HB3 SER A 38 -7.213 5.025 -3.390 1.00 10.33 H new ATOM 0 HG SER A 38 -7.618 6.960 -2.173 1.00 10.01 H new ATOM 581 N THR A 39 -6.187 2.692 -1.741 1.00 3.51 N ATOM 582 CA THR A 39 -6.663 1.746 -0.700 1.00 4.21 C ATOM 583 C THR A 39 -5.475 1.023 -0.037 1.00 13.30 C ATOM 584 O THR A 39 -5.377 0.965 1.186 1.00 3.22 O ATOM 585 CB THR A 39 -7.662 0.698 -1.305 1.00 3.14 C ATOM 586 OG1 THR A 39 -8.787 1.383 -1.879 1.00 61.23 O ATOM 587 CG2 THR A 39 -8.179 -0.314 -0.264 1.00 14.24 C ATOM 0 H THR A 39 -6.388 2.384 -2.692 1.00 3.51 H new ATOM 0 HA THR A 39 -7.189 2.325 0.059 1.00 4.21 H new ATOM 0 HB THR A 39 -7.111 0.140 -2.062 1.00 3.14 H new ATOM 0 HG1 THR A 39 -8.497 1.880 -2.672 1.00 61.23 H new ATOM 0 HG21 THR A 39 -8.865 -1.011 -0.744 1.00 14.24 H new ATOM 0 HG22 THR A 39 -7.338 -0.865 0.157 1.00 14.24 H new ATOM 0 HG23 THR A 39 -8.700 0.217 0.532 1.00 14.24 H new ATOM 595 N ALA A 40 -4.562 0.506 -0.879 1.00 63.44 N ATOM 596 CA ALA A 40 -3.322 -0.181 -0.439 1.00 10.15 C ATOM 597 C ALA A 40 -2.409 0.744 0.406 1.00 53.22 C ATOM 598 O ALA A 40 -1.845 0.332 1.424 1.00 14.14 O ATOM 599 CB ALA A 40 -2.569 -0.686 -1.678 1.00 74.32 C ATOM 0 H ALA A 40 -4.660 0.551 -1.893 1.00 63.44 H new ATOM 0 HA ALA A 40 -3.602 -1.018 0.201 1.00 10.15 H new ATOM 0 HB1 ALA A 40 -1.655 -1.193 -1.367 1.00 74.32 H new ATOM 0 HB2 ALA A 40 -3.201 -1.383 -2.229 1.00 74.32 H new ATOM 0 HB3 ALA A 40 -2.315 0.158 -2.319 1.00 74.32 H new ATOM 605 N LEU A 41 -2.296 1.996 -0.040 1.00 33.10 N ATOM 606 CA LEU A 41 -1.471 3.034 0.606 1.00 65.52 C ATOM 607 C LEU A 41 -2.131 3.545 1.925 1.00 42.50 C ATOM 608 O LEU A 41 -1.428 3.849 2.900 1.00 51.22 O ATOM 609 CB LEU A 41 -1.222 4.150 -0.459 1.00 33.32 C ATOM 610 CG LEU A 41 -0.405 5.429 -0.077 1.00 72.21 C ATOM 611 CD1 LEU A 41 -1.300 6.510 0.543 1.00 43.45 C ATOM 612 CD2 LEU A 41 0.806 5.105 0.826 1.00 33.05 C ATOM 0 H LEU A 41 -2.781 2.329 -0.873 1.00 33.10 H new ATOM 0 HA LEU A 41 -0.508 2.638 0.927 1.00 65.52 H new ATOM 0 HB2 LEU A 41 -0.717 3.684 -1.305 1.00 33.32 H new ATOM 0 HB3 LEU A 41 -2.197 4.483 -0.814 1.00 33.32 H new ATOM 0 HG LEU A 41 -0.003 5.832 -1.007 1.00 72.21 H new ATOM 0 HD11 LEU A 41 -0.696 7.382 0.795 1.00 43.45 H new ATOM 0 HD12 LEU A 41 -2.072 6.797 -0.171 1.00 43.45 H new ATOM 0 HD13 LEU A 41 -1.769 6.120 1.447 1.00 43.45 H new ATOM 0 HD21 LEU A 41 1.340 6.025 1.063 1.00 33.05 H new ATOM 0 HD22 LEU A 41 0.458 4.640 1.748 1.00 33.05 H new ATOM 0 HD23 LEU A 41 1.476 4.421 0.305 1.00 33.05 H new ATOM 624 N ALA A 42 -3.477 3.621 1.950 1.00 50.10 N ATOM 625 CA ALA A 42 -4.248 3.953 3.182 1.00 70.33 C ATOM 626 C ALA A 42 -4.029 2.879 4.277 1.00 53.54 C ATOM 627 O ALA A 42 -3.855 3.190 5.459 1.00 43.43 O ATOM 628 CB ALA A 42 -5.743 4.095 2.850 1.00 73.31 C ATOM 0 H ALA A 42 -4.062 3.457 1.131 1.00 50.10 H new ATOM 0 HA ALA A 42 -3.886 4.905 3.570 1.00 70.33 H new ATOM 0 HB1 ALA A 42 -6.296 4.337 3.758 1.00 73.31 H new ATOM 0 HB2 ALA A 42 -5.879 4.891 2.118 1.00 73.31 H new ATOM 0 HB3 ALA A 42 -6.115 3.157 2.438 1.00 73.31 H new ATOM 634 N VAL A 43 -4.020 1.611 3.846 1.00 32.21 N ATOM 635 CA VAL A 43 -3.668 0.456 4.697 1.00 52.05 C ATOM 636 C VAL A 43 -2.183 0.518 5.166 1.00 63.22 C ATOM 637 O VAL A 43 -1.858 0.066 6.265 1.00 44.43 O ATOM 638 CB VAL A 43 -3.976 -0.889 3.939 1.00 54.52 C ATOM 639 CG1 VAL A 43 -3.442 -2.129 4.693 1.00 71.24 C ATOM 640 CG2 VAL A 43 -5.500 -1.026 3.672 1.00 61.52 C ATOM 0 H VAL A 43 -4.258 1.351 2.889 1.00 32.21 H new ATOM 0 HA VAL A 43 -4.284 0.495 5.595 1.00 52.05 H new ATOM 0 HB VAL A 43 -3.450 -0.846 2.986 1.00 54.52 H new ATOM 0 HG11 VAL A 43 -3.681 -3.030 4.127 1.00 71.24 H new ATOM 0 HG12 VAL A 43 -2.361 -2.048 4.807 1.00 71.24 H new ATOM 0 HG13 VAL A 43 -3.907 -2.185 5.677 1.00 71.24 H new ATOM 0 HG21 VAL A 43 -5.695 -1.961 3.147 1.00 61.52 H new ATOM 0 HG22 VAL A 43 -6.037 -1.023 4.620 1.00 61.52 H new ATOM 0 HG23 VAL A 43 -5.839 -0.190 3.061 1.00 61.52 H new ATOM 650 N GLY A 44 -1.299 1.098 4.330 1.00 20.02 N ATOM 651 CA GLY A 44 0.112 1.333 4.704 1.00 22.33 C ATOM 652 C GLY A 44 0.290 2.288 5.904 1.00 3.24 C ATOM 653 O GLY A 44 1.232 2.144 6.696 1.00 23.51 O ATOM 0 H GLY A 44 -1.537 1.413 3.390 1.00 20.02 H new ATOM 0 HA2 GLY A 44 0.579 0.377 4.941 1.00 22.33 H new ATOM 0 HA3 GLY A 44 0.642 1.743 3.844 1.00 22.33 H new ATOM 657 N TRP A 45 -0.632 3.266 6.031 1.00 4.53 N ATOM 658 CA TRP A 45 -0.699 4.186 7.195 1.00 4.33 C ATOM 659 C TRP A 45 -1.131 3.434 8.484 1.00 31.42 C ATOM 660 O TRP A 45 -0.720 3.783 9.600 1.00 61.44 O ATOM 661 CB TRP A 45 -1.679 5.345 6.889 1.00 60.22 C ATOM 662 CG TRP A 45 -1.784 6.390 7.982 1.00 64.43 C ATOM 663 CD1 TRP A 45 -2.812 6.571 8.870 1.00 31.10 C ATOM 664 CD2 TRP A 45 -0.805 7.387 8.301 1.00 31.32 C ATOM 665 NE1 TRP A 45 -2.545 7.637 9.687 1.00 30.31 N ATOM 666 CE2 TRP A 45 -1.320 8.153 9.361 1.00 14.52 C ATOM 667 CE3 TRP A 45 0.455 7.710 7.784 1.00 22.21 C ATOM 668 CZ2 TRP A 45 -0.627 9.225 9.906 1.00 54.32 C ATOM 669 CZ3 TRP A 45 1.146 8.773 8.330 1.00 52.45 C ATOM 670 CH2 TRP A 45 0.602 9.521 9.383 1.00 44.23 C ATOM 0 H TRP A 45 -1.353 3.443 5.331 1.00 4.53 H new ATOM 0 HA TRP A 45 0.297 4.594 7.369 1.00 4.33 H new ATOM 0 HB2 TRP A 45 -1.366 5.834 5.966 1.00 60.22 H new ATOM 0 HB3 TRP A 45 -2.669 4.927 6.708 1.00 60.22 H new ATOM 0 HD1 TRP A 45 -3.703 5.962 8.918 1.00 31.10 H new ATOM 0 HE1 TRP A 45 -3.160 7.990 10.420 1.00 30.31 H new ATOM 0 HE3 TRP A 45 0.879 7.138 6.972 1.00 22.21 H new ATOM 0 HZ2 TRP A 45 -1.044 9.806 10.716 1.00 54.32 H new ATOM 0 HZ3 TRP A 45 2.119 9.032 7.940 1.00 52.45 H new ATOM 0 HH2 TRP A 45 1.165 10.348 9.790 1.00 44.23 H new ATOM 681 N LEU A 46 -1.980 2.410 8.309 1.00 2.44 N ATOM 682 CA LEU A 46 -2.403 1.506 9.402 1.00 23.42 C ATOM 683 C LEU A 46 -1.239 0.571 9.829 1.00 53.00 C ATOM 684 O LEU A 46 -1.029 0.332 11.021 1.00 44.30 O ATOM 685 CB LEU A 46 -3.625 0.676 8.936 1.00 41.11 C ATOM 686 CG LEU A 46 -4.866 1.504 8.480 1.00 42.41 C ATOM 687 CD1 LEU A 46 -5.950 0.597 7.872 1.00 74.14 C ATOM 688 CD2 LEU A 46 -5.427 2.354 9.642 1.00 30.13 C ATOM 0 H LEU A 46 -2.396 2.181 7.406 1.00 2.44 H new ATOM 0 HA LEU A 46 -2.683 2.104 10.269 1.00 23.42 H new ATOM 0 HB2 LEU A 46 -3.314 0.036 8.110 1.00 41.11 H new ATOM 0 HB3 LEU A 46 -3.928 0.019 9.751 1.00 41.11 H new ATOM 0 HG LEU A 46 -4.539 2.190 7.699 1.00 42.41 H new ATOM 0 HD11 LEU A 46 -6.802 1.204 7.564 1.00 74.14 H new ATOM 0 HD12 LEU A 46 -5.544 0.075 7.005 1.00 74.14 H new ATOM 0 HD13 LEU A 46 -6.274 -0.132 8.615 1.00 74.14 H new ATOM 0 HD21 LEU A 46 -6.291 2.920 9.294 1.00 30.13 H new ATOM 0 HD22 LEU A 46 -5.727 1.699 10.460 1.00 30.13 H new ATOM 0 HD23 LEU A 46 -4.659 3.043 9.993 1.00 30.13 H new ATOM 700 N ALA A 47 -0.489 0.064 8.822 1.00 25.45 N ATOM 701 CA ALA A 47 0.717 -0.793 9.014 1.00 20.43 C ATOM 702 C ALA A 47 1.817 -0.094 9.853 1.00 31.13 C ATOM 703 O ALA A 47 2.629 -0.763 10.509 1.00 32.12 O ATOM 704 CB ALA A 47 1.276 -1.222 7.644 1.00 72.25 C ATOM 0 H ALA A 47 -0.703 0.238 7.840 1.00 25.45 H new ATOM 0 HA ALA A 47 0.406 -1.674 9.576 1.00 20.43 H new ATOM 0 HB1 ALA A 47 2.157 -1.848 7.790 1.00 72.25 H new ATOM 0 HB2 ALA A 47 0.517 -1.785 7.101 1.00 72.25 H new ATOM 0 HB3 ALA A 47 1.551 -0.337 7.070 1.00 72.25 H new ATOM 710 N ARG A 48 1.829 1.255 9.807 1.00 53.30 N ATOM 711 CA ARG A 48 2.686 2.104 10.669 1.00 43.22 C ATOM 712 C ARG A 48 2.521 1.764 12.169 1.00 22.44 C ATOM 713 O ARG A 48 3.502 1.635 12.908 1.00 12.05 O ATOM 714 CB ARG A 48 2.326 3.595 10.427 1.00 20.04 C ATOM 715 CG ARG A 48 3.164 4.616 11.229 1.00 15.01 C ATOM 716 CD ARG A 48 2.776 6.072 10.919 1.00 14.31 C ATOM 717 NE ARG A 48 1.359 6.354 11.235 1.00 40.23 N ATOM 718 CZ ARG A 48 0.922 6.936 12.339 1.00 63.30 C ATOM 719 NH1 ARG A 48 1.739 7.271 13.295 1.00 2.32 N ATOM 720 NH2 ARG A 48 -0.340 7.163 12.488 1.00 3.35 N ATOM 0 H ARG A 48 1.242 1.791 9.168 1.00 53.30 H new ATOM 0 HA ARG A 48 3.726 1.914 10.405 1.00 43.22 H new ATOM 0 HB2 ARG A 48 2.440 3.811 9.365 1.00 20.04 H new ATOM 0 HB3 ARG A 48 1.274 3.742 10.671 1.00 20.04 H new ATOM 0 HG2 ARG A 48 3.036 4.429 12.295 1.00 15.01 H new ATOM 0 HG3 ARG A 48 4.221 4.470 11.005 1.00 15.01 H new ATOM 0 HD2 ARG A 48 3.415 6.746 11.491 1.00 14.31 H new ATOM 0 HD3 ARG A 48 2.959 6.278 9.864 1.00 14.31 H new ATOM 0 HE ARG A 48 0.661 6.077 10.544 1.00 40.23 H new ATOM 0 HH11 ARG A 48 2.738 7.086 13.201 1.00 2.32 H new ATOM 0 HH12 ARG A 48 1.381 7.719 14.138 1.00 2.32 H new ATOM 0 HH21 ARG A 48 -0.997 6.894 11.755 1.00 3.35 H new ATOM 0 HH22 ARG A 48 -0.681 7.612 13.338 1.00 3.35 H new ATOM 734 N GLU A 49 1.262 1.610 12.583 1.00 32.20 N ATOM 735 CA GLU A 49 0.878 1.354 13.989 1.00 71.32 C ATOM 736 C GLU A 49 0.489 -0.127 14.228 1.00 22.20 C ATOM 737 O GLU A 49 0.097 -0.489 15.342 1.00 44.15 O ATOM 738 CB GLU A 49 -0.303 2.290 14.341 1.00 31.54 C ATOM 739 CG GLU A 49 -0.004 3.789 14.136 1.00 62.41 C ATOM 740 CD GLU A 49 -1.230 4.674 14.389 1.00 22.11 C ATOM 741 OE1 GLU A 49 -2.034 4.874 13.449 1.00 74.31 O ATOM 742 OE2 GLU A 49 -1.419 5.153 15.530 1.00 35.52 O ATOM 0 H GLU A 49 0.464 1.659 11.950 1.00 32.20 H new ATOM 0 HA GLU A 49 1.734 1.556 14.633 1.00 71.32 H new ATOM 0 HB2 GLU A 49 -1.164 2.016 13.731 1.00 31.54 H new ATOM 0 HB3 GLU A 49 -0.584 2.126 15.381 1.00 31.54 H new ATOM 0 HG2 GLU A 49 0.801 4.090 14.806 1.00 62.41 H new ATOM 0 HG3 GLU A 49 0.351 3.949 13.118 1.00 62.41 H new ATOM 749 N ASN A 50 0.627 -0.970 13.177 1.00 34.40 N ATOM 750 CA ASN A 50 0.114 -2.371 13.154 1.00 71.22 C ATOM 751 C ASN A 50 -1.398 -2.456 13.474 1.00 54.31 C ATOM 752 O ASN A 50 -1.869 -3.420 14.084 1.00 10.20 O ATOM 753 CB ASN A 50 0.964 -3.314 14.045 1.00 33.14 C ATOM 754 CG ASN A 50 2.296 -3.648 13.385 1.00 24.11 C ATOM 755 OD1 ASN A 50 3.281 -2.947 13.561 1.00 33.31 O ATOM 756 ND2 ASN A 50 2.324 -4.700 12.580 1.00 5.04 N ATOM 0 H ASN A 50 1.099 -0.701 12.314 1.00 34.40 H new ATOM 0 HA ASN A 50 0.223 -2.726 12.129 1.00 71.22 H new ATOM 0 HB2 ASN A 50 1.143 -2.842 15.011 1.00 33.14 H new ATOM 0 HB3 ASN A 50 0.410 -4.233 14.237 1.00 33.14 H new ATOM 0 HD21 ASN A 50 3.184 -4.943 12.088 1.00 5.04 H new ATOM 0 HD22 ASN A 50 1.486 -5.267 12.453 1.00 5.04 H new ATOM 763 N LYS A 51 -2.158 -1.451 12.990 1.00 44.04 N ATOM 764 CA LYS A 51 -3.632 -1.504 12.931 1.00 55.12 C ATOM 765 C LYS A 51 -4.095 -2.569 11.903 1.00 62.45 C ATOM 766 O LYS A 51 -5.248 -3.013 11.917 1.00 21.23 O ATOM 767 CB LYS A 51 -4.224 -0.115 12.570 1.00 65.32 C ATOM 768 CG LYS A 51 -4.238 0.928 13.712 1.00 42.24 C ATOM 769 CD LYS A 51 -4.968 2.235 13.294 1.00 75.11 C ATOM 770 CE LYS A 51 -5.330 3.152 14.477 1.00 22.15 C ATOM 771 NZ LYS A 51 -4.140 3.732 15.148 1.00 1.33 N ATOM 0 H LYS A 51 -1.766 -0.581 12.630 1.00 44.04 H new ATOM 0 HA LYS A 51 -4.000 -1.785 13.918 1.00 55.12 H new ATOM 0 HB2 LYS A 51 -3.656 0.295 11.735 1.00 65.32 H new ATOM 0 HB3 LYS A 51 -5.247 -0.257 12.220 1.00 65.32 H new ATOM 0 HG2 LYS A 51 -4.729 0.502 14.587 1.00 42.24 H new ATOM 0 HG3 LYS A 51 -3.214 1.161 14.003 1.00 42.24 H new ATOM 0 HD2 LYS A 51 -4.335 2.787 12.599 1.00 75.11 H new ATOM 0 HD3 LYS A 51 -5.880 1.975 12.756 1.00 75.11 H new ATOM 0 HE2 LYS A 51 -5.969 3.960 14.121 1.00 22.15 H new ATOM 0 HE3 LYS A 51 -5.910 2.585 15.205 1.00 22.15 H new ATOM 0 HZ1 LYS A 51 -4.438 4.242 16.004 1.00 1.33 H new ATOM 0 HZ2 LYS A 51 -3.483 2.969 15.410 1.00 1.33 H new ATOM 0 HZ3 LYS A 51 -3.664 4.392 14.501 1.00 1.33 H new ATOM 785 N VAL A 52 -3.165 -2.954 11.010 1.00 74.11 N ATOM 786 CA VAL A 52 -3.317 -4.102 10.098 1.00 65.12 C ATOM 787 C VAL A 52 -2.089 -5.034 10.213 1.00 40.43 C ATOM 788 O VAL A 52 -0.973 -4.577 10.496 1.00 45.13 O ATOM 789 CB VAL A 52 -3.503 -3.657 8.600 1.00 22.25 C ATOM 790 CG1 VAL A 52 -4.805 -2.848 8.422 1.00 35.44 C ATOM 791 CG2 VAL A 52 -2.277 -2.862 8.086 1.00 0.43 C ATOM 0 H VAL A 52 -2.274 -2.469 10.900 1.00 74.11 H new ATOM 0 HA VAL A 52 -4.220 -4.634 10.398 1.00 65.12 H new ATOM 0 HB VAL A 52 -3.582 -4.561 7.996 1.00 22.25 H new ATOM 0 HG11 VAL A 52 -4.910 -2.552 7.378 1.00 35.44 H new ATOM 0 HG12 VAL A 52 -5.657 -3.462 8.713 1.00 35.44 H new ATOM 0 HG13 VAL A 52 -4.769 -1.957 9.049 1.00 35.44 H new ATOM 0 HG21 VAL A 52 -2.441 -2.571 7.048 1.00 0.43 H new ATOM 0 HG22 VAL A 52 -2.141 -1.969 8.696 1.00 0.43 H new ATOM 0 HG23 VAL A 52 -1.385 -3.486 8.152 1.00 0.43 H new ATOM 801 N VAL A 53 -2.314 -6.340 10.011 1.00 42.32 N ATOM 802 CA VAL A 53 -1.242 -7.366 9.953 1.00 1.35 C ATOM 803 C VAL A 53 -1.421 -8.210 8.665 1.00 2.32 C ATOM 804 O VAL A 53 -2.543 -8.591 8.309 1.00 3.21 O ATOM 805 CB VAL A 53 -1.203 -8.269 11.257 1.00 71.41 C ATOM 806 CG1 VAL A 53 -0.765 -7.440 12.496 1.00 73.32 C ATOM 807 CG2 VAL A 53 -2.562 -8.956 11.530 1.00 33.43 C ATOM 0 H VAL A 53 -3.249 -6.726 9.881 1.00 42.32 H new ATOM 0 HA VAL A 53 -0.275 -6.863 9.917 1.00 1.35 H new ATOM 0 HB VAL A 53 -0.465 -9.051 11.077 1.00 71.41 H new ATOM 0 HG11 VAL A 53 -0.747 -8.083 13.376 1.00 73.32 H new ATOM 0 HG12 VAL A 53 0.230 -7.029 12.326 1.00 73.32 H new ATOM 0 HG13 VAL A 53 -1.471 -6.625 12.657 1.00 73.32 H new ATOM 0 HG21 VAL A 53 -2.488 -9.563 12.432 1.00 33.43 H new ATOM 0 HG22 VAL A 53 -3.333 -8.197 11.666 1.00 33.43 H new ATOM 0 HG23 VAL A 53 -2.824 -9.592 10.685 1.00 33.43 H new ATOM 817 N ILE A 54 -0.316 -8.456 7.940 1.00 31.25 N ATOM 818 CA ILE A 54 -0.365 -9.011 6.563 1.00 22.43 C ATOM 819 C ILE A 54 0.008 -10.515 6.522 1.00 30.20 C ATOM 820 O ILE A 54 1.037 -10.932 7.055 1.00 13.05 O ATOM 821 CB ILE A 54 0.578 -8.186 5.599 1.00 72.14 C ATOM 822 CG1 ILE A 54 0.216 -6.663 5.634 1.00 23.13 C ATOM 823 CG2 ILE A 54 0.547 -8.723 4.139 1.00 61.33 C ATOM 824 CD1 ILE A 54 -1.207 -6.321 5.198 1.00 11.44 C ATOM 0 H ILE A 54 0.629 -8.280 8.281 1.00 31.25 H new ATOM 0 HA ILE A 54 -1.395 -8.922 6.219 1.00 22.43 H new ATOM 0 HB ILE A 54 1.596 -8.313 5.967 1.00 72.14 H new ATOM 0 HG12 ILE A 54 0.366 -6.294 6.648 1.00 23.13 H new ATOM 0 HG13 ILE A 54 0.914 -6.125 4.992 1.00 23.13 H new ATOM 0 HG21 ILE A 54 1.211 -8.123 3.516 1.00 61.33 H new ATOM 0 HG22 ILE A 54 0.878 -9.762 4.126 1.00 61.33 H new ATOM 0 HG23 ILE A 54 -0.469 -8.661 3.750 1.00 61.33 H new ATOM 0 HD11 ILE A 54 -1.357 -5.243 5.258 1.00 11.44 H new ATOM 0 HD12 ILE A 54 -1.363 -6.652 4.171 1.00 11.44 H new ATOM 0 HD13 ILE A 54 -1.919 -6.823 5.853 1.00 11.44 H new ATOM 836 N GLU A 55 -0.862 -11.309 5.879 1.00 32.42 N ATOM 837 CA GLU A 55 -0.640 -12.744 5.594 1.00 4.44 C ATOM 838 C GLU A 55 -0.737 -12.988 4.082 1.00 60.44 C ATOM 839 O GLU A 55 -1.565 -12.381 3.401 1.00 4.43 O ATOM 840 CB GLU A 55 -1.688 -13.612 6.339 1.00 22.13 C ATOM 841 CG GLU A 55 -1.419 -13.814 7.843 1.00 70.52 C ATOM 842 CD GLU A 55 -0.191 -14.697 8.123 1.00 70.54 C ATOM 843 OE1 GLU A 55 -0.213 -15.891 7.735 1.00 44.24 O ATOM 844 OE2 GLU A 55 0.794 -14.211 8.716 1.00 11.34 O ATOM 0 H GLU A 55 -1.759 -10.969 5.534 1.00 32.42 H new ATOM 0 HA GLU A 55 0.354 -13.025 5.943 1.00 4.44 H new ATOM 0 HB2 GLU A 55 -2.669 -13.152 6.220 1.00 22.13 H new ATOM 0 HB3 GLU A 55 -1.734 -14.590 5.859 1.00 22.13 H new ATOM 0 HG2 GLU A 55 -1.275 -12.842 8.314 1.00 70.52 H new ATOM 0 HG3 GLU A 55 -2.297 -14.265 8.306 1.00 70.52 H new ATOM 851 N ARG A 56 0.127 -13.867 3.545 1.00 2.32 N ATOM 852 CA ARG A 56 0.069 -14.263 2.122 1.00 13.22 C ATOM 853 C ARG A 56 -0.226 -15.769 1.983 1.00 52.34 C ATOM 854 O ARG A 56 0.608 -16.611 2.327 1.00 23.24 O ATOM 855 CB ARG A 56 1.374 -13.868 1.377 1.00 71.12 C ATOM 856 CG ARG A 56 1.686 -12.353 1.429 1.00 13.41 C ATOM 857 CD ARG A 56 2.801 -11.936 0.458 1.00 63.01 C ATOM 858 NE ARG A 56 2.383 -12.115 -0.943 1.00 11.43 N ATOM 859 CZ ARG A 56 3.110 -11.836 -1.999 1.00 34.11 C ATOM 860 NH1 ARG A 56 4.325 -11.383 -1.893 1.00 24.24 N ATOM 861 NH2 ARG A 56 2.605 -12.008 -3.171 1.00 14.01 N ATOM 0 H ARG A 56 0.874 -14.318 4.073 1.00 2.32 H new ATOM 0 HA ARG A 56 -0.752 -13.720 1.653 1.00 13.22 H new ATOM 0 HB2 ARG A 56 2.210 -14.417 1.811 1.00 71.12 H new ATOM 0 HB3 ARG A 56 1.295 -14.178 0.335 1.00 71.12 H new ATOM 0 HG2 ARG A 56 0.780 -11.793 1.196 1.00 13.41 H new ATOM 0 HG3 ARG A 56 1.976 -12.082 2.444 1.00 13.41 H new ATOM 0 HD2 ARG A 56 3.066 -10.893 0.631 1.00 63.01 H new ATOM 0 HD3 ARG A 56 3.695 -12.528 0.652 1.00 63.01 H new ATOM 0 HE ARG A 56 1.448 -12.488 -1.106 1.00 11.43 H new ATOM 0 HH11 ARG A 56 4.736 -11.236 -0.971 1.00 24.24 H new ATOM 0 HH12 ARG A 56 4.867 -11.175 -2.732 1.00 24.24 H new ATOM 0 HH21 ARG A 56 1.652 -12.357 -3.269 1.00 14.01 H new ATOM 0 HH22 ARG A 56 3.158 -11.795 -4.001 1.00 14.01 H new ATOM 875 N LYS A 57 -1.433 -16.093 1.493 1.00 70.22 N ATOM 876 CA LYS A 57 -1.851 -17.488 1.217 1.00 1.22 C ATOM 877 C LYS A 57 -1.979 -17.683 -0.308 1.00 50.04 C ATOM 878 O LYS A 57 -2.687 -16.917 -0.965 1.00 62.05 O ATOM 879 CB LYS A 57 -3.211 -17.810 1.892 1.00 2.23 C ATOM 880 CG LYS A 57 -3.280 -17.589 3.411 1.00 23.20 C ATOM 881 CD LYS A 57 -2.268 -18.410 4.235 1.00 31.14 C ATOM 882 CE LYS A 57 -2.516 -18.264 5.752 1.00 32.53 C ATOM 883 NZ LYS A 57 -2.530 -16.838 6.202 1.00 63.22 N ATOM 0 H LYS A 57 -2.150 -15.401 1.275 1.00 70.22 H new ATOM 0 HA LYS A 57 -1.099 -18.163 1.625 1.00 1.22 H new ATOM 0 HB2 LYS A 57 -3.981 -17.199 1.421 1.00 2.23 H new ATOM 0 HB3 LYS A 57 -3.459 -18.851 1.685 1.00 2.23 H new ATOM 0 HG2 LYS A 57 -3.120 -16.531 3.617 1.00 23.20 H new ATOM 0 HG3 LYS A 57 -4.286 -17.831 3.753 1.00 23.20 H new ATOM 0 HD2 LYS A 57 -2.337 -19.461 3.954 1.00 31.14 H new ATOM 0 HD3 LYS A 57 -1.255 -18.083 3.998 1.00 31.14 H new ATOM 0 HE2 LYS A 57 -3.468 -18.730 6.006 1.00 32.53 H new ATOM 0 HE3 LYS A 57 -1.741 -18.804 6.296 1.00 32.53 H new ATOM 0 HZ1 LYS A 57 -2.991 -16.772 7.132 1.00 63.22 H new ATOM 0 HZ2 LYS A 57 -1.554 -16.487 6.273 1.00 63.22 H new ATOM 0 HZ3 LYS A 57 -3.056 -16.262 5.514 1.00 63.22 H new ATOM 897 N ASN A 58 -1.298 -18.716 -0.849 1.00 4.12 N ATOM 898 CA ASN A 58 -1.293 -19.056 -2.304 1.00 5.54 C ATOM 899 C ASN A 58 -0.811 -17.862 -3.184 1.00 35.25 C ATOM 900 O ASN A 58 -1.221 -17.716 -4.346 1.00 71.55 O ATOM 901 CB ASN A 58 -2.707 -19.543 -2.759 1.00 13.52 C ATOM 902 CG ASN A 58 -3.283 -20.648 -1.867 1.00 15.04 C ATOM 903 OD1 ASN A 58 -3.021 -21.828 -2.062 1.00 4.43 O ATOM 904 ND2 ASN A 58 -4.087 -20.272 -0.887 1.00 4.22 N ATOM 0 H ASN A 58 -0.727 -19.349 -0.289 1.00 4.12 H new ATOM 0 HA ASN A 58 -0.580 -19.868 -2.445 1.00 5.54 H new ATOM 0 HB2 ASN A 58 -3.392 -18.695 -2.763 1.00 13.52 H new ATOM 0 HB3 ASN A 58 -2.646 -19.908 -3.784 1.00 13.52 H new ATOM 0 HD21 ASN A 58 -4.504 -20.971 -0.273 1.00 4.22 H new ATOM 0 HD22 ASN A 58 -4.290 -19.283 -0.745 1.00 4.22 H new ATOM 911 N GLY A 59 0.092 -17.028 -2.618 1.00 13.41 N ATOM 912 CA GLY A 59 0.602 -15.822 -3.296 1.00 62.33 C ATOM 913 C GLY A 59 -0.299 -14.576 -3.147 1.00 73.54 C ATOM 914 O GLY A 59 0.145 -13.453 -3.417 1.00 10.10 O ATOM 0 H GLY A 59 0.482 -17.173 -1.687 1.00 13.41 H new ATOM 0 HA2 GLY A 59 1.591 -15.589 -2.901 1.00 62.33 H new ATOM 0 HA3 GLY A 59 0.725 -16.041 -4.357 1.00 62.33 H new ATOM 918 N LEU A 60 -1.565 -14.775 -2.720 1.00 64.11 N ATOM 919 CA LEU A 60 -2.558 -13.681 -2.572 1.00 71.03 C ATOM 920 C LEU A 60 -2.258 -12.808 -1.330 1.00 5.21 C ATOM 921 O LEU A 60 -1.685 -13.289 -0.352 1.00 3.14 O ATOM 922 CB LEU A 60 -3.995 -14.265 -2.462 1.00 32.13 C ATOM 923 CG LEU A 60 -4.433 -15.261 -3.585 1.00 14.42 C ATOM 924 CD1 LEU A 60 -5.891 -15.726 -3.373 1.00 75.45 C ATOM 925 CD2 LEU A 60 -4.237 -14.663 -4.993 1.00 10.11 C ATOM 0 H LEU A 60 -1.929 -15.694 -2.468 1.00 64.11 H new ATOM 0 HA LEU A 60 -2.487 -13.052 -3.460 1.00 71.03 H new ATOM 0 HB2 LEU A 60 -4.084 -14.773 -1.502 1.00 32.13 H new ATOM 0 HB3 LEU A 60 -4.700 -13.434 -2.449 1.00 32.13 H new ATOM 0 HG LEU A 60 -3.785 -16.135 -3.516 1.00 14.42 H new ATOM 0 HD11 LEU A 60 -6.171 -16.418 -4.167 1.00 75.45 H new ATOM 0 HD12 LEU A 60 -5.977 -16.227 -2.409 1.00 75.45 H new ATOM 0 HD13 LEU A 60 -6.555 -14.862 -3.393 1.00 75.45 H new ATOM 0 HD21 LEU A 60 -4.553 -15.388 -5.743 1.00 10.11 H new ATOM 0 HD22 LEU A 60 -4.834 -13.756 -5.090 1.00 10.11 H new ATOM 0 HD23 LEU A 60 -3.185 -14.422 -5.143 1.00 10.11 H new ATOM 937 N ILE A 61 -2.655 -11.526 -1.387 1.00 54.13 N ATOM 938 CA ILE A 61 -2.396 -10.550 -0.306 1.00 71.10 C ATOM 939 C ILE A 61 -3.667 -10.379 0.574 1.00 64.22 C ATOM 940 O ILE A 61 -4.697 -9.869 0.113 1.00 63.23 O ATOM 941 CB ILE A 61 -1.907 -9.143 -0.872 1.00 3.54 C ATOM 942 CG1 ILE A 61 -0.564 -9.267 -1.695 1.00 2.30 C ATOM 943 CG2 ILE A 61 -1.754 -8.095 0.269 1.00 43.01 C ATOM 944 CD1 ILE A 61 -0.689 -9.883 -3.090 1.00 65.01 C ATOM 0 H ILE A 61 -3.163 -11.134 -2.180 1.00 54.13 H new ATOM 0 HA ILE A 61 -1.586 -10.944 0.309 1.00 71.10 H new ATOM 0 HB ILE A 61 -2.681 -8.795 -1.556 1.00 3.54 H new ATOM 0 HG12 ILE A 61 -0.129 -8.273 -1.796 1.00 2.30 H new ATOM 0 HG13 ILE A 61 0.140 -9.865 -1.117 1.00 2.30 H new ATOM 0 HG21 ILE A 61 -1.419 -7.146 -0.151 1.00 43.01 H new ATOM 0 HG22 ILE A 61 -2.715 -7.954 0.764 1.00 43.01 H new ATOM 0 HG23 ILE A 61 -1.021 -8.450 0.993 1.00 43.01 H new ATOM 0 HD11 ILE A 61 0.293 -9.918 -3.562 1.00 65.01 H new ATOM 0 HD12 ILE A 61 -1.088 -10.894 -3.007 1.00 65.01 H new ATOM 0 HD13 ILE A 61 -1.361 -9.276 -3.697 1.00 65.01 H new ATOM 956 N GLU A 62 -3.584 -10.846 1.838 1.00 73.21 N ATOM 957 CA GLU A 62 -4.659 -10.685 2.839 1.00 73.13 C ATOM 958 C GLU A 62 -4.350 -9.493 3.757 1.00 43.12 C ATOM 959 O GLU A 62 -3.193 -9.284 4.151 1.00 1.41 O ATOM 960 CB GLU A 62 -4.797 -11.943 3.728 1.00 13.21 C ATOM 961 CG GLU A 62 -5.057 -13.266 2.992 1.00 2.25 C ATOM 962 CD GLU A 62 -5.214 -14.434 3.979 1.00 53.51 C ATOM 963 OE1 GLU A 62 -4.214 -14.811 4.623 1.00 34.23 O ATOM 964 OE2 GLU A 62 -6.335 -14.953 4.150 1.00 31.11 O ATOM 0 H GLU A 62 -2.769 -11.346 2.193 1.00 73.21 H new ATOM 0 HA GLU A 62 -5.587 -10.523 2.291 1.00 73.13 H new ATOM 0 HB2 GLU A 62 -3.884 -12.050 4.314 1.00 13.21 H new ATOM 0 HB3 GLU A 62 -5.611 -11.777 4.433 1.00 13.21 H new ATOM 0 HG2 GLU A 62 -5.958 -13.176 2.386 1.00 2.25 H new ATOM 0 HG3 GLU A 62 -4.233 -13.473 2.309 1.00 2.25 H new ATOM 971 N ILE A 63 -5.388 -8.726 4.114 1.00 12.21 N ATOM 972 CA ILE A 63 -5.283 -7.644 5.109 1.00 63.41 C ATOM 973 C ILE A 63 -6.147 -7.954 6.328 1.00 4.21 C ATOM 974 O ILE A 63 -7.378 -7.951 6.250 1.00 11.01 O ATOM 975 CB ILE A 63 -5.709 -6.271 4.521 1.00 40.00 C ATOM 976 CG1 ILE A 63 -4.834 -5.928 3.294 1.00 41.41 C ATOM 977 CG2 ILE A 63 -5.653 -5.141 5.592 1.00 3.04 C ATOM 978 CD1 ILE A 63 -5.191 -4.621 2.655 1.00 54.33 C ATOM 0 H ILE A 63 -6.324 -8.835 3.724 1.00 12.21 H new ATOM 0 HA ILE A 63 -4.235 -7.583 5.402 1.00 63.41 H new ATOM 0 HB ILE A 63 -6.747 -6.346 4.198 1.00 40.00 H new ATOM 0 HG12 ILE A 63 -3.788 -5.901 3.599 1.00 41.41 H new ATOM 0 HG13 ILE A 63 -4.930 -6.723 2.555 1.00 41.41 H new ATOM 0 HG21 ILE A 63 -5.958 -4.197 5.141 1.00 3.04 H new ATOM 0 HG22 ILE A 63 -6.326 -5.385 6.414 1.00 3.04 H new ATOM 0 HG23 ILE A 63 -4.635 -5.050 5.972 1.00 3.04 H new ATOM 0 HD11 ILE A 63 -4.538 -4.443 1.801 1.00 54.33 H new ATOM 0 HD12 ILE A 63 -6.228 -4.651 2.319 1.00 54.33 H new ATOM 0 HD13 ILE A 63 -5.068 -3.816 3.380 1.00 54.33 H new ATOM 990 N TYR A 64 -5.484 -8.178 7.455 1.00 10.13 N ATOM 991 CA TYR A 64 -6.139 -8.497 8.743 1.00 71.34 C ATOM 992 C TYR A 64 -6.277 -7.230 9.609 1.00 4.23 C ATOM 993 O TYR A 64 -5.450 -6.328 9.527 1.00 71.11 O ATOM 994 CB TYR A 64 -5.345 -9.577 9.526 1.00 21.22 C ATOM 995 CG TYR A 64 -5.331 -11.010 8.954 1.00 22.02 C ATOM 996 CD1 TYR A 64 -5.888 -11.332 7.717 1.00 5.41 C ATOM 997 CD2 TYR A 64 -4.752 -12.055 9.688 1.00 11.34 C ATOM 998 CE1 TYR A 64 -5.859 -12.626 7.230 1.00 74.14 C ATOM 999 CE2 TYR A 64 -4.723 -13.348 9.201 1.00 4.51 C ATOM 1000 CZ TYR A 64 -5.282 -13.628 7.971 1.00 34.44 C ATOM 1001 OH TYR A 64 -5.259 -14.916 7.477 1.00 21.23 O ATOM 0 H TYR A 64 -4.466 -8.146 7.515 1.00 10.13 H new ATOM 0 HA TYR A 64 -7.131 -8.889 8.518 1.00 71.34 H new ATOM 0 HB2 TYR A 64 -4.312 -9.239 9.610 1.00 21.22 H new ATOM 0 HB3 TYR A 64 -5.749 -9.623 10.537 1.00 21.22 H new ATOM 0 HD1 TYR A 64 -6.352 -10.555 7.127 1.00 5.41 H new ATOM 0 HD2 TYR A 64 -4.319 -11.845 10.655 1.00 11.34 H new ATOM 0 HE1 TYR A 64 -6.291 -12.849 6.265 1.00 74.14 H new ATOM 0 HE2 TYR A 64 -4.265 -14.136 9.781 1.00 4.51 H new ATOM 0 HH TYR A 64 -4.911 -14.909 6.561 1.00 21.23 H new ATOM 1011 N ASN A 65 -7.319 -7.188 10.448 1.00 63.41 N ATOM 1012 CA ASN A 65 -7.549 -6.080 11.402 1.00 22.34 C ATOM 1013 C ASN A 65 -6.903 -6.428 12.769 1.00 1.12 C ATOM 1014 O ASN A 65 -6.973 -7.579 13.208 1.00 62.54 O ATOM 1015 CB ASN A 65 -9.078 -5.853 11.552 1.00 74.13 C ATOM 1016 CG ASN A 65 -9.443 -4.570 12.306 1.00 10.04 C ATOM 1017 OD1 ASN A 65 -9.588 -4.566 13.522 1.00 20.10 O ATOM 1018 ND2 ASN A 65 -9.594 -3.471 11.589 1.00 40.43 N ATOM 0 H ASN A 65 -8.030 -7.918 10.490 1.00 63.41 H new ATOM 0 HA ASN A 65 -7.091 -5.163 11.032 1.00 22.34 H new ATOM 0 HB2 ASN A 65 -9.530 -5.821 10.561 1.00 74.13 H new ATOM 0 HB3 ASN A 65 -9.513 -6.706 12.073 1.00 74.13 H new ATOM 0 HD21 ASN A 65 -9.837 -2.593 12.047 1.00 40.43 H new ATOM 0 HD22 ASN A 65 -9.468 -3.501 10.577 1.00 40.43 H new ATOM 1025 N GLU A 66 -6.304 -5.434 13.446 1.00 13.44 N ATOM 1026 CA GLU A 66 -5.658 -5.623 14.783 1.00 24.32 C ATOM 1027 C GLU A 66 -6.646 -6.125 15.874 1.00 4.03 C ATOM 1028 O GLU A 66 -6.228 -6.634 16.924 1.00 63.23 O ATOM 1029 CB GLU A 66 -5.031 -4.296 15.266 1.00 41.10 C ATOM 1030 CG GLU A 66 -6.035 -3.116 15.359 1.00 13.30 C ATOM 1031 CD GLU A 66 -5.550 -1.919 16.199 1.00 52.21 C ATOM 1032 OE1 GLU A 66 -4.330 -1.648 16.233 1.00 64.23 O ATOM 1033 OE2 GLU A 66 -6.393 -1.244 16.832 1.00 62.21 O ATOM 0 H GLU A 66 -6.247 -4.478 13.096 1.00 13.44 H new ATOM 0 HA GLU A 66 -4.894 -6.388 14.643 1.00 24.32 H new ATOM 0 HB2 GLU A 66 -4.582 -4.455 16.246 1.00 41.10 H new ATOM 0 HB3 GLU A 66 -4.224 -4.020 14.587 1.00 41.10 H new ATOM 0 HG2 GLU A 66 -6.258 -2.767 14.351 1.00 13.30 H new ATOM 0 HG3 GLU A 66 -6.969 -3.485 15.783 1.00 13.30 H new ATOM 1040 N GLY A 67 -7.950 -5.952 15.610 1.00 33.50 N ATOM 1041 CA GLY A 67 -9.014 -6.336 16.531 1.00 40.42 C ATOM 1042 C GLY A 67 -9.056 -7.827 16.900 1.00 63.14 C ATOM 1043 O GLY A 67 -9.431 -8.166 18.024 1.00 31.13 O ATOM 0 H GLY A 67 -8.291 -5.538 14.743 1.00 33.50 H new ATOM 0 HA2 GLY A 67 -8.907 -5.755 17.447 1.00 40.42 H new ATOM 0 HA3 GLY A 67 -9.972 -6.061 16.089 1.00 40.42 H new ATOM 1047 N HIS A 68 -8.659 -8.731 15.968 1.00 11.31 N ATOM 1048 CA HIS A 68 -8.682 -10.199 16.237 1.00 4.22 C ATOM 1049 C HIS A 68 -7.618 -10.620 17.298 1.00 71.30 C ATOM 1050 O HIS A 68 -7.602 -11.773 17.737 1.00 21.01 O ATOM 1051 CB HIS A 68 -8.550 -11.047 14.932 1.00 73.54 C ATOM 1052 CG HIS A 68 -7.228 -11.005 14.212 1.00 41.42 C ATOM 1053 ND1 HIS A 68 -6.068 -11.554 14.723 1.00 43.45 N ATOM 1054 CD2 HIS A 68 -6.896 -10.526 12.988 1.00 24.33 C ATOM 1055 CE1 HIS A 68 -5.094 -11.409 13.850 1.00 11.31 C ATOM 1056 NE2 HIS A 68 -5.566 -10.793 12.793 1.00 24.20 N ATOM 0 H HIS A 68 -8.324 -8.479 15.038 1.00 11.31 H new ATOM 0 HA HIS A 68 -9.664 -10.414 16.659 1.00 4.22 H new ATOM 0 HB2 HIS A 68 -8.765 -12.086 15.182 1.00 73.54 H new ATOM 0 HB3 HIS A 68 -9.323 -10.719 14.237 1.00 73.54 H new ATOM 0 HD1 HIS A 68 -5.980 -12.002 15.635 1.00 43.45 H new ATOM 0 HD2 HIS A 68 -7.557 -10.027 12.295 1.00 24.33 H new ATOM 0 HE1 HIS A 68 -4.075 -11.742 13.982 1.00 11.31 H new ATOM 1065 N PHE A 69 -6.720 -9.684 17.685 1.00 51.32 N ATOM 1066 CA PHE A 69 -5.788 -9.872 18.822 1.00 3.23 C ATOM 1067 C PHE A 69 -6.480 -9.502 20.161 1.00 61.42 C ATOM 1068 O PHE A 69 -6.508 -10.303 21.103 1.00 33.23 O ATOM 1069 CB PHE A 69 -4.511 -9.010 18.637 1.00 52.50 C ATOM 1070 CG PHE A 69 -3.671 -9.370 17.417 1.00 41.41 C ATOM 1071 CD1 PHE A 69 -2.853 -10.501 17.422 1.00 4.55 C ATOM 1072 CD2 PHE A 69 -3.680 -8.572 16.274 1.00 61.33 C ATOM 1073 CE1 PHE A 69 -2.079 -10.823 16.324 1.00 61.41 C ATOM 1074 CE2 PHE A 69 -2.905 -8.892 15.182 1.00 21.25 C ATOM 1075 CZ PHE A 69 -2.101 -10.015 15.205 1.00 70.40 C ATOM 0 H PHE A 69 -6.621 -8.781 17.220 1.00 51.32 H new ATOM 0 HA PHE A 69 -5.501 -10.923 18.849 1.00 3.23 H new ATOM 0 HB2 PHE A 69 -4.804 -7.963 18.564 1.00 52.50 H new ATOM 0 HB3 PHE A 69 -3.892 -9.106 19.529 1.00 52.50 H new ATOM 0 HD1 PHE A 69 -2.825 -11.134 18.297 1.00 4.55 H new ATOM 0 HD2 PHE A 69 -4.303 -7.691 16.245 1.00 61.33 H new ATOM 0 HE1 PHE A 69 -1.457 -11.706 16.341 1.00 61.41 H new ATOM 0 HE2 PHE A 69 -2.926 -8.263 14.304 1.00 21.25 H new ATOM 0 HZ PHE A 69 -1.490 -10.261 14.349 1.00 70.40 H new ATOM 1085 N ASP A 70 -7.036 -8.273 20.231 1.00 24.40 N ATOM 1086 CA ASP A 70 -7.658 -7.726 21.467 1.00 64.12 C ATOM 1087 C ASP A 70 -9.209 -7.776 21.410 1.00 54.53 C ATOM 1088 O ASP A 70 -9.834 -8.647 22.031 1.00 24.34 O ATOM 1089 CB ASP A 70 -7.160 -6.276 21.701 1.00 2.54 C ATOM 1090 CG ASP A 70 -5.647 -6.203 21.954 1.00 75.32 C ATOM 1091 OD1 ASP A 70 -4.864 -6.244 20.983 1.00 5.05 O ATOM 1092 OD2 ASP A 70 -5.231 -6.107 23.129 1.00 45.11 O ATOM 0 H ASP A 70 -7.069 -7.631 19.439 1.00 24.40 H new ATOM 0 HA ASP A 70 -7.354 -8.352 22.306 1.00 64.12 H new ATOM 0 HB2 ASP A 70 -7.409 -5.666 20.833 1.00 2.54 H new ATOM 0 HB3 ASP A 70 -7.688 -5.848 22.553 1.00 2.54 H new ATOM 1097 N PHE A 71 -9.827 -6.849 20.644 1.00 2.22 N ATOM 1098 CA PHE A 71 -11.303 -6.714 20.568 1.00 4.44 C ATOM 1099 C PHE A 71 -11.763 -6.338 19.135 1.00 61.03 C ATOM 1100 O PHE A 71 -11.320 -5.337 18.563 1.00 23.24 O ATOM 1101 CB PHE A 71 -11.819 -5.679 21.620 1.00 10.31 C ATOM 1102 CG PHE A 71 -11.216 -4.270 21.507 1.00 73.22 C ATOM 1103 CD1 PHE A 71 -9.986 -3.966 22.091 1.00 63.44 C ATOM 1104 CD2 PHE A 71 -11.877 -3.251 20.814 1.00 24.44 C ATOM 1105 CE1 PHE A 71 -9.438 -2.702 21.982 1.00 70.34 C ATOM 1106 CE2 PHE A 71 -11.329 -1.987 20.708 1.00 3.31 C ATOM 1107 CZ PHE A 71 -10.110 -1.712 21.291 1.00 4.23 C ATOM 0 H PHE A 71 -9.323 -6.177 20.065 1.00 2.22 H new ATOM 0 HA PHE A 71 -11.741 -7.683 20.806 1.00 4.44 H new ATOM 0 HB2 PHE A 71 -12.902 -5.601 21.527 1.00 10.31 H new ATOM 0 HB3 PHE A 71 -11.612 -6.066 22.618 1.00 10.31 H new ATOM 0 HD1 PHE A 71 -9.454 -4.731 22.637 1.00 63.44 H new ATOM 0 HD2 PHE A 71 -12.832 -3.456 20.354 1.00 24.44 H new ATOM 0 HE1 PHE A 71 -8.483 -2.488 22.438 1.00 70.34 H new ATOM 0 HE2 PHE A 71 -11.856 -1.214 20.168 1.00 3.31 H new ATOM 0 HZ PHE A 71 -9.681 -0.724 21.208 1.00 4.23 H new ATOM 1117 N SER A 72 -12.630 -7.180 18.548 1.00 61.13 N ATOM 1118 CA SER A 72 -13.274 -6.915 17.239 1.00 22.53 C ATOM 1119 C SER A 72 -14.753 -7.325 17.287 1.00 63.22 C ATOM 1120 O SER A 72 -15.115 -8.296 17.962 1.00 52.24 O ATOM 1121 CB SER A 72 -12.567 -7.662 16.086 1.00 65.13 C ATOM 1122 OG SER A 72 -13.138 -7.334 14.825 1.00 21.15 O ATOM 0 H SER A 72 -12.909 -8.068 18.965 1.00 61.13 H new ATOM 0 HA SER A 72 -13.192 -5.845 17.046 1.00 22.53 H new ATOM 0 HB2 SER A 72 -11.507 -7.409 16.083 1.00 65.13 H new ATOM 0 HB3 SER A 72 -12.638 -8.737 16.250 1.00 65.13 H new ATOM 0 HG SER A 72 -12.668 -7.821 14.116 1.00 21.15 H new ATOM 1128 N PHE A 73 -15.595 -6.598 16.549 1.00 72.11 N ATOM 1129 CA PHE A 73 -17.053 -6.791 16.569 1.00 74.01 C ATOM 1130 C PHE A 73 -17.671 -6.429 15.200 1.00 73.23 C ATOM 1131 O PHE A 73 -17.637 -5.273 14.774 1.00 30.33 O ATOM 1132 CB PHE A 73 -17.699 -5.972 17.738 1.00 61.11 C ATOM 1133 CG PHE A 73 -17.454 -4.449 17.712 1.00 22.20 C ATOM 1134 CD1 PHE A 73 -16.191 -3.911 18.000 1.00 51.34 C ATOM 1135 CD2 PHE A 73 -18.484 -3.554 17.407 1.00 23.51 C ATOM 1136 CE1 PHE A 73 -15.976 -2.543 17.982 1.00 43.34 C ATOM 1137 CE2 PHE A 73 -18.264 -2.187 17.391 1.00 75.21 C ATOM 1138 CZ PHE A 73 -17.012 -1.681 17.675 1.00 74.22 C ATOM 0 H PHE A 73 -15.288 -5.857 15.919 1.00 72.11 H new ATOM 0 HA PHE A 73 -17.265 -7.845 16.751 1.00 74.01 H new ATOM 0 HB2 PHE A 73 -18.775 -6.147 17.727 1.00 61.11 H new ATOM 0 HB3 PHE A 73 -17.322 -6.365 18.682 1.00 61.11 H new ATOM 0 HD1 PHE A 73 -15.373 -4.574 18.240 1.00 51.34 H new ATOM 0 HD2 PHE A 73 -19.468 -3.936 17.180 1.00 23.51 H new ATOM 0 HE1 PHE A 73 -14.996 -2.149 18.208 1.00 43.34 H new ATOM 0 HE2 PHE A 73 -19.075 -1.514 17.155 1.00 75.21 H new ATOM 0 HZ PHE A 73 -16.842 -0.615 17.657 1.00 74.22 H new ATOM 1148 N GLY A 74 -18.220 -7.441 14.500 1.00 52.24 N ATOM 1149 CA GLY A 74 -18.993 -7.218 13.265 1.00 20.31 C ATOM 1150 C GLY A 74 -20.467 -6.888 13.549 1.00 64.44 C ATOM 1151 O GLY A 74 -21.367 -7.370 12.847 1.00 2.35 O ATOM 0 H GLY A 74 -18.142 -8.421 14.770 1.00 52.24 H new ATOM 0 HA2 GLY A 74 -18.543 -6.402 12.700 1.00 20.31 H new ATOM 0 HA3 GLY A 74 -18.937 -8.108 12.638 1.00 20.31 H new ATOM 1155 N LEU A 75 -20.701 -6.042 14.581 1.00 50.23 N ATOM 1156 CA LEU A 75 -22.049 -5.650 15.048 1.00 63.32 C ATOM 1157 C LEU A 75 -22.827 -4.898 13.944 1.00 25.31 C ATOM 1158 O LEU A 75 -24.047 -5.048 13.807 1.00 34.21 O ATOM 1159 CB LEU A 75 -21.926 -4.777 16.332 1.00 31.55 C ATOM 1160 CG LEU A 75 -23.265 -4.351 17.018 1.00 41.34 C ATOM 1161 CD1 LEU A 75 -24.090 -5.584 17.452 1.00 3.44 C ATOM 1162 CD2 LEU A 75 -22.997 -3.404 18.212 1.00 64.13 C ATOM 0 H LEU A 75 -19.949 -5.609 15.117 1.00 50.23 H new ATOM 0 HA LEU A 75 -22.611 -6.553 15.285 1.00 63.32 H new ATOM 0 HB2 LEU A 75 -21.329 -5.325 17.061 1.00 31.55 H new ATOM 0 HB3 LEU A 75 -21.370 -3.874 16.079 1.00 31.55 H new ATOM 0 HG LEU A 75 -23.857 -3.804 16.285 1.00 41.34 H new ATOM 0 HD11 LEU A 75 -25.015 -5.255 17.926 1.00 3.44 H new ATOM 0 HD12 LEU A 75 -24.326 -6.190 16.577 1.00 3.44 H new ATOM 0 HD13 LEU A 75 -23.512 -6.178 18.160 1.00 3.44 H new ATOM 0 HD21 LEU A 75 -23.944 -3.122 18.672 1.00 64.13 H new ATOM 0 HD22 LEU A 75 -22.373 -3.913 18.947 1.00 64.13 H new ATOM 0 HD23 LEU A 75 -22.485 -2.509 17.859 1.00 64.13 H new ATOM 1174 N GLU A 76 -22.096 -4.081 13.174 1.00 13.32 N ATOM 1175 CA GLU A 76 -22.603 -3.457 11.942 1.00 72.14 C ATOM 1176 C GLU A 76 -22.799 -4.553 10.871 1.00 1.41 C ATOM 1177 O GLU A 76 -21.814 -5.127 10.382 1.00 62.35 O ATOM 1178 CB GLU A 76 -21.604 -2.376 11.455 1.00 64.21 C ATOM 1179 CG GLU A 76 -21.243 -1.325 12.526 1.00 73.31 C ATOM 1180 CD GLU A 76 -20.199 -0.315 12.035 1.00 51.41 C ATOM 1181 OE1 GLU A 76 -18.983 -0.572 12.185 1.00 34.11 O ATOM 1182 OE2 GLU A 76 -20.585 0.740 11.484 1.00 54.12 O ATOM 0 H GLU A 76 -21.130 -3.832 13.389 1.00 13.32 H new ATOM 0 HA GLU A 76 -23.561 -2.972 12.131 1.00 72.14 H new ATOM 0 HB2 GLU A 76 -20.690 -2.866 11.119 1.00 64.21 H new ATOM 0 HB3 GLU A 76 -22.029 -1.867 10.590 1.00 64.21 H new ATOM 0 HG2 GLU A 76 -22.146 -0.792 12.825 1.00 73.31 H new ATOM 0 HG3 GLU A 76 -20.863 -1.832 13.413 1.00 73.31 H new ATOM 1189 N HIS A 77 -24.067 -4.869 10.547 1.00 51.30 N ATOM 1190 CA HIS A 77 -24.410 -6.028 9.701 1.00 4.30 C ATOM 1191 C HIS A 77 -24.021 -5.802 8.215 1.00 41.24 C ATOM 1192 O HIS A 77 -24.838 -5.343 7.411 1.00 51.30 O ATOM 1193 CB HIS A 77 -25.915 -6.387 9.853 1.00 31.00 C ATOM 1194 CG HIS A 77 -26.341 -7.655 9.132 1.00 24.41 C ATOM 1195 ND1 HIS A 77 -26.209 -8.912 9.683 1.00 31.00 N ATOM 1196 CD2 HIS A 77 -26.885 -7.854 7.903 1.00 14.51 C ATOM 1197 CE1 HIS A 77 -26.645 -9.820 8.834 1.00 3.44 C ATOM 1198 NE2 HIS A 77 -27.060 -9.206 7.748 1.00 11.43 N ATOM 0 H HIS A 77 -24.876 -4.333 10.861 1.00 51.30 H new ATOM 0 HA HIS A 77 -23.822 -6.877 10.048 1.00 4.30 H new ATOM 0 HB2 HIS A 77 -26.144 -6.494 10.913 1.00 31.00 H new ATOM 0 HB3 HIS A 77 -26.512 -5.555 9.480 1.00 31.00 H new ATOM 0 HD2 HIS A 77 -27.134 -7.090 7.182 1.00 14.51 H new ATOM 0 HE1 HIS A 77 -26.659 -10.887 9.001 1.00 3.44 H new ATOM 0 HE2 HIS A 77 -27.450 -9.662 6.923 1.00 11.43 H new ATOM 1207 N HIS A 78 -22.736 -6.093 7.916 1.00 64.21 N ATOM 1208 CA HIS A 78 -22.160 -6.151 6.555 1.00 52.03 C ATOM 1209 C HIS A 78 -22.459 -4.903 5.667 1.00 32.35 C ATOM 1210 O HIS A 78 -23.540 -4.792 5.077 1.00 50.25 O ATOM 1211 CB HIS A 78 -22.609 -7.458 5.851 1.00 13.04 C ATOM 1212 CG HIS A 78 -22.046 -7.633 4.465 1.00 32.55 C ATOM 1213 ND1 HIS A 78 -22.707 -7.222 3.334 1.00 4.02 N ATOM 1214 CD2 HIS A 78 -20.878 -8.166 4.035 1.00 11.30 C ATOM 1215 CE1 HIS A 78 -21.981 -7.491 2.280 1.00 65.20 C ATOM 1216 NE2 HIS A 78 -20.867 -8.062 2.669 1.00 75.11 N ATOM 0 H HIS A 78 -22.048 -6.301 8.640 1.00 64.21 H new ATOM 0 HA HIS A 78 -21.078 -6.146 6.683 1.00 52.03 H new ATOM 0 HB2 HIS A 78 -22.311 -8.309 6.463 1.00 13.04 H new ATOM 0 HB3 HIS A 78 -23.697 -7.472 5.794 1.00 13.04 H new ATOM 0 HD2 HIS A 78 -20.101 -8.593 4.652 1.00 11.30 H new ATOM 0 HE1 HIS A 78 -22.254 -7.278 1.257 1.00 65.20 H new ATOM 0 HE2 HIS A 78 -20.116 -8.377 2.055 1.00 75.11 H new ATOM 1225 N HIS A 79 -21.485 -3.985 5.561 1.00 0.12 N ATOM 1226 CA HIS A 79 -21.546 -2.857 4.607 1.00 2.05 C ATOM 1227 C HIS A 79 -21.391 -3.391 3.161 1.00 42.13 C ATOM 1228 O HIS A 79 -20.325 -3.896 2.790 1.00 23.21 O ATOM 1229 CB HIS A 79 -20.444 -1.807 4.933 1.00 2.24 C ATOM 1230 CG HIS A 79 -20.321 -0.687 3.923 1.00 1.52 C ATOM 1231 ND1 HIS A 79 -21.261 0.310 3.787 1.00 72.43 N ATOM 1232 CD2 HIS A 79 -19.375 -0.428 2.982 1.00 64.33 C ATOM 1233 CE1 HIS A 79 -20.904 1.127 2.816 1.00 43.32 C ATOM 1234 NE2 HIS A 79 -19.766 0.703 2.311 1.00 34.23 N ATOM 0 H HIS A 79 -20.637 -4.000 6.128 1.00 0.12 H new ATOM 0 HA HIS A 79 -22.514 -2.364 4.697 1.00 2.05 H new ATOM 0 HB2 HIS A 79 -20.651 -1.374 5.912 1.00 2.24 H new ATOM 0 HB3 HIS A 79 -19.484 -2.318 5.007 1.00 2.24 H new ATOM 0 HD2 HIS A 79 -18.481 -1.005 2.797 1.00 64.33 H new ATOM 0 HE1 HIS A 79 -21.453 1.998 2.490 1.00 43.32 H new ATOM 0 HE2 HIS A 79 -19.257 1.144 1.545 1.00 34.23 H new ATOM 1243 N HIS A 80 -22.474 -3.299 2.366 1.00 40.10 N ATOM 1244 CA HIS A 80 -22.461 -3.723 0.945 1.00 20.50 C ATOM 1245 C HIS A 80 -21.560 -2.791 0.099 1.00 10.30 C ATOM 1246 O HIS A 80 -21.410 -1.604 0.420 1.00 40.10 O ATOM 1247 CB HIS A 80 -23.902 -3.768 0.366 1.00 32.53 C ATOM 1248 CG HIS A 80 -24.571 -2.421 0.208 1.00 74.04 C ATOM 1249 ND1 HIS A 80 -24.457 -1.653 -0.938 1.00 20.40 N ATOM 1250 CD2 HIS A 80 -25.354 -1.704 1.050 1.00 22.43 C ATOM 1251 CE1 HIS A 80 -25.133 -0.537 -0.790 1.00 40.23 C ATOM 1252 NE2 HIS A 80 -25.686 -0.540 0.403 1.00 13.12 N ATOM 0 H HIS A 80 -23.373 -2.934 2.681 1.00 40.10 H new ATOM 0 HA HIS A 80 -22.046 -4.730 0.899 1.00 20.50 H new ATOM 0 HB2 HIS A 80 -23.871 -4.258 -0.607 1.00 32.53 H new ATOM 0 HB3 HIS A 80 -24.519 -4.389 1.016 1.00 32.53 H new ATOM 0 HD1 HIS A 80 -23.929 -1.914 -1.770 1.00 20.40 H new ATOM 0 HD2 HIS A 80 -25.660 -1.994 2.044 1.00 22.43 H new ATOM 0 HE1 HIS A 80 -25.220 0.250 -1.524 1.00 40.23 H new ATOM 1261 N HIS A 81 -20.987 -3.327 -0.992 1.00 12.15 N ATOM 1262 CA HIS A 81 -20.048 -2.572 -1.856 1.00 45.32 C ATOM 1263 C HIS A 81 -20.784 -1.690 -2.899 1.00 71.25 C ATOM 1264 O HIS A 81 -22.021 -1.665 -2.969 1.00 53.32 O ATOM 1265 CB HIS A 81 -19.050 -3.546 -2.554 1.00 63.33 C ATOM 1266 CG HIS A 81 -19.673 -4.553 -3.490 1.00 43.22 C ATOM 1267 ND1 HIS A 81 -20.097 -5.792 -3.078 1.00 72.43 N ATOM 1268 CD2 HIS A 81 -19.939 -4.500 -4.821 1.00 15.20 C ATOM 1269 CE1 HIS A 81 -20.597 -6.453 -4.099 1.00 62.14 C ATOM 1270 NE2 HIS A 81 -20.515 -5.696 -5.169 1.00 21.53 N ATOM 0 H HIS A 81 -21.155 -4.284 -1.302 1.00 12.15 H new ATOM 0 HA HIS A 81 -19.487 -1.894 -1.212 1.00 45.32 H new ATOM 0 HB2 HIS A 81 -18.325 -2.956 -3.114 1.00 63.33 H new ATOM 0 HB3 HIS A 81 -18.497 -4.085 -1.785 1.00 63.33 H new ATOM 0 HD2 HIS A 81 -19.735 -3.671 -5.482 1.00 15.20 H new ATOM 0 HE1 HIS A 81 -21.007 -7.452 -4.063 1.00 62.14 H new ATOM 0 HE2 HIS A 81 -20.828 -5.954 -6.105 1.00 21.53 H new ATOM 1279 N HIS A 82 -19.986 -0.947 -3.683 1.00 14.51 N ATOM 1280 CA HIS A 82 -20.451 -0.168 -4.846 1.00 32.14 C ATOM 1281 C HIS A 82 -19.464 -0.344 -6.012 1.00 51.24 C ATOM 1282 O HIS A 82 -18.940 -1.439 -6.248 1.00 1.34 O ATOM 1283 CB HIS A 82 -20.608 1.330 -4.459 1.00 21.24 C ATOM 1284 CG HIS A 82 -21.059 2.227 -5.590 1.00 75.05 C ATOM 1285 ND1 HIS A 82 -22.364 2.280 -6.029 1.00 24.11 N ATOM 1286 CD2 HIS A 82 -20.372 3.090 -6.381 1.00 62.10 C ATOM 1287 CE1 HIS A 82 -22.460 3.127 -7.031 1.00 13.44 C ATOM 1288 NE2 HIS A 82 -21.269 3.631 -7.268 1.00 64.21 N ATOM 0 H HIS A 82 -18.981 -0.868 -3.525 1.00 14.51 H new ATOM 0 HA HIS A 82 -21.427 -0.534 -5.164 1.00 32.14 H new ATOM 0 HB2 HIS A 82 -21.326 1.408 -3.642 1.00 21.24 H new ATOM 0 HB3 HIS A 82 -19.654 1.696 -4.080 1.00 21.24 H new ATOM 0 HD2 HIS A 82 -19.316 3.310 -6.323 1.00 62.10 H new ATOM 0 HE1 HIS A 82 -23.365 3.368 -7.569 1.00 13.44 H new ATOM 0 HE2 HIS A 82 -21.048 4.313 -7.993 1.00 64.21 H new TER 1297 HIS A 82 ATOM 1298 N MET B 1 5.491 -13.233 10.488 1.00 41.35 N ATOM 1299 CA MET B 1 6.596 -12.280 10.426 1.00 25.11 C ATOM 1300 C MET B 1 6.299 -11.147 9.401 1.00 40.11 C ATOM 1301 O MET B 1 7.177 -10.753 8.623 1.00 31.22 O ATOM 1302 CB MET B 1 7.926 -13.040 10.101 1.00 33.53 C ATOM 1303 CG MET B 1 7.964 -13.758 8.740 1.00 23.10 C ATOM 1304 SD MET B 1 9.593 -14.455 8.373 1.00 12.23 S ATOM 1305 CE MET B 1 9.400 -14.977 6.665 1.00 72.20 C ATOM 0 H1 MET B 1 5.714 -13.978 11.178 1.00 41.35 H new ATOM 0 H2 MET B 1 4.623 -12.740 10.779 1.00 41.35 H new ATOM 0 H3 MET B 1 5.348 -13.661 9.551 1.00 41.35 H new ATOM 0 HA MET B 1 6.712 -11.797 11.396 1.00 25.11 H new ATOM 0 HB2 MET B 1 8.750 -12.327 10.139 1.00 33.53 H new ATOM 0 HB3 MET B 1 8.104 -13.776 10.885 1.00 33.53 H new ATOM 0 HG2 MET B 1 7.221 -14.555 8.732 1.00 23.10 H new ATOM 0 HG3 MET B 1 7.687 -13.056 7.954 1.00 23.10 H new ATOM 0 HE1 MET B 1 10.291 -15.518 6.347 1.00 72.20 H new ATOM 0 HE2 MET B 1 8.530 -15.628 6.580 1.00 72.20 H new ATOM 0 HE3 MET B 1 9.262 -14.102 6.030 1.00 72.20 H new ATOM 1315 N ASP B 2 5.064 -10.591 9.457 1.00 51.03 N ATOM 1316 CA ASP B 2 4.562 -9.559 8.497 1.00 62.45 C ATOM 1317 C ASP B 2 5.552 -8.377 8.272 1.00 33.14 C ATOM 1318 O ASP B 2 5.892 -8.065 7.130 1.00 30.42 O ATOM 1319 CB ASP B 2 3.157 -9.038 8.940 1.00 73.55 C ATOM 1320 CG ASP B 2 3.077 -8.648 10.429 1.00 0.32 C ATOM 1321 OD1 ASP B 2 3.377 -7.483 10.785 1.00 75.25 O ATOM 1322 OD2 ASP B 2 2.736 -9.520 11.253 1.00 21.44 O ATOM 0 H ASP B 2 4.380 -10.842 10.170 1.00 51.03 H new ATOM 0 HA ASP B 2 4.473 -10.057 7.531 1.00 62.45 H new ATOM 0 HB2 ASP B 2 2.893 -8.172 8.333 1.00 73.55 H new ATOM 0 HB3 ASP B 2 2.414 -9.809 8.736 1.00 73.55 H new ATOM 1327 N LYS B 3 6.037 -7.759 9.364 1.00 52.11 N ATOM 1328 CA LYS B 3 6.979 -6.607 9.291 1.00 50.32 C ATOM 1329 C LYS B 3 8.377 -6.995 8.743 1.00 21.00 C ATOM 1330 O LYS B 3 9.062 -6.153 8.150 1.00 61.04 O ATOM 1331 CB LYS B 3 7.102 -5.912 10.669 1.00 73.21 C ATOM 1332 CG LYS B 3 5.852 -5.095 11.063 1.00 2.33 C ATOM 1333 CD LYS B 3 5.979 -4.385 12.436 1.00 55.45 C ATOM 1334 CE LYS B 3 5.661 -5.295 13.639 1.00 44.50 C ATOM 1335 NZ LYS B 3 6.605 -6.431 13.811 1.00 54.40 N ATOM 0 H LYS B 3 5.796 -8.034 10.316 1.00 52.11 H new ATOM 0 HA LYS B 3 6.553 -5.905 8.575 1.00 50.32 H new ATOM 0 HB2 LYS B 3 7.287 -6.668 11.432 1.00 73.21 H new ATOM 0 HB3 LYS B 3 7.969 -5.251 10.657 1.00 73.21 H new ATOM 0 HG2 LYS B 3 5.660 -4.347 10.294 1.00 2.33 H new ATOM 0 HG3 LYS B 3 4.987 -5.758 11.085 1.00 2.33 H new ATOM 0 HD2 LYS B 3 6.993 -3.999 12.542 1.00 55.45 H new ATOM 0 HD3 LYS B 3 5.307 -3.527 12.454 1.00 55.45 H new ATOM 0 HE2 LYS B 3 5.666 -4.692 14.547 1.00 44.50 H new ATOM 0 HE3 LYS B 3 4.652 -5.690 13.524 1.00 44.50 H new ATOM 0 HZ1 LYS B 3 6.623 -6.719 14.810 1.00 54.40 H new ATOM 0 HZ2 LYS B 3 6.294 -7.232 13.225 1.00 54.40 H new ATOM 0 HZ3 LYS B 3 7.559 -6.137 13.518 1.00 54.40 H new ATOM 1349 N LYS B 4 8.788 -8.259 8.946 1.00 4.12 N ATOM 1350 CA LYS B 4 10.062 -8.800 8.400 1.00 45.14 C ATOM 1351 C LYS B 4 9.980 -8.929 6.855 1.00 41.21 C ATOM 1352 O LYS B 4 10.901 -8.527 6.130 1.00 55.34 O ATOM 1353 CB LYS B 4 10.369 -10.182 9.047 1.00 22.00 C ATOM 1354 CG LYS B 4 10.482 -10.169 10.594 1.00 21.31 C ATOM 1355 CD LYS B 4 11.752 -9.454 11.140 1.00 63.03 C ATOM 1356 CE LYS B 4 13.033 -10.324 11.076 1.00 23.04 C ATOM 1357 NZ LYS B 4 13.457 -10.667 9.691 1.00 34.04 N ATOM 0 H LYS B 4 8.255 -8.938 9.489 1.00 4.12 H new ATOM 0 HA LYS B 4 10.871 -8.110 8.641 1.00 45.14 H new ATOM 0 HB2 LYS B 4 9.585 -10.883 8.761 1.00 22.00 H new ATOM 0 HB3 LYS B 4 11.303 -10.561 8.632 1.00 22.00 H new ATOM 0 HG2 LYS B 4 9.599 -9.680 11.006 1.00 21.31 H new ATOM 0 HG3 LYS B 4 10.475 -11.197 10.955 1.00 21.31 H new ATOM 0 HD2 LYS B 4 11.916 -8.539 10.571 1.00 63.03 H new ATOM 0 HD3 LYS B 4 11.575 -9.159 12.174 1.00 63.03 H new ATOM 0 HE2 LYS B 4 13.845 -9.795 11.574 1.00 23.04 H new ATOM 0 HE3 LYS B 4 12.863 -11.246 11.633 1.00 23.04 H new ATOM 0 HZ1 LYS B 4 14.485 -10.826 9.672 1.00 34.04 H new ATOM 0 HZ2 LYS B 4 12.967 -11.531 9.382 1.00 34.04 H new ATOM 0 HZ3 LYS B 4 13.216 -9.884 9.050 1.00 34.04 H new ATOM 1371 N ILE B 5 8.848 -9.485 6.381 1.00 64.44 N ATOM 1372 CA ILE B 5 8.551 -9.668 4.938 1.00 10.31 C ATOM 1373 C ILE B 5 8.457 -8.307 4.202 1.00 60.10 C ATOM 1374 O ILE B 5 9.176 -8.064 3.227 1.00 54.35 O ATOM 1375 CB ILE B 5 7.201 -10.459 4.750 1.00 65.13 C ATOM 1376 CG1 ILE B 5 7.275 -11.850 5.455 1.00 33.42 C ATOM 1377 CG2 ILE B 5 6.827 -10.615 3.252 1.00 33.13 C ATOM 1378 CD1 ILE B 5 5.954 -12.607 5.511 1.00 44.05 C ATOM 0 H ILE B 5 8.104 -9.824 6.991 1.00 64.44 H new ATOM 0 HA ILE B 5 9.372 -10.240 4.505 1.00 10.31 H new ATOM 0 HB ILE B 5 6.410 -9.875 5.221 1.00 65.13 H new ATOM 0 HG12 ILE B 5 8.009 -12.466 4.936 1.00 33.42 H new ATOM 0 HG13 ILE B 5 7.640 -11.708 6.472 1.00 33.42 H new ATOM 0 HG21 ILE B 5 5.890 -11.166 3.166 1.00 33.13 H new ATOM 0 HG22 ILE B 5 6.711 -9.629 2.801 1.00 33.13 H new ATOM 0 HG23 ILE B 5 7.617 -11.160 2.735 1.00 33.13 H new ATOM 0 HD11 ILE B 5 6.102 -13.561 6.018 1.00 44.05 H new ATOM 0 HD12 ILE B 5 5.219 -12.016 6.057 1.00 44.05 H new ATOM 0 HD13 ILE B 5 5.594 -12.787 4.498 1.00 44.05 H new ATOM 1390 N VAL B 6 7.558 -7.428 4.687 1.00 54.11 N ATOM 1391 CA VAL B 6 7.322 -6.100 4.075 1.00 44.30 C ATOM 1392 C VAL B 6 8.562 -5.185 4.210 1.00 0.15 C ATOM 1393 O VAL B 6 8.770 -4.312 3.380 1.00 14.03 O ATOM 1394 CB VAL B 6 6.044 -5.393 4.672 1.00 52.44 C ATOM 1395 CG1 VAL B 6 4.813 -6.323 4.586 1.00 1.41 C ATOM 1396 CG2 VAL B 6 6.273 -4.912 6.124 1.00 43.14 C ATOM 0 H VAL B 6 6.979 -7.613 5.506 1.00 54.11 H new ATOM 0 HA VAL B 6 7.140 -6.273 3.014 1.00 44.30 H new ATOM 0 HB VAL B 6 5.851 -4.507 4.067 1.00 52.44 H new ATOM 0 HG11 VAL B 6 3.943 -5.815 5.003 1.00 1.41 H new ATOM 0 HG12 VAL B 6 4.620 -6.576 3.543 1.00 1.41 H new ATOM 0 HG13 VAL B 6 5.006 -7.235 5.151 1.00 1.41 H new ATOM 0 HG21 VAL B 6 5.368 -4.431 6.495 1.00 43.14 H new ATOM 0 HG22 VAL B 6 6.516 -5.766 6.756 1.00 43.14 H new ATOM 0 HG23 VAL B 6 7.097 -4.199 6.145 1.00 43.14 H new ATOM 1406 N GLY B 7 9.377 -5.415 5.263 1.00 20.11 N ATOM 1407 CA GLY B 7 10.658 -4.715 5.440 1.00 73.24 C ATOM 1408 C GLY B 7 11.680 -5.049 4.345 1.00 20.43 C ATOM 1409 O GLY B 7 12.392 -4.161 3.852 1.00 43.22 O ATOM 0 H GLY B 7 9.165 -6.084 6.003 1.00 20.11 H new ATOM 0 HA2 GLY B 7 10.480 -3.640 5.447 1.00 73.24 H new ATOM 0 HA3 GLY B 7 11.077 -4.976 6.412 1.00 73.24 H new ATOM 1413 N ALA B 8 11.737 -6.339 3.965 1.00 23.01 N ATOM 1414 CA ALA B 8 12.596 -6.828 2.862 1.00 20.35 C ATOM 1415 C ALA B 8 12.126 -6.283 1.487 1.00 34.33 C ATOM 1416 O ALA B 8 12.917 -5.727 0.713 1.00 53.34 O ATOM 1417 CB ALA B 8 12.603 -8.368 2.854 1.00 35.01 C ATOM 0 H ALA B 8 11.190 -7.075 4.412 1.00 23.01 H new ATOM 0 HA ALA B 8 13.608 -6.461 3.031 1.00 20.35 H new ATOM 0 HB1 ALA B 8 13.236 -8.725 2.041 1.00 35.01 H new ATOM 0 HB2 ALA B 8 12.991 -8.735 3.804 1.00 35.01 H new ATOM 0 HB3 ALA B 8 11.587 -8.736 2.711 1.00 35.01 H new ATOM 1423 N ASN B 9 10.818 -6.436 1.214 1.00 61.04 N ATOM 1424 CA ASN B 9 10.189 -6.032 -0.070 1.00 14.21 C ATOM 1425 C ASN B 9 10.165 -4.495 -0.257 1.00 70.52 C ATOM 1426 O ASN B 9 10.183 -4.003 -1.392 1.00 34.14 O ATOM 1427 CB ASN B 9 8.755 -6.617 -0.160 1.00 23.55 C ATOM 1428 CG ASN B 9 8.732 -8.149 -0.122 1.00 54.04 C ATOM 1429 OD1 ASN B 9 9.651 -8.814 -0.597 1.00 34.42 O ATOM 1430 ND2 ASN B 9 7.688 -8.724 0.446 1.00 71.32 N ATOM 0 H ASN B 9 10.159 -6.845 1.877 1.00 61.04 H new ATOM 0 HA ASN B 9 10.798 -6.437 -0.878 1.00 14.21 H new ATOM 0 HB2 ASN B 9 8.157 -6.229 0.665 1.00 23.55 H new ATOM 0 HB3 ASN B 9 8.286 -6.274 -1.082 1.00 23.55 H new ATOM 0 HD21 ASN B 9 7.631 -9.741 0.498 1.00 71.32 H new ATOM 0 HD22 ASN B 9 6.938 -8.151 0.833 1.00 71.32 H new ATOM 1437 N ALA B 10 10.142 -3.744 0.863 1.00 30.31 N ATOM 1438 CA ALA B 10 10.180 -2.260 0.845 1.00 4.12 C ATOM 1439 C ALA B 10 11.573 -1.737 0.468 1.00 41.31 C ATOM 1440 O ALA B 10 11.691 -0.705 -0.188 1.00 35.34 O ATOM 1441 CB ALA B 10 9.761 -1.689 2.195 1.00 44.42 C ATOM 0 H ALA B 10 10.097 -4.142 1.801 1.00 30.31 H new ATOM 0 HA ALA B 10 9.472 -1.929 0.085 1.00 4.12 H new ATOM 0 HB1 ALA B 10 9.797 -0.600 2.157 1.00 44.42 H new ATOM 0 HB2 ALA B 10 8.746 -2.011 2.427 1.00 44.42 H new ATOM 0 HB3 ALA B 10 10.440 -2.047 2.968 1.00 44.42 H new ATOM 1447 N GLY B 11 12.619 -2.466 0.895 1.00 60.01 N ATOM 1448 CA GLY B 11 14.000 -2.152 0.505 1.00 11.42 C ATOM 1449 C GLY B 11 14.233 -2.320 -1.003 1.00 73.24 C ATOM 1450 O GLY B 11 14.989 -1.565 -1.616 1.00 54.42 O ATOM 0 H GLY B 11 12.532 -3.275 1.510 1.00 60.01 H new ATOM 0 HA2 GLY B 11 14.233 -1.127 0.794 1.00 11.42 H new ATOM 0 HA3 GLY B 11 14.685 -2.800 1.051 1.00 11.42 H new ATOM 1454 N LYS B 12 13.555 -3.325 -1.584 1.00 73.41 N ATOM 1455 CA LYS B 12 13.570 -3.609 -3.034 1.00 53.14 C ATOM 1456 C LYS B 12 12.855 -2.500 -3.858 1.00 44.30 C ATOM 1457 O LYS B 12 13.421 -1.985 -4.835 1.00 51.42 O ATOM 1458 CB LYS B 12 12.929 -5.005 -3.281 1.00 15.54 C ATOM 1459 CG LYS B 12 12.682 -5.371 -4.764 1.00 74.14 C ATOM 1460 CD LYS B 12 12.261 -6.856 -4.974 1.00 31.21 C ATOM 1461 CE LYS B 12 13.452 -7.828 -5.146 1.00 54.51 C ATOM 1462 NZ LYS B 12 14.395 -7.828 -3.998 1.00 61.13 N ATOM 0 H LYS B 12 12.972 -3.973 -1.054 1.00 73.41 H new ATOM 0 HA LYS B 12 14.604 -3.618 -3.378 1.00 53.14 H new ATOM 0 HB2 LYS B 12 13.574 -5.765 -2.840 1.00 15.54 H new ATOM 0 HB3 LYS B 12 11.978 -5.048 -2.751 1.00 15.54 H new ATOM 0 HG2 LYS B 12 11.905 -4.721 -5.166 1.00 74.14 H new ATOM 0 HG3 LYS B 12 13.589 -5.174 -5.335 1.00 74.14 H new ATOM 0 HD2 LYS B 12 11.663 -7.178 -4.121 1.00 31.21 H new ATOM 0 HD3 LYS B 12 11.622 -6.921 -5.855 1.00 31.21 H new ATOM 0 HE2 LYS B 12 13.067 -8.838 -5.289 1.00 54.51 H new ATOM 0 HE3 LYS B 12 13.997 -7.564 -6.052 1.00 54.51 H new ATOM 0 HZ1 LYS B 12 15.013 -8.663 -4.056 1.00 61.13 H new ATOM 0 HZ2 LYS B 12 14.975 -6.965 -4.025 1.00 61.13 H new ATOM 0 HZ3 LYS B 12 13.858 -7.856 -3.108 1.00 61.13 H new ATOM 1476 N VAL B 13 11.616 -2.130 -3.459 1.00 61.22 N ATOM 1477 CA VAL B 13 10.830 -1.094 -4.183 1.00 33.32 C ATOM 1478 C VAL B 13 11.448 0.324 -4.017 1.00 41.10 C ATOM 1479 O VAL B 13 11.426 1.124 -4.953 1.00 21.14 O ATOM 1480 CB VAL B 13 9.297 -1.087 -3.776 1.00 3.51 C ATOM 1481 CG1 VAL B 13 8.640 -2.466 -4.029 1.00 3.43 C ATOM 1482 CG2 VAL B 13 9.081 -0.639 -2.313 1.00 71.14 C ATOM 0 H VAL B 13 11.140 -2.526 -2.649 1.00 61.22 H new ATOM 0 HA VAL B 13 10.881 -1.367 -5.237 1.00 33.32 H new ATOM 0 HB VAL B 13 8.808 -0.352 -4.416 1.00 3.51 H new ATOM 0 HG11 VAL B 13 7.590 -2.427 -3.740 1.00 3.43 H new ATOM 0 HG12 VAL B 13 8.716 -2.717 -5.087 1.00 3.43 H new ATOM 0 HG13 VAL B 13 9.151 -3.226 -3.439 1.00 3.43 H new ATOM 0 HG21 VAL B 13 8.016 -0.651 -2.082 1.00 71.14 H new ATOM 0 HG22 VAL B 13 9.605 -1.320 -1.643 1.00 71.14 H new ATOM 0 HG23 VAL B 13 9.470 0.371 -2.180 1.00 71.14 H new ATOM 1492 N TRP B 14 12.030 0.601 -2.825 1.00 52.53 N ATOM 1493 CA TRP B 14 12.701 1.893 -2.526 1.00 63.12 C ATOM 1494 C TRP B 14 14.042 2.013 -3.288 1.00 43.51 C ATOM 1495 O TRP B 14 14.435 3.111 -3.691 1.00 74.01 O ATOM 1496 CB TRP B 14 12.922 2.063 -0.999 1.00 12.51 C ATOM 1497 CG TRP B 14 13.317 3.467 -0.572 1.00 52.22 C ATOM 1498 CD1 TRP B 14 12.489 4.489 -0.181 1.00 61.20 C ATOM 1499 CD2 TRP B 14 14.644 3.993 -0.509 1.00 31.32 C ATOM 1500 NE1 TRP B 14 13.229 5.600 0.126 1.00 21.05 N ATOM 1501 CE2 TRP B 14 14.556 5.318 -0.072 1.00 53.13 C ATOM 1502 CE3 TRP B 14 15.896 3.452 -0.786 1.00 74.24 C ATOM 1503 CZ2 TRP B 14 15.683 6.112 0.100 1.00 54.00 C ATOM 1504 CZ3 TRP B 14 17.017 4.237 -0.622 1.00 55.24 C ATOM 1505 CH2 TRP B 14 16.905 5.560 -0.180 1.00 65.45 C ATOM 0 H TRP B 14 12.049 -0.059 -2.047 1.00 52.53 H new ATOM 0 HA TRP B 14 12.046 2.695 -2.867 1.00 63.12 H new ATOM 0 HB2 TRP B 14 12.006 1.783 -0.479 1.00 12.51 H new ATOM 0 HB3 TRP B 14 13.697 1.367 -0.677 1.00 12.51 H new ATOM 0 HD1 TRP B 14 11.412 4.427 -0.124 1.00 61.20 H new ATOM 0 HE1 TRP B 14 12.854 6.492 0.449 1.00 21.05 H new ATOM 0 HE3 TRP B 14 15.988 2.431 -1.125 1.00 74.24 H new ATOM 0 HZ2 TRP B 14 15.598 7.132 0.444 1.00 54.00 H new ATOM 0 HZ3 TRP B 14 17.993 3.827 -0.837 1.00 55.24 H new ATOM 0 HH2 TRP B 14 17.797 6.156 -0.058 1.00 65.45 H new ATOM 1516 N HIS B 15 14.749 0.878 -3.456 1.00 3.24 N ATOM 1517 CA HIS B 15 15.974 0.802 -4.295 1.00 64.34 C ATOM 1518 C HIS B 15 15.669 1.260 -5.742 1.00 31.01 C ATOM 1519 O HIS B 15 16.449 1.999 -6.354 1.00 63.21 O ATOM 1520 CB HIS B 15 16.540 -0.643 -4.283 1.00 25.44 C ATOM 1521 CG HIS B 15 17.766 -0.846 -5.136 1.00 62.04 C ATOM 1522 ND1 HIS B 15 19.039 -0.547 -4.709 1.00 5.23 N ATOM 1523 CD2 HIS B 15 17.904 -1.320 -6.398 1.00 54.43 C ATOM 1524 CE1 HIS B 15 19.901 -0.818 -5.666 1.00 40.34 C ATOM 1525 NE2 HIS B 15 19.241 -1.290 -6.701 1.00 1.33 N ATOM 0 H HIS B 15 14.494 -0.008 -3.020 1.00 3.24 H new ATOM 0 HA HIS B 15 16.727 1.472 -3.879 1.00 64.34 H new ATOM 0 HB2 HIS B 15 16.780 -0.916 -3.255 1.00 25.44 H new ATOM 0 HB3 HIS B 15 15.761 -1.327 -4.621 1.00 25.44 H new ATOM 0 HD2 HIS B 15 17.108 -1.659 -7.045 1.00 54.43 H new ATOM 0 HE1 HIS B 15 20.970 -0.677 -5.611 1.00 40.34 H new ATOM 0 HE2 HIS B 15 19.656 -1.585 -7.585 1.00 1.33 H new ATOM 1534 N ALA B 16 14.507 0.823 -6.254 1.00 74.54 N ATOM 1535 CA ALA B 16 14.002 1.235 -7.577 1.00 34.52 C ATOM 1536 C ALA B 16 13.663 2.751 -7.620 1.00 54.14 C ATOM 1537 O ALA B 16 13.820 3.395 -8.656 1.00 3.21 O ATOM 1538 CB ALA B 16 12.781 0.390 -7.951 1.00 30.43 C ATOM 0 H ALA B 16 13.891 0.175 -5.764 1.00 74.54 H new ATOM 0 HA ALA B 16 14.791 1.066 -8.310 1.00 34.52 H new ATOM 0 HB1 ALA B 16 12.411 0.698 -8.929 1.00 30.43 H new ATOM 0 HB2 ALA B 16 13.063 -0.662 -7.984 1.00 30.43 H new ATOM 0 HB3 ALA B 16 11.998 0.532 -7.206 1.00 30.43 H new ATOM 1544 N LEU B 17 13.206 3.305 -6.475 1.00 61.41 N ATOM 1545 CA LEU B 17 12.926 4.759 -6.323 1.00 12.13 C ATOM 1546 C LEU B 17 14.230 5.593 -6.277 1.00 14.11 C ATOM 1547 O LEU B 17 14.277 6.729 -6.763 1.00 22.25 O ATOM 1548 CB LEU B 17 12.111 5.021 -5.032 1.00 42.13 C ATOM 1549 CG LEU B 17 10.747 4.285 -4.924 1.00 62.21 C ATOM 1550 CD1 LEU B 17 10.089 4.551 -3.560 1.00 32.24 C ATOM 1551 CD2 LEU B 17 9.807 4.651 -6.092 1.00 61.30 C ATOM 0 H LEU B 17 13.020 2.763 -5.631 1.00 61.41 H new ATOM 0 HA LEU B 17 12.349 5.067 -7.195 1.00 12.13 H new ATOM 0 HB2 LEU B 17 12.723 4.737 -4.176 1.00 42.13 H new ATOM 0 HB3 LEU B 17 11.930 6.093 -4.952 1.00 42.13 H new ATOM 0 HG LEU B 17 10.940 3.215 -4.998 1.00 62.21 H new ATOM 0 HD11 LEU B 17 9.135 4.026 -3.507 1.00 32.24 H new ATOM 0 HD12 LEU B 17 10.744 4.195 -2.765 1.00 32.24 H new ATOM 0 HD13 LEU B 17 9.921 5.621 -3.440 1.00 32.24 H new ATOM 0 HD21 LEU B 17 8.864 4.116 -5.981 1.00 61.30 H new ATOM 0 HD22 LEU B 17 9.619 5.725 -6.085 1.00 61.30 H new ATOM 0 HD23 LEU B 17 10.274 4.371 -7.036 1.00 61.30 H new ATOM 1563 N ASN B 18 15.284 5.006 -5.686 1.00 42.22 N ATOM 1564 CA ASN B 18 16.607 5.656 -5.527 1.00 32.40 C ATOM 1565 C ASN B 18 17.234 6.008 -6.906 1.00 33.31 C ATOM 1566 O ASN B 18 17.953 7.004 -7.045 1.00 2.13 O ATOM 1567 CB ASN B 18 17.538 4.720 -4.709 1.00 43.10 C ATOM 1568 CG ASN B 18 18.948 5.276 -4.491 1.00 54.32 C ATOM 1569 OD1 ASN B 18 19.859 5.020 -5.275 1.00 43.45 O ATOM 1570 ND2 ASN B 18 19.132 6.065 -3.447 1.00 62.14 N ATOM 0 H ASN B 18 15.248 4.062 -5.301 1.00 42.22 H new ATOM 0 HA ASN B 18 16.480 6.595 -4.988 1.00 32.40 H new ATOM 0 HB2 ASN B 18 17.081 4.528 -3.738 1.00 43.10 H new ATOM 0 HB3 ASN B 18 17.612 3.761 -5.222 1.00 43.10 H new ATOM 0 HD21 ASN B 18 20.048 6.479 -3.276 1.00 62.14 H new ATOM 0 HD22 ASN B 18 18.358 6.260 -2.813 1.00 62.14 H new ATOM 1577 N GLU B 19 16.928 5.185 -7.919 1.00 64.14 N ATOM 1578 CA GLU B 19 17.452 5.332 -9.299 1.00 2.42 C ATOM 1579 C GLU B 19 16.379 5.892 -10.277 1.00 53.44 C ATOM 1580 O GLU B 19 16.730 6.519 -11.288 1.00 3.14 O ATOM 1581 CB GLU B 19 17.984 3.952 -9.768 1.00 53.34 C ATOM 1582 CG GLU B 19 16.939 2.811 -9.715 1.00 23.45 C ATOM 1583 CD GLU B 19 17.562 1.408 -9.750 1.00 70.40 C ATOM 1584 OE1 GLU B 19 18.081 0.961 -8.704 1.00 53.24 O ATOM 1585 OE2 GLU B 19 17.540 0.747 -10.811 1.00 12.00 O ATOM 0 H GLU B 19 16.303 4.387 -7.809 1.00 64.14 H new ATOM 0 HA GLU B 19 18.263 6.060 -9.298 1.00 2.42 H new ATOM 0 HB2 GLU B 19 18.350 4.046 -10.791 1.00 53.34 H new ATOM 0 HB3 GLU B 19 18.837 3.676 -9.148 1.00 53.34 H new ATOM 0 HG2 GLU B 19 16.346 2.914 -8.806 1.00 23.45 H new ATOM 0 HG3 GLU B 19 16.254 2.917 -10.556 1.00 23.45 H new ATOM 1592 N ALA B 20 15.076 5.671 -9.968 1.00 74.32 N ATOM 1593 CA ALA B 20 13.946 6.143 -10.814 1.00 44.40 C ATOM 1594 C ALA B 20 12.605 6.154 -10.022 1.00 74.30 C ATOM 1595 O ALA B 20 11.862 5.165 -10.011 1.00 43.41 O ATOM 1596 CB ALA B 20 13.834 5.275 -12.090 1.00 4.21 C ATOM 0 H ALA B 20 14.779 5.165 -9.133 1.00 74.32 H new ATOM 0 HA ALA B 20 14.152 7.171 -11.112 1.00 44.40 H new ATOM 0 HB1 ALA B 20 13.004 5.631 -12.700 1.00 4.21 H new ATOM 0 HB2 ALA B 20 14.760 5.346 -12.661 1.00 4.21 H new ATOM 0 HB3 ALA B 20 13.659 4.236 -11.809 1.00 4.21 H new ATOM 1602 N ASP B 21 12.321 7.275 -9.333 1.00 63.11 N ATOM 1603 CA ASP B 21 11.076 7.454 -8.540 1.00 0.42 C ATOM 1604 C ASP B 21 10.032 8.312 -9.294 1.00 72.02 C ATOM 1605 O ASP B 21 10.266 8.753 -10.425 1.00 21.22 O ATOM 1606 CB ASP B 21 11.409 8.080 -7.163 1.00 70.43 C ATOM 1607 CG ASP B 21 11.937 9.512 -7.267 1.00 42.10 C ATOM 1608 OD1 ASP B 21 13.109 9.709 -7.652 1.00 20.23 O ATOM 1609 OD2 ASP B 21 11.177 10.450 -6.984 1.00 44.15 O ATOM 0 H ASP B 21 12.942 8.084 -9.306 1.00 63.11 H new ATOM 0 HA ASP B 21 10.633 6.470 -8.386 1.00 0.42 H new ATOM 0 HB2 ASP B 21 10.514 8.073 -6.541 1.00 70.43 H new ATOM 0 HB3 ASP B 21 12.151 7.461 -6.659 1.00 70.43 H new ATOM 1614 N GLY B 22 8.874 8.546 -8.642 1.00 45.12 N ATOM 1615 CA GLY B 22 7.747 9.252 -9.271 1.00 62.43 C ATOM 1616 C GLY B 22 7.006 8.394 -10.292 1.00 63.52 C ATOM 1617 O GLY B 22 6.268 8.900 -11.136 1.00 2.41 O ATOM 0 H GLY B 22 8.699 8.255 -7.680 1.00 45.12 H new ATOM 0 HA2 GLY B 22 7.049 9.573 -8.498 1.00 62.43 H new ATOM 0 HA3 GLY B 22 8.117 10.153 -9.761 1.00 62.43 H new ATOM 1621 N ILE B 23 7.218 7.078 -10.194 1.00 11.52 N ATOM 1622 CA ILE B 23 6.664 6.078 -11.115 1.00 32.40 C ATOM 1623 C ILE B 23 5.328 5.520 -10.553 1.00 32.35 C ATOM 1624 O ILE B 23 5.096 5.554 -9.341 1.00 0.43 O ATOM 1625 CB ILE B 23 7.733 4.934 -11.346 1.00 41.33 C ATOM 1626 CG1 ILE B 23 7.253 3.895 -12.405 1.00 3.25 C ATOM 1627 CG2 ILE B 23 8.134 4.249 -10.013 1.00 63.14 C ATOM 1628 CD1 ILE B 23 8.273 2.822 -12.753 1.00 10.44 C ATOM 0 H ILE B 23 7.792 6.668 -9.457 1.00 11.52 H new ATOM 0 HA ILE B 23 6.444 6.536 -12.079 1.00 32.40 H new ATOM 0 HB ILE B 23 8.628 5.409 -11.748 1.00 41.33 H new ATOM 0 HG12 ILE B 23 6.349 3.411 -12.035 1.00 3.25 H new ATOM 0 HG13 ILE B 23 6.980 4.426 -13.317 1.00 3.25 H new ATOM 0 HG21 ILE B 23 8.869 3.469 -10.211 1.00 63.14 H new ATOM 0 HG22 ILE B 23 8.563 4.989 -9.338 1.00 63.14 H new ATOM 0 HG23 ILE B 23 7.251 3.806 -9.551 1.00 63.14 H new ATOM 0 HD11 ILE B 23 7.851 2.146 -13.496 1.00 10.44 H new ATOM 0 HD12 ILE B 23 9.170 3.290 -13.157 1.00 10.44 H new ATOM 0 HD13 ILE B 23 8.530 2.260 -11.855 1.00 10.44 H new ATOM 1640 N SER B 24 4.429 5.069 -11.446 1.00 51.50 N ATOM 1641 CA SER B 24 3.162 4.407 -11.047 1.00 52.23 C ATOM 1642 C SER B 24 3.434 3.019 -10.419 1.00 45.24 C ATOM 1643 O SER B 24 4.383 2.334 -10.817 1.00 14.11 O ATOM 1644 CB SER B 24 2.226 4.263 -12.270 1.00 23.22 C ATOM 1645 OG SER B 24 1.926 5.527 -12.841 1.00 3.31 O ATOM 0 H SER B 24 4.553 5.149 -12.455 1.00 51.50 H new ATOM 0 HA SER B 24 2.675 5.031 -10.297 1.00 52.23 H new ATOM 0 HB2 SER B 24 2.697 3.626 -13.018 1.00 23.22 H new ATOM 0 HB3 SER B 24 1.302 3.770 -11.968 1.00 23.22 H new ATOM 0 HG SER B 24 1.334 5.405 -13.613 1.00 3.31 H new ATOM 1651 N ILE B 25 2.570 2.608 -9.462 1.00 12.32 N ATOM 1652 CA ILE B 25 2.713 1.333 -8.710 1.00 32.12 C ATOM 1653 C ILE B 25 2.827 0.060 -9.635 1.00 63.10 C ATOM 1654 O ILE B 25 3.727 -0.741 -9.406 1.00 73.13 O ATOM 1655 CB ILE B 25 1.535 1.139 -7.670 1.00 71.52 C ATOM 1656 CG1 ILE B 25 1.528 2.278 -6.592 1.00 43.41 C ATOM 1657 CG2 ILE B 25 1.580 -0.261 -7.004 1.00 74.24 C ATOM 1658 CD1 ILE B 25 2.725 2.284 -5.661 1.00 74.24 C ATOM 0 H ILE B 25 1.751 3.150 -9.187 1.00 12.32 H new ATOM 0 HA ILE B 25 3.658 1.422 -8.174 1.00 32.12 H new ATOM 0 HB ILE B 25 0.601 1.204 -8.229 1.00 71.52 H new ATOM 0 HG12 ILE B 25 1.478 3.240 -7.102 1.00 43.41 H new ATOM 0 HG13 ILE B 25 0.621 2.186 -5.994 1.00 43.41 H new ATOM 0 HG21 ILE B 25 0.755 -0.354 -6.297 1.00 74.24 H new ATOM 0 HG22 ILE B 25 1.490 -1.031 -7.770 1.00 74.24 H new ATOM 0 HG23 ILE B 25 2.526 -0.383 -6.476 1.00 74.24 H new ATOM 0 HD11 ILE B 25 2.630 3.106 -4.952 1.00 74.24 H new ATOM 0 HD12 ILE B 25 2.768 1.340 -5.118 1.00 74.24 H new ATOM 0 HD13 ILE B 25 3.638 2.410 -6.243 1.00 74.24 H new ATOM 1670 N PRO B 26 1.941 -0.162 -10.687 1.00 40.43 N ATOM 1671 CA PRO B 26 2.027 -1.381 -11.552 1.00 22.13 C ATOM 1672 C PRO B 26 3.326 -1.459 -12.408 1.00 21.12 C ATOM 1673 O PRO B 26 3.835 -2.551 -12.678 1.00 74.23 O ATOM 1674 CB PRO B 26 0.755 -1.278 -12.446 1.00 41.21 C ATOM 1675 CG PRO B 26 0.434 0.185 -12.479 1.00 10.24 C ATOM 1676 CD PRO B 26 0.789 0.695 -11.098 1.00 35.30 C ATOM 0 HA PRO B 26 2.071 -2.291 -10.954 1.00 22.13 H new ATOM 0 HB2 PRO B 26 0.942 -1.666 -13.447 1.00 41.21 H new ATOM 0 HB3 PRO B 26 -0.070 -1.856 -12.029 1.00 41.21 H new ATOM 0 HG2 PRO B 26 1.010 0.698 -13.249 1.00 10.24 H new ATOM 0 HG3 PRO B 26 -0.619 0.353 -12.703 1.00 10.24 H new ATOM 0 HD2 PRO B 26 1.063 1.750 -11.119 1.00 35.30 H new ATOM 0 HD3 PRO B 26 -0.049 0.597 -10.408 1.00 35.30 H new ATOM 1684 N GLU B 27 3.856 -0.292 -12.799 1.00 2.33 N ATOM 1685 CA GLU B 27 5.087 -0.181 -13.615 1.00 4.51 C ATOM 1686 C GLU B 27 6.309 -0.555 -12.765 1.00 43.24 C ATOM 1687 O GLU B 27 7.181 -1.331 -13.167 1.00 12.05 O ATOM 1688 CB GLU B 27 5.218 1.271 -14.134 1.00 55.51 C ATOM 1689 CG GLU B 27 4.073 1.734 -15.063 1.00 14.12 C ATOM 1690 CD GLU B 27 4.002 0.944 -16.386 1.00 75.05 C ATOM 1691 OE1 GLU B 27 4.682 1.330 -17.360 1.00 63.43 O ATOM 1692 OE2 GLU B 27 3.286 -0.084 -16.451 1.00 11.24 O ATOM 0 H GLU B 27 3.445 0.611 -12.560 1.00 2.33 H new ATOM 0 HA GLU B 27 5.032 -0.864 -14.463 1.00 4.51 H new ATOM 0 HB2 GLU B 27 5.267 1.944 -13.278 1.00 55.51 H new ATOM 0 HB3 GLU B 27 6.162 1.366 -14.670 1.00 55.51 H new ATOM 0 HG2 GLU B 27 3.124 1.633 -14.536 1.00 14.12 H new ATOM 0 HG3 GLU B 27 4.202 2.793 -15.287 1.00 14.12 H new ATOM 1699 N LEU B 28 6.315 0.026 -11.567 1.00 41.22 N ATOM 1700 CA LEU B 28 7.261 -0.267 -10.490 1.00 13.45 C ATOM 1701 C LEU B 28 7.192 -1.756 -10.062 1.00 24.34 C ATOM 1702 O LEU B 28 8.217 -2.376 -9.797 1.00 0.42 O ATOM 1703 CB LEU B 28 6.899 0.665 -9.316 1.00 54.40 C ATOM 1704 CG LEU B 28 7.684 0.490 -7.991 1.00 63.10 C ATOM 1705 CD1 LEU B 28 9.181 0.814 -8.153 1.00 52.42 C ATOM 1706 CD2 LEU B 28 7.032 1.336 -6.884 1.00 64.12 C ATOM 0 H LEU B 28 5.635 0.741 -11.309 1.00 41.22 H new ATOM 0 HA LEU B 28 8.285 -0.095 -10.823 1.00 13.45 H new ATOM 0 HB2 LEU B 28 7.031 1.694 -9.651 1.00 54.40 H new ATOM 0 HB3 LEU B 28 5.839 0.534 -9.098 1.00 54.40 H new ATOM 0 HG LEU B 28 7.634 -0.560 -7.702 1.00 63.10 H new ATOM 0 HD11 LEU B 28 9.688 0.677 -7.198 1.00 52.42 H new ATOM 0 HD12 LEU B 28 9.619 0.147 -8.896 1.00 52.42 H new ATOM 0 HD13 LEU B 28 9.296 1.847 -8.480 1.00 52.42 H new ATOM 0 HD21 LEU B 28 7.587 1.210 -5.955 1.00 64.12 H new ATOM 0 HD22 LEU B 28 7.044 2.387 -7.174 1.00 64.12 H new ATOM 0 HD23 LEU B 28 6.002 1.012 -6.738 1.00 64.12 H new ATOM 1718 N ALA B 29 5.963 -2.310 -10.030 1.00 0.43 N ATOM 1719 CA ALA B 29 5.698 -3.721 -9.649 1.00 21.23 C ATOM 1720 C ALA B 29 6.371 -4.714 -10.615 1.00 0.23 C ATOM 1721 O ALA B 29 6.987 -5.702 -10.192 1.00 4.23 O ATOM 1722 CB ALA B 29 4.184 -3.981 -9.586 1.00 55.03 C ATOM 0 H ALA B 29 5.118 -1.791 -10.269 1.00 0.43 H new ATOM 0 HA ALA B 29 6.131 -3.880 -8.661 1.00 21.23 H new ATOM 0 HB1 ALA B 29 4.004 -5.019 -9.306 1.00 55.03 H new ATOM 0 HB2 ALA B 29 3.732 -3.322 -8.845 1.00 55.03 H new ATOM 0 HB3 ALA B 29 3.741 -3.787 -10.563 1.00 55.03 H new ATOM 1728 N ARG B 30 6.253 -4.411 -11.915 1.00 14.41 N ATOM 1729 CA ARG B 30 6.867 -5.198 -12.997 1.00 50.24 C ATOM 1730 C ARG B 30 8.415 -5.146 -12.902 1.00 14.33 C ATOM 1731 O ARG B 30 9.096 -6.145 -13.157 1.00 31.53 O ATOM 1732 CB ARG B 30 6.353 -4.671 -14.360 1.00 54.12 C ATOM 1733 CG ARG B 30 6.827 -5.460 -15.602 1.00 74.14 C ATOM 1734 CD ARG B 30 6.221 -4.904 -16.907 1.00 0.25 C ATOM 1735 NE ARG B 30 6.537 -3.472 -17.096 1.00 55.34 N ATOM 1736 CZ ARG B 30 5.668 -2.510 -17.344 1.00 75.33 C ATOM 1737 NH1 ARG B 30 4.407 -2.759 -17.512 1.00 13.11 N ATOM 1738 NH2 ARG B 30 6.091 -1.299 -17.448 1.00 71.15 N ATOM 0 H ARG B 30 5.724 -3.606 -12.250 1.00 14.41 H new ATOM 0 HA ARG B 30 6.580 -6.245 -12.901 1.00 50.24 H new ATOM 0 HB2 ARG B 30 5.263 -4.675 -14.343 1.00 54.12 H new ATOM 0 HB3 ARG B 30 6.666 -3.633 -14.470 1.00 54.12 H new ATOM 0 HG2 ARG B 30 7.915 -5.421 -15.662 1.00 74.14 H new ATOM 0 HG3 ARG B 30 6.551 -6.509 -15.492 1.00 74.14 H new ATOM 0 HD2 ARG B 30 6.600 -5.474 -17.755 1.00 0.25 H new ATOM 0 HD3 ARG B 30 5.139 -5.038 -16.891 1.00 0.25 H new ATOM 0 HE ARG B 30 7.518 -3.202 -17.028 1.00 55.34 H new ATOM 0 HH11 ARG B 30 4.064 -3.718 -17.454 1.00 13.11 H new ATOM 0 HH12 ARG B 30 3.757 -1.996 -17.702 1.00 13.11 H new ATOM 0 HH21 ARG B 30 7.084 -1.095 -17.339 1.00 71.15 H new ATOM 0 HH22 ARG B 30 5.433 -0.544 -17.639 1.00 71.15 H new ATOM 1752 N LYS B 31 8.950 -3.979 -12.486 1.00 60.41 N ATOM 1753 CA LYS B 31 10.401 -3.786 -12.245 1.00 64.42 C ATOM 1754 C LYS B 31 10.916 -4.626 -11.043 1.00 51.11 C ATOM 1755 O LYS B 31 11.953 -5.286 -11.135 1.00 0.32 O ATOM 1756 CB LYS B 31 10.708 -2.282 -12.001 1.00 44.03 C ATOM 1757 CG LYS B 31 10.556 -1.380 -13.247 1.00 34.23 C ATOM 1758 CD LYS B 31 10.789 0.123 -12.939 1.00 42.22 C ATOM 1759 CE LYS B 31 12.134 0.403 -12.235 1.00 4.41 C ATOM 1760 NZ LYS B 31 13.303 -0.092 -13.014 1.00 11.44 N ATOM 0 H LYS B 31 8.392 -3.144 -12.307 1.00 60.41 H new ATOM 0 HA LYS B 31 10.923 -4.131 -13.137 1.00 64.42 H new ATOM 0 HB2 LYS B 31 10.045 -1.912 -11.219 1.00 44.03 H new ATOM 0 HB3 LYS B 31 11.727 -2.190 -11.625 1.00 44.03 H new ATOM 0 HG2 LYS B 31 11.263 -1.703 -14.011 1.00 34.23 H new ATOM 0 HG3 LYS B 31 9.557 -1.509 -13.663 1.00 34.23 H new ATOM 0 HD2 LYS B 31 10.751 0.687 -13.871 1.00 42.22 H new ATOM 0 HD3 LYS B 31 9.976 0.488 -12.311 1.00 42.22 H new ATOM 0 HE2 LYS B 31 12.238 1.476 -12.073 1.00 4.41 H new ATOM 0 HE3 LYS B 31 12.131 -0.069 -11.253 1.00 4.41 H new ATOM 0 HZ1 LYS B 31 14.182 0.151 -12.514 1.00 11.44 H new ATOM 0 HZ2 LYS B 31 13.238 -1.125 -13.118 1.00 11.44 H new ATOM 0 HZ3 LYS B 31 13.306 0.351 -13.955 1.00 11.44 H new ATOM 1774 N VAL B 32 10.171 -4.601 -9.922 1.00 12.31 N ATOM 1775 CA VAL B 32 10.604 -5.232 -8.643 1.00 52.13 C ATOM 1776 C VAL B 32 10.137 -6.709 -8.514 1.00 41.15 C ATOM 1777 O VAL B 32 10.248 -7.307 -7.437 1.00 24.41 O ATOM 1778 CB VAL B 32 10.102 -4.386 -7.416 1.00 50.54 C ATOM 1779 CG1 VAL B 32 10.654 -2.940 -7.476 1.00 2.31 C ATOM 1780 CG2 VAL B 32 8.559 -4.388 -7.322 1.00 52.03 C ATOM 0 H VAL B 32 9.258 -4.149 -9.868 1.00 12.31 H new ATOM 0 HA VAL B 32 11.694 -5.245 -8.649 1.00 52.13 H new ATOM 0 HB VAL B 32 10.487 -4.857 -6.511 1.00 50.54 H new ATOM 0 HG11 VAL B 32 10.292 -2.376 -6.616 1.00 2.31 H new ATOM 0 HG12 VAL B 32 11.744 -2.966 -7.460 1.00 2.31 H new ATOM 0 HG13 VAL B 32 10.316 -2.459 -8.394 1.00 2.31 H new ATOM 0 HG21 VAL B 32 8.246 -3.794 -6.463 1.00 52.03 H new ATOM 0 HG22 VAL B 32 8.138 -3.960 -8.232 1.00 52.03 H new ATOM 0 HG23 VAL B 32 8.203 -5.411 -7.205 1.00 52.03 H new ATOM 1790 N ASN B 33 9.621 -7.282 -9.625 1.00 52.55 N ATOM 1791 CA ASN B 33 9.187 -8.707 -9.715 1.00 4.15 C ATOM 1792 C ASN B 33 8.009 -9.050 -8.750 1.00 10.43 C ATOM 1793 O ASN B 33 7.724 -10.226 -8.504 1.00 32.42 O ATOM 1794 CB ASN B 33 10.399 -9.670 -9.495 1.00 31.21 C ATOM 1795 CG ASN B 33 11.541 -9.448 -10.493 1.00 64.43 C ATOM 1796 OD1 ASN B 33 12.449 -8.654 -10.261 1.00 61.41 O ATOM 1797 ND2 ASN B 33 11.514 -10.158 -11.605 1.00 52.13 N ATOM 0 H ASN B 33 9.490 -6.768 -10.496 1.00 52.55 H new ATOM 0 HA ASN B 33 8.803 -8.854 -10.725 1.00 4.15 H new ATOM 0 HB2 ASN B 33 10.780 -9.537 -8.482 1.00 31.21 H new ATOM 0 HB3 ASN B 33 10.053 -10.701 -9.573 1.00 31.21 H new ATOM 0 HD21 ASN B 33 12.258 -10.054 -12.295 1.00 52.13 H new ATOM 0 HD22 ASN B 33 10.749 -10.811 -11.775 1.00 52.13 H new ATOM 1804 N LEU B 34 7.310 -8.016 -8.239 1.00 43.30 N ATOM 1805 CA LEU B 34 6.140 -8.176 -7.339 1.00 53.51 C ATOM 1806 C LEU B 34 4.822 -7.859 -8.095 1.00 14.45 C ATOM 1807 O LEU B 34 4.846 -7.348 -9.215 1.00 10.14 O ATOM 1808 CB LEU B 34 6.276 -7.227 -6.108 1.00 61.21 C ATOM 1809 CG LEU B 34 7.535 -7.421 -5.193 1.00 64.15 C ATOM 1810 CD1 LEU B 34 7.602 -6.338 -4.089 1.00 2.34 C ATOM 1811 CD2 LEU B 34 7.573 -8.837 -4.579 1.00 15.33 C ATOM 0 H LEU B 34 7.539 -7.042 -8.437 1.00 43.30 H new ATOM 0 HA LEU B 34 6.111 -9.211 -6.997 1.00 53.51 H new ATOM 0 HB2 LEU B 34 6.277 -6.199 -6.471 1.00 61.21 H new ATOM 0 HB3 LEU B 34 5.386 -7.346 -5.489 1.00 61.21 H new ATOM 0 HG LEU B 34 8.416 -7.308 -5.825 1.00 64.15 H new ATOM 0 HD11 LEU B 34 8.486 -6.501 -3.472 1.00 2.34 H new ATOM 0 HD12 LEU B 34 7.658 -5.352 -4.550 1.00 2.34 H new ATOM 0 HD13 LEU B 34 6.709 -6.398 -3.466 1.00 2.34 H new ATOM 0 HD21 LEU B 34 8.458 -8.938 -3.951 1.00 15.33 H new ATOM 0 HD22 LEU B 34 6.679 -8.996 -3.975 1.00 15.33 H new ATOM 0 HD23 LEU B 34 7.608 -9.579 -5.377 1.00 15.33 H new ATOM 1823 N SER B 35 3.674 -8.187 -7.476 1.00 2.14 N ATOM 1824 CA SER B 35 2.339 -7.747 -7.973 1.00 54.50 C ATOM 1825 C SER B 35 2.027 -6.295 -7.533 1.00 2.20 C ATOM 1826 O SER B 35 2.694 -5.764 -6.641 1.00 64.25 O ATOM 1827 CB SER B 35 1.240 -8.696 -7.455 1.00 41.31 C ATOM 1828 OG SER B 35 -0.041 -8.317 -7.928 1.00 22.53 O ATOM 0 H SER B 35 3.634 -8.755 -6.630 1.00 2.14 H new ATOM 0 HA SER B 35 2.361 -7.778 -9.062 1.00 54.50 H new ATOM 0 HB2 SER B 35 1.459 -9.715 -7.773 1.00 41.31 H new ATOM 0 HB3 SER B 35 1.241 -8.695 -6.365 1.00 41.31 H new ATOM 0 HG SER B 35 -0.715 -8.940 -7.583 1.00 22.53 H new ATOM 1834 N VAL B 36 1.000 -5.671 -8.160 1.00 33.44 N ATOM 1835 CA VAL B 36 0.540 -4.290 -7.821 1.00 30.41 C ATOM 1836 C VAL B 36 0.241 -4.137 -6.307 1.00 22.24 C ATOM 1837 O VAL B 36 0.705 -3.191 -5.666 1.00 53.21 O ATOM 1838 CB VAL B 36 -0.748 -3.899 -8.644 1.00 4.01 C ATOM 1839 CG1 VAL B 36 -1.261 -2.473 -8.300 1.00 50.41 C ATOM 1840 CG2 VAL B 36 -0.498 -4.041 -10.158 1.00 14.12 C ATOM 0 H VAL B 36 0.465 -6.104 -8.913 1.00 33.44 H new ATOM 0 HA VAL B 36 1.356 -3.618 -8.086 1.00 30.41 H new ATOM 0 HB VAL B 36 -1.533 -4.598 -8.354 1.00 4.01 H new ATOM 0 HG11 VAL B 36 -2.149 -2.253 -8.893 1.00 50.41 H new ATOM 0 HG12 VAL B 36 -1.511 -2.422 -7.240 1.00 50.41 H new ATOM 0 HG13 VAL B 36 -0.484 -1.743 -8.525 1.00 50.41 H new ATOM 0 HG21 VAL B 36 -1.401 -3.766 -10.703 1.00 14.12 H new ATOM 0 HG22 VAL B 36 0.320 -3.384 -10.455 1.00 14.12 H new ATOM 0 HG23 VAL B 36 -0.236 -5.074 -10.388 1.00 14.12 H new ATOM 1850 N GLU B 37 -0.528 -5.098 -5.763 1.00 51.31 N ATOM 1851 CA GLU B 37 -0.879 -5.145 -4.324 1.00 64.31 C ATOM 1852 C GLU B 37 0.379 -5.221 -3.423 1.00 53.54 C ATOM 1853 O GLU B 37 0.554 -4.399 -2.526 1.00 53.45 O ATOM 1854 CB GLU B 37 -1.794 -6.359 -4.040 1.00 61.15 C ATOM 1855 CG GLU B 37 -3.156 -6.346 -4.770 1.00 61.32 C ATOM 1856 CD GLU B 37 -4.054 -7.539 -4.376 1.00 23.32 C ATOM 1857 OE1 GLU B 37 -4.459 -7.622 -3.196 1.00 10.32 O ATOM 1858 OE2 GLU B 37 -4.347 -8.399 -5.237 1.00 3.12 O ATOM 0 H GLU B 37 -0.925 -5.865 -6.305 1.00 51.31 H new ATOM 0 HA GLU B 37 -1.406 -4.221 -4.087 1.00 64.31 H new ATOM 0 HB2 GLU B 37 -1.260 -7.268 -4.318 1.00 61.15 H new ATOM 0 HB3 GLU B 37 -1.976 -6.412 -2.967 1.00 61.15 H new ATOM 0 HG2 GLU B 37 -3.676 -5.415 -4.544 1.00 61.32 H new ATOM 0 HG3 GLU B 37 -2.987 -6.364 -5.847 1.00 61.32 H new ATOM 1865 N SER B 38 1.254 -6.201 -3.711 1.00 50.41 N ATOM 1866 CA SER B 38 2.503 -6.452 -2.943 1.00 4.25 C ATOM 1867 C SER B 38 3.450 -5.226 -2.940 1.00 12.41 C ATOM 1868 O SER B 38 4.084 -4.916 -1.928 1.00 11.44 O ATOM 1869 CB SER B 38 3.248 -7.661 -3.550 1.00 22.10 C ATOM 1870 OG SER B 38 2.421 -8.810 -3.617 1.00 3.31 O ATOM 0 H SER B 38 1.120 -6.849 -4.487 1.00 50.41 H new ATOM 0 HA SER B 38 2.214 -6.654 -1.911 1.00 4.25 H new ATOM 0 HB2 SER B 38 3.599 -7.407 -4.550 1.00 22.10 H new ATOM 0 HB3 SER B 38 4.130 -7.883 -2.950 1.00 22.10 H new ATOM 0 HG SER B 38 2.925 -9.554 -4.008 1.00 3.31 H new ATOM 1876 N THR B 39 3.524 -4.545 -4.094 1.00 21.43 N ATOM 1877 CA THR B 39 4.394 -3.366 -4.299 1.00 41.30 C ATOM 1878 C THR B 39 3.862 -2.127 -3.554 1.00 62.52 C ATOM 1879 O THR B 39 4.611 -1.472 -2.848 1.00 62.34 O ATOM 1880 CB THR B 39 4.550 -3.060 -5.822 1.00 32.13 C ATOM 1881 OG1 THR B 39 5.185 -4.174 -6.459 1.00 72.34 O ATOM 1882 CG2 THR B 39 5.364 -1.789 -6.110 1.00 15.42 C ATOM 0 H THR B 39 2.980 -4.795 -4.920 1.00 21.43 H new ATOM 0 HA THR B 39 5.373 -3.605 -3.884 1.00 41.30 H new ATOM 0 HB THR B 39 3.548 -2.891 -6.216 1.00 32.13 H new ATOM 0 HG1 THR B 39 4.522 -4.875 -6.630 1.00 72.34 H new ATOM 0 HG21 THR B 39 5.433 -1.637 -7.187 1.00 15.42 H new ATOM 0 HG22 THR B 39 4.872 -0.930 -5.653 1.00 15.42 H new ATOM 0 HG23 THR B 39 6.366 -1.897 -5.694 1.00 15.42 H new ATOM 1890 N ALA B 40 2.556 -1.832 -3.710 1.00 15.52 N ATOM 1891 CA ALA B 40 1.885 -0.692 -3.020 1.00 73.34 C ATOM 1892 C ALA B 40 1.883 -0.865 -1.477 1.00 45.00 C ATOM 1893 O ALA B 40 1.949 0.110 -0.724 1.00 33.21 O ATOM 1894 CB ALA B 40 0.450 -0.548 -3.540 1.00 53.33 C ATOM 0 H ALA B 40 1.932 -2.369 -4.313 1.00 15.52 H new ATOM 0 HA ALA B 40 2.450 0.213 -3.243 1.00 73.34 H new ATOM 0 HB1 ALA B 40 -0.038 0.285 -3.035 1.00 53.33 H new ATOM 0 HB2 ALA B 40 0.469 -0.360 -4.614 1.00 53.33 H new ATOM 0 HB3 ALA B 40 -0.103 -1.466 -3.342 1.00 53.33 H new ATOM 1900 N LEU B 41 1.809 -2.128 -1.041 1.00 54.45 N ATOM 1901 CA LEU B 41 1.876 -2.533 0.378 1.00 10.54 C ATOM 1902 C LEU B 41 3.326 -2.360 0.928 1.00 72.11 C ATOM 1903 O LEU B 41 3.521 -1.929 2.073 1.00 31.23 O ATOM 1904 CB LEU B 41 1.320 -3.999 0.460 1.00 74.23 C ATOM 1905 CG LEU B 41 1.345 -4.793 1.813 1.00 1.11 C ATOM 1906 CD1 LEU B 41 2.678 -5.527 2.014 1.00 12.23 C ATOM 1907 CD2 LEU B 41 0.988 -3.899 3.022 1.00 22.14 C ATOM 0 H LEU B 41 1.698 -2.919 -1.675 1.00 54.45 H new ATOM 0 HA LEU B 41 1.264 -1.899 1.020 1.00 10.54 H new ATOM 0 HB2 LEU B 41 0.283 -3.967 0.126 1.00 74.23 H new ATOM 0 HB3 LEU B 41 1.872 -4.592 -0.270 1.00 74.23 H new ATOM 0 HG LEU B 41 0.566 -5.553 1.749 1.00 1.11 H new ATOM 0 HD11 LEU B 41 2.658 -6.065 2.962 1.00 12.23 H new ATOM 0 HD12 LEU B 41 2.831 -6.234 1.198 1.00 12.23 H new ATOM 0 HD13 LEU B 41 3.493 -4.804 2.025 1.00 12.23 H new ATOM 0 HD21 LEU B 41 1.019 -4.493 3.935 1.00 22.14 H new ATOM 0 HD22 LEU B 41 1.707 -3.083 3.096 1.00 22.14 H new ATOM 0 HD23 LEU B 41 -0.013 -3.490 2.889 1.00 22.14 H new ATOM 1919 N ALA B 42 4.332 -2.676 0.090 1.00 0.22 N ATOM 1920 CA ALA B 42 5.766 -2.442 0.414 1.00 52.31 C ATOM 1921 C ALA B 42 6.097 -0.922 0.461 1.00 23.13 C ATOM 1922 O ALA B 42 6.877 -0.465 1.302 1.00 74.45 O ATOM 1923 CB ALA B 42 6.653 -3.170 -0.607 1.00 31.40 C ATOM 0 H ALA B 42 4.183 -3.098 -0.826 1.00 0.22 H new ATOM 0 HA ALA B 42 5.968 -2.844 1.407 1.00 52.31 H new ATOM 0 HB1 ALA B 42 7.702 -2.997 -0.367 1.00 31.40 H new ATOM 0 HB2 ALA B 42 6.445 -4.239 -0.573 1.00 31.40 H new ATOM 0 HB3 ALA B 42 6.442 -2.791 -1.607 1.00 31.40 H new ATOM 1929 N VAL B 43 5.480 -0.155 -0.453 1.00 1.10 N ATOM 1930 CA VAL B 43 5.518 1.327 -0.461 1.00 75.13 C ATOM 1931 C VAL B 43 4.825 1.906 0.806 1.00 23.44 C ATOM 1932 O VAL B 43 5.210 2.965 1.309 1.00 1.31 O ATOM 1933 CB VAL B 43 4.865 1.894 -1.786 1.00 2.14 C ATOM 1934 CG1 VAL B 43 4.679 3.428 -1.749 1.00 35.04 C ATOM 1935 CG2 VAL B 43 5.698 1.484 -3.031 1.00 14.24 C ATOM 0 H VAL B 43 4.932 -0.546 -1.219 1.00 1.10 H new ATOM 0 HA VAL B 43 6.561 1.645 -0.440 1.00 75.13 H new ATOM 0 HB VAL B 43 3.872 1.450 -1.858 1.00 2.14 H new ATOM 0 HG11 VAL B 43 4.227 3.762 -2.683 1.00 35.04 H new ATOM 0 HG12 VAL B 43 4.030 3.696 -0.916 1.00 35.04 H new ATOM 0 HG13 VAL B 43 5.649 3.909 -1.622 1.00 35.04 H new ATOM 0 HG21 VAL B 43 5.230 1.885 -3.930 1.00 14.24 H new ATOM 0 HG22 VAL B 43 6.709 1.882 -2.940 1.00 14.24 H new ATOM 0 HG23 VAL B 43 5.741 0.397 -3.098 1.00 14.24 H new ATOM 1945 N GLY B 44 3.812 1.183 1.320 1.00 22.51 N ATOM 1946 CA GLY B 44 3.183 1.501 2.613 1.00 11.24 C ATOM 1947 C GLY B 44 4.153 1.407 3.809 1.00 61.11 C ATOM 1948 O GLY B 44 4.043 2.179 4.773 1.00 23.45 O ATOM 0 H GLY B 44 3.410 0.369 0.854 1.00 22.51 H new ATOM 0 HA2 GLY B 44 2.770 2.509 2.569 1.00 11.24 H new ATOM 0 HA3 GLY B 44 2.348 0.821 2.779 1.00 11.24 H new ATOM 1952 N TRP B 45 5.120 0.461 3.735 1.00 32.54 N ATOM 1953 CA TRP B 45 6.205 0.340 4.742 1.00 73.12 C ATOM 1954 C TRP B 45 7.242 1.495 4.595 1.00 4.24 C ATOM 1955 O TRP B 45 7.972 1.826 5.535 1.00 70.10 O ATOM 1956 CB TRP B 45 6.899 -1.046 4.650 1.00 62.14 C ATOM 1957 CG TRP B 45 7.940 -1.281 5.733 1.00 51.32 C ATOM 1958 CD1 TRP B 45 9.303 -1.231 5.608 1.00 50.01 C ATOM 1959 CD2 TRP B 45 7.686 -1.561 7.117 1.00 35.41 C ATOM 1960 NE1 TRP B 45 9.902 -1.486 6.810 1.00 60.11 N ATOM 1961 CE2 TRP B 45 8.933 -1.688 7.753 1.00 12.25 C ATOM 1962 CE3 TRP B 45 6.520 -1.722 7.875 1.00 60.41 C ATOM 1963 CZ2 TRP B 45 9.050 -1.967 9.108 1.00 20.51 C ATOM 1964 CZ3 TRP B 45 6.638 -1.998 9.221 1.00 65.41 C ATOM 1965 CH2 TRP B 45 7.895 -2.118 9.826 1.00 24.54 C ATOM 0 H TRP B 45 5.172 -0.231 2.987 1.00 32.54 H new ATOM 0 HA TRP B 45 5.752 0.424 5.730 1.00 73.12 H new ATOM 0 HB2 TRP B 45 6.141 -1.827 4.711 1.00 62.14 H new ATOM 0 HB3 TRP B 45 7.375 -1.140 3.674 1.00 62.14 H new ATOM 0 HD1 TRP B 45 9.830 -1.020 4.689 1.00 50.01 H new ATOM 0 HE1 TRP B 45 10.908 -1.520 6.976 1.00 60.11 H new ATOM 0 HE3 TRP B 45 5.547 -1.632 7.415 1.00 60.41 H new ATOM 0 HZ2 TRP B 45 10.018 -2.061 9.578 1.00 20.51 H new ATOM 0 HZ3 TRP B 45 5.747 -2.124 9.818 1.00 65.41 H new ATOM 0 HH2 TRP B 45 7.954 -2.334 10.882 1.00 24.54 H new ATOM 1976 N LEU B 46 7.328 2.086 3.406 1.00 3.41 N ATOM 1977 CA LEU B 46 8.098 3.333 3.198 1.00 53.12 C ATOM 1978 C LEU B 46 7.347 4.558 3.787 1.00 4.20 C ATOM 1979 O LEU B 46 7.958 5.429 4.407 1.00 13.43 O ATOM 1980 CB LEU B 46 8.399 3.512 1.693 1.00 54.30 C ATOM 1981 CG LEU B 46 9.143 2.315 1.027 1.00 40.52 C ATOM 1982 CD1 LEU B 46 9.358 2.553 -0.476 1.00 31.12 C ATOM 1983 CD2 LEU B 46 10.471 2.012 1.759 1.00 35.21 C ATOM 0 H LEU B 46 6.877 1.729 2.564 1.00 3.41 H new ATOM 0 HA LEU B 46 9.046 3.260 3.730 1.00 53.12 H new ATOM 0 HB2 LEU B 46 7.459 3.676 1.166 1.00 54.30 H new ATOM 0 HB3 LEU B 46 8.999 4.413 1.562 1.00 54.30 H new ATOM 0 HG LEU B 46 8.510 1.433 1.121 1.00 40.52 H new ATOM 0 HD11 LEU B 46 9.879 1.699 -0.909 1.00 31.12 H new ATOM 0 HD12 LEU B 46 8.392 2.675 -0.967 1.00 31.12 H new ATOM 0 HD13 LEU B 46 9.955 3.454 -0.620 1.00 31.12 H new ATOM 0 HD21 LEU B 46 10.970 1.173 1.275 1.00 35.21 H new ATOM 0 HD22 LEU B 46 11.116 2.890 1.720 1.00 35.21 H new ATOM 0 HD23 LEU B 46 10.264 1.760 2.799 1.00 35.21 H new ATOM 1995 N ALA B 47 6.011 4.590 3.589 1.00 43.24 N ATOM 1996 CA ALA B 47 5.112 5.672 4.078 1.00 14.14 C ATOM 1997 C ALA B 47 5.122 5.834 5.620 1.00 63.41 C ATOM 1998 O ALA B 47 4.937 6.944 6.135 1.00 4.23 O ATOM 1999 CB ALA B 47 3.678 5.418 3.570 1.00 12.13 C ATOM 0 H ALA B 47 5.515 3.859 3.079 1.00 43.24 H new ATOM 0 HA ALA B 47 5.493 6.611 3.676 1.00 14.14 H new ATOM 0 HB1 ALA B 47 3.020 6.210 3.928 1.00 12.13 H new ATOM 0 HB2 ALA B 47 3.675 5.408 2.480 1.00 12.13 H new ATOM 0 HB3 ALA B 47 3.325 4.456 3.943 1.00 12.13 H new ATOM 2005 N ARG B 48 5.338 4.724 6.352 1.00 34.04 N ATOM 2006 CA ARG B 48 5.442 4.750 7.836 1.00 75.45 C ATOM 2007 C ARG B 48 6.772 5.388 8.335 1.00 34.30 C ATOM 2008 O ARG B 48 6.909 5.706 9.520 1.00 44.54 O ATOM 2009 CB ARG B 48 5.190 3.326 8.426 1.00 44.31 C ATOM 2010 CG ARG B 48 6.074 2.168 7.913 1.00 10.44 C ATOM 2011 CD ARG B 48 7.429 2.013 8.640 1.00 63.43 C ATOM 2012 NE ARG B 48 7.288 1.503 10.015 1.00 55.24 N ATOM 2013 CZ ARG B 48 7.528 2.181 11.109 1.00 73.42 C ATOM 2014 NH1 ARG B 48 7.837 3.443 11.070 1.00 55.34 N ATOM 2015 NH2 ARG B 48 7.450 1.601 12.250 1.00 43.54 N ATOM 0 H ARG B 48 5.445 3.795 5.946 1.00 34.04 H new ATOM 0 HA ARG B 48 4.657 5.405 8.213 1.00 75.45 H new ATOM 0 HB2 ARG B 48 5.310 3.385 9.508 1.00 44.31 H new ATOM 0 HB3 ARG B 48 4.150 3.063 8.235 1.00 44.31 H new ATOM 0 HG2 ARG B 48 5.518 1.236 8.009 1.00 10.44 H new ATOM 0 HG3 ARG B 48 6.263 2.318 6.850 1.00 10.44 H new ATOM 0 HD2 ARG B 48 8.066 1.336 8.070 1.00 63.43 H new ATOM 0 HD3 ARG B 48 7.934 2.979 8.666 1.00 63.43 H new ATOM 0 HE ARG B 48 6.976 0.538 10.124 1.00 55.24 H new ATOM 0 HH11 ARG B 48 7.897 3.926 10.174 1.00 55.34 H new ATOM 0 HH12 ARG B 48 8.020 3.950 11.936 1.00 55.34 H new ATOM 0 HH21 ARG B 48 7.201 0.613 12.304 1.00 43.54 H new ATOM 0 HH22 ARG B 48 7.637 2.127 13.104 1.00 43.54 H new ATOM 2029 N GLU B 49 7.748 5.552 7.422 1.00 52.32 N ATOM 2030 CA GLU B 49 8.993 6.333 7.668 1.00 2.42 C ATOM 2031 C GLU B 49 9.053 7.585 6.753 1.00 61.20 C ATOM 2032 O GLU B 49 10.124 8.184 6.596 1.00 13.50 O ATOM 2033 CB GLU B 49 10.243 5.442 7.418 1.00 22.32 C ATOM 2034 CG GLU B 49 10.360 4.222 8.346 1.00 52.40 C ATOM 2035 CD GLU B 49 11.631 3.406 8.087 1.00 53.13 C ATOM 2036 OE1 GLU B 49 11.671 2.665 7.083 1.00 53.53 O ATOM 2037 OE2 GLU B 49 12.621 3.557 8.841 1.00 1.10 O ATOM 0 H GLU B 49 7.703 5.148 6.487 1.00 52.32 H new ATOM 0 HA GLU B 49 8.985 6.662 8.707 1.00 2.42 H new ATOM 0 HB2 GLU B 49 10.224 5.095 6.385 1.00 22.32 H new ATOM 0 HB3 GLU B 49 11.137 6.055 7.532 1.00 22.32 H new ATOM 0 HG2 GLU B 49 10.352 4.557 9.383 1.00 52.40 H new ATOM 0 HG3 GLU B 49 9.488 3.582 8.211 1.00 52.40 H new ATOM 2044 N ASN B 50 7.888 7.956 6.164 1.00 32.24 N ATOM 2045 CA ASN B 50 7.716 9.082 5.188 1.00 41.03 C ATOM 2046 C ASN B 50 8.773 9.103 4.037 1.00 41.13 C ATOM 2047 O ASN B 50 9.058 10.157 3.451 1.00 4.30 O ATOM 2048 CB ASN B 50 7.585 10.462 5.916 1.00 31.25 C ATOM 2049 CG ASN B 50 8.852 10.965 6.615 1.00 35.10 C ATOM 2050 OD1 ASN B 50 9.079 10.707 7.797 1.00 15.51 O ATOM 2051 ND2 ASN B 50 9.692 11.671 5.886 1.00 11.03 N ATOM 0 H ASN B 50 7.012 7.471 6.355 1.00 32.24 H new ATOM 0 HA ASN B 50 6.770 8.889 4.681 1.00 41.03 H new ATOM 0 HB2 ASN B 50 7.273 11.209 5.186 1.00 31.25 H new ATOM 0 HB3 ASN B 50 6.788 10.388 6.656 1.00 31.25 H new ATOM 0 HD21 ASN B 50 10.557 12.019 6.299 1.00 11.03 H new ATOM 0 HD22 ASN B 50 9.477 11.869 4.909 1.00 11.03 H new ATOM 2058 N LYS B 51 9.294 7.906 3.681 1.00 44.44 N ATOM 2059 CA LYS B 51 10.278 7.716 2.586 1.00 71.30 C ATOM 2060 C LYS B 51 9.658 7.904 1.176 1.00 72.32 C ATOM 2061 O LYS B 51 10.395 7.960 0.185 1.00 50.54 O ATOM 2062 CB LYS B 51 10.927 6.304 2.689 1.00 24.24 C ATOM 2063 CG LYS B 51 11.937 6.142 3.843 1.00 62.41 C ATOM 2064 CD LYS B 51 12.581 4.728 3.890 1.00 53.32 C ATOM 2065 CE LYS B 51 13.854 4.672 4.760 1.00 64.43 C ATOM 2066 NZ LYS B 51 13.616 5.111 6.161 1.00 62.52 N ATOM 0 H LYS B 51 9.042 7.036 4.149 1.00 44.44 H new ATOM 0 HA LYS B 51 11.037 8.489 2.709 1.00 71.30 H new ATOM 0 HB2 LYS B 51 10.136 5.564 2.810 1.00 24.24 H new ATOM 0 HB3 LYS B 51 11.431 6.081 1.749 1.00 24.24 H new ATOM 0 HG2 LYS B 51 12.723 6.890 3.739 1.00 62.41 H new ATOM 0 HG3 LYS B 51 11.434 6.338 4.790 1.00 62.41 H new ATOM 0 HD2 LYS B 51 11.852 4.016 4.277 1.00 53.32 H new ATOM 0 HD3 LYS B 51 12.827 4.413 2.876 1.00 53.32 H new ATOM 0 HE2 LYS B 51 14.241 3.653 4.764 1.00 64.43 H new ATOM 0 HE3 LYS B 51 14.622 5.302 4.312 1.00 64.43 H new ATOM 0 HZ1 LYS B 51 14.069 6.034 6.317 1.00 62.52 H new ATOM 0 HZ2 LYS B 51 12.593 5.195 6.330 1.00 62.52 H new ATOM 0 HZ3 LYS B 51 14.019 4.412 6.817 1.00 62.52 H new ATOM 2080 N VAL B 52 8.311 7.970 1.093 1.00 23.23 N ATOM 2081 CA VAL B 52 7.575 8.199 -0.177 1.00 73.44 C ATOM 2082 C VAL B 52 6.625 9.419 -0.094 1.00 73.12 C ATOM 2083 O VAL B 52 6.052 9.717 0.958 1.00 14.41 O ATOM 2084 CB VAL B 52 6.763 6.928 -0.641 1.00 5.22 C ATOM 2085 CG1 VAL B 52 7.712 5.821 -1.144 1.00 13.32 C ATOM 2086 CG2 VAL B 52 5.841 6.398 0.486 1.00 12.43 C ATOM 0 H VAL B 52 7.700 7.866 1.903 1.00 23.23 H new ATOM 0 HA VAL B 52 8.343 8.407 -0.922 1.00 73.44 H new ATOM 0 HB VAL B 52 6.125 7.231 -1.471 1.00 5.22 H new ATOM 0 HG11 VAL B 52 7.128 4.956 -1.458 1.00 13.32 H new ATOM 0 HG12 VAL B 52 8.291 6.194 -1.989 1.00 13.32 H new ATOM 0 HG13 VAL B 52 8.389 5.530 -0.341 1.00 13.32 H new ATOM 0 HG21 VAL B 52 5.298 5.523 0.130 1.00 12.43 H new ATOM 0 HG22 VAL B 52 6.445 6.124 1.351 1.00 12.43 H new ATOM 0 HG23 VAL B 52 5.131 7.175 0.771 1.00 12.43 H new ATOM 2096 N VAL B 53 6.494 10.117 -1.237 1.00 62.11 N ATOM 2097 CA VAL B 53 5.589 11.267 -1.428 1.00 23.35 C ATOM 2098 C VAL B 53 4.465 10.864 -2.414 1.00 14.40 C ATOM 2099 O VAL B 53 4.742 10.514 -3.563 1.00 64.31 O ATOM 2100 CB VAL B 53 6.383 12.507 -1.990 1.00 11.31 C ATOM 2101 CG1 VAL B 53 5.465 13.739 -2.207 1.00 5.43 C ATOM 2102 CG2 VAL B 53 7.583 12.851 -1.071 1.00 54.13 C ATOM 0 H VAL B 53 7.029 9.891 -2.076 1.00 62.11 H new ATOM 0 HA VAL B 53 5.155 11.548 -0.469 1.00 23.35 H new ATOM 0 HB VAL B 53 6.772 12.230 -2.970 1.00 11.31 H new ATOM 0 HG11 VAL B 53 6.056 14.569 -2.595 1.00 5.43 H new ATOM 0 HG12 VAL B 53 4.681 13.487 -2.921 1.00 5.43 H new ATOM 0 HG13 VAL B 53 5.013 14.028 -1.258 1.00 5.43 H new ATOM 0 HG21 VAL B 53 8.118 13.710 -1.477 1.00 54.13 H new ATOM 0 HG22 VAL B 53 7.219 13.089 -0.072 1.00 54.13 H new ATOM 0 HG23 VAL B 53 8.257 11.996 -1.017 1.00 54.13 H new ATOM 2112 N ILE B 54 3.201 10.934 -1.962 1.00 10.10 N ATOM 2113 CA ILE B 54 2.035 10.428 -2.712 1.00 63.22 C ATOM 2114 C ILE B 54 1.365 11.609 -3.439 1.00 72.54 C ATOM 2115 O ILE B 54 0.778 12.489 -2.797 1.00 32.01 O ATOM 2116 CB ILE B 54 1.000 9.690 -1.758 1.00 23.23 C ATOM 2117 CG1 ILE B 54 1.587 8.347 -1.188 1.00 21.53 C ATOM 2118 CG2 ILE B 54 -0.358 9.426 -2.472 1.00 50.11 C ATOM 2119 CD1 ILE B 54 2.729 8.472 -0.185 1.00 13.23 C ATOM 0 H ILE B 54 2.957 11.345 -1.061 1.00 10.10 H new ATOM 0 HA ILE B 54 2.374 9.690 -3.440 1.00 63.22 H new ATOM 0 HB ILE B 54 0.817 10.363 -0.920 1.00 23.23 H new ATOM 0 HG12 ILE B 54 0.776 7.795 -0.713 1.00 21.53 H new ATOM 0 HG13 ILE B 54 1.935 7.744 -2.027 1.00 21.53 H new ATOM 0 HG21 ILE B 54 -1.037 8.920 -1.786 1.00 50.11 H new ATOM 0 HG22 ILE B 54 -0.796 10.374 -2.783 1.00 50.11 H new ATOM 0 HG23 ILE B 54 -0.193 8.798 -3.348 1.00 50.11 H new ATOM 0 HD11 ILE B 54 3.045 7.478 0.132 1.00 13.23 H new ATOM 0 HD12 ILE B 54 3.568 8.988 -0.652 1.00 13.23 H new ATOM 0 HD13 ILE B 54 2.391 9.039 0.682 1.00 13.23 H new ATOM 2131 N GLU B 55 1.463 11.635 -4.777 1.00 54.45 N ATOM 2132 CA GLU B 55 0.996 12.773 -5.590 1.00 14.13 C ATOM 2133 C GLU B 55 -0.071 12.320 -6.605 1.00 73.33 C ATOM 2134 O GLU B 55 0.224 11.566 -7.538 1.00 2.30 O ATOM 2135 CB GLU B 55 2.209 13.444 -6.285 1.00 71.12 C ATOM 2136 CG GLU B 55 1.946 14.871 -6.791 1.00 60.41 C ATOM 2137 CD GLU B 55 1.333 15.803 -5.729 1.00 12.22 C ATOM 2138 OE1 GLU B 55 2.067 16.256 -4.826 1.00 40.15 O ATOM 2139 OE2 GLU B 55 0.109 16.068 -5.785 1.00 3.10 O ATOM 0 H GLU B 55 1.865 10.874 -5.325 1.00 54.45 H new ATOM 0 HA GLU B 55 0.522 13.511 -4.942 1.00 14.13 H new ATOM 0 HB2 GLU B 55 3.044 13.469 -5.585 1.00 71.12 H new ATOM 0 HB3 GLU B 55 2.517 12.825 -7.127 1.00 71.12 H new ATOM 0 HG2 GLU B 55 2.884 15.301 -7.141 1.00 60.41 H new ATOM 0 HG3 GLU B 55 1.277 14.824 -7.650 1.00 60.41 H new ATOM 2146 N ARG B 56 -1.315 12.788 -6.399 1.00 41.12 N ATOM 2147 CA ARG B 56 -2.473 12.429 -7.235 1.00 45.01 C ATOM 2148 C ARG B 56 -2.657 13.475 -8.355 1.00 43.14 C ATOM 2149 O ARG B 56 -3.246 14.542 -8.152 1.00 75.40 O ATOM 2150 CB ARG B 56 -3.730 12.328 -6.340 1.00 5.35 C ATOM 2151 CG ARG B 56 -3.592 11.294 -5.185 1.00 24.33 C ATOM 2152 CD ARG B 56 -4.406 11.672 -3.928 1.00 21.14 C ATOM 2153 NE ARG B 56 -4.063 13.025 -3.448 1.00 3.13 N ATOM 2154 CZ ARG B 56 -2.967 13.361 -2.795 1.00 52.43 C ATOM 2155 NH1 ARG B 56 -2.105 12.477 -2.393 1.00 11.35 N ATOM 2156 NH2 ARG B 56 -2.745 14.597 -2.543 1.00 65.43 N ATOM 0 H ARG B 56 -1.546 13.431 -5.642 1.00 41.12 H new ATOM 0 HA ARG B 56 -2.308 11.462 -7.710 1.00 45.01 H new ATOM 0 HB2 ARG B 56 -3.943 13.309 -5.915 1.00 5.35 H new ATOM 0 HB3 ARG B 56 -4.585 12.057 -6.959 1.00 5.35 H new ATOM 0 HG2 ARG B 56 -3.918 10.317 -5.540 1.00 24.33 H new ATOM 0 HG3 ARG B 56 -2.540 11.200 -4.914 1.00 24.33 H new ATOM 0 HD2 ARG B 56 -5.471 11.625 -4.155 1.00 21.14 H new ATOM 0 HD3 ARG B 56 -4.216 10.945 -3.138 1.00 21.14 H new ATOM 0 HE ARG B 56 -4.735 13.768 -3.639 1.00 3.13 H new ATOM 0 HH11 ARG B 56 -2.265 11.487 -2.580 1.00 11.35 H new ATOM 0 HH12 ARG B 56 -1.268 12.773 -1.891 1.00 11.35 H new ATOM 0 HH21 ARG B 56 -3.412 15.307 -2.846 1.00 65.43 H new ATOM 0 HH22 ARG B 56 -1.902 14.871 -2.039 1.00 65.43 H new ATOM 2170 N LYS B 57 -2.124 13.142 -9.526 1.00 52.11 N ATOM 2171 CA LYS B 57 -2.121 13.997 -10.723 1.00 73.42 C ATOM 2172 C LYS B 57 -3.168 13.479 -11.724 1.00 21.44 C ATOM 2173 O LYS B 57 -3.007 12.389 -12.281 1.00 72.42 O ATOM 2174 CB LYS B 57 -0.705 13.959 -11.346 1.00 63.15 C ATOM 2175 CG LYS B 57 0.400 14.566 -10.454 1.00 62.40 C ATOM 2176 CD LYS B 57 1.809 14.163 -10.930 1.00 52.30 C ATOM 2177 CE LYS B 57 2.933 14.950 -10.254 1.00 45.20 C ATOM 2178 NZ LYS B 57 4.259 14.581 -10.791 1.00 3.51 N ATOM 0 H LYS B 57 -1.666 12.243 -9.680 1.00 52.11 H new ATOM 0 HA LYS B 57 -2.374 15.024 -10.462 1.00 73.42 H new ATOM 0 HB2 LYS B 57 -0.447 12.924 -11.569 1.00 63.15 H new ATOM 0 HB3 LYS B 57 -0.724 14.495 -12.295 1.00 63.15 H new ATOM 0 HG2 LYS B 57 0.313 15.653 -10.457 1.00 62.40 H new ATOM 0 HG3 LYS B 57 0.257 14.237 -9.425 1.00 62.40 H new ATOM 0 HD2 LYS B 57 1.957 13.100 -10.741 1.00 52.30 H new ATOM 0 HD3 LYS B 57 1.874 14.307 -12.008 1.00 52.30 H new ATOM 0 HE2 LYS B 57 2.767 16.018 -10.397 1.00 45.20 H new ATOM 0 HE3 LYS B 57 2.911 14.765 -9.180 1.00 45.20 H new ATOM 0 HZ1 LYS B 57 4.759 13.983 -10.102 1.00 3.51 H new ATOM 0 HZ2 LYS B 57 4.139 14.057 -11.681 1.00 3.51 H new ATOM 0 HZ3 LYS B 57 4.814 15.443 -10.968 1.00 3.51 H new ATOM 2192 N ASN B 58 -4.242 14.272 -11.930 1.00 73.11 N ATOM 2193 CA ASN B 58 -5.422 13.889 -12.753 1.00 44.00 C ATOM 2194 C ASN B 58 -6.092 12.585 -12.229 1.00 63.24 C ATOM 2195 O ASN B 58 -6.721 11.837 -12.986 1.00 52.22 O ATOM 2196 CB ASN B 58 -5.007 13.772 -14.251 1.00 33.35 C ATOM 2197 CG ASN B 58 -4.326 15.040 -14.774 1.00 13.12 C ATOM 2198 OD1 ASN B 58 -4.642 16.156 -14.365 1.00 74.41 O ATOM 2199 ND2 ASN B 58 -3.377 14.882 -15.671 1.00 51.34 N ATOM 0 H ASN B 58 -4.320 15.206 -11.528 1.00 73.11 H new ATOM 0 HA ASN B 58 -6.174 14.673 -12.667 1.00 44.00 H new ATOM 0 HB2 ASN B 58 -4.332 12.925 -14.372 1.00 33.35 H new ATOM 0 HB3 ASN B 58 -5.891 13.564 -14.854 1.00 33.35 H new ATOM 0 HD21 ASN B 58 -2.886 15.695 -16.042 1.00 51.34 H new ATOM 0 HD22 ASN B 58 -3.132 13.946 -15.995 1.00 51.34 H new ATOM 2206 N GLY B 59 -5.993 12.370 -10.896 1.00 32.23 N ATOM 2207 CA GLY B 59 -6.474 11.140 -10.237 1.00 70.03 C ATOM 2208 C GLY B 59 -5.401 10.034 -10.110 1.00 73.10 C ATOM 2209 O GLY B 59 -5.500 9.162 -9.241 1.00 2.41 O ATOM 0 H GLY B 59 -5.578 13.044 -10.252 1.00 32.23 H new ATOM 0 HA2 GLY B 59 -6.840 11.393 -9.242 1.00 70.03 H new ATOM 0 HA3 GLY B 59 -7.322 10.747 -10.798 1.00 70.03 H new ATOM 2213 N LEU B 60 -4.368 10.084 -10.975 1.00 14.33 N ATOM 2214 CA LEU B 60 -3.296 9.056 -11.050 1.00 11.04 C ATOM 2215 C LEU B 60 -2.245 9.249 -9.931 1.00 45.01 C ATOM 2216 O LEU B 60 -1.670 10.327 -9.799 1.00 23.15 O ATOM 2217 CB LEU B 60 -2.602 9.131 -12.440 1.00 21.44 C ATOM 2218 CG LEU B 60 -3.519 8.881 -13.679 1.00 41.21 C ATOM 2219 CD1 LEU B 60 -2.746 9.106 -14.998 1.00 3.33 C ATOM 2220 CD2 LEU B 60 -4.159 7.471 -13.631 1.00 40.11 C ATOM 0 H LEU B 60 -4.248 10.841 -11.648 1.00 14.33 H new ATOM 0 HA LEU B 60 -3.755 8.077 -10.914 1.00 11.04 H new ATOM 0 HB2 LEU B 60 -2.146 10.116 -12.543 1.00 21.44 H new ATOM 0 HB3 LEU B 60 -1.792 8.401 -12.459 1.00 21.44 H new ATOM 0 HG LEU B 60 -4.330 9.608 -13.644 1.00 41.21 H new ATOM 0 HD11 LEU B 60 -3.409 8.925 -15.844 1.00 3.33 H new ATOM 0 HD12 LEU B 60 -2.382 10.133 -15.036 1.00 3.33 H new ATOM 0 HD13 LEU B 60 -1.901 8.419 -15.046 1.00 3.33 H new ATOM 0 HD21 LEU B 60 -4.791 7.328 -14.507 1.00 40.11 H new ATOM 0 HD22 LEU B 60 -3.374 6.715 -13.623 1.00 40.11 H new ATOM 0 HD23 LEU B 60 -4.763 7.376 -12.729 1.00 40.11 H new ATOM 2232 N ILE B 61 -1.982 8.194 -9.146 1.00 20.23 N ATOM 2233 CA ILE B 61 -1.066 8.269 -7.985 1.00 44.34 C ATOM 2234 C ILE B 61 0.388 7.890 -8.365 1.00 42.22 C ATOM 2235 O ILE B 61 0.651 6.789 -8.862 1.00 3.15 O ATOM 2236 CB ILE B 61 -1.583 7.360 -6.811 1.00 43.12 C ATOM 2237 CG1 ILE B 61 -3.042 7.772 -6.428 1.00 1.35 C ATOM 2238 CG2 ILE B 61 -0.633 7.409 -5.585 1.00 21.31 C ATOM 2239 CD1 ILE B 61 -3.642 7.032 -5.245 1.00 41.25 C ATOM 0 H ILE B 61 -2.391 7.271 -9.291 1.00 20.23 H new ATOM 0 HA ILE B 61 -1.055 9.306 -7.650 1.00 44.34 H new ATOM 0 HB ILE B 61 -1.592 6.325 -7.153 1.00 43.12 H new ATOM 0 HG12 ILE B 61 -3.054 8.840 -6.210 1.00 1.35 H new ATOM 0 HG13 ILE B 61 -3.684 7.617 -7.295 1.00 1.35 H new ATOM 0 HG21 ILE B 61 -1.025 6.768 -4.795 1.00 21.31 H new ATOM 0 HG22 ILE B 61 0.357 7.060 -5.878 1.00 21.31 H new ATOM 0 HG23 ILE B 61 -0.563 8.434 -5.220 1.00 21.31 H new ATOM 0 HD11 ILE B 61 -4.654 7.394 -5.065 1.00 41.25 H new ATOM 0 HD12 ILE B 61 -3.671 5.964 -5.461 1.00 41.25 H new ATOM 0 HD13 ILE B 61 -3.031 7.206 -4.359 1.00 41.25 H new ATOM 2251 N GLU B 62 1.323 8.818 -8.099 1.00 63.12 N ATOM 2252 CA GLU B 62 2.776 8.626 -8.311 1.00 32.34 C ATOM 2253 C GLU B 62 3.504 8.731 -6.956 1.00 52.31 C ATOM 2254 O GLU B 62 3.162 9.589 -6.135 1.00 43.45 O ATOM 2255 CB GLU B 62 3.341 9.694 -9.290 1.00 14.24 C ATOM 2256 CG GLU B 62 2.688 9.715 -10.691 1.00 4.24 C ATOM 2257 CD GLU B 62 3.357 10.691 -11.689 1.00 72.43 C ATOM 2258 OE1 GLU B 62 4.089 11.619 -11.262 1.00 13.31 O ATOM 2259 OE2 GLU B 62 3.144 10.533 -12.915 1.00 33.10 O ATOM 0 H GLU B 62 1.091 9.738 -7.725 1.00 63.12 H new ATOM 0 HA GLU B 62 2.938 7.641 -8.748 1.00 32.34 H new ATOM 0 HB2 GLU B 62 3.222 10.678 -8.837 1.00 14.24 H new ATOM 0 HB3 GLU B 62 4.411 9.525 -9.408 1.00 14.24 H new ATOM 0 HG2 GLU B 62 2.718 8.709 -11.109 1.00 4.24 H new ATOM 0 HG3 GLU B 62 1.637 9.985 -10.586 1.00 4.24 H new ATOM 2266 N ILE B 63 4.507 7.871 -6.718 1.00 3.53 N ATOM 2267 CA ILE B 63 5.256 7.848 -5.444 1.00 41.23 C ATOM 2268 C ILE B 63 6.740 8.274 -5.631 1.00 35.13 C ATOM 2269 O ILE B 63 7.567 7.536 -6.170 1.00 34.11 O ATOM 2270 CB ILE B 63 5.095 6.450 -4.682 1.00 12.33 C ATOM 2271 CG1 ILE B 63 4.949 5.219 -5.655 1.00 25.41 C ATOM 2272 CG2 ILE B 63 3.884 6.502 -3.711 1.00 61.23 C ATOM 2273 CD1 ILE B 63 6.178 4.840 -6.451 1.00 2.43 C ATOM 0 H ILE B 63 4.822 7.176 -7.395 1.00 3.53 H new ATOM 0 HA ILE B 63 4.810 8.600 -4.793 1.00 41.23 H new ATOM 0 HB ILE B 63 6.018 6.299 -4.122 1.00 12.33 H new ATOM 0 HG12 ILE B 63 4.643 4.354 -5.067 1.00 25.41 H new ATOM 0 HG13 ILE B 63 4.141 5.431 -6.355 1.00 25.41 H new ATOM 0 HG21 ILE B 63 3.786 5.544 -3.200 1.00 61.23 H new ATOM 0 HG22 ILE B 63 4.041 7.292 -2.976 1.00 61.23 H new ATOM 0 HG23 ILE B 63 2.974 6.706 -4.275 1.00 61.23 H new ATOM 0 HD11 ILE B 63 5.952 3.980 -7.082 1.00 2.43 H new ATOM 0 HD12 ILE B 63 6.480 5.680 -7.077 1.00 2.43 H new ATOM 0 HD13 ILE B 63 6.989 4.586 -5.769 1.00 2.43 H new ATOM 2285 N TYR B 64 7.047 9.511 -5.208 1.00 24.43 N ATOM 2286 CA TYR B 64 8.422 10.059 -5.204 1.00 5.14 C ATOM 2287 C TYR B 64 9.186 9.621 -3.933 1.00 10.43 C ATOM 2288 O TYR B 64 8.584 9.087 -3.010 1.00 42.30 O ATOM 2289 CB TYR B 64 8.364 11.609 -5.322 1.00 11.11 C ATOM 2290 CG TYR B 64 7.869 12.101 -6.694 1.00 23.31 C ATOM 2291 CD1 TYR B 64 6.504 12.145 -7.012 1.00 1.42 C ATOM 2292 CD2 TYR B 64 8.774 12.504 -7.684 1.00 25.14 C ATOM 2293 CE1 TYR B 64 6.072 12.554 -8.263 1.00 24.03 C ATOM 2294 CE2 TYR B 64 8.345 12.905 -8.933 1.00 54.31 C ATOM 2295 CZ TYR B 64 6.999 12.938 -9.216 1.00 34.44 C ATOM 2296 OH TYR B 64 6.585 13.326 -10.468 1.00 15.43 O ATOM 0 H TYR B 64 6.348 10.166 -4.857 1.00 24.43 H new ATOM 0 HA TYR B 64 8.967 9.663 -6.061 1.00 5.14 H new ATOM 0 HB2 TYR B 64 7.707 12.000 -4.545 1.00 11.11 H new ATOM 0 HB3 TYR B 64 9.357 12.017 -5.135 1.00 11.11 H new ATOM 0 HD1 TYR B 64 5.777 11.855 -6.268 1.00 1.42 H new ATOM 0 HD2 TYR B 64 9.832 12.501 -7.465 1.00 25.14 H new ATOM 0 HE1 TYR B 64 5.017 12.573 -8.493 1.00 24.03 H new ATOM 0 HE2 TYR B 64 9.064 13.192 -9.686 1.00 54.31 H new ATOM 0 HH TYR B 64 7.365 13.564 -11.011 1.00 15.43 H new ATOM 2306 N ASN B 65 10.519 9.809 -3.900 1.00 23.43 N ATOM 2307 CA ASN B 65 11.334 9.472 -2.700 1.00 64.12 C ATOM 2308 C ASN B 65 11.524 10.690 -1.756 1.00 24.30 C ATOM 2309 O ASN B 65 11.298 11.846 -2.147 1.00 51.04 O ATOM 2310 CB ASN B 65 12.698 8.848 -3.119 1.00 74.45 C ATOM 2311 CG ASN B 65 13.586 9.744 -4.002 1.00 23.42 C ATOM 2312 OD1 ASN B 65 13.607 10.967 -3.887 1.00 21.12 O ATOM 2313 ND2 ASN B 65 14.338 9.136 -4.897 1.00 41.13 N ATOM 0 H ASN B 65 11.057 10.188 -4.679 1.00 23.43 H new ATOM 0 HA ASN B 65 10.782 8.725 -2.129 1.00 64.12 H new ATOM 0 HB2 ASN B 65 13.253 8.590 -2.217 1.00 74.45 H new ATOM 0 HB3 ASN B 65 12.505 7.917 -3.652 1.00 74.45 H new ATOM 0 HD21 ASN B 65 14.948 9.681 -5.506 1.00 41.13 H new ATOM 0 HD22 ASN B 65 14.310 8.120 -4.981 1.00 41.13 H new ATOM 2320 N GLU B 66 11.951 10.407 -0.508 1.00 50.20 N ATOM 2321 CA GLU B 66 12.265 11.442 0.516 1.00 44.22 C ATOM 2322 C GLU B 66 13.480 12.333 0.100 1.00 24.32 C ATOM 2323 O GLU B 66 13.626 13.462 0.578 1.00 41.11 O ATOM 2324 CB GLU B 66 12.546 10.753 1.883 1.00 65.20 C ATOM 2325 CG GLU B 66 12.825 11.709 3.068 1.00 13.03 C ATOM 2326 CD GLU B 66 13.212 10.981 4.372 1.00 51.42 C ATOM 2327 OE1 GLU B 66 14.275 10.318 4.401 1.00 75.41 O ATOM 2328 OE2 GLU B 66 12.471 11.066 5.372 1.00 30.45 O ATOM 0 H GLU B 66 12.090 9.453 -0.175 1.00 50.20 H new ATOM 0 HA GLU B 66 11.400 12.099 0.603 1.00 44.22 H new ATOM 0 HB2 GLU B 66 11.690 10.128 2.137 1.00 65.20 H new ATOM 0 HB3 GLU B 66 13.402 10.089 1.766 1.00 65.20 H new ATOM 0 HG2 GLU B 66 13.628 12.392 2.791 1.00 13.03 H new ATOM 0 HG3 GLU B 66 11.938 12.316 3.250 1.00 13.03 H new ATOM 2335 N GLY B 67 14.319 11.820 -0.832 1.00 63.14 N ATOM 2336 CA GLY B 67 15.524 12.528 -1.320 1.00 23.51 C ATOM 2337 C GLY B 67 15.258 13.870 -2.026 1.00 72.14 C ATOM 2338 O GLY B 67 16.194 14.622 -2.303 1.00 13.31 O ATOM 0 H GLY B 67 14.179 10.907 -1.264 1.00 63.14 H new ATOM 0 HA2 GLY B 67 16.188 12.707 -0.474 1.00 23.51 H new ATOM 0 HA3 GLY B 67 16.056 11.873 -2.010 1.00 23.51 H new ATOM 2342 N HIS B 68 13.985 14.155 -2.347 1.00 12.30 N ATOM 2343 CA HIS B 68 13.564 15.469 -2.892 1.00 12.44 C ATOM 2344 C HIS B 68 13.292 16.488 -1.762 1.00 52.11 C ATOM 2345 O HIS B 68 13.543 17.691 -1.919 1.00 33.40 O ATOM 2346 CB HIS B 68 12.320 15.289 -3.794 1.00 21.30 C ATOM 2347 CG HIS B 68 12.583 14.373 -4.957 1.00 41.11 C ATOM 2348 ND1 HIS B 68 13.645 14.554 -5.813 1.00 23.33 N ATOM 2349 CD2 HIS B 68 11.969 13.242 -5.369 1.00 22.21 C ATOM 2350 CE1 HIS B 68 13.672 13.583 -6.691 1.00 45.02 C ATOM 2351 NE2 HIS B 68 12.672 12.774 -6.449 1.00 12.21 N ATOM 0 H HIS B 68 13.219 13.490 -2.239 1.00 12.30 H new ATOM 0 HA HIS B 68 14.379 15.870 -3.495 1.00 12.44 H new ATOM 0 HB2 HIS B 68 11.498 14.890 -3.199 1.00 21.30 H new ATOM 0 HB3 HIS B 68 12.001 16.262 -4.167 1.00 21.30 H new ATOM 0 HD2 HIS B 68 11.091 12.792 -4.930 1.00 22.21 H new ATOM 0 HE1 HIS B 68 14.398 13.469 -7.482 1.00 45.02 H new ATOM 0 HE2 HIS B 68 12.451 11.931 -6.979 1.00 12.21 H new ATOM 2360 N PHE B 69 12.771 16.001 -0.625 1.00 1.22 N ATOM 2361 CA PHE B 69 12.520 16.830 0.573 1.00 4.34 C ATOM 2362 C PHE B 69 13.597 16.540 1.640 1.00 42.13 C ATOM 2363 O PHE B 69 13.413 15.710 2.538 1.00 12.14 O ATOM 2364 CB PHE B 69 11.085 16.580 1.112 1.00 13.42 C ATOM 2365 CG PHE B 69 9.990 16.985 0.122 1.00 22.51 C ATOM 2366 CD1 PHE B 69 9.493 18.290 0.098 1.00 71.20 C ATOM 2367 CD2 PHE B 69 9.472 16.070 -0.798 1.00 44.31 C ATOM 2368 CE1 PHE B 69 8.511 18.662 -0.805 1.00 24.04 C ATOM 2369 CE2 PHE B 69 8.489 16.445 -1.700 1.00 62.14 C ATOM 2370 CZ PHE B 69 8.011 17.740 -1.705 1.00 75.33 C ATOM 0 H PHE B 69 12.511 15.022 -0.506 1.00 1.22 H new ATOM 0 HA PHE B 69 12.585 17.885 0.309 1.00 4.34 H new ATOM 0 HB2 PHE B 69 10.974 15.523 1.354 1.00 13.42 H new ATOM 0 HB3 PHE B 69 10.950 17.136 2.040 1.00 13.42 H new ATOM 0 HD1 PHE B 69 9.880 19.020 0.794 1.00 71.20 H new ATOM 0 HD2 PHE B 69 9.843 15.056 -0.806 1.00 44.31 H new ATOM 0 HE1 PHE B 69 8.135 19.675 -0.806 1.00 24.04 H new ATOM 0 HE2 PHE B 69 8.096 15.723 -2.400 1.00 62.14 H new ATOM 0 HZ PHE B 69 7.248 18.032 -2.411 1.00 75.33 H new ATOM 2380 N ASP B 70 14.737 17.239 1.516 1.00 21.12 N ATOM 2381 CA ASP B 70 15.929 17.050 2.379 1.00 4.03 C ATOM 2382 C ASP B 70 15.822 17.847 3.712 1.00 3.14 C ATOM 2383 O ASP B 70 16.828 18.288 4.282 1.00 43.35 O ATOM 2384 CB ASP B 70 17.210 17.414 1.573 1.00 21.23 C ATOM 2385 CG ASP B 70 17.222 18.854 1.024 1.00 41.30 C ATOM 2386 OD1 ASP B 70 16.397 19.167 0.138 1.00 33.12 O ATOM 2387 OD2 ASP B 70 18.061 19.675 1.465 1.00 31.03 O ATOM 0 H ASP B 70 14.865 17.961 0.807 1.00 21.12 H new ATOM 0 HA ASP B 70 15.988 16.002 2.671 1.00 4.03 H new ATOM 0 HB2 ASP B 70 18.081 17.274 2.213 1.00 21.23 H new ATOM 0 HB3 ASP B 70 17.312 16.718 0.740 1.00 21.23 H new ATOM 2392 N PHE B 71 14.589 17.949 4.242 1.00 53.44 N ATOM 2393 CA PHE B 71 14.289 18.625 5.524 1.00 60.33 C ATOM 2394 C PHE B 71 14.197 17.587 6.678 1.00 23.44 C ATOM 2395 O PHE B 71 13.524 17.819 7.685 1.00 3.51 O ATOM 2396 CB PHE B 71 12.960 19.419 5.388 1.00 14.12 C ATOM 2397 CG PHE B 71 12.928 20.396 4.212 1.00 53.23 C ATOM 2398 CD1 PHE B 71 13.551 21.643 4.299 1.00 55.40 C ATOM 2399 CD2 PHE B 71 12.291 20.061 3.013 1.00 10.23 C ATOM 2400 CE1 PHE B 71 13.528 22.525 3.230 1.00 55.41 C ATOM 2401 CE2 PHE B 71 12.268 20.944 1.948 1.00 3.23 C ATOM 2402 CZ PHE B 71 12.891 22.174 2.054 1.00 41.20 C ATOM 0 H PHE B 71 13.762 17.561 3.789 1.00 53.44 H new ATOM 0 HA PHE B 71 15.094 19.319 5.763 1.00 60.33 H new ATOM 0 HB2 PHE B 71 12.137 18.712 5.280 1.00 14.12 H new ATOM 0 HB3 PHE B 71 12.785 19.973 6.310 1.00 14.12 H new ATOM 0 HD1 PHE B 71 14.057 21.924 5.211 1.00 55.40 H new ATOM 0 HD2 PHE B 71 11.810 19.099 2.917 1.00 10.23 H new ATOM 0 HE1 PHE B 71 14.009 23.488 3.316 1.00 55.41 H new ATOM 0 HE2 PHE B 71 11.763 20.672 1.033 1.00 3.23 H new ATOM 0 HZ PHE B 71 12.880 22.859 1.219 1.00 41.20 H new ATOM 2412 N SER B 72 14.899 16.452 6.521 1.00 24.34 N ATOM 2413 CA SER B 72 14.926 15.354 7.521 1.00 73.23 C ATOM 2414 C SER B 72 15.935 15.632 8.660 1.00 14.13 C ATOM 2415 O SER B 72 15.949 14.915 9.669 1.00 71.12 O ATOM 2416 CB SER B 72 15.259 14.014 6.827 1.00 42.43 C ATOM 2417 OG SER B 72 14.348 13.748 5.769 1.00 71.20 O ATOM 0 H SER B 72 15.468 16.263 5.696 1.00 24.34 H new ATOM 0 HA SER B 72 13.935 15.294 7.971 1.00 73.23 H new ATOM 0 HB2 SER B 72 16.276 14.046 6.436 1.00 42.43 H new ATOM 0 HB3 SER B 72 15.222 13.204 7.556 1.00 42.43 H new ATOM 0 HG SER B 72 14.743 13.096 5.153 1.00 71.20 H new ATOM 2423 N PHE B 73 16.786 16.666 8.480 1.00 41.41 N ATOM 2424 CA PHE B 73 17.731 17.141 9.518 1.00 11.33 C ATOM 2425 C PHE B 73 16.987 17.871 10.676 1.00 21.40 C ATOM 2426 O PHE B 73 15.762 18.050 10.638 1.00 34.11 O ATOM 2427 CB PHE B 73 18.800 18.085 8.880 1.00 70.02 C ATOM 2428 CG PHE B 73 18.273 19.460 8.436 1.00 50.40 C ATOM 2429 CD1 PHE B 73 17.566 19.609 7.245 1.00 32.34 C ATOM 2430 CD2 PHE B 73 18.479 20.601 9.222 1.00 73.35 C ATOM 2431 CE1 PHE B 73 17.089 20.848 6.849 1.00 24.32 C ATOM 2432 CE2 PHE B 73 18.001 21.836 8.826 1.00 12.33 C ATOM 2433 CZ PHE B 73 17.304 21.959 7.641 1.00 23.05 C ATOM 0 H PHE B 73 16.838 17.196 7.610 1.00 41.41 H new ATOM 0 HA PHE B 73 18.230 16.270 9.941 1.00 11.33 H new ATOM 0 HB2 PHE B 73 19.604 18.236 9.600 1.00 70.02 H new ATOM 0 HB3 PHE B 73 19.236 17.584 8.016 1.00 70.02 H new ATOM 0 HD1 PHE B 73 17.387 18.746 6.621 1.00 32.34 H new ATOM 0 HD2 PHE B 73 19.020 20.514 10.153 1.00 73.35 H new ATOM 0 HE1 PHE B 73 16.548 20.945 5.919 1.00 24.32 H new ATOM 0 HE2 PHE B 73 18.173 22.705 9.444 1.00 12.33 H new ATOM 0 HZ PHE B 73 16.927 22.923 7.333 1.00 23.05 H new ATOM 2443 N GLY B 74 17.749 18.303 11.691 1.00 62.40 N ATOM 2444 CA GLY B 74 17.205 19.083 12.798 1.00 53.00 C ATOM 2445 C GLY B 74 18.278 19.865 13.540 1.00 1.44 C ATOM 2446 O GLY B 74 19.300 20.248 12.961 1.00 20.31 O ATOM 0 H GLY B 74 18.750 18.121 11.763 1.00 62.40 H new ATOM 0 HA2 GLY B 74 16.454 19.775 12.417 1.00 53.00 H new ATOM 0 HA3 GLY B 74 16.699 18.415 13.495 1.00 53.00 H new ATOM 2450 N LEU B 75 18.037 20.112 14.828 1.00 21.35 N ATOM 2451 CA LEU B 75 18.984 20.806 15.722 1.00 22.23 C ATOM 2452 C LEU B 75 19.566 19.802 16.734 1.00 3.01 C ATOM 2453 O LEU B 75 18.909 18.812 17.085 1.00 15.41 O ATOM 2454 CB LEU B 75 18.295 21.998 16.465 1.00 11.13 C ATOM 2455 CG LEU B 75 17.849 23.229 15.601 1.00 74.23 C ATOM 2456 CD1 LEU B 75 19.002 23.752 14.724 1.00 63.44 C ATOM 2457 CD2 LEU B 75 16.584 22.934 14.768 1.00 61.21 C ATOM 0 H LEU B 75 17.171 19.836 15.291 1.00 21.35 H new ATOM 0 HA LEU B 75 19.792 21.219 15.118 1.00 22.23 H new ATOM 0 HB2 LEU B 75 17.415 21.611 16.978 1.00 11.13 H new ATOM 0 HB3 LEU B 75 18.980 22.357 17.233 1.00 11.13 H new ATOM 0 HG LEU B 75 17.583 24.023 16.298 1.00 74.23 H new ATOM 0 HD11 LEU B 75 18.657 24.605 14.139 1.00 63.44 H new ATOM 0 HD12 LEU B 75 19.832 24.060 15.360 1.00 63.44 H new ATOM 0 HD13 LEU B 75 19.335 22.962 14.051 1.00 63.44 H new ATOM 0 HD21 LEU B 75 16.316 23.817 14.188 1.00 61.21 H new ATOM 0 HD22 LEU B 75 16.779 22.101 14.092 1.00 61.21 H new ATOM 0 HD23 LEU B 75 15.762 22.675 15.435 1.00 61.21 H new ATOM 2469 N GLU B 76 20.809 20.053 17.172 1.00 75.25 N ATOM 2470 CA GLU B 76 21.504 19.228 18.192 1.00 10.30 C ATOM 2471 C GLU B 76 20.710 19.182 19.519 1.00 1.42 C ATOM 2472 O GLU B 76 20.081 20.177 19.906 1.00 1.13 O ATOM 2473 CB GLU B 76 22.922 19.797 18.463 1.00 72.14 C ATOM 2474 CG GLU B 76 23.845 19.849 17.229 1.00 23.13 C ATOM 2475 CD GLU B 76 25.206 20.507 17.528 1.00 34.03 C ATOM 2476 OE1 GLU B 76 26.143 19.799 17.950 1.00 3.42 O ATOM 2477 OE2 GLU B 76 25.334 21.742 17.364 1.00 62.42 O ATOM 0 H GLU B 76 21.369 20.835 16.832 1.00 75.25 H new ATOM 0 HA GLU B 76 21.581 18.214 17.800 1.00 10.30 H new ATOM 0 HB2 GLU B 76 22.823 20.804 18.868 1.00 72.14 H new ATOM 0 HB3 GLU B 76 23.401 19.190 19.232 1.00 72.14 H new ATOM 0 HG2 GLU B 76 24.009 18.836 16.861 1.00 23.13 H new ATOM 0 HG3 GLU B 76 23.347 20.401 16.432 1.00 23.13 H new ATOM 2484 N HIS B 77 20.735 18.026 20.205 1.00 73.20 N ATOM 2485 CA HIS B 77 20.066 17.874 21.508 1.00 51.31 C ATOM 2486 C HIS B 77 20.820 18.692 22.590 1.00 70.44 C ATOM 2487 O HIS B 77 21.862 18.258 23.107 1.00 54.42 O ATOM 2488 CB HIS B 77 19.946 16.382 21.909 1.00 44.13 C ATOM 2489 CG HIS B 77 19.160 16.168 23.181 1.00 12.23 C ATOM 2490 ND1 HIS B 77 19.725 16.262 24.437 1.00 63.01 N ATOM 2491 CD2 HIS B 77 17.845 15.923 23.388 1.00 3.52 C ATOM 2492 CE1 HIS B 77 18.798 16.088 25.353 1.00 10.34 C ATOM 2493 NE2 HIS B 77 17.650 15.880 24.746 1.00 62.03 N ATOM 0 H HIS B 77 21.211 17.185 19.879 1.00 73.20 H new ATOM 0 HA HIS B 77 19.052 18.265 21.424 1.00 51.31 H new ATOM 0 HB2 HIS B 77 19.469 15.832 21.098 1.00 44.13 H new ATOM 0 HB3 HIS B 77 20.945 15.964 22.033 1.00 44.13 H new ATOM 0 HD2 HIS B 77 17.091 15.787 22.627 1.00 3.52 H new ATOM 0 HE1 HIS B 77 18.953 16.112 26.422 1.00 10.34 H new ATOM 0 HE2 HIS B 77 16.757 15.713 25.210 1.00 62.03 H new ATOM 2502 N HIS B 78 20.285 19.885 22.890 1.00 12.24 N ATOM 2503 CA HIS B 78 20.905 20.853 23.807 1.00 42.33 C ATOM 2504 C HIS B 78 20.945 20.310 25.258 1.00 62.11 C ATOM 2505 O HIS B 78 19.902 20.026 25.859 1.00 62.23 O ATOM 2506 CB HIS B 78 20.135 22.197 23.733 1.00 62.31 C ATOM 2507 CG HIS B 78 20.775 23.334 24.488 1.00 43.54 C ATOM 2508 ND1 HIS B 78 21.929 23.954 24.064 1.00 4.20 N ATOM 2509 CD2 HIS B 78 20.411 23.974 25.627 1.00 20.44 C ATOM 2510 CE1 HIS B 78 22.247 24.918 24.900 1.00 42.02 C ATOM 2511 NE2 HIS B 78 21.342 24.952 25.857 1.00 0.25 N ATOM 0 H HIS B 78 19.400 20.208 22.499 1.00 12.24 H new ATOM 0 HA HIS B 78 21.938 21.017 23.500 1.00 42.33 H new ATOM 0 HB2 HIS B 78 20.035 22.485 22.687 1.00 62.31 H new ATOM 0 HB3 HIS B 78 19.127 22.044 24.120 1.00 62.31 H new ATOM 0 HD2 HIS B 78 19.548 23.754 26.238 1.00 20.44 H new ATOM 0 HE1 HIS B 78 23.104 25.570 24.816 1.00 42.02 H new ATOM 0 HE2 HIS B 78 21.336 25.602 26.643 1.00 0.25 H new ATOM 2520 N HIS B 79 22.166 20.170 25.793 1.00 11.03 N ATOM 2521 CA HIS B 79 22.415 19.667 27.161 1.00 65.33 C ATOM 2522 C HIS B 79 23.462 20.554 27.872 1.00 52.13 C ATOM 2523 O HIS B 79 24.226 21.266 27.212 1.00 72.45 O ATOM 2524 CB HIS B 79 22.895 18.191 27.103 1.00 23.13 C ATOM 2525 CG HIS B 79 24.201 17.988 26.363 1.00 50.52 C ATOM 2526 ND1 HIS B 79 24.272 17.803 24.998 1.00 54.20 N ATOM 2527 CD2 HIS B 79 25.486 17.946 26.806 1.00 52.34 C ATOM 2528 CE1 HIS B 79 25.530 17.656 24.639 1.00 55.33 C ATOM 2529 NE2 HIS B 79 26.286 17.740 25.712 1.00 21.12 N ATOM 0 H HIS B 79 23.020 20.404 25.287 1.00 11.03 H new ATOM 0 HA HIS B 79 21.487 19.708 27.731 1.00 65.33 H new ATOM 0 HB2 HIS B 79 23.006 17.817 28.121 1.00 23.13 H new ATOM 0 HB3 HIS B 79 22.123 17.589 26.625 1.00 23.13 H new ATOM 0 HD1 HIS B 79 23.473 17.783 24.364 1.00 54.20 H new ATOM 0 HD2 HIS B 79 25.815 18.055 27.829 1.00 52.34 H new ATOM 0 HE1 HIS B 79 25.883 17.493 23.631 1.00 55.33 H new ATOM 2538 N HIS B 80 23.502 20.486 29.213 1.00 41.31 N ATOM 2539 CA HIS B 80 24.472 21.248 30.034 1.00 51.00 C ATOM 2540 C HIS B 80 25.902 20.653 29.907 1.00 23.11 C ATOM 2541 O HIS B 80 26.093 19.443 30.095 1.00 64.24 O ATOM 2542 CB HIS B 80 24.016 21.256 31.513 1.00 32.42 C ATOM 2543 CG HIS B 80 24.889 22.083 32.425 1.00 75.42 C ATOM 2544 ND1 HIS B 80 25.879 21.541 33.222 1.00 12.13 N ATOM 2545 CD2 HIS B 80 24.922 23.418 32.659 1.00 40.44 C ATOM 2546 CE1 HIS B 80 26.471 22.495 33.905 1.00 4.04 C ATOM 2547 NE2 HIS B 80 25.914 23.643 33.581 1.00 73.24 N ATOM 0 H HIS B 80 22.868 19.905 29.762 1.00 41.31 H new ATOM 0 HA HIS B 80 24.505 22.274 29.666 1.00 51.00 H new ATOM 0 HB2 HIS B 80 22.995 21.634 31.565 1.00 32.42 H new ATOM 0 HB3 HIS B 80 23.995 20.230 31.881 1.00 32.42 H new ATOM 0 HD2 HIS B 80 24.287 24.164 32.205 1.00 40.44 H new ATOM 0 HE1 HIS B 80 27.277 22.360 34.611 1.00 4.04 H new ATOM 0 HE2 HIS B 80 26.178 24.554 33.955 1.00 73.24 H new ATOM 2556 N HIS B 81 26.892 21.511 29.578 1.00 34.42 N ATOM 2557 CA HIS B 81 28.316 21.104 29.501 1.00 4.42 C ATOM 2558 C HIS B 81 28.911 20.855 30.915 1.00 65.11 C ATOM 2559 O HIS B 81 28.767 21.687 31.815 1.00 71.43 O ATOM 2560 CB HIS B 81 29.161 22.141 28.690 1.00 54.14 C ATOM 2561 CG HIS B 81 29.002 23.603 29.070 1.00 45.04 C ATOM 2562 ND1 HIS B 81 28.646 24.571 28.156 1.00 21.12 N ATOM 2563 CD2 HIS B 81 29.176 24.265 30.244 1.00 15.43 C ATOM 2564 CE1 HIS B 81 28.604 25.745 28.742 1.00 13.33 C ATOM 2565 NE2 HIS B 81 28.919 25.593 30.009 1.00 3.53 N ATOM 0 H HIS B 81 26.732 22.495 29.360 1.00 34.42 H new ATOM 0 HA HIS B 81 28.361 20.158 28.961 1.00 4.42 H new ATOM 0 HB2 HIS B 81 30.213 21.876 28.793 1.00 54.14 H new ATOM 0 HB3 HIS B 81 28.907 22.035 27.635 1.00 54.14 H new ATOM 0 HD2 HIS B 81 29.464 23.827 31.188 1.00 15.43 H new ATOM 0 HE1 HIS B 81 28.353 26.680 28.263 1.00 13.33 H new ATOM 0 HE2 HIS B 81 28.965 26.339 30.703 1.00 3.53 H new ATOM 2574 N HIS B 82 29.542 19.684 31.097 1.00 23.04 N ATOM 2575 CA HIS B 82 30.221 19.309 32.356 1.00 33.14 C ATOM 2576 C HIS B 82 31.260 18.206 32.088 1.00 3.32 C ATOM 2577 O HIS B 82 32.267 18.433 31.415 1.00 40.24 O ATOM 2578 CB HIS B 82 29.193 18.836 33.422 1.00 30.41 C ATOM 2579 CG HIS B 82 29.771 18.644 34.805 1.00 13.04 C ATOM 2580 ND1 HIS B 82 30.063 17.409 35.348 1.00 53.44 N ATOM 2581 CD2 HIS B 82 30.110 19.549 35.754 1.00 44.20 C ATOM 2582 CE1 HIS B 82 30.551 17.566 36.561 1.00 12.32 C ATOM 2583 NE2 HIS B 82 30.590 18.850 36.831 1.00 43.43 N ATOM 0 H HIS B 82 29.598 18.966 30.375 1.00 23.04 H new ATOM 0 HA HIS B 82 30.732 20.189 32.746 1.00 33.14 H new ATOM 0 HB2 HIS B 82 28.384 19.565 33.477 1.00 30.41 H new ATOM 0 HB3 HIS B 82 28.752 17.895 33.092 1.00 30.41 H new ATOM 0 HD2 HIS B 82 30.019 20.622 35.677 1.00 44.20 H new ATOM 0 HE1 HIS B 82 30.866 16.772 37.222 1.00 12.32 H new ATOM 0 HE2 HIS B 82 30.924 19.262 37.702 1.00 43.43 H new TER 2592 HIS B 82