USER MOD reduce.3.24.130724 H: found=0, std=0, add=2001, rem=0, adj=66 USER MOD reduce.3.24.130724 removed 2000 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 126 ASN : amide:sc= -0.667 K(o=-0.67,f=-6.9!) USER MOD Set 1.2: B 131 ASN :FLIP amide:sc= 0 F(o=-1.5,f=-0.67) USER MOD Set 2.1: B 54 TYR OH : rot 15:sc= -0.58 USER MOD Set 2.2: B 119 HIS : no HE2:sc= -1.2 K(o=-1.6,f=-2.9!) USER MOD Set 2.3: B 128 THR OG1 : rot -137:sc= 0.19 USER MOD Set 3.1: A 10 THR OG1 : rot 86:sc= 0.433 USER MOD Set 3.2: B 80 THR OG1 : rot 180:sc= 0.418 USER MOD Set 4.1: B 7 THR OG1 : rot 28:sc= 1.19 USER MOD Set 4.2: B 21 SER OG : rot -74:sc= 1.26 USER MOD Set 4.3: B 25 LYS NZ :NH3+ 147:sc= -1.23! (180deg=-4.76!) USER MOD Set 5.1: A 80 THR OG1 : rot -95:sc= 0.029 USER MOD Set 5.2: B 10 THR OG1 : rot 180:sc= -1.19 USER MOD Set 5.3: B 22 HIS : no HD1:sc= 0 X(o=-1.2,f=-1.2) USER MOD Set 6.1: A 55 SER OG : rot -76:sc= 1.14 USER MOD Set 6.2: B 11 SER OG : rot -137:sc= 0.417 USER MOD Set 7.1: A 11 SER OG : rot 40:sc= 1.01 USER MOD Set 7.2: B 55 SER OG : rot -85:sc= -0.237 USER MOD Set 8.1: A 7 THR OG1 : rot -167:sc= 0.275 USER MOD Set 8.2: A 21 SER OG : rot 70:sc= -0.964 USER MOD Set 8.3: A 25 LYS NZ :NH3+ 166:sc= -0.0664 (180deg=-0.404) USER MOD Set 8.4: B 48 GLN : amide:sc= -2 K(o=-2.8,f=-5.1!) USER MOD Set 9.1: A 5 TYR OH : rot 180:sc= 0.407 USER MOD Set 9.2: B 45 ASN : amide:sc= 0.0925 K(o=0.5,f=-1.5!) USER MOD Single : A 1 MET CE :methyl -138:sc= -0.0323 (180deg=-1.06) USER MOD Single : A 1 MET N :NH3+ -110:sc= 0.121 (180deg=-0.0826) USER MOD Single : A 2 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 6 LYS NZ :NH3+ 179:sc= 1.89 (180deg=1.86) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc= -0.0276 X(o=-0.028,f=-0.15) USER MOD Single : A 24 GLN : amide:sc= 0.0459 X(o=0.046,f=-0.13) USER MOD Single : A 29 LYS NZ :NH3+ 157:sc= 1.05 (180deg=0.473) USER MOD Single : A 31 SER OG : rot 122:sc= -0.392 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.369 K(o=-0.37,f=-4.2!) USER MOD Single : A 48 GLN : amide:sc= -4.74! C(o=-4.7!,f=-9.5!) USER MOD Single : A 54 TYR OH : rot 44:sc= -0.213 USER MOD Single : A 57 CYS SG : rot -20:sc= -1.98! USER MOD Single : A 60 SER OG : rot -109:sc= 0.485 USER MOD Single : A 62 MET CE :methyl -161:sc= -0.219 (180deg=-0.749) USER MOD Single : A 63 LYS NZ :NH3+ -175:sc=-0.000394 (180deg=-0.0672) USER MOD Single : A 68 GLN : amide:sc= -0.316 X(o=-0.32,f=-0.0082) USER MOD Single : A 69 ASN : amide:sc= -0.649 X(o=-0.65,f=-0.25) USER MOD Single : A 70 LYS NZ :NH3+ -166:sc= 1.2 (180deg=1.01) USER MOD Single : A 71 GLN :FLIP amide:sc=-0.00667 F(o=-1,f=-0.0067) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 56:sc= -0.695! USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= 0.656 K(o=0.66,f=-5.9!) USER MOD Single : A 112 LYS NZ :NH3+ -171:sc= -0.0119 (180deg=-0.116) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= -10.3! C(o=-10!,f=-10!) USER MOD Single : A 120 HIS : no HD1:sc= -0.224 X(o=-0.22,f=0) USER MOD Single : A 122 CYS SG : rot 86:sc= 0.06 USER MOD Single : A 124 TYR OH : rot 23:sc= 0.748 USER MOD Single : A 125 SER OG : rot 76:sc= 0.788 USER MOD Single : A 128 THR OG1 : rot 120:sc= -0.331 USER MOD Single : A 130 ASN :FLIP amide:sc= -0.101 F(o=-0.97,f=-0.1) USER MOD Single : A 131 ASN :FLIP amide:sc= -0.037 F(o=-1.3!,f=-0.037) USER MOD Single : B 1 MET CE :methyl 165:sc= -3.99! (180deg=-4.79!) USER MOD Single : B 1 MET N :NH3+ 132:sc= 0.0565 (180deg=-0.0888) USER MOD Single : B 2 ASN : amide:sc= -0.0351 X(o=-0.035,f=-0.53) USER MOD Single : B 5 TYR OH : rot 180:sc= -0.497 USER MOD Single : B 6 LYS NZ :NH3+ 166:sc= 1.7 (180deg=1.47) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 THR OG1 : rot 171:sc= -1.33 USER MOD Single : B 24 GLN : amide:sc= 0.483 K(o=0.48,f=-0.14) USER MOD Single : B 29 LYS NZ :NH3+ -108:sc= -0.549 (180deg=-2.26!) USER MOD Single : B 31 SER OG : rot -71:sc= -1.72 USER MOD Single : B 44 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 CYS SG : rot 113:sc= 0.177 USER MOD Single : B 60 SER OG : rot 109:sc= 0.202 USER MOD Single : B 62 MET CE :methyl -145:sc= -1.6 (180deg=-3.4!) USER MOD Single : B 63 LYS NZ :NH3+ -141:sc= 1.85 (180deg=-0.671) USER MOD Single : B 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 69 ASN : amide:sc= -0.189 K(o=-0.19,f=-0.84) USER MOD Single : B 70 LYS NZ :NH3+ -167:sc= -0.0115 (180deg=-0.18) USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : B 72 THR OG1 : rot 39:sc= 0.0413 USER MOD Single : B 77 THR OG1 : rot 67:sc= 0.023 USER MOD Single : B 78 THR OG1 : rot 180:sc= -0.359 USER MOD Single : B 88 ASN : amide:sc= 0.56 K(o=0.56,f=-5.4!) USER MOD Single : B 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc= -0.386 X(o=-0.39,f=-0.048) USER MOD Single : B 122 CYS SG : rot 180:sc= -0.0125 USER MOD Single : B 124 TYR OH : rot 11:sc= 0.718 USER MOD Single : B 130 ASN :FLIP amide:sc= -0.0188 F(o=-1,f=-0.019) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.585 1.030 0.713 1.00 60.05 N ATOM 2 CA MET A 1 2.735 1.318 -0.176 1.00 3.23 C ATOM 3 C MET A 1 3.350 0.018 -0.680 1.00 42.13 C ATOM 4 O MET A 1 2.946 -1.069 -0.267 1.00 30.31 O ATOM 5 CB MET A 1 3.800 2.138 0.561 1.00 13.52 C ATOM 6 CG MET A 1 4.473 1.377 1.690 1.00 60.32 C ATOM 7 SD MET A 1 5.665 2.378 2.601 1.00 71.43 S ATOM 8 CE MET A 1 6.969 2.548 1.385 1.00 20.11 C ATOM 0 H1 MET A 1 0.702 1.306 0.238 1.00 60.05 H new ATOM 0 H2 MET A 1 1.559 0.013 0.929 1.00 60.05 H new ATOM 0 H3 MET A 1 1.686 1.569 1.597 1.00 60.05 H new ATOM 0 HA MET A 1 2.371 1.898 -1.024 1.00 3.23 H new ATOM 0 HB2 MET A 1 4.558 2.460 -0.153 1.00 13.52 H new ATOM 0 HB3 MET A 1 3.339 3.039 0.965 1.00 13.52 H new ATOM 0 HG2 MET A 1 3.712 1.012 2.379 1.00 60.32 H new ATOM 0 HG3 MET A 1 4.979 0.502 1.281 1.00 60.32 H new ATOM 0 HE1 MET A 1 7.937 2.428 1.871 1.00 20.11 H new ATOM 0 HE2 MET A 1 6.852 1.784 0.616 1.00 20.11 H new ATOM 0 HE3 MET A 1 6.913 3.535 0.927 1.00 20.11 H new ATOM 20 N ASN A 2 4.341 0.137 -1.555 1.00 22.52 N ATOM 21 CA ASN A 2 5.010 -1.032 -2.126 1.00 14.33 C ATOM 22 C ASN A 2 6.321 -1.291 -1.395 1.00 22.14 C ATOM 23 O ASN A 2 7.383 -0.849 -1.826 1.00 72.55 O ATOM 24 CB ASN A 2 5.275 -0.840 -3.629 1.00 31.34 C ATOM 25 CG ASN A 2 5.934 -2.060 -4.262 1.00 75.52 C ATOM 26 OD1 ASN A 2 5.722 -3.189 -3.825 1.00 52.13 O ATOM 27 ND2 ASN A 2 6.736 -1.841 -5.295 1.00 35.23 N ATOM 0 H ASN A 2 4.702 1.031 -1.887 1.00 22.52 H new ATOM 0 HA ASN A 2 4.353 -1.893 -2.004 1.00 14.33 H new ATOM 0 HB2 ASN A 2 4.333 -0.634 -4.138 1.00 31.34 H new ATOM 0 HB3 ASN A 2 5.914 0.031 -3.774 1.00 31.34 H new ATOM 0 HD21 ASN A 2 7.201 -2.624 -5.755 1.00 35.23 H new ATOM 0 HD22 ASN A 2 6.888 -0.890 -5.630 1.00 35.23 H new ATOM 34 N ILE A 3 6.234 -1.964 -0.259 1.00 0.23 N ATOM 35 CA ILE A 3 7.410 -2.298 0.527 1.00 51.02 C ATOM 36 C ILE A 3 8.323 -3.265 -0.220 1.00 3.13 C ATOM 37 O ILE A 3 7.943 -4.398 -0.516 1.00 22.24 O ATOM 38 CB ILE A 3 6.999 -2.898 1.890 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.217 -1.856 2.697 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.219 -3.384 2.669 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.061 -0.676 3.140 1.00 23.10 C ATOM 0 H ILE A 3 5.355 -2.291 0.141 1.00 0.23 H new ATOM 0 HA ILE A 3 7.965 -1.376 0.700 1.00 51.02 H new ATOM 0 HB ILE A 3 6.360 -3.763 1.712 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.385 -1.492 2.095 1.00 25.54 H new ATOM 0 HG13 ILE A 3 5.788 -2.336 3.576 1.00 25.54 H new ATOM 0 HG21 ILE A 3 7.899 -3.801 3.624 1.00 24.42 H new ATOM 0 HG22 ILE A 3 8.736 -4.151 2.093 1.00 24.42 H new ATOM 0 HG23 ILE A 3 8.894 -2.547 2.847 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.443 0.021 3.706 1.00 23.10 H new ATOM 0 HD12 ILE A 3 7.878 -1.029 3.769 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.469 -0.171 2.264 1.00 23.10 H new ATOM 53 N LEU A 4 9.524 -2.792 -0.523 1.00 41.13 N ATOM 54 CA LEU A 4 10.541 -3.601 -1.185 1.00 42.04 C ATOM 55 C LEU A 4 11.251 -4.475 -0.165 1.00 41.22 C ATOM 56 O LEU A 4 11.598 -5.623 -0.447 1.00 74.21 O ATOM 57 CB LEU A 4 11.560 -2.703 -1.895 1.00 22.30 C ATOM 58 CG LEU A 4 10.975 -1.745 -2.941 1.00 5.11 C ATOM 59 CD1 LEU A 4 12.070 -0.866 -3.547 1.00 73.22 C ATOM 60 CD2 LEU A 4 10.231 -2.519 -4.030 1.00 52.13 C ATOM 0 H LEU A 4 9.822 -1.838 -0.318 1.00 41.13 H new ATOM 0 HA LEU A 4 10.054 -4.234 -1.926 1.00 42.04 H new ATOM 0 HB2 LEU A 4 12.087 -2.116 -1.143 1.00 22.30 H new ATOM 0 HB3 LEU A 4 12.301 -3.337 -2.382 1.00 22.30 H new ATOM 0 HG LEU A 4 10.259 -1.093 -2.441 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.631 -0.195 -4.286 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.543 -0.279 -2.760 1.00 73.22 H new ATOM 0 HD13 LEU A 4 12.818 -1.496 -4.028 1.00 73.22 H new ATOM 0 HD21 LEU A 4 9.825 -1.819 -4.761 1.00 52.13 H new ATOM 0 HD22 LEU A 4 10.920 -3.202 -4.526 1.00 52.13 H new ATOM 0 HD23 LEU A 4 9.417 -3.088 -3.581 1.00 52.13 H new ATOM 72 N TYR A 5 11.468 -3.922 1.026 1.00 24.01 N ATOM 73 CA TYR A 5 12.149 -4.653 2.090 1.00 4.44 C ATOM 74 C TYR A 5 11.512 -4.334 3.435 1.00 12.52 C ATOM 75 O TYR A 5 11.234 -3.180 3.726 1.00 21.34 O ATOM 76 CB TYR A 5 13.639 -4.283 2.112 1.00 54.43 C ATOM 77 CG TYR A 5 14.483 -5.162 3.016 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.505 -4.973 4.395 1.00 4.50 C ATOM 79 CD2 TYR A 5 15.258 -6.185 2.485 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.270 -5.778 5.214 1.00 2.54 C ATOM 81 CE2 TYR A 5 16.027 -6.995 3.300 1.00 4.33 C ATOM 82 CZ TYR A 5 16.028 -6.788 4.663 1.00 33.20 C ATOM 83 OH TYR A 5 16.791 -7.596 5.479 1.00 31.30 O ATOM 0 H TYR A 5 11.184 -2.975 1.277 1.00 24.01 H new ATOM 0 HA TYR A 5 12.053 -5.722 1.900 1.00 4.44 H new ATOM 0 HB2 TYR A 5 14.032 -4.341 1.097 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.740 -3.246 2.434 1.00 54.43 H new ATOM 0 HD1 TYR A 5 13.913 -4.182 4.832 1.00 4.50 H new ATOM 0 HD2 TYR A 5 15.260 -6.351 1.418 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.275 -5.617 6.282 1.00 2.54 H new ATOM 0 HE2 TYR A 5 16.624 -7.786 2.871 1.00 4.33 H new ATOM 0 HH TYR A 5 17.264 -8.258 4.933 1.00 31.30 H new ATOM 93 N LYS A 6 11.264 -5.356 4.241 1.00 51.40 N ATOM 94 CA LYS A 6 10.763 -5.155 5.600 1.00 43.32 C ATOM 95 C LYS A 6 11.365 -6.177 6.560 1.00 62.42 C ATOM 96 O LYS A 6 11.574 -7.341 6.206 1.00 13.53 O ATOM 97 CB LYS A 6 9.222 -5.203 5.647 1.00 1.54 C ATOM 98 CG LYS A 6 8.647 -5.169 7.067 1.00 51.03 C ATOM 99 CD LYS A 6 7.164 -4.788 7.103 1.00 30.33 C ATOM 100 CE LYS A 6 6.958 -3.293 6.882 1.00 61.32 C ATOM 101 NZ LYS A 6 5.555 -2.871 7.135 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.400 -6.333 3.981 1.00 51.40 H new ATOM 0 HA LYS A 6 11.074 -4.160 5.920 1.00 43.32 H new ATOM 0 HB2 LYS A 6 8.824 -4.359 5.083 1.00 1.54 H new ATOM 0 HB3 LYS A 6 8.880 -6.110 5.148 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.776 -6.148 7.529 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.214 -4.456 7.666 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.627 -5.346 6.336 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.738 -5.075 8.064 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.626 -2.736 7.539 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.232 -3.039 5.858 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.469 -1.845 6.988 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 4.919 -3.369 6.480 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.294 -3.104 8.114 1.00 4.41 H new ATOM 115 N THR A 7 11.659 -5.708 7.766 1.00 30.21 N ATOM 116 CA THR A 7 12.205 -6.533 8.838 1.00 33.22 C ATOM 117 C THR A 7 11.629 -6.069 10.180 1.00 54.23 C ATOM 118 O THR A 7 11.036 -4.989 10.259 1.00 73.02 O ATOM 119 CB THR A 7 13.753 -6.458 8.856 1.00 43.13 C ATOM 120 OG1 THR A 7 14.283 -7.253 9.923 1.00 11.53 O ATOM 121 CG2 THR A 7 14.237 -5.017 8.998 1.00 62.33 C ATOM 0 H THR A 7 11.524 -4.732 8.031 1.00 30.21 H new ATOM 0 HA THR A 7 11.923 -7.572 8.665 1.00 33.22 H new ATOM 0 HB THR A 7 14.112 -6.850 7.904 1.00 43.13 H new ATOM 0 HG1 THR A 7 15.230 -7.036 10.054 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.327 -4.998 9.007 1.00 62.33 H new ATOM 0 HG22 THR A 7 13.871 -4.426 8.158 1.00 62.33 H new ATOM 0 HG23 THR A 7 13.859 -4.596 9.930 1.00 62.33 H new ATOM 129 N ALA A 8 11.796 -6.868 11.233 1.00 51.42 N ATOM 130 CA ALA A 8 11.189 -6.561 12.530 1.00 62.45 C ATOM 131 C ALA A 8 12.198 -6.680 13.671 1.00 64.34 C ATOM 132 O ALA A 8 13.105 -7.514 13.632 1.00 4.53 O ATOM 133 CB ALA A 8 9.996 -7.479 12.780 1.00 11.23 C ATOM 0 H ALA A 8 12.343 -7.729 11.215 1.00 51.42 H new ATOM 0 HA ALA A 8 10.848 -5.526 12.501 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.552 -7.243 13.747 1.00 11.23 H new ATOM 0 HB2 ALA A 8 9.254 -7.334 11.995 1.00 11.23 H new ATOM 0 HB3 ALA A 8 10.329 -8.517 12.777 1.00 11.23 H new ATOM 139 N ALA A 9 12.031 -5.836 14.688 1.00 62.04 N ATOM 140 CA ALA A 9 12.868 -5.873 15.884 1.00 13.24 C ATOM 141 C ALA A 9 12.014 -5.667 17.133 1.00 53.42 C ATOM 142 O ALA A 9 11.291 -4.681 17.234 1.00 45.34 O ATOM 143 CB ALA A 9 13.958 -4.812 15.800 1.00 65.14 C ATOM 0 H ALA A 9 11.314 -5.110 14.706 1.00 62.04 H new ATOM 0 HA ALA A 9 13.344 -6.851 15.948 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.574 -4.851 16.698 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.580 -4.998 14.925 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.501 -3.826 15.717 1.00 65.14 H new ATOM 149 N THR A 10 12.094 -6.602 18.073 1.00 61.23 N ATOM 150 CA THR A 10 11.312 -6.536 19.302 1.00 51.35 C ATOM 151 C THR A 10 12.212 -6.180 20.484 1.00 43.21 C ATOM 152 O THR A 10 13.358 -6.616 20.559 1.00 73.43 O ATOM 153 CB THR A 10 10.575 -7.873 19.576 1.00 34.35 C ATOM 154 OG1 THR A 10 9.677 -7.726 20.687 1.00 3.15 O ATOM 155 CG2 THR A 10 11.554 -9.012 19.854 1.00 70.40 C ATOM 0 H THR A 10 12.698 -7.421 18.006 1.00 61.23 H new ATOM 0 HA THR A 10 10.560 -5.757 19.178 1.00 51.35 H new ATOM 0 HB THR A 10 10.010 -8.125 18.679 1.00 34.35 H new ATOM 0 HG1 THR A 10 8.820 -7.372 20.370 1.00 3.15 H new ATOM 0 HG21 THR A 10 10.999 -9.931 20.041 1.00 70.40 H new ATOM 0 HG22 THR A 10 12.205 -9.151 18.991 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.157 -8.768 20.728 1.00 70.40 H new ATOM 163 N SER A 11 11.690 -5.373 21.392 1.00 71.32 N ATOM 164 CA SER A 11 12.440 -4.923 22.559 1.00 2.43 C ATOM 165 C SER A 11 11.679 -5.259 23.842 1.00 11.12 C ATOM 166 O SER A 11 10.595 -4.725 24.091 1.00 53.54 O ATOM 167 CB SER A 11 12.703 -3.413 22.452 1.00 22.21 C ATOM 168 OG SER A 11 11.501 -2.692 22.247 1.00 52.01 O ATOM 0 H SER A 11 10.738 -5.011 21.344 1.00 71.32 H new ATOM 0 HA SER A 11 13.398 -5.441 22.594 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.189 -3.061 23.362 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.390 -3.219 21.628 1.00 22.21 H new ATOM 0 HG SER A 11 10.789 -3.080 22.798 1.00 52.01 H new ATOM 174 N THR A 12 12.246 -6.160 24.638 1.00 54.12 N ATOM 175 CA THR A 12 11.613 -6.620 25.872 1.00 52.53 C ATOM 176 C THR A 12 11.996 -5.733 27.056 1.00 72.12 C ATOM 177 O THR A 12 13.032 -5.062 27.034 1.00 13.04 O ATOM 178 CB THR A 12 12.040 -8.070 26.189 1.00 35.03 C ATOM 179 OG1 THR A 12 12.082 -8.839 24.980 1.00 61.53 O ATOM 180 CG2 THR A 12 11.088 -8.732 27.182 1.00 33.34 C ATOM 0 H THR A 12 13.151 -6.590 24.449 1.00 54.12 H new ATOM 0 HA THR A 12 10.535 -6.571 25.720 1.00 52.53 H new ATOM 0 HB THR A 12 13.031 -8.034 26.642 1.00 35.03 H new ATOM 0 HG1 THR A 12 12.355 -9.757 25.186 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.420 -9.751 27.381 1.00 33.34 H new ATOM 0 HG22 THR A 12 11.081 -8.165 28.113 1.00 33.34 H new ATOM 0 HG23 THR A 12 10.082 -8.754 26.763 1.00 33.34 H new ATOM 188 N GLY A 13 11.157 -5.738 28.085 1.00 62.44 N ATOM 189 CA GLY A 13 11.473 -5.043 29.318 1.00 34.44 C ATOM 190 C GLY A 13 12.487 -5.804 30.153 1.00 13.14 C ATOM 191 O GLY A 13 12.137 -6.430 31.157 1.00 50.55 O ATOM 0 H GLY A 13 10.256 -6.216 28.086 1.00 62.44 H new ATOM 0 HA2 GLY A 13 11.864 -4.052 29.086 1.00 34.44 H new ATOM 0 HA3 GLY A 13 10.561 -4.898 29.897 1.00 34.44 H new ATOM 195 N GLY A 14 13.744 -5.781 29.710 1.00 62.02 N ATOM 196 CA GLY A 14 14.818 -6.435 30.444 1.00 43.32 C ATOM 197 C GLY A 14 15.172 -5.702 31.729 1.00 33.13 C ATOM 198 O GLY A 14 14.294 -5.140 32.387 1.00 44.52 O ATOM 0 H GLY A 14 14.039 -5.318 28.850 1.00 62.02 H new ATOM 0 HA2 GLY A 14 14.522 -7.457 30.681 1.00 43.32 H new ATOM 0 HA3 GLY A 14 15.702 -6.498 29.810 1.00 43.32 H new ATOM 202 N ARG A 15 16.458 -5.706 32.089 1.00 24.13 N ATOM 203 CA ARG A 15 16.921 -5.024 33.297 1.00 34.21 C ATOM 204 C ARG A 15 16.473 -3.568 33.276 1.00 4.22 C ATOM 205 O ARG A 15 15.927 -3.059 34.256 1.00 73.04 O ATOM 206 CB ARG A 15 18.450 -5.120 33.430 1.00 34.44 C ATOM 207 CG ARG A 15 18.994 -4.523 34.730 1.00 1.44 C ATOM 208 CD ARG A 15 18.327 -5.135 35.962 1.00 44.04 C ATOM 209 NE ARG A 15 18.517 -6.586 36.032 1.00 64.51 N ATOM 210 CZ ARG A 15 17.524 -7.481 36.058 1.00 22.54 C ATOM 211 NH1 ARG A 15 16.255 -7.083 35.988 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 17.807 -8.774 36.144 1.00 44.23 N ATOM 0 H ARG A 15 17.195 -6.174 31.561 1.00 24.13 H new ATOM 0 HA ARG A 15 16.479 -5.515 34.164 1.00 34.21 H new ATOM 0 HB2 ARG A 15 18.746 -6.167 33.370 1.00 34.44 H new ATOM 0 HB3 ARG A 15 18.912 -4.609 32.585 1.00 34.44 H new ATOM 0 HG2 ARG A 15 20.071 -4.686 34.782 1.00 1.44 H new ATOM 0 HG3 ARG A 15 18.834 -3.445 34.729 1.00 1.44 H new ATOM 0 HD2 ARG A 15 18.735 -4.673 36.861 1.00 44.04 H new ATOM 0 HD3 ARG A 15 17.261 -4.911 35.945 1.00 44.04 H new ATOM 0 HE ARG A 15 19.474 -6.938 36.063 1.00 64.51 H new ATOM 0 HH11 ARG A 15 16.035 -6.090 35.914 1.00 12.40 H new ATOM 0 HH12 ARG A 15 15.503 -7.772 36.008 1.00 12.40 H new ATOM 0 HH21 ARG A 15 18.778 -9.081 36.190 1.00 44.23 H new ATOM 0 HH22 ARG A 15 17.053 -9.461 36.164 1.00 44.23 H new ATOM 226 N ASP A 16 16.723 -2.901 32.155 1.00 4.14 N ATOM 227 CA ASP A 16 16.118 -1.602 31.888 1.00 22.02 C ATOM 228 C ASP A 16 15.411 -1.660 30.547 1.00 52.02 C ATOM 229 O ASP A 16 14.288 -1.167 30.404 1.00 74.22 O ATOM 230 CB ASP A 16 17.162 -0.487 31.880 1.00 50.13 C ATOM 231 CG ASP A 16 16.535 0.892 31.726 1.00 53.42 C ATOM 232 OD1 ASP A 16 16.600 1.467 30.622 1.00 45.04 O ATOM 233 OD2 ASP A 16 15.954 1.391 32.712 1.00 61.02 O1- ATOM 0 H ASP A 16 17.340 -3.239 31.417 1.00 4.14 H new ATOM 0 HA ASP A 16 15.406 -1.378 32.682 1.00 22.02 H new ATOM 0 HB2 ASP A 16 17.734 -0.522 32.807 1.00 50.13 H new ATOM 0 HB3 ASP A 16 17.865 -0.657 31.065 1.00 50.13 H new ATOM 238 N GLY A 17 16.070 -2.286 29.565 1.00 73.12 N ATOM 239 CA GLY A 17 15.400 -2.645 28.335 1.00 31.14 C ATOM 240 C GLY A 17 16.209 -3.626 27.511 1.00 63.12 C ATOM 241 O GLY A 17 17.396 -3.837 27.766 1.00 34.35 O ATOM 0 H GLY A 17 17.055 -2.547 29.608 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.428 -3.081 28.566 1.00 31.14 H new ATOM 0 HA3 GLY A 17 15.214 -1.746 27.748 1.00 31.14 H new ATOM 245 N ARG A 18 15.562 -4.233 26.532 1.00 71.41 N ATOM 246 CA ARG A 18 16.221 -5.123 25.580 1.00 64.41 C ATOM 247 C ARG A 18 16.011 -4.612 24.164 1.00 2.04 C ATOM 248 O ARG A 18 15.240 -3.681 23.937 1.00 73.24 O ATOM 249 CB ARG A 18 15.680 -6.560 25.667 1.00 30.54 C ATOM 250 CG ARG A 18 16.234 -7.400 26.813 1.00 21.30 C ATOM 251 CD ARG A 18 15.877 -8.870 26.616 1.00 2.42 C ATOM 252 NE ARG A 18 16.482 -9.746 27.622 1.00 61.43 N ATOM 253 CZ ARG A 18 17.354 -10.720 27.339 1.00 42.21 C ATOM 254 NH1 ARG A 18 17.814 -10.867 26.101 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 17.779 -11.535 28.295 1.00 11.32 N ATOM 0 H ARG A 18 14.561 -4.125 26.370 1.00 71.41 H new ATOM 0 HA ARG A 18 17.282 -5.136 25.831 1.00 64.41 H new ATOM 0 HB2 ARG A 18 14.595 -6.516 25.763 1.00 30.54 H new ATOM 0 HB3 ARG A 18 15.897 -7.069 24.728 1.00 30.54 H new ATOM 0 HG2 ARG A 18 17.317 -7.286 26.865 1.00 21.30 H new ATOM 0 HG3 ARG A 18 15.830 -7.045 27.761 1.00 21.30 H new ATOM 0 HD2 ARG A 18 14.793 -8.982 26.649 1.00 2.42 H new ATOM 0 HD3 ARG A 18 16.200 -9.187 25.625 1.00 2.42 H new ATOM 0 HE ARG A 18 16.222 -9.605 28.598 1.00 61.43 H new ATOM 0 HH11 ARG A 18 17.502 -10.236 25.363 1.00 65.11 H new ATOM 0 HH12 ARG A 18 18.479 -11.611 25.889 1.00 65.11 H new ATOM 0 HH21 ARG A 18 17.441 -11.420 29.250 1.00 11.32 H new ATOM 0 HH22 ARG A 18 18.444 -12.276 28.075 1.00 11.32 H new ATOM 269 N ALA A 19 16.708 -5.228 23.226 1.00 71.12 N ATOM 270 CA ALA A 19 16.506 -4.986 21.808 1.00 34.25 C ATOM 271 C ALA A 19 16.932 -6.223 21.030 1.00 41.03 C ATOM 272 O ALA A 19 18.067 -6.680 21.156 1.00 12.34 O ATOM 273 CB ALA A 19 17.288 -3.758 21.354 1.00 5.35 C ATOM 0 H ALA A 19 17.435 -5.915 23.428 1.00 71.12 H new ATOM 0 HA ALA A 19 15.451 -4.789 21.618 1.00 34.25 H new ATOM 0 HB1 ALA A 19 17.123 -3.595 20.289 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.950 -2.885 21.912 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.351 -3.916 21.536 1.00 5.35 H new ATOM 279 N THR A 20 16.030 -6.767 20.238 1.00 63.53 N ATOM 280 CA THR A 20 16.296 -7.987 19.495 1.00 0.02 C ATOM 281 C THR A 20 15.699 -7.903 18.096 1.00 61.21 C ATOM 282 O THR A 20 14.483 -7.843 17.936 1.00 50.32 O ATOM 283 CB THR A 20 15.704 -9.219 20.232 1.00 22.13 C ATOM 284 OG1 THR A 20 16.172 -9.252 21.591 1.00 4.20 O ATOM 285 CG2 THR A 20 16.081 -10.527 19.534 1.00 30.30 C ATOM 0 H THR A 20 15.098 -6.381 20.090 1.00 63.53 H new ATOM 0 HA THR A 20 17.377 -8.102 19.419 1.00 0.02 H new ATOM 0 HB THR A 20 14.618 -9.123 20.216 1.00 22.13 H new ATOM 0 HG1 THR A 20 15.793 -10.031 22.049 1.00 4.20 H new ATOM 0 HG21 THR A 20 15.649 -11.367 20.078 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.697 -10.519 18.514 1.00 30.30 H new ATOM 0 HG23 THR A 20 17.166 -10.628 19.512 1.00 30.30 H new ATOM 293 N SER A 21 16.552 -7.891 17.082 1.00 52.22 N ATOM 294 CA SER A 21 16.075 -7.925 15.714 1.00 61.23 C ATOM 295 C SER A 21 15.534 -9.317 15.444 1.00 4.01 C ATOM 296 O SER A 21 16.323 -10.280 15.356 1.00 53.51 O ATOM 297 CB SER A 21 17.181 -7.563 14.722 1.00 62.30 C ATOM 298 OG SER A 21 16.760 -7.765 13.385 1.00 0.33 O ATOM 0 H SER A 21 17.567 -7.858 17.182 1.00 52.22 H new ATOM 0 HA SER A 21 15.288 -7.182 15.581 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.470 -6.521 14.861 1.00 62.30 H new ATOM 0 HB3 SER A 21 18.065 -8.169 14.923 1.00 62.30 H new ATOM 0 HG SER A 21 16.085 -7.094 13.150 1.00 0.33 H new ATOM 304 N HIS A 22 14.191 -9.378 15.320 1.00 22.03 N ATOM 305 CA HIS A 22 13.401 -10.620 15.298 1.00 2.11 C ATOM 306 C HIS A 22 13.845 -11.569 14.200 1.00 71.44 C ATOM 307 O HIS A 22 13.634 -12.781 14.291 1.00 63.31 O ATOM 308 CB HIS A 22 11.910 -10.291 15.119 1.00 42.33 C ATOM 309 CG HIS A 22 11.025 -11.502 15.018 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.648 -12.062 13.815 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.443 -12.260 15.979 1.00 33.23 C ATOM 312 CE1 HIS A 22 9.875 -13.105 14.040 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.737 -13.249 15.344 1.00 41.54 N ATOM 0 H HIS A 22 13.615 -8.541 15.230 1.00 22.03 H new ATOM 0 HA HIS A 22 13.564 -11.120 16.253 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.579 -9.681 15.960 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.787 -9.688 14.220 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.521 -12.112 17.046 1.00 33.23 H new ATOM 0 HE1 HIS A 22 9.430 -13.735 13.285 1.00 21.33 H new ATOM 0 HE2 HIS A 22 9.193 -13.978 15.805 1.00 41.54 H new ATOM 322 N ASP A 23 14.504 -11.031 13.191 1.00 65.30 N ATOM 323 CA ASP A 23 15.020 -11.845 12.096 1.00 52.23 C ATOM 324 C ASP A 23 16.326 -12.508 12.532 1.00 2.53 C ATOM 325 O ASP A 23 17.130 -12.931 11.701 1.00 21.54 O ATOM 326 CB ASP A 23 15.252 -10.978 10.848 1.00 41.44 C ATOM 327 CG ASP A 23 13.971 -10.416 10.247 1.00 73.43 C ATOM 328 OD1 ASP A 23 13.694 -10.691 9.059 1.00 71.33 O ATOM 329 OD2 ASP A 23 13.244 -9.683 10.950 1.00 13.13 O1- ATOM 0 H ASP A 23 14.697 -10.033 13.103 1.00 65.30 H new ATOM 0 HA ASP A 23 14.291 -12.615 11.845 1.00 52.23 H new ATOM 0 HB2 ASP A 23 15.914 -10.152 11.108 1.00 41.44 H new ATOM 0 HB3 ASP A 23 15.766 -11.573 10.093 1.00 41.44 H new ATOM 334 N GLN A 24 16.519 -12.579 13.857 1.00 30.45 N ATOM 335 CA GLN A 24 17.676 -13.223 14.471 1.00 23.53 C ATOM 336 C GLN A 24 18.945 -12.477 14.097 1.00 71.34 C ATOM 337 O GLN A 24 20.055 -13.008 14.197 1.00 22.01 O ATOM 338 CB GLN A 24 17.753 -14.704 14.067 1.00 42.54 C ATOM 339 CG GLN A 24 16.505 -15.503 14.440 1.00 72.53 C ATOM 340 CD GLN A 24 16.168 -15.426 15.924 1.00 14.50 C ATOM 341 OE1 GLN A 24 16.628 -16.244 16.722 1.00 45.33 O ATOM 342 NE2 GLN A 24 15.353 -14.450 16.306 1.00 4.22 N ATOM 0 H GLN A 24 15.866 -12.185 14.534 1.00 30.45 H new ATOM 0 HA GLN A 24 17.568 -13.187 15.555 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.909 -14.771 12.990 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.622 -15.158 14.544 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.658 -15.134 13.861 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.652 -16.546 14.160 1.00 72.53 H new ATOM 0 HE21 GLN A 24 14.990 -13.790 15.618 1.00 4.22 H new ATOM 0 HE22 GLN A 24 15.089 -14.360 17.287 1.00 4.22 H new ATOM 351 N LYS A 25 18.764 -11.224 13.695 1.00 22.35 N ATOM 352 CA LYS A 25 19.869 -10.375 13.289 1.00 24.04 C ATOM 353 C LYS A 25 20.539 -9.770 14.514 1.00 45.31 C ATOM 354 O LYS A 25 21.759 -9.599 14.538 1.00 73.44 O ATOM 355 CB LYS A 25 19.380 -9.244 12.371 1.00 30.31 C ATOM 356 CG LYS A 25 18.495 -9.701 11.217 1.00 12.14 C ATOM 357 CD LYS A 25 19.257 -10.507 10.171 1.00 61.23 C ATOM 358 CE LYS A 25 18.335 -10.947 9.035 1.00 52.51 C ATOM 359 NZ LYS A 25 17.624 -9.794 8.415 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.850 -10.773 13.643 1.00 22.35 H new ATOM 0 HA LYS A 25 20.585 -10.990 12.743 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.828 -8.520 12.971 1.00 30.31 H new ATOM 0 HB3 LYS A 25 20.247 -8.724 11.963 1.00 30.31 H new ATOM 0 HG2 LYS A 25 17.677 -10.305 11.610 1.00 12.14 H new ATOM 0 HG3 LYS A 25 18.047 -8.829 10.741 1.00 12.14 H new ATOM 0 HD2 LYS A 25 20.073 -9.907 9.769 1.00 61.23 H new ATOM 0 HD3 LYS A 25 19.706 -11.383 10.639 1.00 61.23 H new ATOM 0 HE2 LYS A 25 18.919 -11.465 8.274 1.00 52.51 H new ATOM 0 HE3 LYS A 25 17.605 -11.661 9.416 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 17.200 -10.092 7.513 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 16.875 -9.462 9.056 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 18.299 -9.022 8.242 1.00 22.01 H new ATOM 373 N LEU A 26 19.744 -9.443 15.540 1.00 32.33 N ATOM 374 CA LEU A 26 20.292 -8.716 16.690 1.00 24.31 C ATOM 375 C LEU A 26 19.668 -9.163 17.990 1.00 21.31 C ATOM 376 O LEU A 26 18.487 -9.493 18.040 1.00 11.34 O ATOM 377 CB LEU A 26 20.099 -7.205 16.491 1.00 35.55 C ATOM 378 CG LEU A 26 20.481 -6.310 17.680 1.00 2.25 C ATOM 379 CD1 LEU A 26 21.980 -6.377 17.967 1.00 31.22 C ATOM 380 CD2 LEU A 26 20.039 -4.874 17.419 1.00 74.42 C ATOM 0 H LEU A 26 18.750 -9.662 15.599 1.00 32.33 H new ATOM 0 HA LEU A 26 21.357 -8.940 16.751 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.686 -6.895 15.627 1.00 35.55 H new ATOM 0 HB3 LEU A 26 19.052 -7.022 16.247 1.00 35.55 H new ATOM 0 HG LEU A 26 19.963 -6.679 18.565 1.00 2.25 H new ATOM 0 HD11 LEU A 26 22.218 -5.733 18.814 1.00 31.22 H new ATOM 0 HD12 LEU A 26 22.260 -7.404 18.203 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.534 -6.042 17.090 1.00 31.22 H new ATOM 0 HD21 LEU A 26 20.315 -4.248 18.268 1.00 74.42 H new ATOM 0 HD22 LEU A 26 20.528 -4.501 16.519 1.00 74.42 H new ATOM 0 HD23 LEU A 26 18.958 -4.845 17.283 1.00 74.42 H new ATOM 392 N ASP A 27 20.487 -9.147 19.033 1.00 3.11 N ATOM 393 CA ASP A 27 20.086 -9.579 20.358 1.00 12.11 C ATOM 394 C ASP A 27 20.964 -8.906 21.422 1.00 11.44 C ATOM 395 O ASP A 27 22.044 -9.388 21.759 1.00 42.31 O ATOM 396 CB ASP A 27 20.166 -11.111 20.453 1.00 5.04 C ATOM 397 CG ASP A 27 21.565 -11.666 20.202 1.00 74.13 C ATOM 398 OD1 ASP A 27 22.016 -11.658 19.038 1.00 54.23 O ATOM 399 OD2 ASP A 27 22.223 -12.113 21.169 1.00 11.42 O1- ATOM 0 H ASP A 27 21.455 -8.831 18.979 1.00 3.11 H new ATOM 0 HA ASP A 27 19.054 -9.281 20.540 1.00 12.11 H new ATOM 0 HB2 ASP A 27 19.832 -11.423 21.443 1.00 5.04 H new ATOM 0 HB3 ASP A 27 19.476 -11.548 19.731 1.00 5.04 H new ATOM 404 N VAL A 28 20.509 -7.755 21.909 1.00 5.03 N ATOM 405 CA VAL A 28 21.234 -6.990 22.929 1.00 42.02 C ATOM 406 C VAL A 28 20.287 -6.402 23.973 1.00 62.12 C ATOM 407 O VAL A 28 19.067 -6.568 23.896 1.00 32.30 O ATOM 408 CB VAL A 28 22.075 -5.839 22.317 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.330 -6.387 21.645 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.236 -5.015 21.340 1.00 1.00 C ATOM 0 H VAL A 28 19.633 -7.325 21.612 1.00 5.03 H new ATOM 0 HA VAL A 28 21.907 -7.702 23.407 1.00 42.02 H new ATOM 0 HB VAL A 28 22.391 -5.177 23.123 1.00 24.24 H new ATOM 0 HG11 VAL A 28 23.906 -5.563 21.222 1.00 34.22 H new ATOM 0 HG12 VAL A 28 23.937 -6.913 22.382 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.046 -7.076 20.850 1.00 34.22 H new ATOM 0 HG21 VAL A 28 21.846 -4.214 20.923 1.00 1.00 H new ATOM 0 HG22 VAL A 28 20.880 -5.657 20.534 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.383 -4.586 21.865 1.00 1.00 H new ATOM 420 N LYS A 29 20.873 -5.727 24.953 1.00 24.10 N ATOM 421 CA LYS A 29 20.138 -5.112 26.054 1.00 44.35 C ATOM 422 C LYS A 29 20.703 -3.725 26.354 1.00 43.02 C ATOM 423 O LYS A 29 21.913 -3.507 26.257 1.00 12.55 O ATOM 424 CB LYS A 29 20.230 -6.018 27.294 1.00 13.02 C ATOM 425 CG LYS A 29 20.390 -5.272 28.623 1.00 22.53 C ATOM 426 CD LYS A 29 20.469 -6.229 29.812 1.00 24.23 C ATOM 427 CE LYS A 29 21.587 -7.259 29.652 1.00 1.41 C ATOM 428 NZ LYS A 29 22.928 -6.630 29.500 1.00 62.42 N1+ ATOM 0 H LYS A 29 21.882 -5.589 25.008 1.00 24.10 H new ATOM 0 HA LYS A 29 19.090 -4.997 25.775 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.332 -6.634 27.345 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.074 -6.696 27.170 1.00 13.02 H new ATOM 0 HG2 LYS A 29 21.292 -4.661 28.589 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.549 -4.592 28.760 1.00 22.53 H new ATOM 0 HD2 LYS A 29 20.632 -5.658 30.726 1.00 24.23 H new ATOM 0 HD3 LYS A 29 19.516 -6.745 29.925 1.00 24.23 H new ATOM 0 HE2 LYS A 29 21.595 -7.918 30.520 1.00 1.41 H new ATOM 0 HE3 LYS A 29 21.381 -7.881 28.781 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 23.664 -7.309 29.781 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 23.072 -6.354 28.508 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 22.986 -5.786 30.105 1.00 62.42 H new ATOM 442 N LEU A 30 19.829 -2.793 26.722 1.00 2.53 N ATOM 443 CA LEU A 30 20.241 -1.438 27.048 1.00 41.03 C ATOM 444 C LEU A 30 19.725 -1.026 28.430 1.00 64.12 C ATOM 445 O LEU A 30 18.799 -1.656 28.987 1.00 54.30 O ATOM 446 CB LEU A 30 19.816 -0.431 25.949 1.00 11.12 C ATOM 447 CG LEU A 30 18.412 -0.590 25.319 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.322 -1.841 24.446 1.00 21.32 C ATOM 449 CD2 LEU A 30 17.320 -0.584 26.383 1.00 54.12 C ATOM 0 H LEU A 30 18.825 -2.956 26.801 1.00 2.53 H new ATOM 0 HA LEU A 30 21.330 -1.421 27.086 1.00 41.03 H new ATOM 0 HB2 LEU A 30 19.880 0.571 26.372 1.00 11.12 H new ATOM 0 HB3 LEU A 30 20.550 -0.485 25.145 1.00 11.12 H new ATOM 0 HG LEU A 30 18.252 0.273 24.672 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.321 -1.917 24.022 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.054 -1.776 23.641 1.00 21.32 H new ATOM 0 HD13 LEU A 30 18.527 -2.723 25.052 1.00 21.32 H new ATOM 0 HD21 LEU A 30 16.347 -0.698 25.906 1.00 54.12 H new ATOM 0 HD22 LEU A 30 17.483 -1.409 27.076 1.00 54.12 H new ATOM 0 HD23 LEU A 30 17.349 0.359 26.929 1.00 54.12 H new ATOM 461 N SER A 31 20.333 0.030 28.972 1.00 75.34 N ATOM 462 CA SER A 31 20.055 0.474 30.329 1.00 34.22 C ATOM 463 C SER A 31 20.719 1.820 30.610 1.00 62.41 C ATOM 464 O SER A 31 21.810 2.100 30.106 1.00 64.13 O ATOM 465 CB SER A 31 20.537 -0.581 31.337 1.00 52.23 C ATOM 466 OG SER A 31 21.891 -0.937 31.107 1.00 11.31 O ATOM 0 H SER A 31 21.027 0.595 28.483 1.00 75.34 H new ATOM 0 HA SER A 31 18.978 0.600 30.436 1.00 34.22 H new ATOM 0 HB2 SER A 31 20.428 -0.195 32.350 1.00 52.23 H new ATOM 0 HB3 SER A 31 19.909 -1.469 31.265 1.00 52.23 H new ATOM 0 HG SER A 31 22.417 -0.761 31.915 1.00 11.31 H new ATOM 472 N ALA A 32 20.058 2.640 31.422 1.00 52.21 N ATOM 473 CA ALA A 32 20.563 3.962 31.771 1.00 43.51 C ATOM 474 C ALA A 32 21.685 3.863 32.808 1.00 25.12 C ATOM 475 O ALA A 32 21.508 3.250 33.871 1.00 4.30 O ATOM 476 CB ALA A 32 19.427 4.837 32.295 1.00 22.44 C ATOM 0 H ALA A 32 19.163 2.408 31.854 1.00 52.21 H new ATOM 0 HA ALA A 32 20.975 4.421 30.872 1.00 43.51 H new ATOM 0 HB1 ALA A 32 19.816 5.822 32.553 1.00 22.44 H new ATOM 0 HB2 ALA A 32 18.662 4.939 31.526 1.00 22.44 H new ATOM 0 HB3 ALA A 32 18.992 4.376 33.181 1.00 22.44 H new ATOM 482 N PRO A 33 22.861 4.455 32.511 1.00 32.33 N ATOM 483 CA PRO A 33 23.985 4.501 33.451 1.00 35.40 C ATOM 484 C PRO A 33 23.595 5.203 34.750 1.00 50.42 C ATOM 485 O PRO A 33 22.777 6.129 34.750 1.00 70.53 O ATOM 486 CB PRO A 33 25.069 5.292 32.698 1.00 73.33 C ATOM 487 CG PRO A 33 24.339 6.014 31.616 1.00 10.15 C ATOM 488 CD PRO A 33 23.191 5.122 31.239 1.00 32.53 C ATOM 0 HA PRO A 33 24.320 3.507 33.746 1.00 35.40 H new ATOM 0 HB2 PRO A 33 25.581 5.989 33.361 1.00 73.33 H new ATOM 0 HB3 PRO A 33 25.828 4.627 32.286 1.00 73.33 H new ATOM 0 HG2 PRO A 33 23.984 6.984 31.963 1.00 10.15 H new ATOM 0 HG3 PRO A 33 24.989 6.199 30.761 1.00 10.15 H new ATOM 0 HD2 PRO A 33 22.347 5.692 30.851 1.00 32.53 H new ATOM 0 HD3 PRO A 33 23.473 4.405 30.468 1.00 32.53 H new ATOM 496 N ARG A 34 24.184 4.766 35.854 1.00 10.53 N ATOM 497 CA ARG A 34 23.822 5.280 37.171 1.00 33.33 C ATOM 498 C ARG A 34 24.263 6.739 37.329 1.00 40.12 C ATOM 499 O ARG A 34 23.778 7.446 38.212 1.00 0.24 O ATOM 500 CB ARG A 34 24.440 4.401 38.265 1.00 35.21 C ATOM 501 CG ARG A 34 24.003 4.762 39.678 1.00 34.41 C ATOM 502 CD ARG A 34 22.526 4.473 39.931 1.00 50.12 C ATOM 503 NE ARG A 34 22.132 4.842 41.293 1.00 3.50 N ATOM 504 CZ ARG A 34 20.880 4.817 41.751 1.00 2.33 C ATOM 505 NH1 ARG A 34 19.882 4.449 40.963 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 20.629 5.171 43.003 1.00 21.42 N ATOM 0 H ARG A 34 24.916 4.056 35.866 1.00 10.53 H new ATOM 0 HA ARG A 34 22.737 5.249 37.270 1.00 33.33 H new ATOM 0 HB2 ARG A 34 24.178 3.361 38.071 1.00 35.21 H new ATOM 0 HB3 ARG A 34 25.526 4.473 38.203 1.00 35.21 H new ATOM 0 HG2 ARG A 34 24.606 4.203 40.394 1.00 34.41 H new ATOM 0 HG3 ARG A 34 24.197 5.820 39.855 1.00 34.41 H new ATOM 0 HD2 ARG A 34 21.918 5.024 39.213 1.00 50.12 H new ATOM 0 HD3 ARG A 34 22.329 3.413 39.768 1.00 50.12 H new ATOM 0 HE ARG A 34 22.867 5.139 41.936 1.00 3.50 H new ATOM 0 HH11 ARG A 34 20.067 4.181 39.996 1.00 23.02 H new ATOM 0 HH12 ARG A 34 18.928 4.433 41.322 1.00 23.02 H new ATOM 0 HH21 ARG A 34 21.393 5.462 43.614 1.00 21.42 H new ATOM 0 HH22 ARG A 34 19.672 5.153 43.356 1.00 21.42 H new ATOM 520 N GLU A 35 25.166 7.178 36.451 1.00 72.31 N ATOM 521 CA GLU A 35 25.667 8.558 36.454 1.00 75.14 C ATOM 522 C GLU A 35 24.516 9.561 36.451 1.00 65.21 C ATOM 523 O GLU A 35 24.581 10.606 37.102 1.00 33.12 O ATOM 524 CB GLU A 35 26.569 8.818 35.230 1.00 20.34 C ATOM 525 CG GLU A 35 27.894 8.057 35.238 1.00 71.30 C ATOM 526 CD GLU A 35 27.744 6.582 34.895 1.00 31.03 C ATOM 527 OE1 GLU A 35 28.020 6.204 33.740 1.00 31.45 O ATOM 528 OE2 GLU A 35 27.360 5.791 35.781 1.00 43.03 O1- ATOM 0 H GLU A 35 25.570 6.592 35.720 1.00 72.31 H new ATOM 0 HA GLU A 35 26.250 8.689 37.365 1.00 75.14 H new ATOM 0 HB2 GLU A 35 26.019 8.552 34.328 1.00 20.34 H new ATOM 0 HB3 GLU A 35 26.780 9.886 35.172 1.00 20.34 H new ATOM 0 HG2 GLU A 35 28.576 8.521 34.525 1.00 71.30 H new ATOM 0 HG3 GLU A 35 28.352 8.149 36.223 1.00 71.30 H new ATOM 535 N LEU A 36 23.459 9.227 35.723 1.00 33.22 N ATOM 536 CA LEU A 36 22.316 10.119 35.553 1.00 32.24 C ATOM 537 C LEU A 36 21.157 9.684 36.446 1.00 55.25 C ATOM 538 O LEU A 36 20.001 10.038 36.201 1.00 40.24 O ATOM 539 CB LEU A 36 21.900 10.120 34.076 1.00 11.21 C ATOM 540 CG LEU A 36 23.038 10.453 33.096 1.00 24.22 C ATOM 541 CD1 LEU A 36 22.588 10.285 31.650 1.00 52.21 C ATOM 542 CD2 LEU A 36 23.561 11.868 33.338 1.00 63.44 C ATOM 0 H LEU A 36 23.368 8.336 35.235 1.00 33.22 H new ATOM 0 HA LEU A 36 22.595 11.130 35.848 1.00 32.24 H new ATOM 0 HB2 LEU A 36 21.495 9.140 33.824 1.00 11.21 H new ATOM 0 HB3 LEU A 36 21.095 10.842 33.938 1.00 11.21 H new ATOM 0 HG LEU A 36 23.851 9.750 33.276 1.00 24.22 H new ATOM 0 HD11 LEU A 36 23.414 10.528 30.981 1.00 52.21 H new ATOM 0 HD12 LEU A 36 22.277 9.254 31.483 1.00 52.21 H new ATOM 0 HD13 LEU A 36 21.751 10.953 31.450 1.00 52.21 H new ATOM 0 HD21 LEU A 36 24.365 12.084 32.635 1.00 63.44 H new ATOM 0 HD22 LEU A 36 22.752 12.584 33.195 1.00 63.44 H new ATOM 0 HD23 LEU A 36 23.939 11.947 34.357 1.00 63.44 H new ATOM 554 N GLY A 37 21.484 8.941 37.500 1.00 72.22 N ATOM 555 CA GLY A 37 20.471 8.417 38.399 1.00 12.23 C ATOM 556 C GLY A 37 19.792 7.190 37.827 1.00 31.23 C ATOM 557 O GLY A 37 18.649 6.884 38.171 1.00 41.24 O ATOM 0 H GLY A 37 22.441 8.691 37.748 1.00 72.22 H new ATOM 0 HA2 GLY A 37 20.929 8.166 39.356 1.00 12.23 H new ATOM 0 HA3 GLY A 37 19.725 9.187 38.595 1.00 12.23 H new ATOM 561 N GLY A 38 20.505 6.484 36.949 1.00 73.44 N ATOM 562 CA GLY A 38 19.955 5.303 36.313 1.00 31.42 C ATOM 563 C GLY A 38 20.049 4.086 37.208 1.00 22.15 C ATOM 564 O GLY A 38 19.657 4.135 38.372 1.00 21.21 O ATOM 0 H GLY A 38 21.458 6.713 36.668 1.00 73.44 H new ATOM 0 HA2 GLY A 38 18.912 5.483 36.053 1.00 31.42 H new ATOM 0 HA3 GLY A 38 20.487 5.111 35.381 1.00 31.42 H new ATOM 568 N ALA A 39 20.590 2.997 36.681 1.00 14.21 N ATOM 569 CA ALA A 39 20.718 1.759 37.452 1.00 43.43 C ATOM 570 C ALA A 39 22.141 1.218 37.403 1.00 63.22 C ATOM 571 O ALA A 39 22.470 0.253 38.096 1.00 3.43 O ATOM 572 CB ALA A 39 19.736 0.717 36.930 1.00 5.43 C ATOM 0 H ALA A 39 20.947 2.941 35.727 1.00 14.21 H new ATOM 0 HA ALA A 39 20.484 1.982 38.493 1.00 43.43 H new ATOM 0 HB1 ALA A 39 19.838 -0.201 37.509 1.00 5.43 H new ATOM 0 HB2 ALA A 39 18.718 1.096 37.026 1.00 5.43 H new ATOM 0 HB3 ALA A 39 19.949 0.510 35.881 1.00 5.43 H new ATOM 578 N GLY A 40 22.975 1.843 36.579 1.00 15.31 N ATOM 579 CA GLY A 40 24.355 1.402 36.427 1.00 42.15 C ATOM 580 C GLY A 40 24.461 -0.032 35.950 1.00 45.53 C ATOM 581 O GLY A 40 25.448 -0.717 36.223 1.00 15.12 O ATOM 0 H GLY A 40 22.721 2.651 36.010 1.00 15.31 H new ATOM 0 HA2 GLY A 40 24.865 2.055 35.719 1.00 42.15 H new ATOM 0 HA3 GLY A 40 24.871 1.502 37.382 1.00 42.15 H new ATOM 585 N ALA A 41 23.436 -0.488 35.239 1.00 5.32 N ATOM 586 CA ALA A 41 23.400 -1.849 34.720 1.00 5.21 C ATOM 587 C ALA A 41 24.237 -1.959 33.451 1.00 44.21 C ATOM 588 O ALA A 41 24.334 -1.000 32.680 1.00 13.22 O ATOM 589 CB ALA A 41 21.961 -2.269 34.443 1.00 40.21 C ATOM 0 H ALA A 41 22.614 0.070 35.008 1.00 5.32 H new ATOM 0 HA ALA A 41 23.822 -2.518 35.470 1.00 5.21 H new ATOM 0 HB1 ALA A 41 21.947 -3.288 34.056 1.00 40.21 H new ATOM 0 HB2 ALA A 41 21.385 -2.225 35.367 1.00 40.21 H new ATOM 0 HB3 ALA A 41 21.520 -1.595 33.708 1.00 40.21 H new ATOM 595 N GLU A 42 24.847 -3.124 33.244 1.00 32.32 N ATOM 596 CA GLU A 42 25.638 -3.376 32.045 1.00 71.23 C ATOM 597 C GLU A 42 24.732 -3.450 30.817 1.00 1.12 C ATOM 598 O GLU A 42 24.212 -4.508 30.446 1.00 55.43 O ATOM 599 CB GLU A 42 26.465 -4.654 32.193 1.00 42.31 C ATOM 600 CG GLU A 42 25.637 -5.868 32.568 1.00 52.14 C ATOM 601 CD GLU A 42 26.494 -7.080 32.892 1.00 31.41 C ATOM 602 OE1 GLU A 42 26.574 -8.003 32.050 1.00 24.22 O ATOM 603 OE2 GLU A 42 27.110 -7.106 33.977 1.00 54.53 O1- ATOM 0 H GLU A 42 24.807 -3.909 33.894 1.00 32.32 H new ATOM 0 HA GLU A 42 26.332 -2.546 31.911 1.00 71.23 H new ATOM 0 HB2 GLU A 42 26.984 -4.853 31.255 1.00 42.31 H new ATOM 0 HB3 GLU A 42 27.230 -4.497 32.953 1.00 42.31 H new ATOM 0 HG2 GLU A 42 25.014 -5.627 33.429 1.00 52.14 H new ATOM 0 HG3 GLU A 42 24.964 -6.112 31.746 1.00 52.14 H new ATOM 610 N GLY A 43 24.493 -2.292 30.251 1.00 3.30 N ATOM 611 CA GLY A 43 23.755 -2.179 29.011 1.00 20.41 C ATOM 612 C GLY A 43 24.353 -1.127 28.100 1.00 55.55 C ATOM 613 O GLY A 43 25.573 -0.960 28.049 1.00 25.21 O ATOM 0 H GLY A 43 24.804 -1.400 30.635 1.00 3.30 H new ATOM 0 HA2 GLY A 43 23.750 -3.142 28.501 1.00 20.41 H new ATOM 0 HA3 GLY A 43 22.717 -1.927 29.227 1.00 20.41 H new ATOM 617 N THR A 44 23.502 -0.420 27.376 1.00 1.14 N ATOM 618 CA THR A 44 23.929 0.612 26.460 1.00 0.00 C ATOM 619 C THR A 44 22.918 1.765 26.468 1.00 54.32 C ATOM 620 O THR A 44 21.777 1.590 26.909 1.00 53.24 O ATOM 621 CB THR A 44 24.052 0.017 25.038 1.00 74.01 C ATOM 622 OG1 THR A 44 24.992 -1.069 25.041 1.00 60.01 O ATOM 623 CG2 THR A 44 24.489 1.066 24.032 1.00 54.14 C ATOM 0 H THR A 44 22.491 -0.550 27.411 1.00 1.14 H new ATOM 0 HA THR A 44 24.900 0.997 26.771 1.00 0.00 H new ATOM 0 HB THR A 44 23.068 -0.348 24.743 1.00 74.01 H new ATOM 0 HG1 THR A 44 25.064 -1.442 24.138 1.00 60.01 H new ATOM 0 HG21 THR A 44 24.565 0.613 23.044 1.00 54.14 H new ATOM 0 HG22 THR A 44 23.756 1.873 24.006 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.460 1.467 24.323 1.00 54.14 H new ATOM 631 N ASN A 45 23.353 2.943 26.016 1.00 72.33 N ATOM 632 CA ASN A 45 22.461 4.089 25.829 1.00 33.43 C ATOM 633 C ASN A 45 21.913 4.094 24.403 1.00 24.30 C ATOM 634 O ASN A 45 22.689 4.071 23.441 1.00 63.01 O ATOM 635 CB ASN A 45 23.200 5.414 26.109 1.00 4.20 C ATOM 636 CG ASN A 45 23.175 5.810 27.577 1.00 5.33 C ATOM 637 OD1 ASN A 45 22.219 5.520 28.292 1.00 50.31 O ATOM 638 ND2 ASN A 45 24.220 6.486 28.033 1.00 41.45 N ATOM 0 H ASN A 45 24.326 3.129 25.771 1.00 72.33 H new ATOM 0 HA ASN A 45 21.636 3.999 26.535 1.00 33.43 H new ATOM 0 HB2 ASN A 45 24.235 5.322 25.781 1.00 4.20 H new ATOM 0 HB3 ASN A 45 22.747 6.209 25.516 1.00 4.20 H new ATOM 0 HD21 ASN A 45 24.249 6.784 29.008 1.00 41.45 H new ATOM 0 HD22 ASN A 45 24.995 6.708 27.409 1.00 41.45 H new ATOM 645 N PRO A 46 20.574 4.119 24.243 1.00 63.04 N ATOM 646 CA PRO A 46 19.929 4.125 22.919 1.00 61.02 C ATOM 647 C PRO A 46 20.423 5.273 22.039 1.00 4.44 C ATOM 648 O PRO A 46 20.553 5.124 20.823 1.00 23.02 O ATOM 649 CB PRO A 46 18.436 4.293 23.245 1.00 23.35 C ATOM 650 CG PRO A 46 18.296 3.774 24.636 1.00 42.23 C ATOM 651 CD PRO A 46 19.579 4.134 25.336 1.00 1.14 C ATOM 0 HA PRO A 46 20.151 3.220 22.353 1.00 61.02 H new ATOM 0 HB2 PRO A 46 18.130 5.337 23.178 1.00 23.35 H new ATOM 0 HB3 PRO A 46 17.812 3.733 22.548 1.00 23.35 H new ATOM 0 HG2 PRO A 46 17.438 4.222 25.137 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.138 2.695 24.638 1.00 42.23 H new ATOM 0 HD2 PRO A 46 19.518 5.113 25.812 1.00 1.14 H new ATOM 0 HD3 PRO A 46 19.827 3.415 26.117 1.00 1.14 H new ATOM 659 N GLU A 47 20.718 6.404 22.672 1.00 25.31 N ATOM 660 CA GLU A 47 21.207 7.589 21.970 1.00 53.11 C ATOM 661 C GLU A 47 22.494 7.275 21.211 1.00 42.42 C ATOM 662 O GLU A 47 22.669 7.681 20.061 1.00 0.52 O ATOM 663 CB GLU A 47 21.443 8.732 22.968 1.00 52.55 C ATOM 664 CG GLU A 47 20.270 8.963 23.917 1.00 35.10 C ATOM 665 CD GLU A 47 18.935 9.023 23.189 1.00 32.04 C ATOM 666 OE1 GLU A 47 18.190 8.014 23.219 1.00 53.13 O ATOM 667 OE2 GLU A 47 18.643 10.067 22.571 1.00 62.13 O1- ATOM 0 H GLU A 47 20.626 6.526 23.680 1.00 25.31 H new ATOM 0 HA GLU A 47 20.452 7.899 21.248 1.00 53.11 H new ATOM 0 HB2 GLU A 47 22.336 8.514 23.553 1.00 52.55 H new ATOM 0 HB3 GLU A 47 21.640 9.651 22.416 1.00 52.55 H new ATOM 0 HG2 GLU A 47 20.242 8.162 24.656 1.00 35.10 H new ATOM 0 HG3 GLU A 47 20.425 9.894 24.462 1.00 35.10 H new ATOM 674 N GLN A 48 23.388 6.534 21.862 1.00 41.14 N ATOM 675 CA GLN A 48 24.636 6.111 21.244 1.00 71.11 C ATOM 676 C GLN A 48 24.341 5.164 20.085 1.00 34.04 C ATOM 677 O GLN A 48 24.996 5.209 19.046 1.00 32.22 O ATOM 678 CB GLN A 48 25.530 5.433 22.299 1.00 12.45 C ATOM 679 CG GLN A 48 26.914 5.011 21.800 1.00 72.35 C ATOM 680 CD GLN A 48 26.914 3.717 20.991 1.00 3.55 C ATOM 681 OE1 GLN A 48 27.721 3.539 20.081 1.00 43.42 O ATOM 682 NE2 GLN A 48 26.023 2.793 21.333 1.00 72.04 N ATOM 0 H GLN A 48 23.267 6.214 22.823 1.00 41.14 H new ATOM 0 HA GLN A 48 25.166 6.978 20.850 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.656 6.116 23.139 1.00 12.45 H new ATOM 0 HB3 GLN A 48 25.013 4.552 22.679 1.00 12.45 H new ATOM 0 HG2 GLN A 48 27.327 5.811 21.186 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.577 4.892 22.657 1.00 72.35 H new ATOM 0 HE21 GLN A 48 25.367 2.973 22.093 1.00 72.04 H new ATOM 0 HE22 GLN A 48 25.994 1.903 20.835 1.00 72.04 H new ATOM 691 N LEU A 49 23.333 4.320 20.279 1.00 51.33 N ATOM 692 CA LEU A 49 22.938 3.334 19.280 1.00 61.13 C ATOM 693 C LEU A 49 22.474 4.041 18.001 1.00 21.55 C ATOM 694 O LEU A 49 22.910 3.702 16.898 1.00 71.11 O ATOM 695 CB LEU A 49 21.837 2.427 19.877 1.00 4.20 C ATOM 696 CG LEU A 49 21.420 1.191 19.053 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.503 1.575 17.898 1.00 0.52 C ATOM 698 CD2 LEU A 49 22.649 0.436 18.545 1.00 52.41 C ATOM 0 H LEU A 49 22.769 4.300 21.129 1.00 51.33 H new ATOM 0 HA LEU A 49 23.787 2.706 19.010 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.175 2.083 20.854 1.00 4.20 H new ATOM 0 HB3 LEU A 49 20.949 3.037 20.043 1.00 4.20 H new ATOM 0 HG LEU A 49 20.860 0.528 19.712 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.229 0.681 17.339 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.603 2.048 18.290 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.021 2.271 17.238 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.330 -0.431 17.967 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.245 1.094 17.913 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.249 0.106 19.393 1.00 52.41 H new ATOM 710 N PHE A 50 21.600 5.034 18.161 1.00 3.42 N ATOM 711 CA PHE A 50 21.113 5.835 17.036 1.00 25.51 C ATOM 712 C PHE A 50 22.264 6.603 16.390 1.00 64.45 C ATOM 713 O PHE A 50 22.408 6.611 15.168 1.00 15.22 O ATOM 714 CB PHE A 50 20.019 6.803 17.514 1.00 52.14 C ATOM 715 CG PHE A 50 19.594 7.841 16.495 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.845 7.488 15.378 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.919 9.178 16.674 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.434 8.441 14.467 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.514 10.133 15.761 1.00 34.34 C ATOM 720 CZ PHE A 50 18.770 9.764 14.656 1.00 61.21 C ATOM 0 H PHE A 50 21.212 5.305 19.065 1.00 3.42 H new ATOM 0 HA PHE A 50 20.686 5.167 16.288 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.144 6.223 17.806 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.374 7.317 18.407 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.581 6.453 15.220 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.495 9.476 17.537 1.00 31.01 H new ATOM 0 HE1 PHE A 50 17.850 8.150 13.607 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.779 11.169 15.911 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.453 10.510 13.943 1.00 61.21 H new ATOM 730 N ALA A 51 23.075 7.245 17.224 1.00 33.43 N ATOM 731 CA ALA A 51 24.232 8.005 16.758 1.00 33.33 C ATOM 732 C ALA A 51 25.153 7.152 15.886 1.00 4.13 C ATOM 733 O ALA A 51 25.476 7.527 14.756 1.00 52.03 O ATOM 734 CB ALA A 51 25.004 8.558 17.950 1.00 51.41 C ATOM 0 H ALA A 51 22.951 7.254 18.236 1.00 33.43 H new ATOM 0 HA ALA A 51 23.867 8.830 16.146 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.865 9.124 17.595 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.355 9.212 18.532 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.344 7.734 18.577 1.00 51.41 H new ATOM 740 N ALA A 52 25.555 5.999 16.410 1.00 32.43 N ATOM 741 CA ALA A 52 26.472 5.107 15.708 1.00 41.10 C ATOM 742 C ALA A 52 25.824 4.565 14.440 1.00 30.53 C ATOM 743 O ALA A 52 26.428 4.571 13.360 1.00 13.40 O ATOM 744 CB ALA A 52 26.905 3.962 16.620 1.00 51.43 C ATOM 0 H ALA A 52 25.258 5.658 17.324 1.00 32.43 H new ATOM 0 HA ALA A 52 27.358 5.676 15.425 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.589 3.306 16.081 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.407 4.367 17.499 1.00 51.43 H new ATOM 0 HB3 ALA A 52 26.028 3.394 16.933 1.00 51.43 H new ATOM 750 N GLY A 53 24.582 4.120 14.579 1.00 32.23 N ATOM 751 CA GLY A 53 23.852 3.559 13.463 1.00 45.35 C ATOM 752 C GLY A 53 23.670 4.547 12.331 1.00 24.44 C ATOM 753 O GLY A 53 23.886 4.211 11.172 1.00 23.31 O ATOM 0 H GLY A 53 24.063 4.139 15.457 1.00 32.23 H new ATOM 0 HA2 GLY A 53 24.381 2.681 13.092 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.874 3.221 13.806 1.00 45.35 H new ATOM 757 N TYR A 54 23.289 5.776 12.670 1.00 20.42 N ATOM 758 CA TYR A 54 23.030 6.810 11.671 1.00 1.52 C ATOM 759 C TYR A 54 24.333 7.313 11.052 1.00 10.14 C ATOM 760 O TYR A 54 24.396 7.551 9.849 1.00 3.35 O ATOM 761 CB TYR A 54 22.234 7.972 12.290 1.00 4.31 C ATOM 762 CG TYR A 54 21.927 9.115 11.326 1.00 71.40 C ATOM 763 CD1 TYR A 54 21.708 8.884 9.968 1.00 61.33 C ATOM 764 CD2 TYR A 54 21.852 10.427 11.782 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.430 9.926 9.099 1.00 65.13 C ATOM 766 CE2 TYR A 54 21.572 11.470 10.919 1.00 14.31 C ATOM 767 CZ TYR A 54 21.363 11.214 9.579 1.00 61.32 C ATOM 768 OH TYR A 54 21.087 12.253 8.717 1.00 14.13 O ATOM 0 H TYR A 54 23.152 6.081 13.634 1.00 20.42 H new ATOM 0 HA TYR A 54 22.430 6.369 10.875 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.295 7.583 12.683 1.00 4.31 H new ATOM 0 HB3 TYR A 54 22.794 8.369 13.137 1.00 4.31 H new ATOM 0 HD1 TYR A 54 21.756 7.874 9.587 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.015 10.635 12.829 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.267 9.729 8.050 1.00 65.13 H new ATOM 0 HE2 TYR A 54 21.517 12.482 11.292 1.00 14.31 H new ATOM 0 HH TYR A 54 20.351 11.998 8.122 1.00 14.13 H new ATOM 778 N SER A 55 25.374 7.465 11.867 1.00 11.10 N ATOM 779 CA SER A 55 26.665 7.935 11.367 1.00 22.53 C ATOM 780 C SER A 55 27.237 6.938 10.358 1.00 50.31 C ATOM 781 O SER A 55 27.734 7.325 9.298 1.00 23.31 O ATOM 782 CB SER A 55 27.645 8.162 12.524 1.00 0.44 C ATOM 783 OG SER A 55 27.808 6.991 13.305 1.00 35.10 O ATOM 0 H SER A 55 25.351 7.272 12.868 1.00 11.10 H new ATOM 0 HA SER A 55 26.514 8.889 10.862 1.00 22.53 H new ATOM 0 HB2 SER A 55 28.611 8.473 12.128 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.283 8.974 13.155 1.00 0.44 H new ATOM 0 HG SER A 55 27.025 6.871 13.882 1.00 35.10 H new ATOM 789 N ALA A 56 27.140 5.650 10.689 1.00 25.24 N ATOM 790 CA ALA A 56 27.581 4.592 9.786 1.00 63.14 C ATOM 791 C ALA A 56 26.637 4.484 8.589 1.00 34.41 C ATOM 792 O ALA A 56 27.076 4.380 7.444 1.00 72.41 O ATOM 793 CB ALA A 56 27.669 3.265 10.530 1.00 2.41 C ATOM 0 H ALA A 56 26.760 5.317 11.575 1.00 25.24 H new ATOM 0 HA ALA A 56 28.574 4.841 9.413 1.00 63.14 H new ATOM 0 HB1 ALA A 56 27.999 2.485 9.844 1.00 2.41 H new ATOM 0 HB2 ALA A 56 28.382 3.354 11.349 1.00 2.41 H new ATOM 0 HB3 ALA A 56 26.688 3.006 10.929 1.00 2.41 H new ATOM 799 N CYS A 57 25.335 4.530 8.870 1.00 43.11 N ATOM 800 CA CYS A 57 24.305 4.491 7.831 1.00 65.50 C ATOM 801 C CYS A 57 24.517 5.616 6.830 1.00 1.30 C ATOM 802 O CYS A 57 24.250 5.457 5.639 1.00 31.43 O ATOM 803 CB CYS A 57 22.902 4.603 8.442 1.00 74.40 C ATOM 804 SG CYS A 57 21.562 4.616 7.228 1.00 3.24 S ATOM 0 H CYS A 57 24.965 4.595 9.818 1.00 43.11 H new ATOM 0 HA CYS A 57 24.386 3.533 7.318 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.749 3.769 9.126 1.00 74.40 H new ATOM 0 HB3 CYS A 57 22.848 5.516 9.035 1.00 74.40 H new ATOM 0 HG CYS A 57 22.033 4.956 6.065 1.00 3.24 H new ATOM 810 N PHE A 58 24.972 6.763 7.334 1.00 12.51 N ATOM 811 CA PHE A 58 25.192 7.945 6.511 1.00 55.51 C ATOM 812 C PHE A 58 26.133 7.617 5.352 1.00 60.31 C ATOM 813 O PHE A 58 26.016 8.183 4.265 1.00 54.45 O ATOM 814 CB PHE A 58 25.766 9.082 7.370 1.00 64.12 C ATOM 815 CG PHE A 58 25.575 10.454 6.779 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.597 11.086 6.083 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.363 11.113 6.926 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.410 12.345 5.546 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.172 12.370 6.392 1.00 51.42 C ATOM 820 CZ PHE A 58 25.197 12.987 5.701 1.00 5.31 C ATOM 0 H PHE A 58 25.197 6.896 8.320 1.00 12.51 H new ATOM 0 HA PHE A 58 24.238 8.270 6.095 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.297 9.053 8.353 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.831 8.908 7.520 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.548 10.588 5.960 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.559 10.635 7.466 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.211 12.827 5.006 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.223 12.871 6.514 1.00 51.42 H new ATOM 0 HZ PHE A 58 25.050 13.971 5.282 1.00 5.31 H new ATOM 830 N LEU A 59 27.055 6.684 5.589 1.00 64.51 N ATOM 831 CA LEU A 59 27.970 6.222 4.551 1.00 63.33 C ATOM 832 C LEU A 59 27.201 5.450 3.480 1.00 14.15 C ATOM 833 O LEU A 59 27.358 5.706 2.288 1.00 3.51 O ATOM 834 CB LEU A 59 29.072 5.339 5.157 1.00 74.12 C ATOM 835 CG LEU A 59 30.113 4.799 4.158 1.00 31.41 C ATOM 836 CD1 LEU A 59 30.891 5.941 3.506 1.00 61.22 C ATOM 837 CD2 LEU A 59 31.061 3.823 4.849 1.00 2.33 C ATOM 0 H LEU A 59 27.186 6.233 6.495 1.00 64.51 H new ATOM 0 HA LEU A 59 28.440 7.091 4.090 1.00 63.33 H new ATOM 0 HB2 LEU A 59 29.593 5.913 5.923 1.00 74.12 H new ATOM 0 HB3 LEU A 59 28.601 4.493 5.657 1.00 74.12 H new ATOM 0 HG LEU A 59 29.582 4.264 3.371 1.00 31.41 H new ATOM 0 HD11 LEU A 59 31.619 5.532 2.805 1.00 61.22 H new ATOM 0 HD12 LEU A 59 30.200 6.593 2.972 1.00 61.22 H new ATOM 0 HD13 LEU A 59 31.410 6.514 4.275 1.00 61.22 H new ATOM 0 HD21 LEU A 59 31.790 3.452 4.128 1.00 2.33 H new ATOM 0 HD22 LEU A 59 31.581 4.333 5.660 1.00 2.33 H new ATOM 0 HD23 LEU A 59 30.491 2.986 5.253 1.00 2.33 H new ATOM 849 N SER A 60 26.362 4.514 3.917 1.00 34.05 N ATOM 850 CA SER A 60 25.540 3.713 3.011 1.00 74.40 C ATOM 851 C SER A 60 24.600 4.623 2.204 1.00 42.34 C ATOM 852 O SER A 60 24.400 4.435 0.995 1.00 41.15 O ATOM 853 CB SER A 60 24.734 2.691 3.824 1.00 52.34 C ATOM 854 OG SER A 60 25.535 2.111 4.841 1.00 74.20 O ATOM 0 H SER A 60 26.232 4.289 4.904 1.00 34.05 H new ATOM 0 HA SER A 60 26.184 3.182 2.311 1.00 74.40 H new ATOM 0 HB2 SER A 60 23.867 3.178 4.271 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.356 1.911 3.163 1.00 52.34 H new ATOM 0 HG SER A 60 25.733 1.180 4.610 1.00 74.20 H new ATOM 860 N ALA A 61 24.044 5.625 2.883 1.00 5.22 N ATOM 861 CA ALA A 61 23.176 6.607 2.246 1.00 61.10 C ATOM 862 C ALA A 61 23.952 7.373 1.182 1.00 23.52 C ATOM 863 O ALA A 61 23.517 7.481 0.036 1.00 64.15 O ATOM 864 CB ALA A 61 22.601 7.564 3.288 1.00 23.00 C ATOM 0 H ALA A 61 24.182 5.776 3.882 1.00 5.22 H new ATOM 0 HA ALA A 61 22.346 6.088 1.766 1.00 61.10 H new ATOM 0 HB1 ALA A 61 21.955 8.291 2.797 1.00 23.00 H new ATOM 0 HB2 ALA A 61 22.022 7.000 4.020 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.415 8.084 3.793 1.00 23.00 H new ATOM 870 N MET A 62 25.123 7.876 1.569 1.00 1.42 N ATOM 871 CA MET A 62 25.997 8.601 0.650 1.00 22.23 C ATOM 872 C MET A 62 26.557 7.670 -0.422 1.00 52.25 C ATOM 873 O MET A 62 26.998 8.127 -1.473 1.00 52.11 O ATOM 874 CB MET A 62 27.136 9.294 1.412 1.00 12.31 C ATOM 875 CG MET A 62 26.697 10.551 2.153 1.00 13.45 C ATOM 876 SD MET A 62 26.035 11.816 1.044 1.00 13.34 S ATOM 877 CE MET A 62 27.418 12.064 -0.071 1.00 61.32 C ATOM 0 H MET A 62 25.489 7.794 2.517 1.00 1.42 H new ATOM 0 HA MET A 62 25.400 9.367 0.155 1.00 22.23 H new ATOM 0 HB2 MET A 62 27.564 8.591 2.127 1.00 12.31 H new ATOM 0 HB3 MET A 62 27.927 9.554 0.709 1.00 12.31 H new ATOM 0 HG2 MET A 62 25.939 10.287 2.891 1.00 13.45 H new ATOM 0 HG3 MET A 62 27.546 10.961 2.700 1.00 13.45 H new ATOM 0 HE1 MET A 62 27.306 13.020 -0.583 1.00 61.32 H new ATOM 0 HE2 MET A 62 28.348 12.064 0.497 1.00 61.32 H new ATOM 0 HE3 MET A 62 27.442 11.259 -0.806 1.00 61.32 H new ATOM 887 N LYS A 63 26.545 6.370 -0.146 1.00 50.31 N ATOM 888 CA LYS A 63 26.925 5.366 -1.138 1.00 32.21 C ATOM 889 C LYS A 63 25.875 5.343 -2.242 1.00 55.33 C ATOM 890 O LYS A 63 26.202 5.397 -3.431 1.00 31.21 O ATOM 891 CB LYS A 63 27.076 3.982 -0.468 1.00 32.54 C ATOM 892 CG LYS A 63 27.425 2.822 -1.413 1.00 62.32 C ATOM 893 CD LYS A 63 26.187 2.202 -2.067 1.00 52.53 C ATOM 894 CE LYS A 63 26.534 0.967 -2.893 1.00 52.13 C ATOM 895 NZ LYS A 63 27.488 1.274 -3.990 1.00 51.23 N1+ ATOM 0 H LYS A 63 26.276 5.984 0.759 1.00 50.31 H new ATOM 0 HA LYS A 63 27.890 5.620 -1.577 1.00 32.21 H new ATOM 0 HB2 LYS A 63 27.851 4.051 0.296 1.00 32.54 H new ATOM 0 HB3 LYS A 63 26.144 3.742 0.044 1.00 32.54 H new ATOM 0 HG2 LYS A 63 28.100 3.182 -2.190 1.00 62.32 H new ATOM 0 HG3 LYS A 63 27.961 2.053 -0.856 1.00 62.32 H new ATOM 0 HD2 LYS A 63 25.467 1.931 -1.295 1.00 52.53 H new ATOM 0 HD3 LYS A 63 25.706 2.942 -2.706 1.00 52.53 H new ATOM 0 HE2 LYS A 63 26.965 0.206 -2.242 1.00 52.13 H new ATOM 0 HE3 LYS A 63 25.621 0.546 -3.315 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 27.629 0.426 -4.575 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 27.105 2.041 -4.579 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 28.399 1.570 -3.585 1.00 51.23 H new ATOM 909 N PHE A 64 24.608 5.274 -1.838 1.00 54.13 N ATOM 910 CA PHE A 64 23.500 5.333 -2.786 1.00 15.41 C ATOM 911 C PHE A 64 23.497 6.681 -3.515 1.00 43.31 C ATOM 912 O PHE A 64 23.271 6.750 -4.726 1.00 31.42 O ATOM 913 CB PHE A 64 22.164 5.107 -2.061 1.00 54.23 C ATOM 914 CG PHE A 64 20.956 5.266 -2.955 1.00 22.52 C ATOM 915 CD1 PHE A 64 20.730 4.381 -4.003 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.055 6.304 -2.753 1.00 44.41 C ATOM 917 CE1 PHE A 64 19.631 4.532 -4.829 1.00 70.35 C ATOM 918 CE2 PHE A 64 18.954 6.454 -3.577 1.00 31.33 C ATOM 919 CZ PHE A 64 18.744 5.568 -4.616 1.00 62.32 C ATOM 0 H PHE A 64 24.325 5.177 -0.863 1.00 54.13 H new ATOM 0 HA PHE A 64 23.628 4.542 -3.524 1.00 15.41 H new ATOM 0 HB2 PHE A 64 22.158 4.105 -1.631 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.087 5.810 -1.232 1.00 54.23 H new ATOM 0 HD1 PHE A 64 21.419 3.567 -4.174 1.00 70.34 H new ATOM 0 HD2 PHE A 64 20.216 7.001 -1.944 1.00 44.41 H new ATOM 0 HE1 PHE A 64 19.467 3.839 -5.641 1.00 70.35 H new ATOM 0 HE2 PHE A 64 18.259 7.263 -3.408 1.00 31.33 H new ATOM 0 HZ PHE A 64 17.886 5.686 -5.261 1.00 62.32 H new ATOM 929 N VAL A 65 23.764 7.749 -2.768 1.00 22.12 N ATOM 930 CA VAL A 65 23.833 9.094 -3.334 1.00 1.13 C ATOM 931 C VAL A 65 24.951 9.188 -4.371 1.00 2.04 C ATOM 932 O VAL A 65 24.731 9.640 -5.496 1.00 1.42 O ATOM 933 CB VAL A 65 24.054 10.164 -2.233 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.360 11.529 -2.850 1.00 35.23 C ATOM 935 CG2 VAL A 65 22.838 10.247 -1.312 1.00 41.32 C ATOM 0 H VAL A 65 23.937 7.709 -1.764 1.00 22.12 H new ATOM 0 HA VAL A 65 22.876 9.290 -3.818 1.00 1.13 H new ATOM 0 HB VAL A 65 24.916 9.864 -1.637 1.00 51.41 H new ATOM 0 HG11 VAL A 65 24.511 12.261 -2.057 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.263 11.460 -3.457 1.00 35.23 H new ATOM 0 HG13 VAL A 65 23.525 11.840 -3.477 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.012 11.003 -0.546 1.00 41.32 H new ATOM 0 HG22 VAL A 65 21.958 10.517 -1.895 1.00 41.32 H new ATOM 0 HG23 VAL A 65 22.675 9.280 -0.836 1.00 41.32 H new ATOM 945 N ALA A 66 26.142 8.742 -3.995 1.00 10.53 N ATOM 946 CA ALA A 66 27.295 8.774 -4.889 1.00 34.24 C ATOM 947 C ALA A 66 26.993 8.014 -6.177 1.00 52.01 C ATOM 948 O ALA A 66 27.462 8.384 -7.259 1.00 55.45 O ATOM 949 CB ALA A 66 28.523 8.192 -4.194 1.00 2.15 C ATOM 0 H ALA A 66 26.337 8.352 -3.073 1.00 10.53 H new ATOM 0 HA ALA A 66 27.506 9.812 -5.147 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.375 8.223 -4.874 1.00 2.15 H new ATOM 0 HB2 ALA A 66 28.749 8.778 -3.303 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.324 7.159 -3.908 1.00 2.15 H new ATOM 955 N GLY A 67 26.165 6.985 -6.049 1.00 41.30 N ATOM 956 CA GLY A 67 25.824 6.138 -7.182 1.00 41.44 C ATOM 957 C GLY A 67 24.988 6.868 -8.216 1.00 65.01 C ATOM 958 O GLY A 67 25.122 6.633 -9.420 1.00 24.21 O ATOM 0 H GLY A 67 25.718 6.718 -5.172 1.00 41.30 H new ATOM 0 HA2 GLY A 67 26.739 5.774 -7.649 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.278 5.264 -6.828 1.00 41.44 H new ATOM 962 N GLN A 68 24.143 7.781 -7.747 1.00 2.22 N ATOM 963 CA GLN A 68 23.252 8.535 -8.626 1.00 3.22 C ATOM 964 C GLN A 68 23.903 9.859 -9.000 1.00 13.50 C ATOM 965 O GLN A 68 23.544 10.487 -9.994 1.00 73.33 O ATOM 966 CB GLN A 68 21.894 8.780 -7.948 1.00 70.02 C ATOM 967 CG GLN A 68 22.005 9.402 -6.563 1.00 23.14 C ATOM 968 CD GLN A 68 20.659 9.779 -5.971 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.173 10.895 -6.157 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.052 8.851 -5.251 1.00 55.13 N ATOM 0 H GLN A 68 24.056 8.018 -6.759 1.00 2.22 H new ATOM 0 HA GLN A 68 23.077 7.952 -9.530 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.294 9.432 -8.582 1.00 70.02 H new ATOM 0 HB3 GLN A 68 21.361 7.833 -7.869 1.00 70.02 H new ATOM 0 HG2 GLN A 68 22.506 8.701 -5.895 1.00 23.14 H new ATOM 0 HG3 GLN A 68 22.632 10.291 -6.620 1.00 23.14 H new ATOM 0 HE21 GLN A 68 20.489 7.939 -5.121 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.146 9.047 -4.825 1.00 55.13 H new ATOM 979 N ASN A 69 24.887 10.255 -8.202 1.00 45.10 N ATOM 980 CA ASN A 69 25.606 11.508 -8.407 1.00 61.12 C ATOM 981 C ASN A 69 26.864 11.279 -9.232 1.00 41.24 C ATOM 982 O ASN A 69 27.637 12.207 -9.471 1.00 42.44 O ATOM 983 CB ASN A 69 25.942 12.156 -7.056 1.00 43.31 C ATOM 984 CG ASN A 69 24.790 12.986 -6.506 1.00 21.20 C ATOM 985 OD1 ASN A 69 24.720 14.197 -6.725 1.00 73.01 O ATOM 986 ND2 ASN A 69 23.867 12.343 -5.809 1.00 73.35 N ATOM 0 H ASN A 69 25.209 9.719 -7.396 1.00 45.10 H new ATOM 0 HA ASN A 69 24.963 12.191 -8.963 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.201 11.378 -6.338 1.00 43.31 H new ATOM 0 HB3 ASN A 69 26.821 12.790 -7.169 1.00 43.31 H new ATOM 0 HD21 ASN A 69 23.066 12.850 -5.434 1.00 73.35 H new ATOM 0 HD22 ASN A 69 23.957 11.340 -5.647 1.00 73.35 H new ATOM 993 N LYS A 70 27.051 10.028 -9.654 1.00 63.25 N ATOM 994 CA LYS A 70 28.107 9.646 -10.597 1.00 32.31 C ATOM 995 C LYS A 70 29.493 9.909 -10.008 1.00 12.34 C ATOM 996 O LYS A 70 30.462 10.128 -10.741 1.00 70.50 O ATOM 997 CB LYS A 70 27.948 10.393 -11.940 1.00 4.35 C ATOM 998 CG LYS A 70 26.507 10.523 -12.449 1.00 13.20 C ATOM 999 CD LYS A 70 25.664 9.276 -12.181 1.00 32.43 C ATOM 1000 CE LYS A 70 24.361 9.297 -12.974 1.00 4.32 C ATOM 1001 NZ LYS A 70 23.574 10.536 -12.717 1.00 52.12 N1+ ATOM 0 H LYS A 70 26.472 9.245 -9.350 1.00 63.25 H new ATOM 0 HA LYS A 70 28.009 8.576 -10.783 1.00 32.31 H new ATOM 0 HB2 LYS A 70 28.370 11.392 -11.834 1.00 4.35 H new ATOM 0 HB3 LYS A 70 28.538 9.876 -12.697 1.00 4.35 H new ATOM 0 HG2 LYS A 70 26.036 11.383 -11.973 1.00 13.20 H new ATOM 0 HG3 LYS A 70 26.523 10.721 -13.521 1.00 13.20 H new ATOM 0 HD2 LYS A 70 26.236 8.386 -12.444 1.00 32.43 H new ATOM 0 HD3 LYS A 70 25.441 9.209 -11.116 1.00 32.43 H new ATOM 0 HE2 LYS A 70 24.583 9.222 -14.039 1.00 4.32 H new ATOM 0 HE3 LYS A 70 23.762 8.425 -12.711 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 22.606 10.413 -13.076 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 23.543 10.722 -11.694 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 24.023 11.339 -13.201 1.00 52.12 H new ATOM 1015 N GLN A 71 29.585 9.851 -8.687 1.00 41.25 N ATOM 1016 CA GLN A 71 30.831 10.128 -7.978 1.00 41.44 C ATOM 1017 C GLN A 71 31.247 8.932 -7.127 1.00 11.15 C ATOM 1018 O GLN A 71 30.469 7.999 -6.920 1.00 3.32 O ATOM 1019 CB GLN A 71 30.668 11.368 -7.087 1.00 65.11 C ATOM 1020 CG GLN A 71 29.413 11.322 -6.224 1.00 11.32 C ATOM 1021 CD GLN A 71 29.541 12.093 -4.928 1.00 14.24 C ATOM 1022 OE1 GLN A 71 29.915 11.385 -3.884 1.00 4.02 O flip ATOM 1023 NE2 GLN A 71 29.275 13.290 -4.863 1.00 60.02 N flip ATOM 0 H GLN A 71 28.803 9.612 -8.077 1.00 41.25 H new ATOM 0 HA GLN A 71 31.609 10.316 -8.717 1.00 41.44 H new ATOM 0 HB2 GLN A 71 31.542 11.463 -6.442 1.00 65.11 H new ATOM 0 HB3 GLN A 71 30.638 12.258 -7.715 1.00 65.11 H new ATOM 0 HG2 GLN A 71 28.575 11.723 -6.794 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.176 10.283 -5.997 1.00 11.32 H new ATOM 0 HE21 GLN A 71 28.989 13.795 -5.702 1.00 60.02 H new ATOM 0 HE22 GLN A 71 29.340 13.779 -3.970 1.00 60.02 H new ATOM 1032 N THR A 72 32.474 8.979 -6.627 1.00 0.13 N ATOM 1033 CA THR A 72 33.011 7.937 -5.763 1.00 33.54 C ATOM 1034 C THR A 72 33.506 8.543 -4.453 1.00 64.51 C ATOM 1035 O THR A 72 34.049 9.648 -4.442 1.00 2.32 O ATOM 1036 CB THR A 72 34.170 7.180 -6.457 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.075 8.120 -7.057 1.00 1.42 O ATOM 1038 CG2 THR A 72 33.643 6.219 -7.520 1.00 71.13 C ATOM 0 H THR A 72 33.126 9.742 -6.809 1.00 0.13 H new ATOM 0 HA THR A 72 32.210 7.227 -5.555 1.00 33.54 H new ATOM 0 HB THR A 72 34.696 6.597 -5.701 1.00 55.21 H new ATOM 0 HG1 THR A 72 35.807 7.636 -7.493 1.00 1.42 H new ATOM 0 HG21 THR A 72 34.480 5.702 -7.990 1.00 71.13 H new ATOM 0 HG22 THR A 72 32.981 5.489 -7.054 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.092 6.779 -8.276 1.00 71.13 H new ATOM 1046 N LEU A 73 33.297 7.826 -3.354 1.00 24.22 N ATOM 1047 CA LEU A 73 33.708 8.287 -2.030 1.00 2.33 C ATOM 1048 C LEU A 73 34.889 7.456 -1.521 1.00 44.11 C ATOM 1049 O LEU A 73 34.938 6.245 -1.750 1.00 52.40 O ATOM 1050 CB LEU A 73 32.523 8.194 -1.055 1.00 54.54 C ATOM 1051 CG LEU A 73 31.328 9.102 -1.390 1.00 53.14 C ATOM 1052 CD1 LEU A 73 30.145 8.800 -0.474 1.00 63.13 C ATOM 1053 CD2 LEU A 73 31.726 10.575 -1.289 1.00 44.41 C ATOM 0 H LEU A 73 32.841 6.914 -3.354 1.00 24.22 H new ATOM 0 HA LEU A 73 34.026 9.327 -2.098 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.177 7.161 -1.026 1.00 54.54 H new ATOM 0 HB3 LEU A 73 32.877 8.440 -0.054 1.00 54.54 H new ATOM 0 HG LEU A 73 31.023 8.899 -2.417 1.00 53.14 H new ATOM 0 HD11 LEU A 73 29.311 9.454 -0.729 1.00 63.13 H new ATOM 0 HD12 LEU A 73 29.843 7.760 -0.601 1.00 63.13 H new ATOM 0 HD13 LEU A 73 30.435 8.970 0.563 1.00 63.13 H new ATOM 0 HD21 LEU A 73 30.867 11.201 -1.530 1.00 44.41 H new ATOM 0 HD22 LEU A 73 32.061 10.793 -0.275 1.00 44.41 H new ATOM 0 HD23 LEU A 73 32.534 10.782 -1.990 1.00 44.41 H new ATOM 1065 N PRO A 74 35.863 8.093 -0.840 1.00 14.33 N ATOM 1066 CA PRO A 74 37.033 7.393 -0.289 1.00 71.54 C ATOM 1067 C PRO A 74 36.641 6.393 0.800 1.00 22.35 C ATOM 1068 O PRO A 74 36.053 6.771 1.811 1.00 71.04 O ATOM 1069 CB PRO A 74 37.889 8.523 0.306 1.00 0.31 C ATOM 1070 CG PRO A 74 36.934 9.648 0.536 1.00 75.32 C ATOM 1071 CD PRO A 74 35.904 9.542 -0.556 1.00 21.31 C ATOM 0 HA PRO A 74 37.552 6.809 -1.049 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.364 8.211 1.236 1.00 0.31 H new ATOM 0 HB3 PRO A 74 38.687 8.815 -0.376 1.00 0.31 H new ATOM 0 HG2 PRO A 74 36.470 9.572 1.519 1.00 75.32 H new ATOM 0 HG3 PRO A 74 37.446 10.609 0.498 1.00 75.32 H new ATOM 0 HD2 PRO A 74 34.933 9.917 -0.232 1.00 21.31 H new ATOM 0 HD3 PRO A 74 36.190 10.117 -1.437 1.00 21.31 H new ATOM 1079 N ALA A 75 36.987 5.127 0.597 1.00 74.43 N ATOM 1080 CA ALA A 75 36.629 4.066 1.541 1.00 72.21 C ATOM 1081 C ALA A 75 37.526 4.081 2.777 1.00 34.41 C ATOM 1082 O ALA A 75 37.387 3.246 3.669 1.00 42.34 O ATOM 1083 CB ALA A 75 36.681 2.707 0.851 1.00 2.05 C ATOM 0 H ALA A 75 37.516 4.806 -0.214 1.00 74.43 H new ATOM 0 HA ALA A 75 35.610 4.251 1.880 1.00 72.21 H new ATOM 0 HB1 ALA A 75 36.413 1.927 1.563 1.00 2.05 H new ATOM 0 HB2 ALA A 75 35.978 2.695 0.018 1.00 2.05 H new ATOM 0 HB3 ALA A 75 37.689 2.527 0.478 1.00 2.05 H new ATOM 1089 N ASP A 76 38.439 5.040 2.823 1.00 35.21 N ATOM 1090 CA ASP A 76 39.379 5.166 3.935 1.00 24.42 C ATOM 1091 C ASP A 76 38.809 6.079 5.022 1.00 33.35 C ATOM 1092 O ASP A 76 39.427 6.296 6.064 1.00 61.01 O ATOM 1093 CB ASP A 76 40.710 5.713 3.403 1.00 72.44 C ATOM 1094 CG ASP A 76 41.833 5.694 4.432 1.00 23.12 C ATOM 1095 OD1 ASP A 76 42.091 6.738 5.068 1.00 55.31 O ATOM 1096 OD2 ASP A 76 42.478 4.635 4.596 1.00 42.23 O1- ATOM 0 H ASP A 76 38.552 5.749 2.099 1.00 35.21 H new ATOM 0 HA ASP A 76 39.546 4.187 4.383 1.00 24.42 H new ATOM 0 HB2 ASP A 76 41.013 5.126 2.536 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.561 6.737 3.059 1.00 72.44 H new ATOM 1101 N THR A 77 37.603 6.572 4.781 1.00 11.55 N ATOM 1102 CA THR A 77 36.972 7.555 5.658 1.00 12.43 C ATOM 1103 C THR A 77 36.573 6.963 7.007 1.00 50.31 C ATOM 1104 O THR A 77 36.448 5.744 7.168 1.00 30.02 O ATOM 1105 CB THR A 77 35.729 8.194 4.994 1.00 41.10 C ATOM 1106 OG1 THR A 77 35.057 9.054 5.923 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.757 7.131 4.492 1.00 73.22 C ATOM 0 H THR A 77 37.034 6.306 3.977 1.00 11.55 H new ATOM 0 HA THR A 77 37.724 8.325 5.831 1.00 12.43 H new ATOM 0 HB THR A 77 36.075 8.776 4.140 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.684 9.730 6.255 1.00 73.42 H new ATOM 0 HG21 THR A 77 33.895 7.614 4.031 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.256 6.500 3.756 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.424 6.518 5.329 1.00 73.22 H new ATOM 1115 N THR A 78 36.379 7.854 7.973 1.00 13.54 N ATOM 1116 CA THR A 78 35.944 7.484 9.310 1.00 2.03 C ATOM 1117 C THR A 78 34.991 8.552 9.848 1.00 41.21 C ATOM 1118 O THR A 78 35.100 9.726 9.500 1.00 33.42 O ATOM 1119 CB THR A 78 37.149 7.330 10.273 1.00 65.01 C ATOM 1120 OG1 THR A 78 38.130 6.446 9.707 1.00 41.13 O ATOM 1121 CG2 THR A 78 36.710 6.786 11.630 1.00 52.04 C ATOM 0 H THR A 78 36.520 8.856 7.848 1.00 13.54 H new ATOM 0 HA THR A 78 35.434 6.523 9.250 1.00 2.03 H new ATOM 0 HB THR A 78 37.583 8.320 10.416 1.00 65.01 H new ATOM 0 HG1 THR A 78 38.886 6.358 10.324 1.00 41.13 H new ATOM 0 HG21 THR A 78 37.578 6.690 12.282 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.992 7.470 12.081 1.00 52.04 H new ATOM 0 HG23 THR A 78 36.246 5.809 11.497 1.00 52.04 H new ATOM 1129 N VAL A 79 34.056 8.142 10.685 1.00 13.33 N ATOM 1130 CA VAL A 79 33.085 9.054 11.279 1.00 51.35 C ATOM 1131 C VAL A 79 33.063 8.845 12.787 1.00 40.33 C ATOM 1132 O VAL A 79 33.371 7.756 13.266 1.00 15.54 O ATOM 1133 CB VAL A 79 31.660 8.823 10.693 1.00 73.54 C ATOM 1134 CG1 VAL A 79 30.640 9.780 11.308 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.673 8.962 9.171 1.00 4.51 C ATOM 0 H VAL A 79 33.945 7.170 10.974 1.00 13.33 H new ATOM 0 HA VAL A 79 33.381 10.077 11.046 1.00 51.35 H new ATOM 0 HB VAL A 79 31.360 7.807 10.948 1.00 73.54 H new ATOM 0 HG11 VAL A 79 29.657 9.591 10.876 1.00 32.33 H new ATOM 0 HG12 VAL A 79 30.599 9.624 12.386 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.935 10.809 11.101 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.668 8.797 8.782 1.00 4.51 H new ATOM 0 HG22 VAL A 79 32.007 9.964 8.900 1.00 4.51 H new ATOM 0 HG23 VAL A 79 32.353 8.225 8.744 1.00 4.51 H new ATOM 1145 N THR A 80 32.769 9.892 13.541 1.00 3.21 N ATOM 1146 CA THR A 80 32.558 9.751 14.974 1.00 52.54 C ATOM 1147 C THR A 80 31.334 10.545 15.415 1.00 43.34 C ATOM 1148 O THR A 80 31.325 11.775 15.366 1.00 4.30 O ATOM 1149 CB THR A 80 33.797 10.193 15.785 1.00 61.00 C ATOM 1150 OG1 THR A 80 34.954 9.470 15.336 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.593 9.941 17.277 1.00 20.33 C ATOM 0 H THR A 80 32.671 10.844 13.188 1.00 3.21 H new ATOM 0 HA THR A 80 32.390 8.693 15.174 1.00 52.54 H new ATOM 0 HB THR A 80 33.942 11.262 15.628 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.089 8.683 15.904 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.480 10.261 17.825 1.00 20.33 H new ATOM 0 HG22 THR A 80 32.728 10.505 17.626 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.426 8.877 17.447 1.00 20.33 H new ATOM 1159 N ALA A 81 30.295 9.830 15.820 1.00 63.21 N ATOM 1160 CA ALA A 81 29.086 10.445 16.340 1.00 75.00 C ATOM 1161 C ALA A 81 29.181 10.545 17.857 1.00 14.40 C ATOM 1162 O ALA A 81 29.133 9.531 18.556 1.00 73.21 O ATOM 1163 CB ALA A 81 27.859 9.646 15.924 1.00 42.42 C ATOM 0 H ALA A 81 30.267 8.811 15.797 1.00 63.21 H new ATOM 0 HA ALA A 81 28.985 11.448 15.926 1.00 75.00 H new ATOM 0 HB1 ALA A 81 26.963 10.122 16.323 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.799 9.612 14.836 1.00 42.42 H new ATOM 0 HB3 ALA A 81 27.936 8.631 16.315 1.00 42.42 H new ATOM 1169 N GLU A 82 29.344 11.760 18.354 1.00 71.31 N ATOM 1170 CA GLU A 82 29.516 11.991 19.786 1.00 72.51 C ATOM 1171 C GLU A 82 28.275 12.676 20.352 1.00 53.13 C ATOM 1172 O GLU A 82 28.039 13.856 20.101 1.00 25.01 O ATOM 1173 CB GLU A 82 30.773 12.846 20.023 1.00 74.00 C ATOM 1174 CG GLU A 82 31.100 13.085 21.494 1.00 3.23 C ATOM 1175 CD GLU A 82 32.405 13.846 21.694 1.00 23.22 C ATOM 1176 OE1 GLU A 82 32.515 14.988 21.202 1.00 3.55 O ATOM 1177 OE2 GLU A 82 33.327 13.309 22.356 1.00 51.44 O1- ATOM 0 H GLU A 82 29.361 12.608 17.787 1.00 71.31 H new ATOM 0 HA GLU A 82 29.644 11.038 20.299 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.625 12.359 19.548 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.641 13.810 19.531 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.285 13.642 21.956 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.162 12.126 22.008 1.00 3.23 H new ATOM 1184 N VAL A 83 27.485 11.931 21.117 1.00 31.40 N ATOM 1185 CA VAL A 83 26.226 12.443 21.657 1.00 74.25 C ATOM 1186 C VAL A 83 26.328 12.667 23.159 1.00 12.15 C ATOM 1187 O VAL A 83 27.012 11.925 23.862 1.00 3.30 O ATOM 1188 CB VAL A 83 25.042 11.487 21.360 1.00 22.15 C ATOM 1189 CG1 VAL A 83 24.814 11.368 19.858 1.00 60.03 C ATOM 1190 CG2 VAL A 83 25.273 10.110 21.982 1.00 42.03 C ATOM 0 H VAL A 83 27.693 10.967 21.379 1.00 31.40 H new ATOM 0 HA VAL A 83 26.035 13.395 21.162 1.00 74.25 H new ATOM 0 HB VAL A 83 24.146 11.911 21.813 1.00 22.15 H new ATOM 0 HG11 VAL A 83 23.979 10.693 19.669 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.586 12.351 19.446 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.713 10.975 19.384 1.00 60.03 H new ATOM 0 HG21 VAL A 83 24.426 9.462 21.757 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.183 9.673 21.571 1.00 42.03 H new ATOM 0 HG23 VAL A 83 25.375 10.211 23.063 1.00 42.03 H new ATOM 1200 N GLY A 84 25.644 13.692 23.645 1.00 33.12 N ATOM 1201 CA GLY A 84 25.669 14.010 25.055 1.00 23.12 C ATOM 1202 C GLY A 84 24.308 14.408 25.569 1.00 64.22 C ATOM 1203 O GLY A 84 23.414 14.732 24.790 1.00 21.33 O ATOM 0 H GLY A 84 25.067 14.314 23.080 1.00 33.12 H new ATOM 0 HA2 GLY A 84 26.030 13.147 25.615 1.00 23.12 H new ATOM 0 HA3 GLY A 84 26.375 14.822 25.231 1.00 23.12 H new ATOM 1207 N ILE A 85 24.158 14.391 26.881 1.00 23.52 N ATOM 1208 CA ILE A 85 22.912 14.758 27.530 1.00 1.40 C ATOM 1209 C ILE A 85 23.221 15.654 28.720 1.00 61.15 C ATOM 1210 O ILE A 85 24.108 15.346 29.530 1.00 10.52 O ATOM 1211 CB ILE A 85 22.109 13.497 27.972 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.782 13.874 28.677 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.963 12.594 28.862 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.901 14.112 30.172 1.00 71.32 C ATOM 0 H ILE A 85 24.899 14.122 27.528 1.00 23.52 H new ATOM 0 HA ILE A 85 22.286 15.300 26.821 1.00 1.40 H new ATOM 0 HB ILE A 85 21.849 12.944 27.069 1.00 52.02 H new ATOM 0 HG12 ILE A 85 20.382 14.774 28.211 1.00 53.33 H new ATOM 0 HG13 ILE A 85 20.057 13.078 28.507 1.00 53.33 H new ATOM 0 HG21 ILE A 85 22.382 11.721 29.158 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.847 12.272 28.312 1.00 35.55 H new ATOM 0 HG23 ILE A 85 23.270 13.145 29.751 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.923 14.370 30.578 1.00 71.32 H new ATOM 0 HD12 ILE A 85 21.268 13.207 30.656 1.00 71.32 H new ATOM 0 HD13 ILE A 85 21.598 14.930 30.356 1.00 71.32 H new ATOM 1226 N GLY A 86 22.509 16.774 28.792 1.00 43.44 N ATOM 1227 CA GLY A 86 22.701 17.734 29.866 1.00 64.20 C ATOM 1228 C GLY A 86 21.430 18.506 30.153 1.00 43.21 C ATOM 1229 O GLY A 86 20.465 18.404 29.391 1.00 31.32 O ATOM 0 H GLY A 86 21.792 17.037 28.116 1.00 43.44 H new ATOM 0 HA2 GLY A 86 23.023 17.213 30.768 1.00 64.20 H new ATOM 0 HA3 GLY A 86 23.497 18.428 29.597 1.00 64.20 H new ATOM 1233 N PRO A 87 21.388 19.278 31.252 1.00 20.43 N ATOM 1234 CA PRO A 87 20.205 20.040 31.640 1.00 73.43 C ATOM 1235 C PRO A 87 20.044 21.310 30.804 1.00 33.24 C ATOM 1236 O PRO A 87 20.934 22.163 30.772 1.00 11.41 O ATOM 1237 CB PRO A 87 20.456 20.388 33.125 1.00 75.13 C ATOM 1238 CG PRO A 87 21.756 19.733 33.490 1.00 24.22 C ATOM 1239 CD PRO A 87 22.485 19.494 32.196 1.00 44.21 C ATOM 0 HA PRO A 87 19.286 19.475 31.483 1.00 73.43 H new ATOM 0 HB2 PRO A 87 20.509 21.467 33.269 1.00 75.13 H new ATOM 0 HB3 PRO A 87 19.645 20.022 33.754 1.00 75.13 H new ATOM 0 HG2 PRO A 87 22.340 20.371 34.154 1.00 24.22 H new ATOM 0 HG3 PRO A 87 21.584 18.795 34.019 1.00 24.22 H new ATOM 0 HD2 PRO A 87 23.102 20.347 31.914 1.00 44.21 H new ATOM 0 HD3 PRO A 87 23.146 18.629 32.256 1.00 44.21 H new ATOM 1247 N ASN A 88 18.914 21.419 30.119 1.00 50.13 N ATOM 1248 CA ASN A 88 18.604 22.597 29.318 1.00 62.23 C ATOM 1249 C ASN A 88 18.231 23.759 30.232 1.00 31.22 C ATOM 1250 O ASN A 88 17.706 23.546 31.328 1.00 11.01 O ATOM 1251 CB ASN A 88 17.449 22.300 28.355 1.00 63.43 C ATOM 1252 CG ASN A 88 17.167 23.451 27.399 1.00 21.32 C ATOM 1253 OD1 ASN A 88 16.355 24.329 27.685 1.00 63.22 O ATOM 1254 ND2 ASN A 88 17.842 23.460 26.262 1.00 22.41 N ATOM 0 H ASN A 88 18.191 20.700 30.102 1.00 50.13 H new ATOM 0 HA ASN A 88 19.485 22.866 28.734 1.00 62.23 H new ATOM 0 HB2 ASN A 88 17.683 21.405 27.779 1.00 63.43 H new ATOM 0 HB3 ASN A 88 16.549 22.083 28.930 1.00 63.43 H new ATOM 0 HD21 ASN A 88 17.697 24.212 25.589 1.00 22.41 H new ATOM 0 HD22 ASN A 88 18.508 22.715 26.058 1.00 22.41 H new ATOM 1261 N GLU A 89 18.482 24.980 29.767 1.00 43.32 N ATOM 1262 CA GLU A 89 18.205 26.190 30.546 1.00 2.23 C ATOM 1263 C GLU A 89 16.715 26.316 30.891 1.00 10.40 C ATOM 1264 O GLU A 89 16.329 27.130 31.731 1.00 74.31 O ATOM 1265 CB GLU A 89 18.687 27.426 29.773 1.00 13.04 C ATOM 1266 CG GLU A 89 18.115 27.532 28.363 1.00 64.14 C ATOM 1267 CD GLU A 89 18.667 28.719 27.591 1.00 35.31 C ATOM 1268 OE1 GLU A 89 19.756 28.592 26.987 1.00 70.11 O ATOM 1269 OE2 GLU A 89 18.013 29.783 27.572 1.00 74.23 O1- ATOM 0 H GLU A 89 18.881 25.161 28.846 1.00 43.32 H new ATOM 0 HA GLU A 89 18.749 26.119 31.488 1.00 2.23 H new ATOM 0 HB2 GLU A 89 18.417 28.321 30.333 1.00 13.04 H new ATOM 0 HB3 GLU A 89 19.775 27.404 29.713 1.00 13.04 H new ATOM 0 HG2 GLU A 89 18.335 26.615 27.817 1.00 64.14 H new ATOM 0 HG3 GLU A 89 17.030 27.615 28.421 1.00 64.14 H new ATOM 1276 N GLU A 90 15.886 25.515 30.228 1.00 62.24 N ATOM 1277 CA GLU A 90 14.451 25.470 30.508 1.00 33.11 C ATOM 1278 C GLU A 90 14.176 24.848 31.880 1.00 41.22 C ATOM 1279 O GLU A 90 13.179 25.163 32.533 1.00 23.51 O ATOM 1280 CB GLU A 90 13.728 24.661 29.421 1.00 62.35 C ATOM 1281 CG GLU A 90 12.247 24.437 29.704 1.00 2.12 C ATOM 1282 CD GLU A 90 11.548 23.622 28.629 1.00 32.41 C ATOM 1283 OE1 GLU A 90 10.965 24.224 27.702 1.00 34.55 O ATOM 1284 OE2 GLU A 90 11.573 22.374 28.712 1.00 15.02 O1- ATOM 0 H GLU A 90 16.185 24.882 29.486 1.00 62.24 H new ATOM 0 HA GLU A 90 14.076 26.493 30.512 1.00 33.11 H new ATOM 0 HB2 GLU A 90 13.832 25.178 28.467 1.00 62.35 H new ATOM 0 HB3 GLU A 90 14.218 23.693 29.315 1.00 62.35 H new ATOM 0 HG2 GLU A 90 12.140 23.929 30.663 1.00 2.12 H new ATOM 0 HG3 GLU A 90 11.752 25.403 29.798 1.00 2.12 H new ATOM 1291 N GLY A 91 15.083 23.985 32.320 1.00 4.53 N ATOM 1292 CA GLY A 91 14.864 23.211 33.531 1.00 50.31 C ATOM 1293 C GLY A 91 14.501 21.776 33.205 1.00 52.42 C ATOM 1294 O GLY A 91 13.684 21.154 33.886 1.00 50.31 O ATOM 0 H GLY A 91 15.974 23.805 31.857 1.00 4.53 H new ATOM 0 HA2 GLY A 91 15.764 23.231 34.146 1.00 50.31 H new ATOM 0 HA3 GLY A 91 14.066 23.667 34.118 1.00 50.31 H new ATOM 1298 N GLY A 92 15.101 21.261 32.137 1.00 31.10 N ATOM 1299 CA GLY A 92 14.853 19.895 31.707 1.00 44.24 C ATOM 1300 C GLY A 92 16.097 19.279 31.114 1.00 74.12 C ATOM 1301 O GLY A 92 17.199 19.748 31.385 1.00 42.22 O ATOM 0 H GLY A 92 15.763 21.773 31.554 1.00 31.10 H new ATOM 0 HA2 GLY A 92 14.517 19.299 32.555 1.00 44.24 H new ATOM 0 HA3 GLY A 92 14.050 19.882 30.970 1.00 44.24 H new ATOM 1305 N PHE A 93 15.937 18.239 30.305 1.00 65.13 N ATOM 1306 CA PHE A 93 17.077 17.597 29.650 1.00 72.25 C ATOM 1307 C PHE A 93 17.215 18.078 28.212 1.00 30.35 C ATOM 1308 O PHE A 93 16.261 18.595 27.626 1.00 35.35 O ATOM 1309 CB PHE A 93 16.936 16.069 29.663 1.00 70.53 C ATOM 1310 CG PHE A 93 16.879 15.466 31.042 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.865 14.583 31.384 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.842 15.778 31.994 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.809 14.024 32.643 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.789 15.221 33.258 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.770 14.342 33.583 1.00 12.34 C ATOM 0 H PHE A 93 15.033 17.821 30.085 1.00 65.13 H new ATOM 0 HA PHE A 93 17.971 17.873 30.209 1.00 72.25 H new ATOM 0 HB2 PHE A 93 16.031 15.794 29.121 1.00 70.53 H new ATOM 0 HB3 PHE A 93 17.776 15.633 29.123 1.00 70.53 H new ATOM 0 HD1 PHE A 93 15.110 14.330 30.655 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.639 16.462 31.744 1.00 64.21 H new ATOM 0 HE1 PHE A 93 15.014 13.338 32.894 1.00 2.11 H new ATOM 0 HE2 PHE A 93 18.542 15.471 33.991 1.00 3.04 H new ATOM 0 HZ PHE A 93 16.726 13.906 34.570 1.00 12.34 H new ATOM 1325 N ALA A 94 18.406 17.903 27.655 1.00 73.43 N ATOM 1326 CA ALA A 94 18.672 18.232 26.264 1.00 60.33 C ATOM 1327 C ALA A 94 19.767 17.326 25.715 1.00 65.32 C ATOM 1328 O ALA A 94 20.763 17.056 26.400 1.00 32.10 O ATOM 1329 CB ALA A 94 19.068 19.697 26.122 1.00 64.21 C ATOM 0 H ALA A 94 19.213 17.529 28.155 1.00 73.43 H new ATOM 0 HA ALA A 94 17.761 18.071 25.688 1.00 60.33 H new ATOM 0 HB1 ALA A 94 19.262 19.921 25.073 1.00 64.21 H new ATOM 0 HB2 ALA A 94 18.258 20.330 26.484 1.00 64.21 H new ATOM 0 HB3 ALA A 94 19.967 19.889 26.707 1.00 64.21 H new ATOM 1335 N LEU A 95 19.559 16.836 24.497 1.00 31.23 N ATOM 1336 CA LEU A 95 20.534 15.994 23.815 1.00 75.45 C ATOM 1337 C LEU A 95 21.372 16.831 22.855 1.00 41.42 C ATOM 1338 O LEU A 95 20.842 17.512 21.975 1.00 2.34 O ATOM 1339 CB LEU A 95 19.835 14.846 23.061 1.00 51.22 C ATOM 1340 CG LEU A 95 19.459 13.617 23.914 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.715 12.873 24.366 1.00 64.34 C ATOM 1342 CD2 LEU A 95 18.618 14.026 25.122 1.00 71.23 C ATOM 0 H LEU A 95 18.712 17.011 23.957 1.00 31.23 H new ATOM 0 HA LEU A 95 21.193 15.555 24.564 1.00 75.45 H new ATOM 0 HB2 LEU A 95 18.928 15.237 22.601 1.00 51.22 H new ATOM 0 HB3 LEU A 95 20.487 14.518 22.251 1.00 51.22 H new ATOM 0 HG LEU A 95 18.862 12.947 23.295 1.00 42.15 H new ATOM 0 HD11 LEU A 95 20.430 12.009 24.966 1.00 64.34 H new ATOM 0 HD12 LEU A 95 21.274 12.539 23.492 1.00 64.34 H new ATOM 0 HD13 LEU A 95 21.338 13.540 24.962 1.00 64.34 H new ATOM 0 HD21 LEU A 95 18.366 13.141 25.707 1.00 71.23 H new ATOM 0 HD22 LEU A 95 19.185 14.721 25.741 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.702 14.508 24.781 1.00 71.23 H new ATOM 1354 N ASP A 96 22.678 16.777 23.051 1.00 51.32 N ATOM 1355 CA ASP A 96 23.639 17.488 22.211 1.00 15.24 C ATOM 1356 C ASP A 96 24.415 16.486 21.377 1.00 33.43 C ATOM 1357 O ASP A 96 25.215 15.710 21.903 1.00 1.11 O ATOM 1358 CB ASP A 96 24.609 18.278 23.082 1.00 62.10 C ATOM 1359 CG ASP A 96 25.705 18.981 22.291 1.00 42.14 C ATOM 1360 OD1 ASP A 96 26.899 18.689 22.534 1.00 0.44 O ATOM 1361 OD2 ASP A 96 25.386 19.832 21.436 1.00 11.32 O1- ATOM 0 H ASP A 96 23.109 16.236 23.801 1.00 51.32 H new ATOM 0 HA ASP A 96 23.103 18.176 21.558 1.00 15.24 H new ATOM 0 HB2 ASP A 96 24.050 19.021 23.652 1.00 62.10 H new ATOM 0 HB3 ASP A 96 25.069 17.603 23.803 1.00 62.10 H new ATOM 1366 N VAL A 97 24.167 16.496 20.086 1.00 3.45 N ATOM 1367 CA VAL A 97 24.776 15.529 19.179 1.00 33.41 C ATOM 1368 C VAL A 97 25.826 16.199 18.303 1.00 35.23 C ATOM 1369 O VAL A 97 25.496 16.986 17.432 1.00 5.33 O ATOM 1370 CB VAL A 97 23.709 14.864 18.273 1.00 12.11 C ATOM 1371 CG1 VAL A 97 24.351 13.850 17.327 1.00 31.40 C ATOM 1372 CG2 VAL A 97 22.609 14.213 19.114 1.00 41.42 C ATOM 0 H VAL A 97 23.545 17.165 19.632 1.00 3.45 H new ATOM 0 HA VAL A 97 25.250 14.762 19.792 1.00 33.41 H new ATOM 0 HB VAL A 97 23.249 15.643 17.665 1.00 12.11 H new ATOM 0 HG11 VAL A 97 23.581 13.397 16.702 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.082 14.354 16.695 1.00 31.40 H new ATOM 0 HG13 VAL A 97 24.849 13.074 17.909 1.00 31.40 H new ATOM 0 HG21 VAL A 97 21.872 13.753 18.456 1.00 41.42 H new ATOM 0 HG22 VAL A 97 23.047 13.450 19.758 1.00 41.42 H new ATOM 0 HG23 VAL A 97 22.124 14.971 19.728 1.00 41.42 H new ATOM 1382 N GLU A 98 27.086 15.876 18.533 1.00 23.12 N ATOM 1383 CA GLU A 98 28.175 16.365 17.698 1.00 44.32 C ATOM 1384 C GLU A 98 28.557 15.302 16.679 1.00 21.31 C ATOM 1385 O GLU A 98 29.158 14.282 17.023 1.00 34.12 O ATOM 1386 CB GLU A 98 29.387 16.750 18.557 1.00 13.10 C ATOM 1387 CG GLU A 98 29.163 17.998 19.401 1.00 35.31 C ATOM 1388 CD GLU A 98 30.366 18.360 20.251 1.00 11.53 C ATOM 1389 OE1 GLU A 98 31.464 18.559 19.692 1.00 51.52 O ATOM 1390 OE2 GLU A 98 30.221 18.462 21.487 1.00 21.24 O1- ATOM 0 H GLU A 98 27.385 15.271 19.298 1.00 23.12 H new ATOM 0 HA GLU A 98 27.841 17.258 17.170 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.636 15.917 19.214 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.247 16.911 17.907 1.00 13.10 H new ATOM 0 HG2 GLU A 98 28.922 18.835 18.746 1.00 35.31 H new ATOM 0 HG3 GLU A 98 28.300 17.842 20.049 1.00 35.31 H new ATOM 1397 N LEU A 99 28.183 15.532 15.429 1.00 4.53 N ATOM 1398 CA LEU A 99 28.464 14.583 14.363 1.00 32.31 C ATOM 1399 C LEU A 99 29.769 14.959 13.665 1.00 52.01 C ATOM 1400 O LEU A 99 29.845 15.975 12.971 1.00 21.43 O ATOM 1401 CB LEU A 99 27.304 14.530 13.359 1.00 42.25 C ATOM 1402 CG LEU A 99 27.390 13.388 12.334 1.00 64.41 C ATOM 1403 CD1 LEU A 99 27.434 12.035 13.044 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.218 13.452 11.356 1.00 23.33 C ATOM 0 H LEU A 99 27.684 16.369 15.128 1.00 4.53 H new ATOM 0 HA LEU A 99 28.572 13.589 14.798 1.00 32.31 H new ATOM 0 HB2 LEU A 99 26.369 14.435 13.911 1.00 42.25 H new ATOM 0 HB3 LEU A 99 27.262 15.478 12.823 1.00 42.25 H new ATOM 0 HG LEU A 99 28.312 13.504 11.764 1.00 64.41 H new ATOM 0 HD11 LEU A 99 27.495 11.237 12.304 1.00 73.33 H new ATOM 0 HD12 LEU A 99 28.308 11.994 13.694 1.00 73.33 H new ATOM 0 HD13 LEU A 99 26.531 11.908 13.641 1.00 73.33 H new ATOM 0 HD21 LEU A 99 26.298 12.635 10.639 1.00 23.33 H new ATOM 0 HD22 LEU A 99 25.281 13.363 11.905 1.00 23.33 H new ATOM 0 HD23 LEU A 99 26.238 14.404 10.825 1.00 23.33 H new ATOM 1416 N ARG A 100 30.790 14.134 13.872 1.00 15.15 N ATOM 1417 CA ARG A 100 32.120 14.377 13.330 1.00 11.05 C ATOM 1418 C ARG A 100 32.341 13.549 12.070 1.00 44.33 C ATOM 1419 O ARG A 100 32.343 12.318 12.120 1.00 60.34 O ATOM 1420 CB ARG A 100 33.166 14.033 14.379 1.00 62.13 C ATOM 1421 CG ARG A 100 34.572 14.418 13.970 1.00 11.51 C ATOM 1422 CD ARG A 100 35.545 14.164 15.097 1.00 61.51 C ATOM 1423 NE ARG A 100 35.223 14.959 16.289 1.00 42.53 N ATOM 1424 CZ ARG A 100 36.066 15.180 17.300 1.00 32.53 C ATOM 1425 NH1 ARG A 100 37.298 14.690 17.269 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 35.672 15.893 18.346 1.00 1.52 N ATOM 0 H ARG A 100 30.717 13.277 14.421 1.00 15.15 H new ATOM 0 HA ARG A 100 32.210 15.431 13.066 1.00 11.05 H new ATOM 0 HB2 ARG A 100 32.915 14.538 15.312 1.00 62.13 H new ATOM 0 HB3 ARG A 100 33.133 12.962 14.578 1.00 62.13 H new ATOM 0 HG2 ARG A 100 34.869 13.847 13.091 1.00 11.51 H new ATOM 0 HG3 ARG A 100 34.599 15.471 13.690 1.00 11.51 H new ATOM 0 HD2 ARG A 100 35.535 13.105 15.354 1.00 61.51 H new ATOM 0 HD3 ARG A 100 36.556 14.401 14.764 1.00 61.51 H new ATOM 0 HE ARG A 100 34.292 15.370 16.348 1.00 42.53 H new ATOM 0 HH11 ARG A 100 37.608 14.139 16.468 1.00 73.43 H new ATOM 0 HH12 ARG A 100 37.936 14.864 18.046 1.00 73.43 H new ATOM 0 HH21 ARG A 100 34.726 16.272 18.378 1.00 1.52 H new ATOM 0 HH22 ARG A 100 36.315 16.063 19.119 1.00 1.52 H new ATOM 1440 N VAL A 101 32.537 14.229 10.943 1.00 42.14 N ATOM 1441 CA VAL A 101 32.638 13.562 9.648 1.00 72.23 C ATOM 1442 C VAL A 101 34.052 13.695 9.081 1.00 42.25 C ATOM 1443 O VAL A 101 34.419 14.756 8.585 1.00 41.22 O ATOM 1444 CB VAL A 101 31.628 14.180 8.651 1.00 14.41 C ATOM 1445 CG1 VAL A 101 31.616 13.406 7.340 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.229 14.243 9.268 1.00 42.30 C ATOM 0 H VAL A 101 32.629 15.244 10.901 1.00 42.14 H new ATOM 0 HA VAL A 101 32.411 12.506 9.791 1.00 72.23 H new ATOM 0 HB VAL A 101 31.945 15.200 8.432 1.00 14.41 H new ATOM 0 HG11 VAL A 101 30.899 13.860 6.656 1.00 25.41 H new ATOM 0 HG12 VAL A 101 32.610 13.432 6.893 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.331 12.371 7.531 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.534 14.681 8.551 1.00 42.30 H new ATOM 0 HG22 VAL A 101 29.899 13.236 9.525 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.256 14.857 10.168 1.00 42.30 H new ATOM 1456 N ALA A 102 34.842 12.622 9.149 1.00 43.12 N ATOM 1457 CA ALA A 102 36.251 12.682 8.750 1.00 40.03 C ATOM 1458 C ALA A 102 36.498 11.994 7.408 1.00 12.52 C ATOM 1459 O ALA A 102 36.579 10.765 7.332 1.00 73.10 O ATOM 1460 CB ALA A 102 37.133 12.060 9.833 1.00 44.05 C ATOM 0 H ALA A 102 34.534 11.706 9.474 1.00 43.12 H new ATOM 0 HA ALA A 102 36.512 13.733 8.630 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.177 12.110 9.525 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.003 12.607 10.767 1.00 44.05 H new ATOM 0 HB3 ALA A 102 36.848 11.018 9.980 1.00 44.05 H new ATOM 1466 N LEU A 103 36.627 12.800 6.355 1.00 73.31 N ATOM 1467 CA LEU A 103 36.991 12.295 5.028 1.00 63.24 C ATOM 1468 C LEU A 103 38.469 12.556 4.764 1.00 11.33 C ATOM 1469 O LEU A 103 38.965 13.658 5.013 1.00 24.41 O ATOM 1470 CB LEU A 103 36.159 12.949 3.909 1.00 41.13 C ATOM 1471 CG LEU A 103 34.724 12.426 3.722 1.00 32.24 C ATOM 1472 CD1 LEU A 103 34.708 10.924 3.509 1.00 55.32 C ATOM 1473 CD2 LEU A 103 33.837 12.824 4.895 1.00 41.41 C ATOM 0 H LEU A 103 36.485 13.809 6.394 1.00 73.31 H new ATOM 0 HA LEU A 103 36.785 11.225 5.022 1.00 63.24 H new ATOM 0 HB2 LEU A 103 36.108 14.020 4.104 1.00 41.13 H new ATOM 0 HB3 LEU A 103 36.694 12.821 2.968 1.00 41.13 H new ATOM 0 HG LEU A 103 34.318 12.891 2.824 1.00 32.24 H new ATOM 0 HD11 LEU A 103 33.680 10.586 3.380 1.00 55.32 H new ATOM 0 HD12 LEU A 103 35.286 10.677 2.618 1.00 55.32 H new ATOM 0 HD13 LEU A 103 35.147 10.429 4.375 1.00 55.32 H new ATOM 0 HD21 LEU A 103 32.829 12.441 4.735 1.00 41.41 H new ATOM 0 HD22 LEU A 103 34.243 12.406 5.816 1.00 41.41 H new ATOM 0 HD23 LEU A 103 33.804 13.911 4.974 1.00 41.41 H new ATOM 1485 N PRO A 104 39.191 11.544 4.262 1.00 73.52 N ATOM 1486 CA PRO A 104 40.602 11.678 3.915 1.00 62.42 C ATOM 1487 C PRO A 104 40.797 12.433 2.609 1.00 45.15 C ATOM 1488 O PRO A 104 39.961 12.368 1.706 1.00 0.45 O ATOM 1489 CB PRO A 104 41.068 10.232 3.781 1.00 24.31 C ATOM 1490 CG PRO A 104 39.854 9.478 3.364 1.00 63.40 C ATOM 1491 CD PRO A 104 38.688 10.182 4.012 1.00 45.41 C ATOM 0 HA PRO A 104 41.161 12.248 4.658 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.864 10.140 3.042 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.463 9.855 4.724 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.752 9.471 2.279 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.910 8.438 3.686 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.815 10.192 3.360 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.389 9.690 4.938 1.00 45.41 H new ATOM 1499 N GLY A 105 41.908 13.146 2.528 1.00 54.45 N ATOM 1500 CA GLY A 105 42.211 13.941 1.350 1.00 13.33 C ATOM 1501 C GLY A 105 41.217 15.075 1.129 1.00 43.42 C ATOM 1502 O GLY A 105 41.169 15.666 0.045 1.00 1.41 O ATOM 0 H GLY A 105 42.614 13.191 3.263 1.00 54.45 H new ATOM 0 HA2 GLY A 105 43.214 14.357 1.447 1.00 13.33 H new ATOM 0 HA3 GLY A 105 42.217 13.294 0.473 1.00 13.33 H new ATOM 1506 N LEU A 106 40.421 15.379 2.149 1.00 4.51 N ATOM 1507 CA LEU A 106 39.406 16.428 2.057 1.00 40.14 C ATOM 1508 C LEU A 106 39.680 17.532 3.071 1.00 43.11 C ATOM 1509 O LEU A 106 40.066 17.264 4.215 1.00 42.33 O ATOM 1510 CB LEU A 106 38.003 15.831 2.267 1.00 65.03 C ATOM 1511 CG LEU A 106 36.852 16.844 2.415 1.00 43.51 C ATOM 1512 CD1 LEU A 106 36.738 17.734 1.183 1.00 44.14 C ATOM 1513 CD2 LEU A 106 35.530 16.124 2.677 1.00 41.21 C ATOM 0 H LEU A 106 40.458 14.912 3.055 1.00 4.51 H new ATOM 0 HA LEU A 106 39.450 16.867 1.060 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.779 15.177 1.424 1.00 65.03 H new ATOM 0 HB3 LEU A 106 38.026 15.205 3.159 1.00 65.03 H new ATOM 0 HG LEU A 106 37.077 17.480 3.271 1.00 43.51 H new ATOM 0 HD11 LEU A 106 35.917 18.438 1.318 1.00 44.14 H new ATOM 0 HD12 LEU A 106 37.669 18.284 1.044 1.00 44.14 H new ATOM 0 HD13 LEU A 106 36.547 17.117 0.305 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.730 16.857 2.778 1.00 41.21 H new ATOM 0 HD22 LEU A 106 35.307 15.457 1.844 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.608 15.543 3.596 1.00 41.21 H new ATOM 1525 N ASP A 107 39.494 18.774 2.637 1.00 72.42 N ATOM 1526 CA ASP A 107 39.683 19.937 3.502 1.00 14.02 C ATOM 1527 C ASP A 107 38.510 20.086 4.439 1.00 1.12 C ATOM 1528 O ASP A 107 37.425 19.579 4.170 1.00 10.24 O ATOM 1529 CB ASP A 107 39.774 21.234 2.695 1.00 13.35 C ATOM 1530 CG ASP A 107 40.755 22.226 3.296 1.00 12.43 C ATOM 1531 OD1 ASP A 107 41.937 22.235 2.888 1.00 14.01 O ATOM 1532 OD2 ASP A 107 40.346 22.997 4.189 1.00 2.52 O1- ATOM 0 H ASP A 107 39.210 19.004 1.685 1.00 72.42 H new ATOM 0 HA ASP A 107 40.612 19.772 4.048 1.00 14.02 H new ATOM 0 HB2 ASP A 107 40.077 21.002 1.674 1.00 13.35 H new ATOM 0 HB3 ASP A 107 38.787 21.693 2.639 1.00 13.35 H new ATOM 1537 N ALA A 108 38.723 20.834 5.500 1.00 41.30 N ATOM 1538 CA ALA A 108 37.648 21.242 6.375 1.00 54.32 C ATOM 1539 C ALA A 108 36.735 22.217 5.644 1.00 74.35 C ATOM 1540 O ALA A 108 35.513 22.097 5.702 1.00 33.14 O ATOM 1541 CB ALA A 108 38.229 21.893 7.612 1.00 73.33 C ATOM 0 H ALA A 108 39.643 21.175 5.779 1.00 41.30 H new ATOM 0 HA ALA A 108 37.064 20.371 6.672 1.00 54.32 H new ATOM 0 HB1 ALA A 108 37.420 22.202 8.274 1.00 73.33 H new ATOM 0 HB2 ALA A 108 38.871 21.181 8.131 1.00 73.33 H new ATOM 0 HB3 ALA A 108 38.815 22.766 7.323 1.00 73.33 H new ATOM 1547 N ALA A 109 37.347 23.160 4.930 1.00 23.13 N ATOM 1548 CA ALA A 109 36.608 24.191 4.205 1.00 64.13 C ATOM 1549 C ALA A 109 35.637 23.564 3.209 1.00 31.24 C ATOM 1550 O ALA A 109 34.446 23.885 3.195 1.00 41.21 O ATOM 1551 CB ALA A 109 37.576 25.129 3.495 1.00 33.23 C ATOM 0 H ALA A 109 38.360 23.231 4.838 1.00 23.13 H new ATOM 0 HA ALA A 109 36.026 24.769 4.923 1.00 64.13 H new ATOM 0 HB1 ALA A 109 37.014 25.893 2.958 1.00 33.23 H new ATOM 0 HB2 ALA A 109 38.226 25.605 4.229 1.00 33.23 H new ATOM 0 HB3 ALA A 109 38.182 24.561 2.789 1.00 33.23 H new ATOM 1557 N ALA A 110 36.153 22.653 2.388 1.00 73.25 N ATOM 1558 CA ALA A 110 35.330 21.965 1.402 1.00 12.34 C ATOM 1559 C ALA A 110 34.344 21.037 2.102 1.00 44.05 C ATOM 1560 O ALA A 110 33.161 20.982 1.750 1.00 34.04 O ATOM 1561 CB ALA A 110 36.204 21.188 0.423 1.00 53.00 C ATOM 0 H ALA A 110 37.135 22.376 2.387 1.00 73.25 H new ATOM 0 HA ALA A 110 34.767 22.706 0.835 1.00 12.34 H new ATOM 0 HB1 ALA A 110 35.572 20.681 -0.306 1.00 53.00 H new ATOM 0 HB2 ALA A 110 36.873 21.877 -0.094 1.00 53.00 H new ATOM 0 HB3 ALA A 110 36.793 20.450 0.968 1.00 53.00 H new ATOM 1567 N ALA A 111 34.839 20.321 3.111 1.00 5.14 N ATOM 1568 CA ALA A 111 34.004 19.410 3.893 1.00 43.54 C ATOM 1569 C ALA A 111 32.785 20.125 4.483 1.00 4.44 C ATOM 1570 O ALA A 111 31.710 19.539 4.573 1.00 54.13 O ATOM 1571 CB ALA A 111 34.818 18.747 4.994 1.00 13.31 C ATOM 0 H ALA A 111 35.815 20.354 3.406 1.00 5.14 H new ATOM 0 HA ALA A 111 33.638 18.638 3.216 1.00 43.54 H new ATOM 0 HB1 ALA A 111 34.178 18.073 5.564 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.637 18.181 4.550 1.00 13.31 H new ATOM 0 HB3 ALA A 111 35.223 19.511 5.658 1.00 13.31 H new ATOM 1577 N LYS A 112 32.956 21.390 4.870 1.00 1.14 N ATOM 1578 CA LYS A 112 31.853 22.185 5.418 1.00 13.13 C ATOM 1579 C LYS A 112 30.639 22.153 4.492 1.00 74.23 C ATOM 1580 O LYS A 112 29.510 21.969 4.947 1.00 4.50 O ATOM 1581 CB LYS A 112 32.277 23.644 5.644 1.00 13.05 C ATOM 1582 CG LYS A 112 33.263 23.840 6.789 1.00 32.13 C ATOM 1583 CD LYS A 112 33.664 25.305 6.935 1.00 10.41 C ATOM 1584 CE LYS A 112 34.697 25.502 8.036 1.00 22.11 C ATOM 1585 NZ LYS A 112 34.180 25.096 9.369 1.00 2.23 N1+ ATOM 0 H LYS A 112 33.845 21.886 4.815 1.00 1.14 H new ATOM 0 HA LYS A 112 31.584 21.740 6.376 1.00 13.13 H new ATOM 0 HB2 LYS A 112 32.723 24.027 4.726 1.00 13.05 H new ATOM 0 HB3 LYS A 112 31.387 24.243 5.840 1.00 13.05 H new ATOM 0 HG2 LYS A 112 32.817 23.489 7.719 1.00 32.13 H new ATOM 0 HG3 LYS A 112 34.152 23.234 6.613 1.00 32.13 H new ATOM 0 HD2 LYS A 112 34.067 25.667 5.989 1.00 10.41 H new ATOM 0 HD3 LYS A 112 32.780 25.904 7.155 1.00 10.41 H new ATOM 0 HE2 LYS A 112 35.590 24.922 7.802 1.00 22.11 H new ATOM 0 HE3 LYS A 112 34.997 26.550 8.068 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 34.854 25.387 10.106 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 33.262 25.554 9.539 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 34.062 24.063 9.396 1.00 2.23 H new ATOM 1599 N THR A 113 30.877 22.337 3.197 1.00 31.43 N ATOM 1600 CA THR A 113 29.790 22.381 2.228 1.00 60.21 C ATOM 1601 C THR A 113 29.364 20.964 1.833 1.00 74.22 C ATOM 1602 O THR A 113 28.175 20.694 1.659 1.00 73.22 O ATOM 1603 CB THR A 113 30.174 23.197 0.962 1.00 31.33 C ATOM 1604 OG1 THR A 113 28.995 23.701 0.308 1.00 10.35 O ATOM 1605 CG2 THR A 113 30.960 22.353 -0.030 1.00 32.43 C ATOM 0 H THR A 113 31.808 22.457 2.797 1.00 31.43 H new ATOM 0 HA THR A 113 28.951 22.886 2.706 1.00 60.21 H new ATOM 0 HB THR A 113 30.799 24.026 1.294 1.00 31.33 H new ATOM 0 HG1 THR A 113 29.255 24.213 -0.486 1.00 10.35 H new ATOM 0 HG21 THR A 113 31.211 22.956 -0.902 1.00 32.43 H new ATOM 0 HG22 THR A 113 31.876 21.997 0.441 1.00 32.43 H new ATOM 0 HG23 THR A 113 30.357 21.500 -0.340 1.00 32.43 H new ATOM 1613 N LEU A 114 30.339 20.060 1.710 1.00 23.12 N ATOM 1614 CA LEU A 114 30.061 18.684 1.295 1.00 20.51 C ATOM 1615 C LEU A 114 29.174 17.984 2.319 1.00 41.04 C ATOM 1616 O LEU A 114 28.144 17.399 1.972 1.00 13.34 O ATOM 1617 CB LEU A 114 31.364 17.894 1.090 1.00 61.01 C ATOM 1618 CG LEU A 114 32.323 18.464 0.030 1.00 11.45 C ATOM 1619 CD1 LEU A 114 33.483 17.504 -0.227 1.00 1.51 C ATOM 1620 CD2 LEU A 114 31.578 18.780 -1.267 1.00 50.51 C ATOM 0 H LEU A 114 31.324 20.255 1.891 1.00 23.12 H new ATOM 0 HA LEU A 114 29.533 18.722 0.342 1.00 20.51 H new ATOM 0 HB2 LEU A 114 31.892 17.843 2.042 1.00 61.01 H new ATOM 0 HB3 LEU A 114 31.109 16.871 0.812 1.00 61.01 H new ATOM 0 HG LEU A 114 32.736 19.396 0.416 1.00 11.45 H new ATOM 0 HD11 LEU A 114 34.147 17.929 -0.980 1.00 1.51 H new ATOM 0 HD12 LEU A 114 34.037 17.347 0.698 1.00 1.51 H new ATOM 0 HD13 LEU A 114 33.094 16.550 -0.583 1.00 1.51 H new ATOM 0 HD21 LEU A 114 32.278 19.181 -2.000 1.00 50.51 H new ATOM 0 HD22 LEU A 114 31.126 17.869 -1.658 1.00 50.51 H new ATOM 0 HD23 LEU A 114 30.798 19.516 -1.069 1.00 50.51 H new ATOM 1632 N VAL A 115 29.569 18.069 3.583 1.00 72.22 N ATOM 1633 CA VAL A 115 28.805 17.476 4.670 1.00 32.34 C ATOM 1634 C VAL A 115 27.454 18.169 4.799 1.00 1.13 C ATOM 1635 O VAL A 115 26.462 17.536 5.142 1.00 25.22 O ATOM 1636 CB VAL A 115 29.565 17.554 6.020 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.715 17.002 7.167 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.895 16.807 5.932 1.00 35.24 C ATOM 0 H VAL A 115 30.420 18.546 3.880 1.00 72.22 H new ATOM 0 HA VAL A 115 28.657 16.423 4.430 1.00 32.34 H new ATOM 0 HB VAL A 115 29.769 18.604 6.228 1.00 63.01 H new ATOM 0 HG11 VAL A 115 29.275 17.070 8.100 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.797 17.583 7.251 1.00 14.41 H new ATOM 0 HG13 VAL A 115 28.468 15.959 6.968 1.00 14.41 H new ATOM 0 HG21 VAL A 115 31.413 16.873 6.889 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.709 15.760 5.692 1.00 35.24 H new ATOM 0 HG23 VAL A 115 31.513 17.254 5.153 1.00 35.24 H new ATOM 1648 N ASP A 116 27.419 19.466 4.502 1.00 34.11 N ATOM 1649 CA ASP A 116 26.180 20.241 4.577 1.00 22.44 C ATOM 1650 C ASP A 116 25.130 19.683 3.621 1.00 4.20 C ATOM 1651 O ASP A 116 24.052 19.249 4.044 1.00 63.50 O ATOM 1652 CB ASP A 116 26.430 21.714 4.238 1.00 1.42 C ATOM 1653 CG ASP A 116 25.150 22.539 4.307 1.00 43.12 C ATOM 1654 OD1 ASP A 116 24.841 23.252 3.328 1.00 62.34 O ATOM 1655 OD2 ASP A 116 24.427 22.448 5.324 1.00 50.12 O1- ATOM 0 H ASP A 116 28.234 20.004 4.207 1.00 34.11 H new ATOM 0 HA ASP A 116 25.814 20.166 5.601 1.00 22.44 H new ATOM 0 HB2 ASP A 116 27.165 22.126 4.930 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.857 21.789 3.238 1.00 1.42 H new ATOM 1660 N ARG A 117 25.462 19.698 2.331 1.00 43.12 N ATOM 1661 CA ARG A 117 24.553 19.237 1.288 1.00 25.23 C ATOM 1662 C ARG A 117 24.225 17.758 1.472 1.00 51.42 C ATOM 1663 O ARG A 117 23.073 17.341 1.319 1.00 42.42 O ATOM 1664 CB ARG A 117 25.168 19.501 -0.094 1.00 4.30 C ATOM 1665 CG ARG A 117 26.565 18.918 -0.268 1.00 3.24 C ATOM 1666 CD ARG A 117 27.249 19.444 -1.521 1.00 12.41 C ATOM 1667 NE ARG A 117 26.576 18.995 -2.741 1.00 15.40 N ATOM 1668 CZ ARG A 117 26.628 19.634 -3.910 1.00 54.12 C ATOM 1669 NH1 ARG A 117 27.291 20.778 -4.023 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 26.003 19.127 -4.960 1.00 65.24 N ATOM 0 H ARG A 117 26.362 20.028 1.983 1.00 43.12 H new ATOM 0 HA ARG A 117 23.618 19.793 1.362 1.00 25.23 H new ATOM 0 HB2 ARG A 117 24.513 19.084 -0.859 1.00 4.30 H new ATOM 0 HB3 ARG A 117 25.210 20.577 -0.263 1.00 4.30 H new ATOM 0 HG2 ARG A 117 27.171 19.161 0.605 1.00 3.24 H new ATOM 0 HG3 ARG A 117 26.501 17.831 -0.319 1.00 3.24 H new ATOM 0 HD2 ARG A 117 27.265 20.534 -1.495 1.00 12.41 H new ATOM 0 HD3 ARG A 117 28.287 19.110 -1.535 1.00 12.41 H new ATOM 0 HE ARG A 117 26.030 18.135 -2.694 1.00 15.40 H new ATOM 0 HH11 ARG A 117 27.766 21.175 -3.212 1.00 44.31 H new ATOM 0 HH12 ARG A 117 27.326 21.261 -4.921 1.00 44.31 H new ATOM 0 HH21 ARG A 117 25.485 18.252 -4.872 1.00 65.24 H new ATOM 0 HH22 ARG A 117 26.039 19.611 -5.857 1.00 65.24 H new ATOM 1684 N ALA A 118 25.238 16.970 1.825 1.00 40.10 N ATOM 1685 CA ALA A 118 25.043 15.550 2.109 1.00 45.33 C ATOM 1686 C ALA A 118 24.061 15.377 3.268 1.00 63.41 C ATOM 1687 O ALA A 118 23.136 14.569 3.205 1.00 0.11 O ATOM 1688 CB ALA A 118 26.376 14.883 2.430 1.00 44.02 C ATOM 0 H ALA A 118 26.202 17.290 1.921 1.00 40.10 H new ATOM 0 HA ALA A 118 24.626 15.069 1.225 1.00 45.33 H new ATOM 0 HB1 ALA A 118 26.213 13.826 2.639 1.00 44.02 H new ATOM 0 HB2 ALA A 118 27.048 14.985 1.578 1.00 44.02 H new ATOM 0 HB3 ALA A 118 26.821 15.361 3.303 1.00 44.02 H new ATOM 1694 N HIS A 119 24.254 16.184 4.307 1.00 52.13 N ATOM 1695 CA HIS A 119 23.416 16.151 5.504 1.00 15.33 C ATOM 1696 C HIS A 119 22.104 16.904 5.262 1.00 0.40 C ATOM 1697 O HIS A 119 21.361 17.199 6.201 1.00 63.33 O ATOM 1698 CB HIS A 119 24.190 16.778 6.673 1.00 54.45 C ATOM 1699 CG HIS A 119 23.589 16.561 8.025 1.00 21.21 C ATOM 1700 ND1 HIS A 119 22.812 17.501 8.663 1.00 2.34 N ATOM 1701 CD2 HIS A 119 23.705 15.526 8.888 1.00 20.34 C ATOM 1702 CE1 HIS A 119 22.482 17.055 9.859 1.00 52.23 C ATOM 1703 NE2 HIS A 119 23.008 15.857 10.021 1.00 74.13 N ATOM 0 H HIS A 119 24.997 16.881 4.344 1.00 52.13 H new ATOM 0 HA HIS A 119 23.168 15.117 5.746 1.00 15.33 H new ATOM 0 HB2 HIS A 119 25.203 16.375 6.675 1.00 54.45 H new ATOM 0 HB3 HIS A 119 24.274 17.851 6.498 1.00 54.45 H new ATOM 0 HD2 HIS A 119 24.247 14.608 8.716 1.00 20.34 H new ATOM 0 HE1 HIS A 119 21.881 17.583 10.585 1.00 52.23 H new ATOM 0 HE2 HIS A 119 22.912 15.273 10.852 1.00 74.13 H new ATOM 1712 N HIS A 120 21.854 17.263 4.003 1.00 43.52 N ATOM 1713 CA HIS A 120 20.586 17.863 3.596 1.00 31.45 C ATOM 1714 C HIS A 120 19.784 16.864 2.765 1.00 61.14 C ATOM 1715 O HIS A 120 18.574 16.726 2.943 1.00 43.11 O ATOM 1716 CB HIS A 120 20.829 19.145 2.781 1.00 2.24 C ATOM 1717 CG HIS A 120 19.591 19.965 2.543 1.00 45.12 C ATOM 1718 ND1 HIS A 120 19.449 21.258 2.999 1.00 44.32 N ATOM 1719 CD2 HIS A 120 18.438 19.676 1.888 1.00 50.50 C ATOM 1720 CE1 HIS A 120 18.268 21.724 2.640 1.00 65.24 C ATOM 1721 NE2 HIS A 120 17.633 20.785 1.967 1.00 75.14 N ATOM 0 H HIS A 120 22.522 17.146 3.241 1.00 43.52 H new ATOM 0 HA HIS A 120 20.022 18.124 4.492 1.00 31.45 H new ATOM 0 HB2 HIS A 120 21.564 19.759 3.301 1.00 2.24 H new ATOM 0 HB3 HIS A 120 21.263 18.874 1.819 1.00 2.24 H new ATOM 0 HD2 HIS A 120 18.198 18.745 1.396 1.00 50.50 H new ATOM 0 HE1 HIS A 120 17.886 22.710 2.861 1.00 65.24 H new ATOM 0 HE2 HIS A 120 16.697 20.869 1.570 1.00 75.14 H new ATOM 1730 N VAL A 121 20.474 16.172 1.856 1.00 33.11 N ATOM 1731 CA VAL A 121 19.826 15.256 0.916 1.00 23.21 C ATOM 1732 C VAL A 121 19.568 13.881 1.538 1.00 3.02 C ATOM 1733 O VAL A 121 18.570 13.231 1.216 1.00 30.52 O ATOM 1734 CB VAL A 121 20.660 15.089 -0.383 1.00 61.42 C ATOM 1735 CG1 VAL A 121 20.812 16.429 -1.100 1.00 74.54 C ATOM 1736 CG2 VAL A 121 22.028 14.472 -0.085 1.00 44.31 C ATOM 0 H VAL A 121 21.487 16.230 1.751 1.00 33.11 H new ATOM 0 HA VAL A 121 18.865 15.706 0.665 1.00 23.21 H new ATOM 0 HB VAL A 121 20.124 14.406 -1.043 1.00 61.42 H new ATOM 0 HG11 VAL A 121 21.399 16.291 -2.008 1.00 74.54 H new ATOM 0 HG12 VAL A 121 19.827 16.816 -1.360 1.00 74.54 H new ATOM 0 HG13 VAL A 121 21.318 17.137 -0.444 1.00 74.54 H new ATOM 0 HG21 VAL A 121 22.590 14.367 -1.013 1.00 44.31 H new ATOM 0 HG22 VAL A 121 22.577 15.118 0.600 1.00 44.31 H new ATOM 0 HG23 VAL A 121 21.893 13.491 0.370 1.00 44.31 H new ATOM 1746 N CYS A 122 20.465 13.441 2.420 1.00 31.44 N ATOM 1747 CA CYS A 122 20.315 12.148 3.090 1.00 53.14 C ATOM 1748 C CYS A 122 19.128 12.177 4.058 1.00 23.34 C ATOM 1749 O CYS A 122 18.807 13.226 4.614 1.00 24.32 O ATOM 1750 CB CYS A 122 21.603 11.784 3.840 1.00 50.43 C ATOM 1751 SG CYS A 122 23.042 11.557 2.770 1.00 72.12 S ATOM 0 H CYS A 122 21.302 13.959 2.687 1.00 31.44 H new ATOM 0 HA CYS A 122 20.124 11.388 2.332 1.00 53.14 H new ATOM 0 HB2 CYS A 122 21.823 12.568 4.564 1.00 50.43 H new ATOM 0 HB3 CYS A 122 21.435 10.867 4.404 1.00 50.43 H new ATOM 0 HG CYS A 122 23.608 12.707 2.553 1.00 72.12 H new ATOM 1757 N PRO A 123 18.460 11.021 4.270 1.00 50.40 N ATOM 1758 CA PRO A 123 17.289 10.934 5.155 1.00 60.03 C ATOM 1759 C PRO A 123 17.641 11.204 6.624 1.00 74.45 C ATOM 1760 O PRO A 123 18.819 11.294 6.986 1.00 30.15 O ATOM 1761 CB PRO A 123 16.799 9.488 4.963 1.00 24.23 C ATOM 1762 CG PRO A 123 18.001 8.738 4.497 1.00 34.14 C ATOM 1763 CD PRO A 123 18.794 9.713 3.669 1.00 45.03 C ATOM 0 HA PRO A 123 16.537 11.683 4.910 1.00 60.03 H new ATOM 0 HB2 PRO A 123 16.411 9.075 5.894 1.00 24.23 H new ATOM 0 HB3 PRO A 123 15.993 9.437 4.231 1.00 24.23 H new ATOM 0 HG2 PRO A 123 18.587 8.374 5.341 1.00 34.14 H new ATOM 0 HG3 PRO A 123 17.715 7.867 3.908 1.00 34.14 H new ATOM 0 HD2 PRO A 123 19.863 9.508 3.721 1.00 45.03 H new ATOM 0 HD3 PRO A 123 18.512 9.670 2.617 1.00 45.03 H new ATOM 1771 N TYR A 124 16.600 11.322 7.461 1.00 53.44 N ATOM 1772 CA TYR A 124 16.741 11.663 8.885 1.00 1.24 C ATOM 1773 C TYR A 124 17.232 13.112 9.028 1.00 42.34 C ATOM 1774 O TYR A 124 17.451 13.596 10.134 1.00 23.13 O ATOM 1775 CB TYR A 124 17.704 10.692 9.618 1.00 65.44 C ATOM 1776 CG TYR A 124 17.272 9.222 9.617 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.060 8.518 10.809 1.00 42.12 C ATOM 1778 CD2 TYR A 124 17.083 8.533 8.420 1.00 13.25 C ATOM 1779 CE1 TYR A 124 16.678 7.191 10.793 1.00 14.31 C ATOM 1780 CE2 TYR A 124 16.700 7.206 8.404 1.00 12.12 C ATOM 1781 CZ TYR A 124 16.500 6.540 9.593 1.00 5.42 C ATOM 1782 OH TYR A 124 16.116 5.217 9.582 1.00 60.35 O ATOM 0 H TYR A 124 15.633 11.183 7.169 1.00 53.44 H new ATOM 0 HA TYR A 124 15.761 11.564 9.352 1.00 1.24 H new ATOM 0 HB2 TYR A 124 18.689 10.765 9.157 1.00 65.44 H new ATOM 0 HB3 TYR A 124 17.811 11.022 10.651 1.00 65.44 H new ATOM 0 HD1 TYR A 124 17.197 9.021 11.755 1.00 42.12 H new ATOM 0 HD2 TYR A 124 17.240 9.048 7.484 1.00 13.25 H new ATOM 0 HE1 TYR A 124 16.519 6.664 11.722 1.00 14.31 H new ATOM 0 HE2 TYR A 124 16.558 6.693 7.464 1.00 12.12 H new ATOM 0 HH TYR A 124 15.663 5.001 10.424 1.00 60.35 H new ATOM 1792 N SER A 125 17.338 13.801 7.888 1.00 23.21 N ATOM 1793 CA SER A 125 17.988 15.110 7.786 1.00 62.44 C ATOM 1794 C SER A 125 17.343 16.158 8.694 1.00 2.13 C ATOM 1795 O SER A 125 18.015 16.789 9.515 1.00 5.11 O ATOM 1796 CB SER A 125 17.946 15.591 6.326 1.00 61.32 C ATOM 1797 OG SER A 125 18.508 16.886 6.176 1.00 44.54 O ATOM 0 H SER A 125 16.970 13.461 6.999 1.00 23.21 H new ATOM 0 HA SER A 125 19.020 14.989 8.117 1.00 62.44 H new ATOM 0 HB2 SER A 125 18.488 14.886 5.696 1.00 61.32 H new ATOM 0 HB3 SER A 125 16.913 15.601 5.977 1.00 61.32 H new ATOM 0 HG SER A 125 19.485 16.826 6.223 1.00 44.54 H new ATOM 1803 N ASN A 126 16.039 16.321 8.569 1.00 23.44 N ATOM 1804 CA ASN A 126 15.341 17.428 9.219 1.00 73.42 C ATOM 1805 C ASN A 126 15.325 17.223 10.727 1.00 24.25 C ATOM 1806 O ASN A 126 15.469 18.172 11.503 1.00 64.13 O ATOM 1807 CB ASN A 126 13.912 17.573 8.670 1.00 54.23 C ATOM 1808 CG ASN A 126 13.043 16.352 8.929 1.00 23.41 C ATOM 1809 OD1 ASN A 126 13.538 15.232 9.044 1.00 4.50 O ATOM 1810 ND2 ASN A 126 11.738 16.561 9.011 1.00 5.31 N ATOM 0 H ASN A 126 15.437 15.704 8.024 1.00 23.44 H new ATOM 0 HA ASN A 126 15.876 18.352 9.000 1.00 73.42 H new ATOM 0 HB2 ASN A 126 13.443 18.447 9.122 1.00 54.23 H new ATOM 0 HB3 ASN A 126 13.959 17.756 7.597 1.00 54.23 H new ATOM 0 HD21 ASN A 126 11.105 15.778 9.175 1.00 5.31 H new ATOM 0 HD22 ASN A 126 11.365 17.505 8.910 1.00 5.31 H new ATOM 1817 N ALA A 127 15.203 15.969 11.129 1.00 54.04 N ATOM 1818 CA ALA A 127 15.172 15.601 12.538 1.00 54.10 C ATOM 1819 C ALA A 127 16.576 15.484 13.109 1.00 52.15 C ATOM 1820 O ALA A 127 16.754 15.096 14.261 1.00 1.24 O ATOM 1821 CB ALA A 127 14.440 14.285 12.712 1.00 41.33 C ATOM 0 H ALA A 127 15.123 15.177 10.491 1.00 54.04 H new ATOM 0 HA ALA A 127 14.647 16.388 13.080 1.00 54.10 H new ATOM 0 HB1 ALA A 127 14.421 14.016 13.768 1.00 41.33 H new ATOM 0 HB2 ALA A 127 13.419 14.385 12.344 1.00 41.33 H new ATOM 0 HB3 ALA A 127 14.953 13.506 12.149 1.00 41.33 H new ATOM 1827 N THR A 128 17.575 15.829 12.309 1.00 1.20 N ATOM 1828 CA THR A 128 18.961 15.660 12.719 1.00 2.03 C ATOM 1829 C THR A 128 19.748 16.954 12.514 1.00 41.31 C ATOM 1830 O THR A 128 20.977 16.965 12.568 1.00 64.41 O ATOM 1831 CB THR A 128 19.623 14.477 11.962 1.00 53.22 C ATOM 1832 OG1 THR A 128 20.735 13.966 12.711 1.00 44.43 O ATOM 1833 CG2 THR A 128 20.108 14.882 10.577 1.00 73.21 C ATOM 0 H THR A 128 17.453 16.226 11.377 1.00 1.20 H new ATOM 0 HA THR A 128 18.974 15.423 13.783 1.00 2.03 H new ATOM 0 HB THR A 128 18.859 13.708 11.848 1.00 53.22 H new ATOM 0 HG1 THR A 128 20.578 13.023 12.928 1.00 44.43 H new ATOM 0 HG21 THR A 128 20.564 14.023 10.085 1.00 73.21 H new ATOM 0 HG22 THR A 128 19.264 15.234 9.984 1.00 73.21 H new ATOM 0 HG23 THR A 128 20.844 15.680 10.668 1.00 73.21 H new ATOM 1841 N ARG A 129 19.035 18.047 12.241 1.00 15.30 N ATOM 1842 CA ARG A 129 19.643 19.359 12.218 1.00 1.24 C ATOM 1843 C ARG A 129 18.624 20.448 12.544 1.00 21.22 C ATOM 1844 O ARG A 129 18.911 21.376 13.298 1.00 60.25 O ATOM 1845 CB ARG A 129 20.253 19.609 10.845 1.00 61.34 C ATOM 1846 CG ARG A 129 19.264 19.490 9.695 1.00 45.30 C ATOM 1847 CD ARG A 129 19.961 19.501 8.345 1.00 1.10 C ATOM 1848 NE ARG A 129 20.768 20.712 8.150 1.00 10.14 N ATOM 1849 CZ ARG A 129 21.648 20.885 7.158 1.00 72.04 C ATOM 1850 NH1 ARG A 129 21.831 19.936 6.242 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 22.344 22.013 7.081 1.00 55.55 N ATOM 0 H ARG A 129 18.036 18.040 12.034 1.00 15.30 H new ATOM 0 HA ARG A 129 20.422 19.393 12.980 1.00 1.24 H new ATOM 0 HB2 ARG A 129 20.692 20.606 10.831 1.00 61.34 H new ATOM 0 HB3 ARG A 129 21.066 18.900 10.686 1.00 61.34 H new ATOM 0 HG2 ARG A 129 18.693 18.568 9.801 1.00 45.30 H new ATOM 0 HG3 ARG A 129 18.551 20.313 9.742 1.00 45.30 H new ATOM 0 HD2 ARG A 129 20.600 18.622 8.260 1.00 1.10 H new ATOM 0 HD3 ARG A 129 19.216 19.431 7.552 1.00 1.10 H new ATOM 0 HE ARG A 129 20.649 21.474 8.817 1.00 10.14 H new ATOM 0 HH11 ARG A 129 21.298 19.068 6.293 1.00 12.15 H new ATOM 0 HH12 ARG A 129 22.504 20.077 5.489 1.00 12.15 H new ATOM 0 HH21 ARG A 129 22.207 22.745 7.778 1.00 55.55 H new ATOM 0 HH22 ARG A 129 23.016 22.147 6.325 1.00 55.55 H new ATOM 1865 N ASN A 130 17.438 20.339 11.956 1.00 53.23 N ATOM 1866 CA ASN A 130 16.411 21.360 12.116 1.00 71.44 C ATOM 1867 C ASN A 130 15.705 21.220 13.457 1.00 71.52 C ATOM 1868 O ASN A 130 15.579 22.191 14.208 1.00 41.25 O ATOM 1869 CB ASN A 130 15.391 21.280 10.972 1.00 51.21 C ATOM 1870 CG ASN A 130 16.005 21.510 9.597 1.00 65.44 C ATOM 1871 OD1 ASN A 130 17.025 22.355 9.515 1.00 64.05 O flip ATOM 1872 ND2 ASN A 130 15.558 20.935 8.606 1.00 32.23 N flip ATOM 0 H ASN A 130 17.165 19.554 11.365 1.00 53.23 H new ATOM 0 HA ASN A 130 16.899 22.334 12.086 1.00 71.44 H new ATOM 0 HB2 ASN A 130 14.913 20.301 10.989 1.00 51.21 H new ATOM 0 HB3 ASN A 130 14.608 22.020 11.141 1.00 51.21 H new ATOM 0 HD21 ASN A 130 14.773 20.291 8.701 1.00 32.23 H new ATOM 0 HD22 ASN A 130 15.972 21.102 7.689 1.00 32.23 H new ATOM 1879 N ASN A 131 15.254 20.004 13.758 1.00 23.53 N ATOM 1880 CA ASN A 131 14.434 19.765 14.943 1.00 43.51 C ATOM 1881 C ASN A 131 15.288 19.437 16.169 1.00 71.03 C ATOM 1882 O ASN A 131 14.880 19.696 17.302 1.00 72.12 O ATOM 1883 CB ASN A 131 13.452 18.615 14.683 1.00 43.33 C ATOM 1884 CG ASN A 131 12.311 18.564 15.697 1.00 4.41 C ATOM 1885 OD1 ASN A 131 11.884 19.722 16.188 1.00 52.34 O flip ATOM 1886 ND2 ASN A 131 11.807 17.491 16.028 1.00 53.22 N flip ATOM 0 H ASN A 131 15.442 19.171 13.199 1.00 23.53 H new ATOM 0 HA ASN A 131 13.884 20.683 15.149 1.00 43.51 H new ATOM 0 HB2 ASN A 131 13.036 18.719 13.681 1.00 43.33 H new ATOM 0 HB3 ASN A 131 13.994 17.670 14.706 1.00 43.33 H new ATOM 0 HD21 ASN A 131 12.158 16.619 15.632 1.00 53.22 H new ATOM 0 HD22 ASN A 131 11.038 17.474 16.698 1.00 53.22 H new ATOM 1893 N VAL A 132 16.472 18.872 15.940 1.00 22.24 N ATOM 1894 CA VAL A 132 17.319 18.389 17.032 1.00 51.15 C ATOM 1895 C VAL A 132 18.696 19.048 16.976 1.00 30.12 C ATOM 1896 O VAL A 132 19.213 19.333 15.894 1.00 33.10 O ATOM 1897 CB VAL A 132 17.466 16.844 16.983 1.00 54.43 C ATOM 1898 CG1 VAL A 132 18.332 16.333 18.136 1.00 31.31 C ATOM 1899 CG2 VAL A 132 16.090 16.172 16.996 1.00 70.22 C ATOM 0 H VAL A 132 16.867 18.737 15.010 1.00 22.24 H new ATOM 0 HA VAL A 132 16.837 18.659 17.972 1.00 51.15 H new ATOM 0 HB VAL A 132 17.968 16.583 16.051 1.00 54.43 H new ATOM 0 HG11 VAL A 132 18.416 15.248 18.075 1.00 31.31 H new ATOM 0 HG12 VAL A 132 19.325 16.778 18.071 1.00 31.31 H new ATOM 0 HG13 VAL A 132 17.873 16.608 19.086 1.00 31.31 H new ATOM 0 HG21 VAL A 132 16.213 15.090 16.961 1.00 70.22 H new ATOM 0 HG22 VAL A 132 15.559 16.448 17.907 1.00 70.22 H new ATOM 0 HG23 VAL A 132 15.517 16.500 16.129 1.00 70.22 H new ATOM 1909 N ALA A 133 19.275 19.290 18.153 1.00 44.32 N ATOM 1910 CA ALA A 133 20.560 19.975 18.263 1.00 45.42 C ATOM 1911 C ALA A 133 21.712 19.058 17.882 1.00 30.31 C ATOM 1912 O ALA A 133 22.249 18.311 18.711 1.00 14.22 O ATOM 1913 CB ALA A 133 20.745 20.533 19.670 1.00 22.23 C ATOM 0 H ALA A 133 18.869 19.019 19.049 1.00 44.32 H new ATOM 0 HA ALA A 133 20.561 20.807 17.559 1.00 45.42 H new ATOM 0 HB1 ALA A 133 21.707 21.041 19.736 1.00 22.23 H new ATOM 0 HB2 ALA A 133 19.945 21.241 19.889 1.00 22.23 H new ATOM 0 HB3 ALA A 133 20.715 19.717 20.392 1.00 22.23 H new ATOM 1919 N VAL A 134 22.068 19.112 16.608 1.00 55.21 N ATOM 1920 CA VAL A 134 23.178 18.346 16.082 1.00 14.23 C ATOM 1921 C VAL A 134 24.241 19.276 15.497 1.00 75.02 C ATOM 1922 O VAL A 134 24.027 19.916 14.466 1.00 44.45 O ATOM 1923 CB VAL A 134 22.707 17.344 15.005 1.00 13.33 C ATOM 1924 CG1 VAL A 134 23.886 16.546 14.466 1.00 2.32 C ATOM 1925 CG2 VAL A 134 21.628 16.414 15.565 1.00 40.12 C ATOM 0 H VAL A 134 21.594 19.689 15.913 1.00 55.21 H new ATOM 0 HA VAL A 134 23.612 17.783 16.908 1.00 14.23 H new ATOM 0 HB VAL A 134 22.271 17.906 14.179 1.00 13.33 H new ATOM 0 HG11 VAL A 134 23.535 15.845 13.708 1.00 2.32 H new ATOM 0 HG12 VAL A 134 24.613 17.226 14.022 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.355 15.995 15.281 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.311 15.717 14.790 1.00 40.12 H new ATOM 0 HG22 VAL A 134 22.031 15.857 16.411 1.00 40.12 H new ATOM 0 HG23 VAL A 134 20.773 17.005 15.893 1.00 40.12 H new ATOM 1935 N ARG A 135 25.374 19.356 16.183 1.00 5.32 N ATOM 1936 CA ARG A 135 26.503 20.162 15.748 1.00 35.41 C ATOM 1937 C ARG A 135 27.295 19.395 14.686 1.00 62.34 C ATOM 1938 O ARG A 135 27.874 18.344 14.974 1.00 24.24 O ATOM 1939 CB ARG A 135 27.415 20.491 16.946 1.00 72.41 C ATOM 1940 CG ARG A 135 26.665 20.830 18.238 1.00 24.53 C ATOM 1941 CD ARG A 135 25.733 22.030 18.085 1.00 72.30 C ATOM 1942 NE ARG A 135 26.452 23.244 17.693 1.00 54.11 N ATOM 1943 CZ ARG A 135 26.502 24.363 18.421 1.00 2.05 C ATOM 1944 NH1 ARG A 135 25.957 24.407 19.633 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 27.128 25.428 17.944 1.00 32.21 N ATOM 0 H ARG A 135 25.534 18.861 17.060 1.00 5.32 H new ATOM 0 HA ARG A 135 26.134 21.096 15.323 1.00 35.41 H new ATOM 0 HB2 ARG A 135 28.070 19.640 17.133 1.00 72.41 H new ATOM 0 HB3 ARG A 135 28.054 21.333 16.680 1.00 72.41 H new ATOM 0 HG2 ARG A 135 26.085 19.963 18.554 1.00 24.53 H new ATOM 0 HG3 ARG A 135 27.387 21.035 19.028 1.00 24.53 H new ATOM 0 HD2 ARG A 135 24.972 21.804 17.338 1.00 72.30 H new ATOM 0 HD3 ARG A 135 25.213 22.206 19.027 1.00 72.30 H new ATOM 0 HE ARG A 135 26.949 23.235 16.802 1.00 54.11 H new ATOM 0 HH11 ARG A 135 25.495 23.581 20.015 1.00 12.22 H new ATOM 0 HH12 ARG A 135 26.001 25.266 20.181 1.00 12.22 H new ATOM 0 HH21 ARG A 135 27.569 25.391 17.025 1.00 32.21 H new ATOM 0 HH22 ARG A 135 27.169 26.285 18.496 1.00 32.21 H new ATOM 1959 N LEU A 136 27.299 19.907 13.463 1.00 14.32 N ATOM 1960 CA LEU A 136 28.021 19.276 12.364 1.00 2.32 C ATOM 1961 C LEU A 136 29.481 19.704 12.367 1.00 50.04 C ATOM 1962 O LEU A 136 29.823 20.810 11.943 1.00 1.31 O ATOM 1963 CB LEU A 136 27.366 19.598 11.010 1.00 33.50 C ATOM 1964 CG LEU A 136 26.207 18.670 10.611 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.562 19.138 9.311 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.704 17.229 10.473 1.00 32.41 C ATOM 0 H LEU A 136 26.808 20.763 13.205 1.00 14.32 H new ATOM 0 HA LEU A 136 27.976 18.197 12.510 1.00 2.32 H new ATOM 0 HB2 LEU A 136 26.998 20.624 11.037 1.00 33.50 H new ATOM 0 HB3 LEU A 136 28.130 19.554 10.234 1.00 33.50 H new ATOM 0 HG LEU A 136 25.453 18.706 11.397 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.745 18.467 9.048 1.00 3.54 H new ATOM 0 HD12 LEU A 136 25.174 20.148 9.440 1.00 3.54 H new ATOM 0 HD13 LEU A 136 26.305 19.134 8.514 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.873 16.583 10.190 1.00 32.41 H new ATOM 0 HD22 LEU A 136 27.477 17.183 9.706 1.00 32.41 H new ATOM 0 HD23 LEU A 136 27.117 16.894 11.425 1.00 32.41 H new ATOM 1978 N VAL A 137 30.332 18.821 12.862 1.00 24.14 N ATOM 1979 CA VAL A 137 31.764 19.061 12.902 1.00 11.21 C ATOM 1980 C VAL A 137 32.453 18.228 11.826 1.00 22.22 C ATOM 1981 O VAL A 137 32.468 16.997 11.876 1.00 60.11 O ATOM 1982 CB VAL A 137 32.355 18.768 14.309 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.592 17.635 14.991 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.854 18.454 14.223 1.00 51.44 C ATOM 0 H VAL A 137 30.050 17.919 13.247 1.00 24.14 H new ATOM 0 HA VAL A 137 31.944 20.117 12.700 1.00 11.21 H new ATOM 0 HB VAL A 137 32.240 19.665 14.918 1.00 74.42 H new ATOM 0 HG11 VAL A 137 32.023 17.447 15.974 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.545 17.916 15.101 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.663 16.732 14.385 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.242 18.253 15.222 1.00 51.44 H new ATOM 0 HG22 VAL A 137 34.007 17.579 13.592 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.380 19.307 13.794 1.00 51.44 H new ATOM 1994 N VAL A 138 32.994 18.913 10.836 1.00 43.23 N ATOM 1995 CA VAL A 138 33.646 18.263 9.713 1.00 53.11 C ATOM 1996 C VAL A 138 35.130 18.092 10.002 1.00 13.33 C ATOM 1997 O VAL A 138 35.771 18.972 10.585 1.00 44.02 O ATOM 1998 CB VAL A 138 33.454 19.038 8.391 1.00 15.42 C ATOM 1999 CG1 VAL A 138 31.993 19.428 8.200 1.00 20.25 C ATOM 2000 CG2 VAL A 138 34.371 20.245 8.345 1.00 13.44 C ATOM 0 H VAL A 138 32.994 19.932 10.787 1.00 43.23 H new ATOM 0 HA VAL A 138 33.177 17.287 9.588 1.00 53.11 H new ATOM 0 HB VAL A 138 33.726 18.386 7.561 1.00 15.42 H new ATOM 0 HG11 VAL A 138 31.881 19.973 7.263 1.00 20.25 H new ATOM 0 HG12 VAL A 138 31.377 18.529 8.173 1.00 20.25 H new ATOM 0 HG13 VAL A 138 31.674 20.061 9.028 1.00 20.25 H new ATOM 0 HG21 VAL A 138 34.222 20.779 7.407 1.00 13.44 H new ATOM 0 HG22 VAL A 138 34.143 20.907 9.180 1.00 13.44 H new ATOM 0 HG23 VAL A 138 35.408 19.917 8.415 1.00 13.44 H new ATOM 2010 N ALA A 139 35.653 16.947 9.632 1.00 53.03 N ATOM 2011 CA ALA A 139 37.044 16.598 9.917 1.00 12.31 C ATOM 2012 C ALA A 139 37.781 16.213 8.637 1.00 73.13 C ATOM 2013 O ALA A 139 37.169 15.734 7.676 1.00 43.50 O ATOM 2014 CB ALA A 139 37.103 15.463 10.931 1.00 22.50 C ATOM 0 H ALA A 139 35.137 16.227 9.126 1.00 53.03 H new ATOM 0 HA ALA A 139 37.539 17.472 10.341 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.144 15.212 11.136 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.617 15.775 11.855 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.591 14.589 10.529 1.00 22.50 H new ATOM 2021 N MET B 1 27.078 22.802 25.647 1.00 72.34 N ATOM 2022 CA MET B 1 26.431 23.237 26.874 1.00 63.32 C ATOM 2023 C MET B 1 26.963 22.460 28.075 1.00 71.35 C ATOM 2024 O MET B 1 27.972 21.753 27.982 1.00 2.40 O ATOM 2025 CB MET B 1 24.918 23.042 26.765 1.00 41.04 C ATOM 2026 CG MET B 1 24.527 21.587 26.604 1.00 5.33 C ATOM 2027 SD MET B 1 22.746 21.328 26.681 1.00 24.33 S ATOM 2028 CE MET B 1 22.690 19.551 26.864 1.00 72.42 C ATOM 0 H1 MET B 1 26.358 22.628 24.917 1.00 72.34 H new ATOM 0 H2 MET B 1 27.732 23.541 25.319 1.00 72.34 H new ATOM 0 H3 MET B 1 27.608 21.925 25.826 1.00 72.34 H new ATOM 0 HA MET B 1 26.652 24.294 27.019 1.00 63.32 H new ATOM 0 HB2 MET B 1 24.438 23.447 27.656 1.00 41.04 H new ATOM 0 HB3 MET B 1 24.543 23.611 25.915 1.00 41.04 H new ATOM 0 HG2 MET B 1 24.902 21.219 25.649 1.00 5.33 H new ATOM 0 HG3 MET B 1 25.009 20.998 27.384 1.00 5.33 H new ATOM 0 HE1 MET B 1 21.695 19.250 27.190 1.00 72.42 H new ATOM 0 HE2 MET B 1 22.916 19.079 25.908 1.00 72.42 H new ATOM 0 HE3 MET B 1 23.425 19.238 27.606 1.00 72.42 H new ATOM 2038 N ASN B 2 26.275 22.595 29.200 1.00 33.33 N ATOM 2039 CA ASN B 2 26.638 21.882 30.424 1.00 51.30 C ATOM 2040 C ASN B 2 26.167 20.429 30.357 1.00 60.31 C ATOM 2041 O ASN B 2 25.210 20.037 31.022 1.00 61.35 O ATOM 2042 CB ASN B 2 26.048 22.574 31.664 1.00 21.53 C ATOM 2043 CG ASN B 2 26.488 21.918 32.965 1.00 32.42 C ATOM 2044 OD1 ASN B 2 27.599 21.389 33.067 1.00 51.33 O ATOM 2045 ND2 ASN B 2 25.621 21.939 33.968 1.00 42.33 N ATOM 0 H ASN B 2 25.456 23.196 29.294 1.00 33.33 H new ATOM 0 HA ASN B 2 27.724 21.897 30.510 1.00 51.30 H new ATOM 0 HB2 ASN B 2 26.350 23.621 31.669 1.00 21.53 H new ATOM 0 HB3 ASN B 2 24.960 22.556 31.602 1.00 21.53 H new ATOM 0 HD21 ASN B 2 25.863 21.509 34.861 1.00 42.33 H new ATOM 0 HD22 ASN B 2 24.712 22.385 33.847 1.00 42.33 H new ATOM 2052 N ILE B 3 26.818 19.653 29.503 1.00 21.23 N ATOM 2053 CA ILE B 3 26.545 18.227 29.379 1.00 72.42 C ATOM 2054 C ILE B 3 26.858 17.488 30.681 1.00 64.03 C ATOM 2055 O ILE B 3 27.868 17.759 31.335 1.00 40.30 O ATOM 2056 CB ILE B 3 27.374 17.605 28.228 1.00 60.30 C ATOM 2057 CG1 ILE B 3 27.030 18.281 26.894 1.00 50.54 C ATOM 2058 CG2 ILE B 3 27.137 16.101 28.144 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.638 17.963 26.397 1.00 13.01 C ATOM 0 H ILE B 3 27.549 19.992 28.877 1.00 21.23 H new ATOM 0 HA ILE B 3 25.483 18.120 29.158 1.00 72.42 H new ATOM 0 HB ILE B 3 28.431 17.772 28.437 1.00 60.30 H new ATOM 0 HG12 ILE B 3 27.129 19.361 27.007 1.00 50.54 H new ATOM 0 HG13 ILE B 3 27.755 17.971 26.141 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.729 15.684 27.329 1.00 62.10 H new ATOM 0 HG22 ILE B 3 27.432 15.633 29.083 1.00 62.10 H new ATOM 0 HG23 ILE B 3 26.080 15.909 27.960 1.00 62.10 H new ATOM 0 HD11 ILE B 3 25.464 18.474 25.450 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.541 16.887 26.252 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.904 18.298 27.130 1.00 13.01 H new ATOM 2071 N LEU B 4 25.976 16.568 31.049 1.00 23.11 N ATOM 2072 CA LEU B 4 26.183 15.703 32.204 1.00 23.43 C ATOM 2073 C LEU B 4 26.900 14.429 31.775 1.00 41.14 C ATOM 2074 O LEU B 4 27.868 14.007 32.407 1.00 62.34 O ATOM 2075 CB LEU B 4 24.840 15.344 32.856 1.00 50.44 C ATOM 2076 CG LEU B 4 24.027 16.532 33.387 1.00 31.23 C ATOM 2077 CD1 LEU B 4 22.692 16.062 33.963 1.00 75.25 C ATOM 2078 CD2 LEU B 4 24.827 17.312 34.431 1.00 11.04 C ATOM 0 H LEU B 4 25.099 16.400 30.557 1.00 23.11 H new ATOM 0 HA LEU B 4 26.795 16.237 32.931 1.00 23.43 H new ATOM 0 HB2 LEU B 4 24.233 14.808 32.126 1.00 50.44 H new ATOM 0 HB3 LEU B 4 25.028 14.657 33.681 1.00 50.44 H new ATOM 0 HG LEU B 4 23.817 17.201 32.552 1.00 31.23 H new ATOM 0 HD11 LEU B 4 22.133 16.921 34.333 1.00 75.25 H new ATOM 0 HD12 LEU B 4 22.116 15.562 33.185 1.00 75.25 H new ATOM 0 HD13 LEU B 4 22.874 15.367 34.783 1.00 75.25 H new ATOM 0 HD21 LEU B 4 24.232 18.150 34.794 1.00 11.04 H new ATOM 0 HD22 LEU B 4 25.075 16.655 35.265 1.00 11.04 H new ATOM 0 HD23 LEU B 4 25.745 17.688 33.980 1.00 11.04 H new ATOM 2090 N TYR B 5 26.417 13.823 30.693 1.00 23.42 N ATOM 2091 CA TYR B 5 26.999 12.577 30.184 1.00 44.15 C ATOM 2092 C TYR B 5 27.121 12.636 28.665 1.00 24.15 C ATOM 2093 O TYR B 5 26.151 12.938 27.979 1.00 75.34 O ATOM 2094 CB TYR B 5 26.127 11.380 30.601 1.00 21.21 C ATOM 2095 CG TYR B 5 26.675 10.019 30.193 1.00 10.12 C ATOM 2096 CD1 TYR B 5 26.483 9.519 28.907 1.00 52.12 C ATOM 2097 CD2 TYR B 5 27.376 9.231 31.101 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.971 8.281 28.542 1.00 75.45 C ATOM 2099 CE2 TYR B 5 27.869 7.989 30.739 1.00 10.31 C ATOM 2100 CZ TYR B 5 27.664 7.520 29.458 1.00 52.51 C ATOM 2101 OH TYR B 5 28.153 6.285 29.087 1.00 25.44 O ATOM 0 H TYR B 5 25.626 14.171 30.151 1.00 23.42 H new ATOM 0 HA TYR B 5 27.995 12.453 30.610 1.00 44.15 H new ATOM 0 HB2 TYR B 5 26.005 11.397 31.684 1.00 21.21 H new ATOM 0 HB3 TYR B 5 25.135 11.502 30.166 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.943 10.111 28.183 1.00 52.12 H new ATOM 0 HD2 TYR B 5 27.538 9.595 32.105 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.810 7.909 27.541 1.00 75.45 H new ATOM 0 HE2 TYR B 5 28.411 7.390 31.456 1.00 10.31 H new ATOM 0 HH TYR B 5 28.618 5.876 29.846 1.00 25.44 H new ATOM 2111 N LYS B 6 28.311 12.352 28.142 1.00 30.03 N ATOM 2112 CA LYS B 6 28.537 12.335 26.698 1.00 63.12 C ATOM 2113 C LYS B 6 29.305 11.080 26.286 1.00 12.41 C ATOM 2114 O LYS B 6 30.348 10.753 26.857 1.00 54.02 O ATOM 2115 CB LYS B 6 29.280 13.604 26.238 1.00 22.40 C ATOM 2116 CG LYS B 6 29.638 13.611 24.752 1.00 43.31 C ATOM 2117 CD LYS B 6 29.980 15.013 24.236 1.00 65.01 C ATOM 2118 CE LYS B 6 28.739 15.897 24.104 1.00 23.11 C ATOM 2119 NZ LYS B 6 29.051 17.231 23.516 1.00 52.41 N1+ ATOM 0 H LYS B 6 29.137 12.130 28.698 1.00 30.03 H new ATOM 0 HA LYS B 6 27.564 12.319 26.206 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.661 14.474 26.456 1.00 22.40 H new ATOM 0 HB3 LYS B 6 30.194 13.709 26.822 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.487 12.948 24.583 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.802 13.210 24.179 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.690 15.485 24.915 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.471 14.932 23.266 1.00 65.01 H new ATOM 0 HE2 LYS B 6 28.001 15.392 23.481 1.00 23.11 H new ATOM 0 HE3 LYS B 6 28.287 16.033 25.086 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 28.168 17.698 23.228 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 29.538 17.817 24.224 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 29.665 17.109 22.686 1.00 52.41 H new ATOM 2133 N THR B 7 28.771 10.381 25.295 1.00 10.14 N ATOM 2134 CA THR B 7 29.367 9.157 24.785 1.00 42.05 C ATOM 2135 C THR B 7 29.702 9.330 23.304 1.00 63.52 C ATOM 2136 O THR B 7 28.924 9.919 22.547 1.00 72.52 O ATOM 2137 CB THR B 7 28.413 7.948 24.997 1.00 0.35 C ATOM 2138 OG1 THR B 7 28.988 6.735 24.491 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.058 8.184 24.340 1.00 24.11 C ATOM 0 H THR B 7 27.909 10.649 24.821 1.00 10.14 H new ATOM 0 HA THR B 7 30.286 8.954 25.335 1.00 42.05 H new ATOM 0 HB THR B 7 28.266 7.846 26.072 1.00 0.35 H new ATOM 0 HG1 THR B 7 29.965 6.795 24.531 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.417 7.319 24.508 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.593 9.070 24.773 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.194 8.332 23.269 1.00 24.11 H new ATOM 2147 N ALA B 8 30.869 8.839 22.903 1.00 4.15 N ATOM 2148 CA ALA B 8 31.337 8.993 21.528 1.00 51.31 C ATOM 2149 C ALA B 8 31.432 7.643 20.835 1.00 33.43 C ATOM 2150 O ALA B 8 31.928 6.671 21.414 1.00 64.22 O ATOM 2151 CB ALA B 8 32.686 9.696 21.502 1.00 24.44 C ATOM 0 H ALA B 8 31.511 8.330 23.511 1.00 4.15 H new ATOM 0 HA ALA B 8 30.613 9.604 20.989 1.00 51.31 H new ATOM 0 HB1 ALA B 8 33.021 9.803 20.470 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.591 10.682 21.957 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.414 9.107 22.060 1.00 24.44 H new ATOM 2157 N ALA B 9 30.961 7.586 19.597 1.00 21.22 N ATOM 2158 CA ALA B 9 30.996 6.363 18.814 1.00 20.22 C ATOM 2159 C ALA B 9 31.660 6.602 17.464 1.00 31.45 C ATOM 2160 O ALA B 9 31.216 7.435 16.677 1.00 1.21 O ATOM 2161 CB ALA B 9 29.591 5.808 18.647 1.00 3.15 C ATOM 0 H ALA B 9 30.547 8.382 19.111 1.00 21.22 H new ATOM 0 HA ALA B 9 31.594 5.624 19.347 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.629 4.891 18.058 1.00 3.15 H new ATOM 0 HB2 ALA B 9 29.166 5.592 19.627 1.00 3.15 H new ATOM 0 HB3 ALA B 9 28.968 6.542 18.135 1.00 3.15 H new ATOM 2167 N THR B 10 32.733 5.869 17.218 1.00 33.23 N ATOM 2168 CA THR B 10 33.495 5.969 15.990 1.00 64.31 C ATOM 2169 C THR B 10 33.057 4.882 15.013 1.00 63.33 C ATOM 2170 O THR B 10 33.224 3.686 15.273 1.00 30.04 O ATOM 2171 CB THR B 10 35.010 5.834 16.273 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.415 6.823 17.233 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.830 5.994 14.998 1.00 23.24 C ATOM 0 H THR B 10 33.102 5.181 17.874 1.00 33.23 H new ATOM 0 HA THR B 10 33.308 6.948 15.550 1.00 64.31 H new ATOM 0 HB THR B 10 35.191 4.836 16.671 1.00 62.43 H new ATOM 0 HG1 THR B 10 36.375 6.733 17.410 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.890 5.894 15.232 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.542 5.225 14.281 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.645 6.978 14.568 1.00 23.24 H new ATOM 2181 N SER B 11 32.465 5.303 13.912 1.00 64.42 N ATOM 2182 CA SER B 11 32.023 4.395 12.874 1.00 20.54 C ATOM 2183 C SER B 11 32.953 4.477 11.658 1.00 44.42 C ATOM 2184 O SER B 11 33.048 5.510 10.994 1.00 74.01 O ATOM 2185 CB SER B 11 30.572 4.719 12.506 1.00 74.14 C ATOM 2186 OG SER B 11 30.388 6.111 12.313 1.00 11.25 O ATOM 0 H SER B 11 32.277 6.286 13.713 1.00 64.42 H new ATOM 0 HA SER B 11 32.064 3.369 13.238 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.297 4.184 11.597 1.00 74.14 H new ATOM 0 HB3 SER B 11 29.907 4.368 13.295 1.00 74.14 H new ATOM 0 HG SER B 11 29.553 6.393 12.741 1.00 11.25 H new ATOM 2192 N THR B 12 33.669 3.388 11.400 1.00 44.31 N ATOM 2193 CA THR B 12 34.610 3.317 10.292 1.00 14.13 C ATOM 2194 C THR B 12 33.942 2.737 9.047 1.00 53.42 C ATOM 2195 O THR B 12 32.945 2.004 9.142 1.00 32.44 O ATOM 2196 CB THR B 12 35.816 2.430 10.662 1.00 2.30 C ATOM 2197 OG1 THR B 12 36.205 2.686 12.019 1.00 14.42 O ATOM 2198 CG2 THR B 12 37.004 2.689 9.738 1.00 31.31 C ATOM 0 H THR B 12 33.613 2.532 11.953 1.00 44.31 H new ATOM 0 HA THR B 12 34.948 4.332 10.084 1.00 14.13 H new ATOM 0 HB THR B 12 35.515 1.389 10.548 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.970 2.120 12.252 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.836 2.047 10.027 1.00 31.31 H new ATOM 0 HG22 THR B 12 36.719 2.472 8.709 1.00 31.31 H new ATOM 0 HG23 THR B 12 37.306 3.733 9.818 1.00 31.31 H new ATOM 2206 N GLY B 13 34.499 3.061 7.885 1.00 25.11 N ATOM 2207 CA GLY B 13 34.019 2.498 6.643 1.00 71.12 C ATOM 2208 C GLY B 13 34.514 1.081 6.435 1.00 70.11 C ATOM 2209 O GLY B 13 35.432 0.846 5.647 1.00 42.34 O ATOM 0 H GLY B 13 35.280 3.709 7.784 1.00 25.11 H new ATOM 0 HA2 GLY B 13 32.929 2.506 6.638 1.00 71.12 H new ATOM 0 HA3 GLY B 13 34.346 3.122 5.811 1.00 71.12 H new ATOM 2213 N GLY B 14 33.930 0.142 7.180 1.00 21.54 N ATOM 2214 CA GLY B 14 34.249 -1.269 7.008 1.00 31.21 C ATOM 2215 C GLY B 14 33.765 -1.806 5.670 1.00 73.40 C ATOM 2216 O GLY B 14 33.894 -1.133 4.646 1.00 13.01 O ATOM 0 H GLY B 14 33.238 0.335 7.904 1.00 21.54 H new ATOM 0 HA2 GLY B 14 35.327 -1.408 7.085 1.00 31.21 H new ATOM 0 HA3 GLY B 14 33.794 -1.844 7.815 1.00 31.21 H new ATOM 2220 N ARG B 15 33.216 -3.020 5.663 1.00 12.42 N ATOM 2221 CA ARG B 15 32.658 -3.588 4.436 1.00 62.32 C ATOM 2222 C ARG B 15 31.448 -2.784 3.974 1.00 53.41 C ATOM 2223 O ARG B 15 31.364 -2.396 2.809 1.00 34.04 O ATOM 2224 CB ARG B 15 32.301 -5.072 4.621 1.00 22.32 C ATOM 2225 CG ARG B 15 33.507 -6.003 4.513 1.00 23.03 C ATOM 2226 CD ARG B 15 34.219 -5.840 3.169 1.00 52.22 C ATOM 2227 NE ARG B 15 33.306 -6.048 2.036 1.00 65.14 N ATOM 2228 CZ ARG B 15 33.362 -5.374 0.884 1.00 55.23 C ATOM 2229 NH1 ARG B 15 34.308 -4.466 0.677 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 32.476 -5.615 -0.073 1.00 51.30 N ATOM 0 H ARG B 15 33.146 -3.623 6.482 1.00 12.42 H new ATOM 0 HA ARG B 15 33.421 -3.529 3.659 1.00 62.32 H new ATOM 0 HB2 ARG B 15 31.833 -5.207 5.596 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.563 -5.357 3.871 1.00 22.32 H new ATOM 0 HG2 ARG B 15 34.205 -5.793 5.324 1.00 23.03 H new ATOM 0 HG3 ARG B 15 33.182 -7.037 4.632 1.00 23.03 H new ATOM 0 HD2 ARG B 15 34.653 -4.842 3.107 1.00 52.22 H new ATOM 0 HD3 ARG B 15 35.043 -6.551 3.106 1.00 52.22 H new ATOM 0 HE ARG B 15 32.579 -6.756 2.136 1.00 65.14 H new ATOM 0 HH11 ARG B 15 35.001 -4.277 1.401 1.00 21.14 H new ATOM 0 HH12 ARG B 15 34.342 -3.957 -0.206 1.00 21.14 H new ATOM 0 HH21 ARG B 15 31.749 -6.317 0.070 1.00 51.30 H new ATOM 0 HH22 ARG B 15 32.521 -5.099 -0.952 1.00 51.30 H new ATOM 2244 N ASP B 16 30.508 -2.547 4.883 1.00 43.23 N ATOM 2245 CA ASP B 16 29.390 -1.645 4.603 1.00 64.45 C ATOM 2246 C ASP B 16 29.326 -0.572 5.693 1.00 45.23 C ATOM 2247 O ASP B 16 29.154 0.610 5.403 1.00 44.01 O ATOM 2248 CB ASP B 16 28.081 -2.438 4.525 1.00 65.33 C ATOM 2249 CG ASP B 16 26.927 -1.658 3.894 1.00 54.31 C ATOM 2250 OD1 ASP B 16 26.390 -0.741 4.549 1.00 24.34 O ATOM 2251 OD2 ASP B 16 26.514 -2.007 2.764 1.00 12.23 O1- ATOM 0 H ASP B 16 30.495 -2.962 5.815 1.00 43.23 H new ATOM 0 HA ASP B 16 29.539 -1.156 3.640 1.00 64.45 H new ATOM 0 HB2 ASP B 16 28.251 -3.347 3.949 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.793 -2.747 5.530 1.00 65.33 H new ATOM 2256 N GLY B 17 29.499 -0.989 6.957 1.00 22.41 N ATOM 2257 CA GLY B 17 29.810 -0.033 8.006 1.00 74.22 C ATOM 2258 C GLY B 17 30.321 -0.717 9.255 1.00 32.04 C ATOM 2259 O GLY B 17 29.978 -1.867 9.517 1.00 11.23 O ATOM 0 H GLY B 17 29.429 -1.960 7.263 1.00 22.41 H new ATOM 0 HA2 GLY B 17 30.559 0.672 7.645 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.918 0.545 8.247 1.00 74.22 H new ATOM 2263 N ARG B 18 31.147 -0.023 10.029 1.00 41.41 N ATOM 2264 CA ARG B 18 31.712 -0.584 11.255 1.00 45.30 C ATOM 2265 C ARG B 18 31.552 0.415 12.403 1.00 1.35 C ATOM 2266 O ARG B 18 32.317 1.367 12.509 1.00 0.54 O ATOM 2267 CB ARG B 18 33.197 -0.920 11.029 1.00 74.40 C ATOM 2268 CG ARG B 18 33.876 -1.647 12.187 1.00 53.04 C ATOM 2269 CD ARG B 18 33.304 -3.046 12.414 1.00 43.11 C ATOM 2270 NE ARG B 18 34.153 -3.851 13.300 1.00 64.22 N ATOM 2271 CZ ARG B 18 34.377 -3.578 14.589 1.00 63.34 C ATOM 2272 NH1 ARG B 18 33.785 -2.549 15.174 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 35.188 -4.341 15.302 1.00 54.01 N ATOM 0 H ARG B 18 31.443 0.933 9.830 1.00 41.41 H new ATOM 0 HA ARG B 18 31.182 -1.499 11.518 1.00 45.30 H new ATOM 0 HB2 ARG B 18 33.283 -1.535 10.133 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.738 0.006 10.833 1.00 74.40 H new ATOM 0 HG2 ARG B 18 34.945 -1.723 11.988 1.00 53.04 H new ATOM 0 HG3 ARG B 18 33.762 -1.059 13.098 1.00 53.04 H new ATOM 0 HD2 ARG B 18 32.306 -2.964 12.845 1.00 43.11 H new ATOM 0 HD3 ARG B 18 33.197 -3.554 11.455 1.00 43.11 H new ATOM 0 HE ARG B 18 34.603 -4.676 12.905 1.00 64.22 H new ATOM 0 HH11 ARG B 18 33.150 -1.955 14.640 1.00 23.22 H new ATOM 0 HH12 ARG B 18 33.963 -2.350 16.158 1.00 23.22 H new ATOM 0 HH21 ARG B 18 35.646 -5.143 14.869 1.00 54.01 H new ATOM 0 HH22 ARG B 18 35.355 -4.128 16.285 1.00 54.01 H new ATOM 2287 N ALA B 19 30.557 0.196 13.258 1.00 25.44 N ATOM 2288 CA ALA B 19 30.226 1.146 14.322 1.00 25.14 C ATOM 2289 C ALA B 19 30.822 0.689 15.648 1.00 64.21 C ATOM 2290 O ALA B 19 30.573 -0.427 16.092 1.00 14.23 O ATOM 2291 CB ALA B 19 28.713 1.299 14.443 1.00 63.23 C ATOM 0 H ALA B 19 29.963 -0.633 13.237 1.00 25.44 H new ATOM 0 HA ALA B 19 30.654 2.116 14.067 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.481 2.008 15.238 1.00 63.23 H new ATOM 0 HB2 ALA B 19 28.308 1.666 13.500 1.00 63.23 H new ATOM 0 HB3 ALA B 19 28.267 0.332 14.678 1.00 63.23 H new ATOM 2297 N THR B 20 31.617 1.543 16.272 1.00 63.15 N ATOM 2298 CA THR B 20 32.284 1.205 17.523 1.00 31.24 C ATOM 2299 C THR B 20 32.239 2.382 18.485 1.00 2.34 C ATOM 2300 O THR B 20 32.881 3.395 18.243 1.00 75.11 O ATOM 2301 CB THR B 20 33.755 0.814 17.244 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.783 -0.207 16.239 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.467 0.312 18.501 1.00 14.05 C ATOM 0 H THR B 20 31.818 2.483 15.931 1.00 63.15 H new ATOM 0 HA THR B 20 31.765 0.361 17.978 1.00 31.24 H new ATOM 0 HB THR B 20 34.282 1.706 16.904 1.00 15.15 H new ATOM 0 HG1 THR B 20 34.708 -0.358 15.952 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.496 0.050 18.256 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.463 1.095 19.259 1.00 14.05 H new ATOM 0 HG23 THR B 20 33.950 -0.567 18.885 1.00 14.05 H new ATOM 2311 N SER B 21 31.496 2.244 19.584 1.00 21.31 N ATOM 2312 CA SER B 21 31.416 3.315 20.563 1.00 32.44 C ATOM 2313 C SER B 21 32.799 3.469 21.152 1.00 11.23 C ATOM 2314 O SER B 21 33.236 2.597 21.926 1.00 42.34 O ATOM 2315 CB SER B 21 30.376 3.034 21.658 1.00 31.41 C ATOM 2316 OG SER B 21 30.133 4.179 22.462 1.00 74.21 O ATOM 0 H SER B 21 30.951 1.413 19.812 1.00 21.31 H new ATOM 0 HA SER B 21 31.086 4.235 20.081 1.00 32.44 H new ATOM 0 HB2 SER B 21 29.443 2.708 21.198 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.724 2.215 22.288 1.00 31.41 H new ATOM 0 HG SER B 21 30.890 4.320 23.068 1.00 74.21 H new ATOM 2322 N HIS B 22 33.449 4.577 20.745 1.00 5.04 N ATOM 2323 CA HIS B 22 34.887 4.826 20.902 1.00 32.51 C ATOM 2324 C HIS B 22 35.347 4.701 22.340 1.00 35.24 C ATOM 2325 O HIS B 22 36.500 4.363 22.605 1.00 73.12 O ATOM 2326 CB HIS B 22 35.219 6.228 20.369 1.00 3.43 C ATOM 2327 CG HIS B 22 36.655 6.633 20.537 1.00 12.52 C ATOM 2328 ND1 HIS B 22 37.059 7.623 21.405 1.00 31.42 N ATOM 2329 CD2 HIS B 22 37.781 6.185 19.931 1.00 34.34 C ATOM 2330 CE1 HIS B 22 38.367 7.768 21.326 1.00 23.12 C ATOM 2331 NE2 HIS B 22 38.830 6.908 20.440 1.00 12.42 N ATOM 0 H HIS B 22 32.966 5.347 20.282 1.00 5.04 H new ATOM 0 HA HIS B 22 35.417 4.064 20.331 1.00 32.51 H new ATOM 0 HB2 HIS B 22 34.964 6.270 19.310 1.00 3.43 H new ATOM 0 HB3 HIS B 22 34.587 6.956 20.878 1.00 3.43 H new ATOM 0 HD2 HIS B 22 37.841 5.405 19.187 1.00 34.34 H new ATOM 0 HE1 HIS B 22 38.959 8.472 21.891 1.00 23.12 H new ATOM 0 HE2 HIS B 22 39.809 6.798 20.176 1.00 12.42 H new ATOM 2340 N ASP B 23 34.433 4.932 23.260 1.00 44.12 N ATOM 2341 CA ASP B 23 34.730 4.819 24.687 1.00 0.24 C ATOM 2342 C ASP B 23 34.684 3.347 25.115 1.00 62.21 C ATOM 2343 O ASP B 23 34.592 3.028 26.302 1.00 40.03 O ATOM 2344 CB ASP B 23 33.745 5.673 25.504 1.00 12.04 C ATOM 2345 CG ASP B 23 32.329 5.630 24.954 1.00 5.31 C ATOM 2346 OD1 ASP B 23 31.652 6.684 24.943 1.00 63.54 O ATOM 2347 OD2 ASP B 23 31.885 4.547 24.517 1.00 33.23 O1- ATOM 0 H ASP B 23 33.472 5.201 23.051 1.00 44.12 H new ATOM 0 HA ASP B 23 35.735 5.196 24.878 1.00 0.24 H new ATOM 0 HB2 ASP B 23 33.739 5.324 26.537 1.00 12.04 H new ATOM 0 HB3 ASP B 23 34.093 6.706 25.518 1.00 12.04 H new ATOM 2352 N GLN B 24 34.755 2.468 24.109 1.00 3.35 N ATOM 2353 CA GLN B 24 34.868 1.024 24.293 1.00 64.10 C ATOM 2354 C GLN B 24 33.586 0.459 24.877 1.00 11.02 C ATOM 2355 O GLN B 24 33.599 -0.549 25.583 1.00 0.33 O ATOM 2356 CB GLN B 24 36.088 0.670 25.158 1.00 41.34 C ATOM 2357 CG GLN B 24 37.415 1.149 24.571 1.00 71.43 C ATOM 2358 CD GLN B 24 37.623 0.701 23.129 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.151 -0.381 22.866 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.233 1.543 22.181 1.00 4.32 N ATOM 0 H GLN B 24 34.735 2.749 23.129 1.00 3.35 H new ATOM 0 HA GLN B 24 35.020 0.565 23.316 1.00 64.10 H new ATOM 0 HB2 GLN B 24 35.960 1.107 26.148 1.00 41.34 H new ATOM 0 HB3 GLN B 24 36.128 -0.411 25.290 1.00 41.34 H new ATOM 0 HG2 GLN B 24 37.455 2.237 24.617 1.00 71.43 H new ATOM 0 HG3 GLN B 24 38.234 0.774 25.184 1.00 71.43 H new ATOM 0 HE21 GLN B 24 36.799 2.431 22.434 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.367 1.303 21.199 1.00 4.32 H new ATOM 2369 N LYS B 25 32.471 1.112 24.559 1.00 34.11 N ATOM 2370 CA LYS B 25 31.169 0.633 24.988 1.00 33.22 C ATOM 2371 C LYS B 25 30.405 -0.050 23.856 1.00 40.01 C ATOM 2372 O LYS B 25 29.376 -0.675 24.109 1.00 34.42 O ATOM 2373 CB LYS B 25 30.342 1.754 25.617 1.00 20.21 C ATOM 2374 CG LYS B 25 30.684 1.957 27.088 1.00 22.43 C ATOM 2375 CD LYS B 25 29.836 3.036 27.751 1.00 41.25 C ATOM 2376 CE LYS B 25 30.237 4.421 27.280 1.00 25.52 C ATOM 2377 NZ LYS B 25 29.700 4.747 25.932 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.447 1.970 24.008 1.00 34.11 H new ATOM 0 HA LYS B 25 31.346 -0.122 25.754 1.00 33.22 H new ATOM 0 HB2 LYS B 25 30.516 2.682 25.073 1.00 20.21 H new ATOM 0 HB3 LYS B 25 29.282 1.521 25.520 1.00 20.21 H new ATOM 0 HG2 LYS B 25 30.547 1.016 27.621 1.00 22.43 H new ATOM 0 HG3 LYS B 25 31.737 2.224 27.177 1.00 22.43 H new ATOM 0 HD2 LYS B 25 28.784 2.864 27.526 1.00 41.25 H new ATOM 0 HD3 LYS B 25 29.945 2.972 28.834 1.00 41.25 H new ATOM 0 HE2 LYS B 25 29.881 5.161 27.997 1.00 25.52 H new ATOM 0 HE3 LYS B 25 31.324 4.493 27.260 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 29.495 5.765 25.877 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 30.403 4.496 25.208 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 28.826 4.208 25.767 1.00 5.33 H new ATOM 2391 N LEU B 26 30.879 0.063 22.605 1.00 71.52 N ATOM 2392 CA LEU B 26 30.254 -0.705 21.521 1.00 40.15 C ATOM 2393 C LEU B 26 31.265 -1.038 20.439 1.00 62.33 C ATOM 2394 O LEU B 26 32.180 -0.265 20.201 1.00 50.50 O ATOM 2395 CB LEU B 26 29.081 0.076 20.920 1.00 64.14 C ATOM 2396 CG LEU B 26 28.444 -0.541 19.667 1.00 70.42 C ATOM 2397 CD1 LEU B 26 27.754 -1.864 19.990 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.479 0.448 19.029 1.00 31.22 C ATOM 0 H LEU B 26 31.662 0.655 22.327 1.00 71.52 H new ATOM 0 HA LEU B 26 29.880 -1.638 21.942 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.310 0.182 21.683 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.425 1.080 20.673 1.00 64.14 H new ATOM 0 HG LEU B 26 29.235 -0.759 18.950 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.313 -2.275 19.082 1.00 23.12 H new ATOM 0 HD12 LEU B 26 28.485 -2.567 20.390 1.00 23.12 H new ATOM 0 HD13 LEU B 26 26.971 -1.695 20.729 1.00 23.12 H new ATOM 0 HD21 LEU B 26 27.033 -0.000 18.141 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.694 0.701 19.741 1.00 31.22 H new ATOM 0 HD23 LEU B 26 28.018 1.352 18.747 1.00 31.22 H new ATOM 2410 N ASP B 27 31.079 -2.184 19.781 1.00 22.45 N ATOM 2411 CA ASP B 27 31.964 -2.616 18.700 1.00 53.33 C ATOM 2412 C ASP B 27 31.249 -3.631 17.796 1.00 42.15 C ATOM 2413 O ASP B 27 31.249 -4.835 18.070 1.00 22.10 O ATOM 2414 CB ASP B 27 33.255 -3.209 19.290 1.00 24.13 C ATOM 2415 CG ASP B 27 34.223 -3.728 18.236 1.00 15.20 C ATOM 2416 OD1 ASP B 27 34.232 -4.946 17.969 1.00 3.40 O ATOM 2417 OD2 ASP B 27 34.987 -2.920 17.674 1.00 21.30 O1- ATOM 0 H ASP B 27 30.318 -2.833 19.981 1.00 22.45 H new ATOM 0 HA ASP B 27 32.230 -1.755 18.087 1.00 53.33 H new ATOM 0 HB2 ASP B 27 33.755 -2.447 19.887 1.00 24.13 H new ATOM 0 HB3 ASP B 27 32.995 -4.024 19.966 1.00 24.13 H new ATOM 2422 N VAL B 28 30.589 -3.124 16.749 1.00 42.42 N ATOM 2423 CA VAL B 28 29.879 -3.964 15.777 1.00 61.03 C ATOM 2424 C VAL B 28 29.990 -3.418 14.352 1.00 62.05 C ATOM 2425 O VAL B 28 30.582 -2.362 14.106 1.00 71.42 O ATOM 2426 CB VAL B 28 28.372 -4.125 16.122 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.174 -5.088 17.287 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.734 -2.767 16.415 1.00 74.12 C ATOM 0 H VAL B 28 30.532 -2.125 16.552 1.00 42.42 H new ATOM 0 HA VAL B 28 30.366 -4.937 15.833 1.00 61.03 H new ATOM 0 HB VAL B 28 27.872 -4.552 15.253 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.110 -5.181 17.506 1.00 44.41 H new ATOM 0 HG12 VAL B 28 28.577 -6.066 17.023 1.00 44.41 H new ATOM 0 HG13 VAL B 28 28.693 -4.707 18.166 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.679 -2.904 16.654 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.240 -2.302 17.261 1.00 74.12 H new ATOM 0 HG23 VAL B 28 27.827 -2.125 15.539 1.00 74.12 H new ATOM 2438 N LYS B 29 29.402 -4.163 13.424 1.00 64.31 N ATOM 2439 CA LYS B 29 29.377 -3.818 12.007 1.00 24.45 C ATOM 2440 C LYS B 29 27.937 -3.826 11.500 1.00 31.35 C ATOM 2441 O LYS B 29 27.117 -4.624 11.959 1.00 25.23 O ATOM 2442 CB LYS B 29 30.212 -4.841 11.224 1.00 11.40 C ATOM 2443 CG LYS B 29 29.925 -4.898 9.723 1.00 53.23 C ATOM 2444 CD LYS B 29 30.526 -6.138 9.052 1.00 3.25 C ATOM 2445 CE LYS B 29 32.037 -6.270 9.267 1.00 32.51 C ATOM 2446 NZ LYS B 29 32.382 -6.857 10.595 1.00 50.55 N1+ ATOM 0 H LYS B 29 28.922 -5.037 13.637 1.00 64.31 H new ATOM 0 HA LYS B 29 29.796 -2.822 11.865 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.268 -4.612 11.368 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.039 -5.830 11.649 1.00 11.40 H new ATOM 0 HG2 LYS B 29 28.847 -4.890 9.563 1.00 53.23 H new ATOM 0 HG3 LYS B 29 30.325 -4.003 9.247 1.00 53.23 H new ATOM 0 HD2 LYS B 29 30.031 -7.028 9.440 1.00 3.25 H new ATOM 0 HD3 LYS B 29 30.320 -6.100 7.982 1.00 3.25 H new ATOM 0 HE2 LYS B 29 32.459 -6.893 8.479 1.00 32.51 H new ATOM 0 HE3 LYS B 29 32.500 -5.287 9.178 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 32.779 -6.117 11.209 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 31.525 -7.249 11.034 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 33.083 -7.614 10.468 1.00 50.55 H new ATOM 2460 N LEU B 30 27.629 -2.946 10.554 1.00 60.42 N ATOM 2461 CA LEU B 30 26.323 -2.912 9.941 1.00 43.12 C ATOM 2462 C LEU B 30 26.448 -2.924 8.414 1.00 50.11 C ATOM 2463 O LEU B 30 27.553 -2.715 7.862 1.00 72.32 O ATOM 2464 CB LEU B 30 25.493 -1.717 10.463 1.00 4.40 C ATOM 2465 CG LEU B 30 26.162 -0.327 10.496 1.00 61.23 C ATOM 2466 CD1 LEU B 30 27.272 -0.228 11.545 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.665 0.063 9.117 1.00 52.40 C ATOM 0 H LEU B 30 28.278 -2.244 10.198 1.00 60.42 H new ATOM 0 HA LEU B 30 25.777 -3.812 10.225 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.596 -1.641 9.849 1.00 4.40 H new ATOM 0 HB3 LEU B 30 25.167 -1.954 11.476 1.00 4.40 H new ATOM 0 HG LEU B 30 25.395 0.387 10.796 1.00 61.23 H new ATOM 0 HD11 LEU B 30 27.706 0.772 11.522 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.856 -0.421 12.534 1.00 42.23 H new ATOM 0 HD13 LEU B 30 28.045 -0.964 11.327 1.00 42.23 H new ATOM 0 HD21 LEU B 30 27.133 1.046 9.165 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.396 -0.670 8.775 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.828 0.093 8.419 1.00 52.40 H new ATOM 2479 N SER B 31 25.324 -3.185 7.747 1.00 24.22 N ATOM 2480 CA SER B 31 25.291 -3.353 6.302 1.00 21.40 C ATOM 2481 C SER B 31 23.906 -3.032 5.742 1.00 43.34 C ATOM 2482 O SER B 31 22.892 -3.451 6.301 1.00 1.33 O ATOM 2483 CB SER B 31 25.674 -4.791 5.937 1.00 62.35 C ATOM 2484 OG SER B 31 26.941 -5.133 6.478 1.00 3.34 O ATOM 0 H SER B 31 24.414 -3.285 8.196 1.00 24.22 H new ATOM 0 HA SER B 31 26.008 -2.660 5.863 1.00 21.40 H new ATOM 0 HB2 SER B 31 24.917 -5.479 6.312 1.00 62.35 H new ATOM 0 HB3 SER B 31 25.696 -4.901 4.853 1.00 62.35 H new ATOM 0 HG SER B 31 27.644 -4.650 5.995 1.00 3.34 H new ATOM 2490 N ALA B 32 23.874 -2.285 4.643 1.00 40.52 N ATOM 2491 CA ALA B 32 22.632 -1.976 3.952 1.00 75.13 C ATOM 2492 C ALA B 32 22.132 -3.198 3.178 1.00 31.44 C ATOM 2493 O ALA B 32 22.902 -3.825 2.437 1.00 42.31 O ATOM 2494 CB ALA B 32 22.833 -0.792 3.010 1.00 44.15 C ATOM 0 H ALA B 32 24.704 -1.880 4.210 1.00 40.52 H new ATOM 0 HA ALA B 32 21.879 -1.707 4.693 1.00 75.13 H new ATOM 0 HB1 ALA B 32 21.896 -0.571 2.499 1.00 44.15 H new ATOM 0 HB2 ALA B 32 23.148 0.080 3.583 1.00 44.15 H new ATOM 0 HB3 ALA B 32 23.598 -1.038 2.274 1.00 44.15 H new ATOM 2500 N PRO B 33 20.842 -3.562 3.344 1.00 64.54 N ATOM 2501 CA PRO B 33 20.247 -4.704 2.647 1.00 71.30 C ATOM 2502 C PRO B 33 20.500 -4.636 1.141 1.00 44.54 C ATOM 2503 O PRO B 33 20.129 -3.665 0.472 1.00 60.20 O ATOM 2504 CB PRO B 33 18.744 -4.609 2.973 1.00 5.21 C ATOM 2505 CG PRO B 33 18.549 -3.265 3.601 1.00 53.32 C ATOM 2506 CD PRO B 33 19.867 -2.896 4.221 1.00 34.02 C ATOM 0 HA PRO B 33 20.679 -5.653 2.966 1.00 71.30 H new ATOM 0 HB2 PRO B 33 18.141 -4.711 2.071 1.00 5.21 H new ATOM 0 HB3 PRO B 33 18.440 -5.406 3.652 1.00 5.21 H new ATOM 0 HG2 PRO B 33 18.249 -2.527 2.857 1.00 53.32 H new ATOM 0 HG3 PRO B 33 17.761 -3.298 4.353 1.00 53.32 H new ATOM 0 HD2 PRO B 33 20.015 -1.816 4.243 1.00 34.02 H new ATOM 0 HD3 PRO B 33 19.942 -3.249 5.250 1.00 34.02 H new ATOM 2514 N ARG B 34 21.135 -5.683 0.621 1.00 0.10 N ATOM 2515 CA ARG B 34 21.567 -5.739 -0.775 1.00 23.43 C ATOM 2516 C ARG B 34 20.411 -5.389 -1.721 1.00 64.55 C ATOM 2517 O ARG B 34 20.611 -4.703 -2.722 1.00 62.12 O ATOM 2518 CB ARG B 34 22.113 -7.151 -1.078 1.00 33.02 C ATOM 2519 CG ARG B 34 23.138 -7.242 -2.219 1.00 11.34 C ATOM 2520 CD ARG B 34 22.617 -6.681 -3.533 1.00 70.25 C ATOM 2521 NE ARG B 34 23.482 -7.017 -4.667 1.00 41.11 N ATOM 2522 CZ ARG B 34 23.618 -6.263 -5.758 1.00 71.43 C ATOM 2523 NH1 ARG B 34 22.969 -5.110 -5.865 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 24.403 -6.671 -6.744 1.00 21.32 N ATOM 0 H ARG B 34 21.366 -6.520 1.157 1.00 0.10 H new ATOM 0 HA ARG B 34 22.356 -5.004 -0.936 1.00 23.43 H new ATOM 0 HB2 ARG B 34 22.572 -7.545 -0.171 1.00 33.02 H new ATOM 0 HB3 ARG B 34 21.272 -7.801 -1.318 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.041 -6.702 -1.933 1.00 11.34 H new ATOM 0 HG3 ARG B 34 23.422 -8.285 -2.363 1.00 11.34 H new ATOM 0 HD2 ARG B 34 21.615 -7.067 -3.718 1.00 70.25 H new ATOM 0 HD3 ARG B 34 22.532 -5.597 -3.454 1.00 70.25 H new ATOM 0 HE ARG B 34 24.015 -7.885 -4.618 1.00 41.11 H new ATOM 0 HH11 ARG B 34 22.361 -4.795 -5.109 1.00 70.13 H new ATOM 0 HH12 ARG B 34 23.079 -4.539 -6.703 1.00 70.13 H new ATOM 0 HH21 ARG B 34 24.900 -7.558 -6.666 1.00 21.32 H new ATOM 0 HH22 ARG B 34 24.510 -6.098 -7.581 1.00 21.32 H new ATOM 2538 N GLU B 35 19.208 -5.833 -1.360 1.00 42.24 N ATOM 2539 CA GLU B 35 18.029 -5.736 -2.229 1.00 63.02 C ATOM 2540 C GLU B 35 17.824 -4.324 -2.783 1.00 12.03 C ATOM 2541 O GLU B 35 17.425 -4.152 -3.937 1.00 54.43 O ATOM 2542 CB GLU B 35 16.757 -6.164 -1.473 1.00 72.41 C ATOM 2543 CG GLU B 35 16.941 -7.356 -0.539 1.00 31.33 C ATOM 2544 CD GLU B 35 17.767 -8.473 -1.151 1.00 34.33 C ATOM 2545 OE1 GLU B 35 18.902 -8.700 -0.674 1.00 72.42 O ATOM 2546 OE2 GLU B 35 17.297 -9.114 -2.113 1.00 24.25 O1- ATOM 0 H GLU B 35 19.020 -6.270 -0.458 1.00 42.24 H new ATOM 0 HA GLU B 35 18.211 -6.409 -3.067 1.00 63.02 H new ATOM 0 HB2 GLU B 35 16.394 -5.317 -0.891 1.00 72.41 H new ATOM 0 HB3 GLU B 35 15.982 -6.406 -2.201 1.00 72.41 H new ATOM 0 HG2 GLU B 35 17.421 -7.019 0.380 1.00 31.33 H new ATOM 0 HG3 GLU B 35 15.962 -7.747 -0.262 1.00 31.33 H new ATOM 2553 N LEU B 36 18.089 -3.316 -1.959 1.00 53.04 N ATOM 2554 CA LEU B 36 17.814 -1.932 -2.339 1.00 1.52 C ATOM 2555 C LEU B 36 19.014 -1.326 -3.065 1.00 52.10 C ATOM 2556 O LEU B 36 18.863 -0.416 -3.882 1.00 30.14 O ATOM 2557 CB LEU B 36 17.442 -1.086 -1.107 1.00 63.52 C ATOM 2558 CG LEU B 36 16.254 -1.606 -0.262 1.00 20.23 C ATOM 2559 CD1 LEU B 36 15.071 -2.002 -1.142 1.00 52.43 C ATOM 2560 CD2 LEU B 36 16.679 -2.774 0.624 1.00 15.21 C ATOM 0 H LEU B 36 18.492 -3.428 -1.029 1.00 53.04 H new ATOM 0 HA LEU B 36 16.962 -1.931 -3.019 1.00 1.52 H new ATOM 0 HB2 LEU B 36 18.318 -1.015 -0.462 1.00 63.52 H new ATOM 0 HB3 LEU B 36 17.209 -0.075 -1.442 1.00 63.52 H new ATOM 0 HG LEU B 36 15.932 -0.788 0.382 1.00 20.23 H new ATOM 0 HD11 LEU B 36 14.256 -2.362 -0.515 1.00 52.43 H new ATOM 0 HD12 LEU B 36 14.735 -1.135 -1.712 1.00 52.43 H new ATOM 0 HD13 LEU B 36 15.377 -2.791 -1.829 1.00 52.43 H new ATOM 0 HD21 LEU B 36 15.824 -3.119 1.206 1.00 15.21 H new ATOM 0 HD22 LEU B 36 17.046 -3.589 0.000 1.00 15.21 H new ATOM 0 HD23 LEU B 36 17.471 -2.449 1.299 1.00 15.21 H new ATOM 2572 N GLY B 37 20.202 -1.848 -2.771 1.00 22.45 N ATOM 2573 CA GLY B 37 21.416 -1.365 -3.413 1.00 25.41 C ATOM 2574 C GLY B 37 22.555 -1.171 -2.433 1.00 51.22 C ATOM 2575 O GLY B 37 23.256 -0.156 -2.476 1.00 30.40 O ATOM 0 H GLY B 37 20.347 -2.600 -2.097 1.00 22.45 H new ATOM 0 HA2 GLY B 37 21.721 -2.073 -4.184 1.00 25.41 H new ATOM 0 HA3 GLY B 37 21.207 -0.419 -3.913 1.00 25.41 H new ATOM 2579 N GLY B 38 22.748 -2.144 -1.545 1.00 53.33 N ATOM 2580 CA GLY B 38 23.828 -2.072 -0.588 1.00 54.12 C ATOM 2581 C GLY B 38 25.004 -2.919 -1.022 1.00 61.21 C ATOM 2582 O GLY B 38 25.360 -2.943 -2.202 1.00 64.12 O ATOM 0 H GLY B 38 22.171 -2.982 -1.475 1.00 53.33 H new ATOM 0 HA2 GLY B 38 24.146 -1.036 -0.473 1.00 54.12 H new ATOM 0 HA3 GLY B 38 23.476 -2.408 0.387 1.00 54.12 H new ATOM 2586 N ALA B 39 25.583 -3.638 -0.078 1.00 3.10 N ATOM 2587 CA ALA B 39 26.770 -4.458 -0.341 1.00 71.25 C ATOM 2588 C ALA B 39 26.485 -5.941 -0.130 1.00 4.43 C ATOM 2589 O ALA B 39 27.314 -6.796 -0.453 1.00 31.41 O ATOM 2590 CB ALA B 39 27.920 -4.012 0.553 1.00 12.41 C ATOM 0 H ALA B 39 25.254 -3.676 0.887 1.00 3.10 H new ATOM 0 HA ALA B 39 27.049 -4.319 -1.385 1.00 71.25 H new ATOM 0 HB1 ALA B 39 28.797 -4.626 0.351 1.00 12.41 H new ATOM 0 HB2 ALA B 39 28.154 -2.967 0.350 1.00 12.41 H new ATOM 0 HB3 ALA B 39 27.632 -4.123 1.598 1.00 12.41 H new ATOM 2596 N GLY B 40 25.303 -6.242 0.408 1.00 23.34 N ATOM 2597 CA GLY B 40 24.950 -7.621 0.729 1.00 31.44 C ATOM 2598 C GLY B 40 25.832 -8.216 1.808 1.00 1.42 C ATOM 2599 O GLY B 40 25.982 -9.435 1.895 1.00 53.13 O ATOM 0 H GLY B 40 24.581 -5.556 0.628 1.00 23.34 H new ATOM 0 HA2 GLY B 40 23.910 -7.659 1.054 1.00 31.44 H new ATOM 0 HA3 GLY B 40 25.025 -8.230 -0.172 1.00 31.44 H new ATOM 2603 N ALA B 41 26.404 -7.352 2.636 1.00 13.10 N ATOM 2604 CA ALA B 41 27.320 -7.783 3.688 1.00 45.11 C ATOM 2605 C ALA B 41 26.550 -8.347 4.884 1.00 24.05 C ATOM 2606 O ALA B 41 25.356 -8.087 5.044 1.00 14.44 O ATOM 2607 CB ALA B 41 28.226 -6.631 4.111 1.00 11.53 C ATOM 0 H ALA B 41 26.250 -6.344 2.600 1.00 13.10 H new ATOM 0 HA ALA B 41 27.948 -8.581 3.292 1.00 45.11 H new ATOM 0 HB1 ALA B 41 28.902 -6.969 4.896 1.00 11.53 H new ATOM 0 HB2 ALA B 41 28.806 -6.291 3.253 1.00 11.53 H new ATOM 0 HB3 ALA B 41 27.617 -5.808 4.486 1.00 11.53 H new ATOM 2613 N GLU B 42 27.245 -9.105 5.726 1.00 15.20 N ATOM 2614 CA GLU B 42 26.617 -9.833 6.834 1.00 53.20 C ATOM 2615 C GLU B 42 26.520 -8.977 8.105 1.00 74.14 C ATOM 2616 O GLU B 42 26.666 -9.485 9.222 1.00 53.42 O ATOM 2617 CB GLU B 42 27.412 -11.121 7.108 1.00 21.14 C ATOM 2618 CG GLU B 42 28.898 -10.889 7.378 1.00 73.23 C ATOM 2619 CD GLU B 42 29.680 -12.187 7.510 1.00 72.34 C ATOM 2620 OE1 GLU B 42 29.801 -12.705 8.640 1.00 61.42 O ATOM 2621 OE2 GLU B 42 30.175 -12.697 6.480 1.00 61.14 O1- ATOM 0 H GLU B 42 28.255 -9.235 5.664 1.00 15.20 H new ATOM 0 HA GLU B 42 25.597 -10.083 6.544 1.00 53.20 H new ATOM 0 HB2 GLU B 42 26.973 -11.631 7.965 1.00 21.14 H new ATOM 0 HB3 GLU B 42 27.309 -11.788 6.252 1.00 21.14 H new ATOM 0 HG2 GLU B 42 29.322 -10.295 6.568 1.00 73.23 H new ATOM 0 HG3 GLU B 42 29.010 -10.307 8.293 1.00 73.23 H new ATOM 2628 N GLY B 43 26.250 -7.686 7.932 1.00 33.24 N ATOM 2629 CA GLY B 43 26.109 -6.787 9.067 1.00 35.43 C ATOM 2630 C GLY B 43 24.656 -6.562 9.455 1.00 2.13 C ATOM 2631 O GLY B 43 23.777 -7.337 9.073 1.00 72.12 O ATOM 0 H GLY B 43 26.126 -7.244 7.021 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.650 -7.196 9.920 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.570 -5.829 8.827 1.00 35.43 H new ATOM 2635 N THR B 44 24.403 -5.501 10.218 1.00 33.20 N ATOM 2636 CA THR B 44 23.053 -5.164 10.664 1.00 33.40 C ATOM 2637 C THR B 44 22.453 -4.081 9.766 1.00 35.03 C ATOM 2638 O THR B 44 23.109 -3.087 9.469 1.00 4.14 O ATOM 2639 CB THR B 44 23.074 -4.669 12.128 1.00 13.15 C ATOM 2640 OG1 THR B 44 23.680 -5.667 12.961 1.00 1.03 O ATOM 2641 CG2 THR B 44 21.668 -4.365 12.636 1.00 34.45 C ATOM 0 H THR B 44 25.122 -4.855 10.543 1.00 33.20 H new ATOM 0 HA THR B 44 22.439 -6.062 10.602 1.00 33.40 H new ATOM 0 HB THR B 44 23.653 -3.746 12.166 1.00 13.15 H new ATOM 0 HG1 THR B 44 23.695 -5.353 13.889 1.00 1.03 H new ATOM 0 HG21 THR B 44 21.721 -4.020 13.668 1.00 34.45 H new ATOM 0 HG22 THR B 44 21.217 -3.590 12.017 1.00 34.45 H new ATOM 0 HG23 THR B 44 21.060 -5.268 12.586 1.00 34.45 H new ATOM 2649 N ASN B 45 21.214 -4.279 9.331 1.00 4.01 N ATOM 2650 CA ASN B 45 20.543 -3.322 8.454 1.00 51.43 C ATOM 2651 C ASN B 45 20.392 -1.958 9.138 1.00 21.43 C ATOM 2652 O ASN B 45 20.116 -1.890 10.338 1.00 31.35 O ATOM 2653 CB ASN B 45 19.166 -3.846 8.050 1.00 71.14 C ATOM 2654 CG ASN B 45 19.205 -5.134 7.252 1.00 11.33 C ATOM 2655 OD1 ASN B 45 20.101 -5.964 7.412 1.00 33.20 O ATOM 2656 ND2 ASN B 45 18.217 -5.311 6.392 1.00 55.34 N ATOM 0 H ASN B 45 20.651 -5.095 9.571 1.00 4.01 H new ATOM 0 HA ASN B 45 21.159 -3.199 7.563 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.572 -4.006 8.949 1.00 71.14 H new ATOM 0 HB3 ASN B 45 18.656 -3.082 7.463 1.00 71.14 H new ATOM 0 HD21 ASN B 45 18.177 -6.161 5.829 1.00 55.34 H new ATOM 0 HD22 ASN B 45 17.495 -4.598 6.291 1.00 55.34 H new ATOM 2663 N PRO B 46 20.564 -0.854 8.380 1.00 54.41 N ATOM 2664 CA PRO B 46 20.483 0.513 8.917 1.00 2.04 C ATOM 2665 C PRO B 46 19.094 0.859 9.459 1.00 14.41 C ATOM 2666 O PRO B 46 18.954 1.260 10.618 1.00 12.32 O ATOM 2667 CB PRO B 46 20.832 1.406 7.709 1.00 21.50 C ATOM 2668 CG PRO B 46 21.505 0.495 6.737 1.00 13.22 C ATOM 2669 CD PRO B 46 20.868 -0.850 6.940 1.00 31.44 C ATOM 0 HA PRO B 46 21.153 0.646 9.767 1.00 2.04 H new ATOM 0 HB2 PRO B 46 19.937 1.853 7.277 1.00 21.50 H new ATOM 0 HB3 PRO B 46 21.488 2.226 8.001 1.00 21.50 H new ATOM 0 HG2 PRO B 46 21.368 0.843 5.713 1.00 13.22 H new ATOM 0 HG3 PRO B 46 22.579 0.452 6.918 1.00 13.22 H new ATOM 0 HD2 PRO B 46 19.968 -0.966 6.336 1.00 31.44 H new ATOM 0 HD3 PRO B 46 21.542 -1.662 6.667 1.00 31.44 H new ATOM 2677 N GLU B 47 18.067 0.708 8.623 1.00 51.12 N ATOM 2678 CA GLU B 47 16.701 1.038 9.027 1.00 42.23 C ATOM 2679 C GLU B 47 16.242 0.099 10.144 1.00 51.31 C ATOM 2680 O GLU B 47 15.525 0.502 11.061 1.00 51.34 O ATOM 2681 CB GLU B 47 15.734 0.995 7.824 1.00 43.35 C ATOM 2682 CG GLU B 47 15.405 -0.400 7.283 1.00 13.13 C ATOM 2683 CD GLU B 47 16.624 -1.193 6.828 1.00 41.12 C ATOM 2684 OE1 GLU B 47 16.704 -2.393 7.156 1.00 53.12 O ATOM 2685 OE2 GLU B 47 17.509 -0.614 6.161 1.00 73.03 O1- ATOM 0 H GLU B 47 18.154 0.361 7.668 1.00 51.12 H new ATOM 0 HA GLU B 47 16.692 2.059 9.410 1.00 42.23 H new ATOM 0 HB2 GLU B 47 14.802 1.481 8.113 1.00 43.35 H new ATOM 0 HB3 GLU B 47 16.164 1.586 7.015 1.00 43.35 H new ATOM 0 HG2 GLU B 47 14.885 -0.965 8.057 1.00 13.13 H new ATOM 0 HG3 GLU B 47 14.716 -0.300 6.444 1.00 13.13 H new ATOM 2692 N GLN B 48 16.686 -1.152 10.061 1.00 65.22 N ATOM 2693 CA GLN B 48 16.452 -2.142 11.109 1.00 23.21 C ATOM 2694 C GLN B 48 17.083 -1.678 12.421 1.00 44.13 C ATOM 2695 O GLN B 48 16.506 -1.835 13.500 1.00 15.51 O ATOM 2696 CB GLN B 48 17.065 -3.480 10.681 1.00 21.32 C ATOM 2697 CG GLN B 48 16.883 -4.620 11.675 1.00 64.34 C ATOM 2698 CD GLN B 48 17.681 -5.853 11.278 1.00 23.41 C ATOM 2699 OE1 GLN B 48 17.199 -6.723 10.555 1.00 3.40 O ATOM 2700 NE2 GLN B 48 18.918 -5.931 11.746 1.00 12.54 N ATOM 0 H GLN B 48 17.218 -1.508 9.267 1.00 65.22 H new ATOM 0 HA GLN B 48 15.379 -2.262 11.261 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.626 -3.775 9.728 1.00 21.32 H new ATOM 0 HB3 GLN B 48 18.132 -3.335 10.509 1.00 21.32 H new ATOM 0 HG2 GLN B 48 17.194 -4.290 12.666 1.00 64.34 H new ATOM 0 HG3 GLN B 48 15.826 -4.878 11.742 1.00 64.34 H new ATOM 0 HE21 GLN B 48 19.285 -5.190 12.343 1.00 12.54 H new ATOM 0 HE22 GLN B 48 19.503 -6.732 11.509 1.00 12.54 H new ATOM 2709 N LEU B 49 18.275 -1.102 12.303 1.00 25.52 N ATOM 2710 CA LEU B 49 19.037 -0.626 13.450 1.00 12.42 C ATOM 2711 C LEU B 49 18.296 0.523 14.138 1.00 73.15 C ATOM 2712 O LEU B 49 18.083 0.494 15.353 1.00 22.33 O ATOM 2713 CB LEU B 49 20.444 -0.200 12.975 1.00 25.41 C ATOM 2714 CG LEU B 49 21.482 0.145 14.065 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.237 1.532 14.648 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.487 -0.914 15.168 1.00 31.54 C ATOM 0 H LEU B 49 18.740 -0.952 11.407 1.00 25.52 H new ATOM 0 HA LEU B 49 19.147 -1.423 14.185 1.00 12.42 H new ATOM 0 HB2 LEU B 49 20.852 -1.004 12.363 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.333 0.669 12.327 1.00 25.41 H new ATOM 0 HG LEU B 49 22.465 0.152 13.594 1.00 55.21 H new ATOM 0 HD11 LEU B 49 21.985 1.743 15.412 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.307 2.277 13.856 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.243 1.569 15.094 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.226 -0.649 15.924 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.500 -0.965 15.628 1.00 31.54 H new ATOM 0 HD23 LEU B 49 21.738 -1.884 14.740 1.00 31.54 H new ATOM 2728 N PHE B 50 17.895 1.523 13.354 1.00 74.53 N ATOM 2729 CA PHE B 50 17.155 2.670 13.885 1.00 13.24 C ATOM 2730 C PHE B 50 15.855 2.214 14.536 1.00 54.12 C ATOM 2731 O PHE B 50 15.553 2.598 15.664 1.00 20.22 O ATOM 2732 CB PHE B 50 16.862 3.693 12.775 1.00 14.34 C ATOM 2733 CG PHE B 50 15.885 4.784 13.173 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.176 5.673 14.200 1.00 53.13 C ATOM 2735 CD2 PHE B 50 14.678 4.929 12.501 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.291 6.675 14.548 1.00 14.14 C ATOM 2737 CE2 PHE B 50 13.788 5.927 12.848 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.094 6.801 13.874 1.00 62.30 C ATOM 0 H PHE B 50 18.069 1.563 12.350 1.00 74.53 H new ATOM 0 HA PHE B 50 17.775 3.150 14.642 1.00 13.24 H new ATOM 0 HB2 PHE B 50 17.800 4.156 12.467 1.00 14.34 H new ATOM 0 HB3 PHE B 50 16.466 3.166 11.907 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.109 5.579 14.735 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.432 4.252 11.696 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.536 7.359 15.347 1.00 14.14 H new ATOM 0 HE2 PHE B 50 12.852 6.024 12.317 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.398 7.580 14.147 1.00 62.30 H new ATOM 2748 N ALA B 51 15.090 1.398 13.816 1.00 24.13 N ATOM 2749 CA ALA B 51 13.831 0.861 14.331 1.00 31.22 C ATOM 2750 C ALA B 51 14.033 0.180 15.687 1.00 63.22 C ATOM 2751 O ALA B 51 13.316 0.465 16.648 1.00 61.14 O ATOM 2752 CB ALA B 51 13.225 -0.115 13.332 1.00 4.33 C ATOM 0 H ALA B 51 15.320 1.092 12.870 1.00 24.13 H new ATOM 0 HA ALA B 51 13.142 1.694 14.473 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.288 -0.507 13.729 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.033 0.400 12.391 1.00 4.33 H new ATOM 0 HB3 ALA B 51 13.919 -0.938 13.161 1.00 4.33 H new ATOM 2758 N ALA B 52 15.021 -0.712 15.753 1.00 2.41 N ATOM 2759 CA ALA B 52 15.332 -1.440 16.984 1.00 55.02 C ATOM 2760 C ALA B 52 15.689 -0.480 18.116 1.00 53.11 C ATOM 2761 O ALA B 52 15.155 -0.580 19.227 1.00 74.31 O ATOM 2762 CB ALA B 52 16.477 -2.417 16.742 1.00 43.35 C ATOM 0 H ALA B 52 15.623 -0.949 14.964 1.00 2.41 H new ATOM 0 HA ALA B 52 14.444 -1.998 17.281 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.699 -2.953 17.665 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.190 -3.130 15.969 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.362 -1.868 16.419 1.00 43.35 H new ATOM 2768 N GLY B 53 16.587 0.456 17.821 1.00 41.34 N ATOM 2769 CA GLY B 53 17.027 1.417 18.815 1.00 4.13 C ATOM 2770 C GLY B 53 15.906 2.330 19.262 1.00 15.42 C ATOM 2771 O GLY B 53 15.818 2.688 20.434 1.00 73.22 O ATOM 0 H GLY B 53 17.020 0.565 16.904 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.428 0.886 19.679 1.00 4.13 H new ATOM 0 HA3 GLY B 53 17.840 2.016 18.404 1.00 4.13 H new ATOM 2775 N TYR B 54 15.040 2.687 18.321 1.00 15.35 N ATOM 2776 CA TYR B 54 13.901 3.557 18.595 1.00 21.24 C ATOM 2777 C TYR B 54 12.869 2.806 19.432 1.00 2.44 C ATOM 2778 O TYR B 54 12.235 3.380 20.313 1.00 55.40 O ATOM 2779 CB TYR B 54 13.292 4.047 17.267 1.00 22.10 C ATOM 2780 CG TYR B 54 12.116 5.009 17.396 1.00 24.43 C ATOM 2781 CD1 TYR B 54 11.934 5.802 18.530 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.192 5.130 16.362 1.00 20.22 C ATOM 2783 CE1 TYR B 54 10.867 6.677 18.623 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.126 6.003 16.452 1.00 11.21 C ATOM 2785 CZ TYR B 54 9.969 6.774 17.582 1.00 15.31 C ATOM 2786 OH TYR B 54 8.910 7.648 17.676 1.00 73.14 O ATOM 0 H TYR B 54 15.106 2.383 17.350 1.00 15.35 H new ATOM 0 HA TYR B 54 14.230 4.428 19.162 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.075 4.535 16.687 1.00 22.10 H new ATOM 0 HB3 TYR B 54 12.966 3.178 16.695 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.637 5.731 19.347 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.311 4.530 15.472 1.00 20.22 H new ATOM 0 HE1 TYR B 54 10.738 7.282 19.508 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.419 6.081 15.640 1.00 11.21 H new ATOM 0 HH TYR B 54 9.070 8.278 18.410 1.00 73.14 H new ATOM 2796 N SER B 55 12.730 1.512 19.164 1.00 62.44 N ATOM 2797 CA SER B 55 11.811 0.662 19.912 1.00 11.44 C ATOM 2798 C SER B 55 12.256 0.585 21.375 1.00 45.34 C ATOM 2799 O SER B 55 11.472 0.836 22.296 1.00 23.33 O ATOM 2800 CB SER B 55 11.772 -0.738 19.280 1.00 71.55 C ATOM 2801 OG SER B 55 10.704 -1.509 19.792 1.00 22.42 O ATOM 0 H SER B 55 13.246 1.027 18.430 1.00 62.44 H new ATOM 0 HA SER B 55 10.808 1.086 19.877 1.00 11.44 H new ATOM 0 HB2 SER B 55 11.671 -0.647 18.199 1.00 71.55 H new ATOM 0 HB3 SER B 55 12.715 -1.250 19.470 1.00 71.55 H new ATOM 0 HG SER B 55 10.985 -1.946 20.623 1.00 22.42 H new ATOM 2807 N ALA B 56 13.532 0.268 21.573 1.00 72.32 N ATOM 2808 CA ALA B 56 14.107 0.172 22.910 1.00 72.14 C ATOM 2809 C ALA B 56 14.103 1.536 23.601 1.00 34.31 C ATOM 2810 O ALA B 56 13.797 1.643 24.791 1.00 51.54 O ATOM 2811 CB ALA B 56 15.521 -0.388 22.834 1.00 11.32 C ATOM 0 H ALA B 56 14.191 0.072 20.819 1.00 72.32 H new ATOM 0 HA ALA B 56 13.495 -0.508 23.503 1.00 72.14 H new ATOM 0 HB1 ALA B 56 15.940 -0.455 23.838 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.496 -1.381 22.384 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.141 0.270 22.225 1.00 11.32 H new ATOM 2817 N CYS B 57 14.434 2.575 22.838 1.00 24.02 N ATOM 2818 CA CYS B 57 14.441 3.941 23.351 1.00 54.22 C ATOM 2819 C CYS B 57 13.032 4.350 23.762 1.00 22.14 C ATOM 2820 O CYS B 57 12.841 5.013 24.778 1.00 1.03 O ATOM 2821 CB CYS B 57 14.986 4.916 22.296 1.00 72.40 C ATOM 2822 SG CYS B 57 15.036 6.644 22.830 1.00 42.35 S ATOM 0 H CYS B 57 14.702 2.495 21.857 1.00 24.02 H new ATOM 0 HA CYS B 57 15.094 3.979 24.223 1.00 54.22 H new ATOM 0 HB2 CYS B 57 15.993 4.605 22.018 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.371 4.843 21.399 1.00 72.40 H new ATOM 0 HG CYS B 57 16.273 7.029 22.938 1.00 42.35 H new ATOM 2828 N PHE B 58 12.047 3.916 22.980 1.00 34.03 N ATOM 2829 CA PHE B 58 10.656 4.266 23.231 1.00 42.11 C ATOM 2830 C PHE B 58 10.191 3.616 24.529 1.00 1.15 C ATOM 2831 O PHE B 58 9.409 4.193 25.282 1.00 52.32 O ATOM 2832 CB PHE B 58 9.776 3.817 22.057 1.00 13.13 C ATOM 2833 CG PHE B 58 8.431 4.493 22.014 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.304 3.885 22.553 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.297 5.746 21.434 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.074 4.517 22.512 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.075 6.378 21.389 1.00 25.32 C ATOM 2838 CZ PHE B 58 5.959 5.765 21.929 1.00 52.03 C ATOM 0 H PHE B 58 12.190 3.319 22.165 1.00 34.03 H new ATOM 0 HA PHE B 58 10.570 5.348 23.328 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.302 4.016 21.123 1.00 13.13 H new ATOM 0 HB3 PHE B 58 9.629 2.739 22.117 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.389 2.909 23.008 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.164 6.233 21.012 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.205 4.036 22.935 1.00 5.05 H new ATOM 0 HE2 PHE B 58 6.988 7.353 20.932 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.000 6.260 21.895 1.00 52.03 H new ATOM 2848 N LEU B 59 10.696 2.412 24.782 1.00 60.43 N ATOM 2849 CA LEU B 59 10.380 1.678 26.001 1.00 11.12 C ATOM 2850 C LEU B 59 10.908 2.424 27.229 1.00 60.54 C ATOM 2851 O LEU B 59 10.153 2.725 28.156 1.00 64.41 O ATOM 2852 CB LEU B 59 10.977 0.263 25.937 1.00 33.41 C ATOM 2853 CG LEU B 59 10.703 -0.630 27.160 1.00 23.42 C ATOM 2854 CD1 LEU B 59 9.202 -0.853 27.346 1.00 12.45 C ATOM 2855 CD2 LEU B 59 11.437 -1.963 27.030 1.00 24.24 C ATOM 0 H LEU B 59 11.331 1.921 24.152 1.00 60.43 H new ATOM 0 HA LEU B 59 9.296 1.598 26.087 1.00 11.12 H new ATOM 0 HB2 LEU B 59 10.587 -0.237 25.050 1.00 33.41 H new ATOM 0 HB3 LEU B 59 12.056 0.349 25.806 1.00 33.41 H new ATOM 0 HG LEU B 59 11.080 -0.118 28.045 1.00 23.42 H new ATOM 0 HD11 LEU B 59 9.033 -1.487 28.216 1.00 12.45 H new ATOM 0 HD12 LEU B 59 8.707 0.107 27.495 1.00 12.45 H new ATOM 0 HD13 LEU B 59 8.794 -1.338 26.459 1.00 12.45 H new ATOM 0 HD21 LEU B 59 11.230 -2.579 27.905 1.00 24.24 H new ATOM 0 HD22 LEU B 59 11.096 -2.480 26.133 1.00 24.24 H new ATOM 0 HD23 LEU B 59 12.510 -1.782 26.959 1.00 24.24 H new ATOM 2867 N SER B 60 12.203 2.738 27.220 1.00 44.21 N ATOM 2868 CA SER B 60 12.838 3.417 28.350 1.00 2.40 C ATOM 2869 C SER B 60 12.258 4.827 28.521 1.00 73.23 C ATOM 2870 O SER B 60 11.973 5.270 29.641 1.00 65.55 O ATOM 2871 CB SER B 60 14.362 3.470 28.149 1.00 63.24 C ATOM 2872 OG SER B 60 15.029 3.854 29.340 1.00 24.13 O ATOM 0 H SER B 60 12.833 2.534 26.444 1.00 44.21 H new ATOM 0 HA SER B 60 12.632 2.854 29.260 1.00 2.40 H new ATOM 0 HB2 SER B 60 14.722 2.493 27.828 1.00 63.24 H new ATOM 0 HB3 SER B 60 14.601 4.175 27.353 1.00 63.24 H new ATOM 0 HG SER B 60 15.506 3.083 29.711 1.00 24.13 H new ATOM 2878 N ALA B 61 12.057 5.516 27.397 1.00 21.42 N ATOM 2879 CA ALA B 61 11.457 6.847 27.405 1.00 31.00 C ATOM 2880 C ALA B 61 10.064 6.793 28.019 1.00 42.41 C ATOM 2881 O ALA B 61 9.713 7.622 28.854 1.00 44.10 O ATOM 2882 CB ALA B 61 11.397 7.422 25.993 1.00 4.34 C ATOM 0 H ALA B 61 12.302 5.172 26.469 1.00 21.42 H new ATOM 0 HA ALA B 61 12.081 7.503 28.012 1.00 31.00 H new ATOM 0 HB1 ALA B 61 10.946 8.414 26.023 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.406 7.494 25.586 1.00 4.34 H new ATOM 0 HB3 ALA B 61 10.796 6.770 25.360 1.00 4.34 H new ATOM 2888 N MET B 62 9.286 5.795 27.606 1.00 64.12 N ATOM 2889 CA MET B 62 7.944 5.569 28.142 1.00 62.41 C ATOM 2890 C MET B 62 8.003 5.402 29.663 1.00 51.11 C ATOM 2891 O MET B 62 7.143 5.903 30.393 1.00 53.32 O ATOM 2892 CB MET B 62 7.329 4.320 27.484 1.00 4.11 C ATOM 2893 CG MET B 62 5.902 3.980 27.915 1.00 71.00 C ATOM 2894 SD MET B 62 4.652 5.141 27.313 1.00 51.43 S ATOM 2895 CE MET B 62 4.686 6.414 28.572 1.00 33.40 C ATOM 0 H MET B 62 9.566 5.122 26.893 1.00 64.12 H new ATOM 0 HA MET B 62 7.317 6.432 27.917 1.00 62.41 H new ATOM 0 HB2 MET B 62 7.339 4.459 26.403 1.00 4.11 H new ATOM 0 HB3 MET B 62 7.969 3.465 27.702 1.00 4.11 H new ATOM 0 HG2 MET B 62 5.655 2.980 27.559 1.00 71.00 H new ATOM 0 HG3 MET B 62 5.860 3.950 29.004 1.00 71.00 H new ATOM 0 HE1 MET B 62 3.680 6.808 28.718 1.00 33.40 H new ATOM 0 HE2 MET B 62 5.049 5.990 29.508 1.00 33.40 H new ATOM 0 HE3 MET B 62 5.349 7.220 28.257 1.00 33.40 H new ATOM 2905 N LYS B 63 9.040 4.709 30.131 1.00 72.03 N ATOM 2906 CA LYS B 63 9.254 4.502 31.562 1.00 43.00 C ATOM 2907 C LYS B 63 9.473 5.838 32.274 1.00 70.35 C ATOM 2908 O LYS B 63 8.797 6.143 33.258 1.00 23.43 O ATOM 2909 CB LYS B 63 10.460 3.577 31.792 1.00 31.31 C ATOM 2910 CG LYS B 63 10.273 2.165 31.239 1.00 20.13 C ATOM 2911 CD LYS B 63 11.587 1.385 31.212 1.00 10.22 C ATOM 2912 CE LYS B 63 12.188 1.212 32.603 1.00 1.23 C ATOM 2913 NZ LYS B 63 13.522 0.562 32.546 1.00 55.13 N1+ ATOM 0 H LYS B 63 9.748 4.279 29.536 1.00 72.03 H new ATOM 0 HA LYS B 63 8.363 4.031 31.977 1.00 43.00 H new ATOM 0 HB2 LYS B 63 11.341 4.023 31.330 1.00 31.31 H new ATOM 0 HB3 LYS B 63 10.658 3.514 32.862 1.00 31.31 H new ATOM 0 HG2 LYS B 63 9.545 1.630 31.849 1.00 20.13 H new ATOM 0 HG3 LYS B 63 9.863 2.221 30.230 1.00 20.13 H new ATOM 0 HD2 LYS B 63 11.415 0.404 30.769 1.00 10.22 H new ATOM 0 HD3 LYS B 63 12.301 1.903 30.572 1.00 10.22 H new ATOM 0 HE2 LYS B 63 12.278 2.186 33.085 1.00 1.23 H new ATOM 0 HE3 LYS B 63 11.517 0.613 33.218 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 13.618 -0.105 33.339 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 13.619 0.048 31.647 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 14.265 1.287 32.612 1.00 55.13 H new ATOM 2927 N PHE B 64 10.409 6.641 31.763 1.00 21.33 N ATOM 2928 CA PHE B 64 10.696 7.948 32.361 1.00 32.24 C ATOM 2929 C PHE B 64 9.473 8.862 32.272 1.00 14.21 C ATOM 2930 O PHE B 64 9.189 9.636 33.191 1.00 73.11 O ATOM 2931 CB PHE B 64 11.908 8.613 31.691 1.00 30.41 C ATOM 2932 CG PHE B 64 12.248 9.962 32.285 1.00 63.34 C ATOM 2933 CD1 PHE B 64 12.571 10.076 33.631 1.00 43.42 C ATOM 2934 CD2 PHE B 64 12.233 11.113 31.507 1.00 31.33 C ATOM 2935 CE1 PHE B 64 12.870 11.306 34.186 1.00 55.11 C ATOM 2936 CE2 PHE B 64 12.533 12.343 32.058 1.00 33.41 C ATOM 2937 CZ PHE B 64 12.851 12.440 33.399 1.00 14.04 C ATOM 0 H PHE B 64 10.976 6.414 30.946 1.00 21.33 H new ATOM 0 HA PHE B 64 10.937 7.786 33.412 1.00 32.24 H new ATOM 0 HB2 PHE B 64 12.772 7.955 31.781 1.00 30.41 H new ATOM 0 HB3 PHE B 64 11.707 8.732 30.626 1.00 30.41 H new ATOM 0 HD1 PHE B 64 12.589 9.192 34.252 1.00 43.42 H new ATOM 0 HD2 PHE B 64 11.984 11.045 30.458 1.00 31.33 H new ATOM 0 HE1 PHE B 64 13.118 11.380 35.234 1.00 55.11 H new ATOM 0 HE2 PHE B 64 12.519 13.229 31.441 1.00 33.41 H new ATOM 0 HZ PHE B 64 13.084 13.402 33.831 1.00 14.04 H new ATOM 2947 N VAL B 65 8.751 8.763 31.163 1.00 75.05 N ATOM 2948 CA VAL B 65 7.519 9.520 30.974 1.00 40.30 C ATOM 2949 C VAL B 65 6.517 9.176 32.072 1.00 43.44 C ATOM 2950 O VAL B 65 5.871 10.061 32.637 1.00 35.52 O ATOM 2951 CB VAL B 65 6.888 9.249 29.583 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.450 9.758 29.524 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.729 9.890 28.479 1.00 51.21 C ATOM 0 H VAL B 65 8.999 8.163 30.377 1.00 75.05 H new ATOM 0 HA VAL B 65 7.771 10.579 31.029 1.00 40.30 H new ATOM 0 HB VAL B 65 6.871 8.171 29.425 1.00 54.45 H new ATOM 0 HG11 VAL B 65 5.032 9.555 28.538 1.00 70.43 H new ATOM 0 HG12 VAL B 65 4.853 9.251 30.282 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.436 10.832 29.710 1.00 70.43 H new ATOM 0 HG21 VAL B 65 7.271 9.690 27.510 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.781 10.967 28.640 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.735 9.471 28.499 1.00 51.21 H new ATOM 2963 N ALA B 66 6.409 7.890 32.381 1.00 30.22 N ATOM 2964 CA ALA B 66 5.530 7.430 33.450 1.00 74.13 C ATOM 2965 C ALA B 66 5.919 8.076 34.778 1.00 44.35 C ATOM 2966 O ALA B 66 5.066 8.358 35.621 1.00 34.23 O ATOM 2967 CB ALA B 66 5.582 5.912 33.563 1.00 23.44 C ATOM 0 H ALA B 66 6.920 7.146 31.906 1.00 30.22 H new ATOM 0 HA ALA B 66 4.509 7.726 33.209 1.00 74.13 H new ATOM 0 HB1 ALA B 66 4.921 5.584 34.365 1.00 23.44 H new ATOM 0 HB2 ALA B 66 5.260 5.466 32.622 1.00 23.44 H new ATOM 0 HB3 ALA B 66 6.602 5.598 33.783 1.00 23.44 H new ATOM 2973 N GLY B 67 7.212 8.348 34.925 1.00 23.35 N ATOM 2974 CA GLY B 67 7.736 8.909 36.161 1.00 73.24 C ATOM 2975 C GLY B 67 7.321 10.354 36.356 1.00 45.13 C ATOM 2976 O GLY B 67 7.163 10.820 37.486 1.00 75.04 O ATOM 0 H GLY B 67 7.914 8.188 34.203 1.00 23.35 H new ATOM 0 HA2 GLY B 67 7.385 8.315 37.005 1.00 73.24 H new ATOM 0 HA3 GLY B 67 8.824 8.843 36.155 1.00 73.24 H new ATOM 2980 N GLN B 68 7.131 11.060 35.246 1.00 2.12 N ATOM 2981 CA GLN B 68 6.721 12.464 35.277 1.00 44.13 C ATOM 2982 C GLN B 68 5.211 12.563 35.087 1.00 40.32 C ATOM 2983 O GLN B 68 4.603 13.602 35.341 1.00 64.50 O ATOM 2984 CB GLN B 68 7.461 13.267 34.197 1.00 33.05 C ATOM 2985 CG GLN B 68 7.344 12.669 32.802 1.00 52.44 C ATOM 2986 CD GLN B 68 8.014 13.517 31.734 1.00 54.32 C ATOM 2987 OE1 GLN B 68 7.390 14.394 31.140 1.00 53.51 O ATOM 2988 NE2 GLN B 68 9.289 13.256 31.477 1.00 53.21 N ATOM 0 H GLN B 68 7.255 10.682 34.307 1.00 2.12 H new ATOM 0 HA GLN B 68 6.981 12.889 36.246 1.00 44.13 H new ATOM 0 HB2 GLN B 68 7.069 14.284 34.181 1.00 33.05 H new ATOM 0 HB3 GLN B 68 8.515 13.336 34.466 1.00 33.05 H new ATOM 0 HG2 GLN B 68 7.790 11.674 32.801 1.00 52.44 H new ATOM 0 HG3 GLN B 68 6.290 12.546 32.553 1.00 52.44 H new ATOM 0 HE21 GLN B 68 9.773 12.520 31.992 1.00 53.21 H new ATOM 0 HE22 GLN B 68 9.786 13.791 30.765 1.00 53.21 H new ATOM 2997 N ASN B 69 4.618 11.459 34.640 1.00 21.43 N ATOM 2998 CA ASN B 69 3.169 11.357 34.478 1.00 41.54 C ATOM 2999 C ASN B 69 2.530 10.710 35.705 1.00 23.00 C ATOM 3000 O ASN B 69 1.310 10.562 35.768 1.00 34.41 O ATOM 3001 CB ASN B 69 2.826 10.573 33.203 1.00 65.13 C ATOM 3002 CG ASN B 69 2.760 11.468 31.977 1.00 21.52 C ATOM 3003 OD1 ASN B 69 1.693 11.953 31.604 1.00 65.21 O ATOM 3004 ND2 ASN B 69 3.901 11.713 31.353 1.00 45.52 N ATOM 0 H ASN B 69 5.125 10.613 34.381 1.00 21.43 H new ATOM 0 HA ASN B 69 2.762 12.363 34.380 1.00 41.54 H new ATOM 0 HB2 ASN B 69 3.575 9.797 33.044 1.00 65.13 H new ATOM 0 HB3 ASN B 69 1.868 10.070 33.335 1.00 65.13 H new ATOM 0 HD21 ASN B 69 3.914 12.322 30.535 1.00 45.52 H new ATOM 0 HD22 ASN B 69 4.767 11.293 31.691 1.00 45.52 H new ATOM 3011 N LYS B 70 3.373 10.329 36.672 1.00 4.22 N ATOM 3012 CA LYS B 70 2.917 9.804 37.962 1.00 71.04 C ATOM 3013 C LYS B 70 2.105 8.521 37.787 1.00 55.13 C ATOM 3014 O LYS B 70 1.236 8.201 38.600 1.00 71.33 O ATOM 3015 CB LYS B 70 2.111 10.880 38.716 1.00 43.15 C ATOM 3016 CG LYS B 70 2.979 11.924 39.423 1.00 61.50 C ATOM 3017 CD LYS B 70 4.147 12.396 38.558 1.00 21.25 C ATOM 3018 CE LYS B 70 4.893 13.570 39.183 1.00 20.34 C ATOM 3019 NZ LYS B 70 4.062 14.801 39.234 1.00 73.12 N1+ ATOM 0 H LYS B 70 4.388 10.376 36.582 1.00 4.22 H new ATOM 0 HA LYS B 70 3.793 9.548 38.558 1.00 71.04 H new ATOM 0 HB2 LYS B 70 1.452 11.387 38.011 1.00 43.15 H new ATOM 0 HB3 LYS B 70 1.474 10.392 39.454 1.00 43.15 H new ATOM 0 HG2 LYS B 70 2.362 12.781 39.694 1.00 61.50 H new ATOM 0 HG3 LYS B 70 3.365 11.503 40.351 1.00 61.50 H new ATOM 0 HD2 LYS B 70 4.840 11.569 38.404 1.00 21.25 H new ATOM 0 HD3 LYS B 70 3.774 12.687 37.576 1.00 21.25 H new ATOM 0 HE2 LYS B 70 5.206 13.303 40.192 1.00 20.34 H new ATOM 0 HE3 LYS B 70 5.799 13.769 38.610 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 4.666 15.618 39.456 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 3.604 14.949 38.312 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 3.334 14.698 39.969 1.00 73.12 H new ATOM 3033 N GLN B 71 2.427 7.778 36.735 1.00 41.03 N ATOM 3034 CA GLN B 71 1.755 6.521 36.430 1.00 14.44 C ATOM 3035 C GLN B 71 2.750 5.365 36.461 1.00 73.31 C ATOM 3036 O GLN B 71 3.965 5.576 36.448 1.00 34.15 O ATOM 3037 CB GLN B 71 1.066 6.591 35.057 1.00 1.40 C ATOM 3038 CG GLN B 71 1.963 7.136 33.956 1.00 33.32 C ATOM 3039 CD GLN B 71 1.610 6.617 32.575 1.00 34.04 C ATOM 3040 OE1 GLN B 71 0.747 7.158 31.885 1.00 74.24 O ATOM 3041 NE2 GLN B 71 2.316 5.585 32.154 1.00 0.43 N ATOM 0 H GLN B 71 3.159 8.029 36.071 1.00 41.03 H new ATOM 0 HA GLN B 71 0.993 6.349 37.190 1.00 14.44 H new ATOM 0 HB2 GLN B 71 0.727 5.593 34.778 1.00 1.40 H new ATOM 0 HB3 GLN B 71 0.179 7.219 35.136 1.00 1.40 H new ATOM 0 HG2 GLN B 71 1.901 8.224 33.953 1.00 33.32 H new ATOM 0 HG3 GLN B 71 2.998 6.876 34.179 1.00 33.32 H new ATOM 0 HE21 GLN B 71 3.022 5.168 32.761 1.00 0.43 H new ATOM 0 HE22 GLN B 71 2.156 5.204 31.221 1.00 0.43 H new ATOM 3050 N THR B 72 2.227 4.147 36.482 1.00 1.35 N ATOM 3051 CA THR B 72 3.044 2.943 36.581 1.00 51.41 C ATOM 3052 C THR B 72 2.715 1.961 35.463 1.00 74.12 C ATOM 3053 O THR B 72 1.555 1.601 35.261 1.00 25.05 O ATOM 3054 CB THR B 72 2.842 2.251 37.946 1.00 13.02 C ATOM 3055 OG1 THR B 72 1.439 2.172 38.251 1.00 4.22 O ATOM 3056 CG2 THR B 72 3.575 3.003 39.051 1.00 71.50 C ATOM 0 H THR B 72 1.225 3.964 36.431 1.00 1.35 H new ATOM 0 HA THR B 72 4.086 3.250 36.486 1.00 51.41 H new ATOM 0 HB THR B 72 3.255 1.244 37.886 1.00 13.02 H new ATOM 0 HG1 THR B 72 0.938 1.965 37.435 1.00 4.22 H new ATOM 0 HG21 THR B 72 3.417 2.496 40.003 1.00 71.50 H new ATOM 0 HG22 THR B 72 4.641 3.031 38.827 1.00 71.50 H new ATOM 0 HG23 THR B 72 3.191 4.021 39.115 1.00 71.50 H new ATOM 3064 N LEU B 73 3.740 1.554 34.727 1.00 74.12 N ATOM 3065 CA LEU B 73 3.584 0.604 33.626 1.00 52.35 C ATOM 3066 C LEU B 73 4.207 -0.755 33.971 1.00 64.24 C ATOM 3067 O LEU B 73 5.259 -0.809 34.610 1.00 14.14 O ATOM 3068 CB LEU B 73 4.186 1.170 32.327 1.00 75.15 C ATOM 3069 CG LEU B 73 5.188 2.311 32.520 1.00 62.34 C ATOM 3070 CD1 LEU B 73 6.474 1.822 33.189 1.00 33.12 C ATOM 3071 CD2 LEU B 73 5.493 2.997 31.195 1.00 51.14 C ATOM 0 H LEU B 73 4.699 1.869 34.872 1.00 74.12 H new ATOM 0 HA LEU B 73 2.517 0.449 33.468 1.00 52.35 H new ATOM 0 HB2 LEU B 73 4.680 0.360 31.791 1.00 75.15 H new ATOM 0 HB3 LEU B 73 3.374 1.524 31.692 1.00 75.15 H new ATOM 0 HG LEU B 73 4.728 3.042 33.185 1.00 62.34 H new ATOM 0 HD11 LEU B 73 7.162 2.659 33.310 1.00 33.12 H new ATOM 0 HD12 LEU B 73 6.238 1.402 34.167 1.00 33.12 H new ATOM 0 HD13 LEU B 73 6.939 1.057 32.568 1.00 33.12 H new ATOM 0 HD21 LEU B 73 6.207 3.804 31.359 1.00 51.14 H new ATOM 0 HD22 LEU B 73 5.917 2.273 30.499 1.00 51.14 H new ATOM 0 HD23 LEU B 73 4.573 3.406 30.777 1.00 51.14 H new ATOM 3083 N PRO B 74 3.555 -1.867 33.573 1.00 22.31 N ATOM 3084 CA PRO B 74 4.130 -3.216 33.700 1.00 33.15 C ATOM 3085 C PRO B 74 5.428 -3.347 32.901 1.00 51.21 C ATOM 3086 O PRO B 74 5.430 -3.165 31.684 1.00 62.01 O ATOM 3087 CB PRO B 74 3.050 -4.132 33.102 1.00 23.12 C ATOM 3088 CG PRO B 74 1.788 -3.338 33.182 1.00 12.13 C ATOM 3089 CD PRO B 74 2.199 -1.902 32.996 1.00 51.43 C ATOM 0 HA PRO B 74 4.383 -3.459 34.732 1.00 33.15 H new ATOM 0 HB2 PRO B 74 3.284 -4.399 32.072 1.00 23.12 H new ATOM 0 HB3 PRO B 74 2.967 -5.064 33.662 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.082 -3.646 32.411 1.00 12.13 H new ATOM 0 HG3 PRO B 74 1.294 -3.483 34.143 1.00 12.13 H new ATOM 0 HD2 PRO B 74 2.201 -1.616 31.944 1.00 51.43 H new ATOM 0 HD3 PRO B 74 1.524 -1.219 33.511 1.00 51.43 H new ATOM 3097 N ALA B 75 6.522 -3.671 33.581 1.00 24.41 N ATOM 3098 CA ALA B 75 7.833 -3.745 32.938 1.00 71.53 C ATOM 3099 C ALA B 75 7.999 -5.028 32.119 1.00 71.01 C ATOM 3100 O ALA B 75 9.005 -5.210 31.437 1.00 12.42 O ATOM 3101 CB ALA B 75 8.939 -3.627 33.980 1.00 50.55 C ATOM 0 H ALA B 75 6.529 -3.887 34.578 1.00 24.41 H new ATOM 0 HA ALA B 75 7.907 -2.908 32.244 1.00 71.53 H new ATOM 0 HB1 ALA B 75 9.910 -3.684 33.488 1.00 50.55 H new ATOM 0 HB2 ALA B 75 8.850 -2.672 34.498 1.00 50.55 H new ATOM 0 HB3 ALA B 75 8.849 -4.441 34.700 1.00 50.55 H new ATOM 3107 N ASP B 76 7.004 -5.908 32.178 1.00 24.20 N ATOM 3108 CA ASP B 76 7.047 -7.181 31.447 1.00 60.22 C ATOM 3109 C ASP B 76 6.651 -6.983 29.977 1.00 14.12 C ATOM 3110 O ASP B 76 6.612 -7.931 29.190 1.00 34.13 O ATOM 3111 CB ASP B 76 6.116 -8.200 32.126 1.00 21.51 C ATOM 3112 CG ASP B 76 6.177 -9.585 31.495 1.00 33.51 C ATOM 3113 OD1 ASP B 76 5.220 -9.976 30.795 1.00 23.44 O ATOM 3114 OD2 ASP B 76 7.184 -10.295 31.704 1.00 41.11 O1- ATOM 0 H ASP B 76 6.154 -5.767 32.724 1.00 24.20 H new ATOM 0 HA ASP B 76 8.068 -7.562 31.468 1.00 60.22 H new ATOM 0 HB2 ASP B 76 6.380 -8.277 33.181 1.00 21.51 H new ATOM 0 HB3 ASP B 76 5.091 -7.832 32.080 1.00 21.51 H new ATOM 3119 N THR B 77 6.387 -5.734 29.618 1.00 44.41 N ATOM 3120 CA THR B 77 5.917 -5.380 28.282 1.00 1.21 C ATOM 3121 C THR B 77 7.001 -5.564 27.212 1.00 31.44 C ATOM 3122 O THR B 77 8.183 -5.757 27.518 1.00 72.52 O ATOM 3123 CB THR B 77 5.405 -3.915 28.257 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.101 -3.511 26.916 1.00 73.25 O ATOM 3125 CG2 THR B 77 6.433 -2.957 28.852 1.00 30.02 C ATOM 0 H THR B 77 6.492 -4.936 30.244 1.00 44.41 H new ATOM 0 HA THR B 77 5.099 -6.061 28.046 1.00 1.21 H new ATOM 0 HB THR B 77 4.500 -3.876 28.863 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.336 -4.026 26.585 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.044 -1.939 28.819 1.00 30.02 H new ATOM 0 HG22 THR B 77 6.634 -3.236 29.886 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.357 -3.011 28.276 1.00 30.02 H new ATOM 3133 N THR B 78 6.569 -5.508 25.954 1.00 70.31 N ATOM 3134 CA THR B 78 7.455 -5.580 24.800 1.00 64.53 C ATOM 3135 C THR B 78 7.021 -4.569 23.743 1.00 71.23 C ATOM 3136 O THR B 78 5.836 -4.253 23.619 1.00 64.44 O ATOM 3137 CB THR B 78 7.457 -6.994 24.166 1.00 53.44 C ATOM 3138 OG1 THR B 78 6.155 -7.586 24.266 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.489 -7.893 24.824 1.00 23.30 C ATOM 0 H THR B 78 5.584 -5.410 25.707 1.00 70.31 H new ATOM 0 HA THR B 78 8.462 -5.354 25.150 1.00 64.53 H new ATOM 0 HB THR B 78 7.722 -6.887 23.114 1.00 53.44 H new ATOM 0 HG1 THR B 78 6.169 -8.478 23.860 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.465 -8.877 24.357 1.00 23.30 H new ATOM 0 HG22 THR B 78 9.481 -7.458 24.703 1.00 23.30 H new ATOM 0 HG23 THR B 78 8.263 -7.990 25.886 1.00 23.30 H new ATOM 3147 N VAL B 79 7.984 -4.069 22.984 1.00 22.45 N ATOM 3148 CA VAL B 79 7.704 -3.172 21.865 1.00 23.02 C ATOM 3149 C VAL B 79 8.411 -3.679 20.624 1.00 31.21 C ATOM 3150 O VAL B 79 9.625 -3.828 20.613 1.00 14.34 O ATOM 3151 CB VAL B 79 8.132 -1.708 22.149 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.926 -0.826 20.915 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.353 -1.151 23.330 1.00 54.24 C ATOM 0 H VAL B 79 8.975 -4.269 23.121 1.00 22.45 H new ATOM 0 HA VAL B 79 6.624 -3.166 21.715 1.00 23.02 H new ATOM 0 HB VAL B 79 9.194 -1.707 22.394 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.234 0.195 21.142 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.524 -1.210 20.089 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.873 -0.833 20.634 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.663 -0.123 23.518 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.287 -1.173 23.105 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.550 -1.757 24.214 1.00 54.24 H new ATOM 3163 N THR B 80 7.644 -3.975 19.596 1.00 72.42 N ATOM 3164 CA THR B 80 8.194 -4.521 18.370 1.00 23.21 C ATOM 3165 C THR B 80 8.090 -3.509 17.233 1.00 63.22 C ATOM 3166 O THR B 80 6.995 -3.194 16.768 1.00 42.43 O ATOM 3167 CB THR B 80 7.475 -5.833 17.987 1.00 22.40 C ATOM 3168 OG1 THR B 80 7.352 -6.667 19.151 1.00 71.34 O ATOM 3169 CG2 THR B 80 8.252 -6.582 16.909 1.00 64.25 C ATOM 0 H THR B 80 6.632 -3.846 19.584 1.00 72.42 H new ATOM 0 HA THR B 80 9.248 -4.741 18.541 1.00 23.21 H new ATOM 0 HB THR B 80 6.487 -5.587 17.597 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.895 -7.500 18.910 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.727 -7.503 16.655 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.337 -5.956 16.021 1.00 64.25 H new ATOM 0 HG23 THR B 80 9.248 -6.823 17.280 1.00 64.25 H new ATOM 3177 N ALA B 81 9.233 -2.994 16.805 1.00 41.34 N ATOM 3178 CA ALA B 81 9.292 -2.055 15.698 1.00 73.43 C ATOM 3179 C ALA B 81 9.533 -2.809 14.399 1.00 13.31 C ATOM 3180 O ALA B 81 10.626 -3.331 14.162 1.00 32.14 O ATOM 3181 CB ALA B 81 10.392 -1.026 15.928 1.00 31.52 C ATOM 0 H ALA B 81 10.141 -3.215 17.214 1.00 41.34 H new ATOM 0 HA ALA B 81 8.341 -1.527 15.631 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.421 -0.331 15.089 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.190 -0.476 16.847 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.353 -1.533 16.013 1.00 31.52 H new ATOM 3187 N GLU B 82 8.493 -2.903 13.581 1.00 50.12 N ATOM 3188 CA GLU B 82 8.592 -3.566 12.291 1.00 53.10 C ATOM 3189 C GLU B 82 8.784 -2.510 11.209 1.00 51.21 C ATOM 3190 O GLU B 82 7.860 -1.760 10.888 1.00 13.21 O ATOM 3191 CB GLU B 82 7.335 -4.406 12.029 1.00 51.24 C ATOM 3192 CG GLU B 82 7.470 -5.365 10.853 1.00 31.41 C ATOM 3193 CD GLU B 82 6.262 -6.274 10.699 1.00 63.34 C ATOM 3194 OE1 GLU B 82 5.591 -6.214 9.651 1.00 35.34 O ATOM 3195 OE2 GLU B 82 5.973 -7.055 11.635 1.00 71.23 O1- ATOM 0 H GLU B 82 7.569 -2.526 13.791 1.00 50.12 H new ATOM 0 HA GLU B 82 9.447 -4.242 12.284 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.098 -4.978 12.926 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.494 -3.737 11.846 1.00 51.24 H new ATOM 0 HG2 GLU B 82 7.608 -4.792 9.936 1.00 31.41 H new ATOM 0 HG3 GLU B 82 8.364 -5.974 10.986 1.00 31.41 H new ATOM 3202 N VAL B 83 9.993 -2.443 10.669 1.00 40.31 N ATOM 3203 CA VAL B 83 10.365 -1.389 9.733 1.00 71.44 C ATOM 3204 C VAL B 83 10.391 -1.908 8.301 1.00 35.11 C ATOM 3205 O VAL B 83 10.912 -2.989 8.025 1.00 1.44 O ATOM 3206 CB VAL B 83 11.745 -0.774 10.094 1.00 65.23 C ATOM 3207 CG1 VAL B 83 12.842 -1.837 10.088 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.096 0.381 9.153 1.00 51.35 C ATOM 0 H VAL B 83 10.739 -3.111 10.865 1.00 40.31 H new ATOM 0 HA VAL B 83 9.606 -0.610 9.810 1.00 71.44 H new ATOM 0 HB VAL B 83 11.675 -0.373 11.105 1.00 65.23 H new ATOM 0 HG11 VAL B 83 13.796 -1.377 10.344 1.00 71.22 H new ATOM 0 HG12 VAL B 83 12.604 -2.610 10.819 1.00 71.22 H new ATOM 0 HG13 VAL B 83 12.910 -2.284 9.096 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.067 0.793 9.429 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.135 0.015 8.127 1.00 51.35 H new ATOM 0 HG23 VAL B 83 11.336 1.159 9.232 1.00 51.35 H new ATOM 3218 N GLY B 84 9.807 -1.136 7.400 1.00 51.11 N ATOM 3219 CA GLY B 84 9.836 -1.454 5.993 1.00 52.45 C ATOM 3220 C GLY B 84 10.341 -0.291 5.168 1.00 30.33 C ATOM 3221 O GLY B 84 10.455 0.828 5.663 1.00 4.21 O ATOM 0 H GLY B 84 9.304 -0.278 7.627 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.475 -2.322 5.829 1.00 52.45 H new ATOM 0 HA3 GLY B 84 8.835 -1.728 5.661 1.00 52.45 H new ATOM 3225 N ILE B 85 10.651 -0.563 3.917 1.00 72.33 N ATOM 3226 CA ILE B 85 11.117 0.453 2.989 1.00 70.35 C ATOM 3227 C ILE B 85 10.623 0.119 1.589 1.00 24.30 C ATOM 3228 O ILE B 85 10.682 -1.039 1.157 1.00 65.43 O ATOM 3229 CB ILE B 85 12.672 0.587 3.020 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.178 1.670 2.038 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.339 -0.757 2.734 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.412 1.179 0.621 1.00 22.31 C ATOM 0 H ILE B 85 10.587 -1.497 3.512 1.00 72.33 H new ATOM 0 HA ILE B 85 10.711 1.418 3.292 1.00 70.35 H new ATOM 0 HB ILE B 85 12.949 0.904 4.025 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.454 2.484 2.011 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.110 2.084 2.423 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.422 -0.639 2.761 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.034 -1.482 3.489 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.037 -1.111 1.748 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.765 2.005 0.003 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.160 0.386 0.629 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.479 0.793 0.211 1.00 22.31 H new ATOM 3244 N GLY B 86 10.126 1.138 0.900 1.00 43.24 N ATOM 3245 CA GLY B 86 9.593 0.976 -0.441 1.00 50.02 C ATOM 3246 C GLY B 86 9.657 2.278 -1.214 1.00 52.30 C ATOM 3247 O GLY B 86 9.944 3.319 -0.625 1.00 42.02 O ATOM 0 H GLY B 86 10.082 2.093 1.255 1.00 43.24 H new ATOM 0 HA2 GLY B 86 10.157 0.207 -0.970 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.560 0.632 -0.386 1.00 50.02 H new ATOM 3251 N PRO B 87 9.404 2.268 -2.532 1.00 42.21 N ATOM 3252 CA PRO B 87 9.518 3.462 -3.355 1.00 30.25 C ATOM 3253 C PRO B 87 8.276 4.349 -3.286 1.00 61.30 C ATOM 3254 O PRO B 87 7.145 3.860 -3.216 1.00 52.32 O ATOM 3255 CB PRO B 87 9.707 2.894 -4.762 1.00 44.10 C ATOM 3256 CG PRO B 87 8.956 1.602 -4.753 1.00 14.42 C ATOM 3257 CD PRO B 87 8.965 1.103 -3.322 1.00 45.13 C ATOM 0 HA PRO B 87 10.331 4.110 -3.027 1.00 30.25 H new ATOM 0 HB2 PRO B 87 9.317 3.574 -5.519 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.762 2.737 -4.988 1.00 44.10 H new ATOM 0 HG2 PRO B 87 7.935 1.745 -5.106 1.00 14.42 H new ATOM 0 HG3 PRO B 87 9.425 0.877 -5.419 1.00 14.42 H new ATOM 0 HD2 PRO B 87 7.977 0.763 -3.013 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.645 0.260 -3.199 1.00 45.13 H new ATOM 3265 N ASN B 88 8.506 5.653 -3.289 1.00 53.24 N ATOM 3266 CA ASN B 88 7.431 6.634 -3.377 1.00 21.43 C ATOM 3267 C ASN B 88 7.079 6.843 -4.847 1.00 21.10 C ATOM 3268 O ASN B 88 7.921 6.624 -5.720 1.00 51.23 O ATOM 3269 CB ASN B 88 7.866 7.961 -2.736 1.00 72.30 C ATOM 3270 CG ASN B 88 6.772 9.021 -2.751 1.00 63.22 C ATOM 3271 OD1 ASN B 88 6.646 9.787 -3.708 1.00 5.32 O ATOM 3272 ND2 ASN B 88 5.980 9.080 -1.691 1.00 3.11 N ATOM 0 H ASN B 88 9.439 6.062 -3.231 1.00 53.24 H new ATOM 0 HA ASN B 88 6.556 6.271 -2.839 1.00 21.43 H new ATOM 0 HB2 ASN B 88 8.171 7.777 -1.706 1.00 72.30 H new ATOM 0 HB3 ASN B 88 8.740 8.343 -3.263 1.00 72.30 H new ATOM 0 HD21 ASN B 88 5.236 9.776 -1.649 1.00 3.11 H new ATOM 0 HD22 ASN B 88 6.114 8.429 -0.917 1.00 3.11 H new ATOM 3279 N GLU B 89 5.852 7.277 -5.118 1.00 65.22 N ATOM 3280 CA GLU B 89 5.381 7.442 -6.497 1.00 51.32 C ATOM 3281 C GLU B 89 6.180 8.516 -7.245 1.00 22.42 C ATOM 3282 O GLU B 89 6.055 8.659 -8.464 1.00 11.02 O ATOM 3283 CB GLU B 89 3.888 7.788 -6.514 1.00 62.31 C ATOM 3284 CG GLU B 89 3.540 9.066 -5.761 1.00 11.15 C ATOM 3285 CD GLU B 89 2.086 9.461 -5.941 1.00 24.23 C ATOM 3286 OE1 GLU B 89 1.241 9.044 -5.120 1.00 4.32 O ATOM 3287 OE2 GLU B 89 1.779 10.182 -6.912 1.00 35.35 O1- ATOM 0 H GLU B 89 5.164 7.521 -4.406 1.00 65.22 H new ATOM 0 HA GLU B 89 5.535 6.494 -7.012 1.00 51.32 H new ATOM 0 HB2 GLU B 89 3.560 7.887 -7.549 1.00 62.31 H new ATOM 0 HB3 GLU B 89 3.328 6.959 -6.081 1.00 62.31 H new ATOM 0 HG2 GLU B 89 3.748 8.928 -4.700 1.00 11.15 H new ATOM 0 HG3 GLU B 89 4.180 9.876 -6.109 1.00 11.15 H new ATOM 3294 N GLU B 90 6.981 9.281 -6.507 1.00 52.12 N ATOM 3295 CA GLU B 90 7.871 10.279 -7.097 1.00 15.12 C ATOM 3296 C GLU B 90 9.027 9.596 -7.838 1.00 74.05 C ATOM 3297 O GLU B 90 9.568 10.131 -8.808 1.00 53.12 O ATOM 3298 CB GLU B 90 8.434 11.190 -5.997 1.00 14.23 C ATOM 3299 CG GLU B 90 9.455 12.200 -6.500 1.00 30.33 C ATOM 3300 CD GLU B 90 10.090 13.009 -5.378 1.00 5.15 C ATOM 3301 OE1 GLU B 90 11.312 12.879 -5.161 1.00 54.43 O ATOM 3302 OE2 GLU B 90 9.370 13.777 -4.710 1.00 12.50 O1- ATOM 0 H GLU B 90 7.032 9.228 -5.490 1.00 52.12 H new ATOM 0 HA GLU B 90 7.300 10.876 -7.808 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.610 11.725 -5.524 1.00 14.23 H new ATOM 0 HB3 GLU B 90 8.897 10.572 -5.228 1.00 14.23 H new ATOM 0 HG2 GLU B 90 10.236 11.676 -7.050 1.00 30.33 H new ATOM 0 HG3 GLU B 90 8.971 12.879 -7.202 1.00 30.33 H new ATOM 3309 N GLY B 91 9.366 8.396 -7.388 1.00 72.20 N ATOM 3310 CA GLY B 91 10.508 7.678 -7.932 1.00 12.11 C ATOM 3311 C GLY B 91 11.696 7.717 -6.993 1.00 71.02 C ATOM 3312 O GLY B 91 12.848 7.760 -7.431 1.00 5.53 O ATOM 0 H GLY B 91 8.867 7.901 -6.649 1.00 72.20 H new ATOM 0 HA2 GLY B 91 10.229 6.642 -8.122 1.00 12.11 H new ATOM 0 HA3 GLY B 91 10.788 8.114 -8.891 1.00 12.11 H new ATOM 3316 N GLY B 92 11.408 7.704 -5.696 1.00 60.34 N ATOM 3317 CA GLY B 92 12.447 7.684 -4.677 1.00 61.32 C ATOM 3318 C GLY B 92 12.129 6.662 -3.610 1.00 12.52 C ATOM 3319 O GLY B 92 11.211 5.864 -3.783 1.00 70.13 O ATOM 0 H GLY B 92 10.458 7.707 -5.326 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.408 7.452 -5.135 1.00 61.32 H new ATOM 0 HA3 GLY B 92 12.540 8.672 -4.225 1.00 61.32 H new ATOM 3323 N PHE B 93 12.869 6.674 -2.507 1.00 71.13 N ATOM 3324 CA PHE B 93 12.626 5.730 -1.416 1.00 4.00 C ATOM 3325 C PHE B 93 11.799 6.372 -0.308 1.00 73.12 C ATOM 3326 O PHE B 93 11.824 7.593 -0.123 1.00 63.14 O ATOM 3327 CB PHE B 93 13.944 5.190 -0.841 1.00 42.41 C ATOM 3328 CG PHE B 93 14.657 4.223 -1.757 1.00 52.32 C ATOM 3329 CD1 PHE B 93 16.007 4.375 -2.041 1.00 72.40 C ATOM 3330 CD2 PHE B 93 13.973 3.157 -2.328 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.657 3.483 -2.873 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.620 2.265 -3.162 1.00 20.53 C ATOM 3333 CZ PHE B 93 15.963 2.428 -3.435 1.00 20.53 C ATOM 0 H PHE B 93 13.639 7.322 -2.342 1.00 71.13 H new ATOM 0 HA PHE B 93 12.063 4.894 -1.832 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.607 6.028 -0.626 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.740 4.694 0.108 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.555 5.198 -1.608 1.00 72.40 H new ATOM 0 HD2 PHE B 93 12.922 3.024 -2.117 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.708 3.610 -3.084 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.075 1.441 -3.600 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.471 1.732 -4.087 1.00 20.53 H new ATOM 3343 N ALA B 94 11.069 5.536 0.418 1.00 22.42 N ATOM 3344 CA ALA B 94 10.237 5.970 1.531 1.00 62.21 C ATOM 3345 C ALA B 94 10.284 4.920 2.635 1.00 42.21 C ATOM 3346 O ALA B 94 10.278 3.719 2.355 1.00 61.15 O ATOM 3347 CB ALA B 94 8.803 6.205 1.065 1.00 43.22 C ATOM 0 H ALA B 94 11.038 4.530 0.250 1.00 22.42 H new ATOM 0 HA ALA B 94 10.619 6.913 1.922 1.00 62.21 H new ATOM 0 HB1 ALA B 94 8.195 6.529 1.909 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.793 6.975 0.294 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.396 5.279 0.659 1.00 43.22 H new ATOM 3353 N LEU B 95 10.346 5.372 3.884 1.00 51.40 N ATOM 3354 CA LEU B 95 10.497 4.471 5.026 1.00 52.52 C ATOM 3355 C LEU B 95 9.176 4.288 5.771 1.00 31.45 C ATOM 3356 O LEU B 95 8.368 5.216 5.876 1.00 74.21 O ATOM 3357 CB LEU B 95 11.589 4.993 5.982 1.00 5.44 C ATOM 3358 CG LEU B 95 13.037 4.605 5.617 1.00 70.54 C ATOM 3359 CD1 LEU B 95 13.256 3.103 5.801 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.380 5.027 4.186 1.00 13.14 C ATOM 0 H LEU B 95 10.294 6.360 4.133 1.00 51.40 H new ATOM 0 HA LEU B 95 10.801 3.496 4.645 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.522 6.080 6.021 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.375 4.624 6.985 1.00 5.44 H new ATOM 0 HG LEU B 95 13.706 5.138 6.293 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.283 2.850 5.538 1.00 3.52 H new ATOM 0 HD12 LEU B 95 13.070 2.833 6.841 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.571 2.554 5.155 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.407 4.740 3.958 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.702 4.534 3.489 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.276 6.108 4.090 1.00 13.14 H new ATOM 3372 N ASP B 96 8.986 3.081 6.285 1.00 51.23 N ATOM 3373 CA ASP B 96 7.791 2.687 7.025 1.00 11.24 C ATOM 3374 C ASP B 96 8.204 2.100 8.371 1.00 14.30 C ATOM 3375 O ASP B 96 9.133 1.301 8.432 1.00 55.22 O ATOM 3376 CB ASP B 96 7.004 1.644 6.212 1.00 22.11 C ATOM 3377 CG ASP B 96 5.881 0.982 7.001 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.829 1.620 7.197 1.00 73.12 O ATOM 3379 OD2 ASP B 96 6.037 -0.190 7.407 1.00 73.53 O1- ATOM 0 H ASP B 96 9.672 2.331 6.198 1.00 51.23 H new ATOM 0 HA ASP B 96 7.156 3.557 7.193 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.583 2.125 5.329 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.692 0.876 5.859 1.00 22.11 H new ATOM 3384 N VAL B 97 7.550 2.515 9.450 1.00 43.21 N ATOM 3385 CA VAL B 97 7.861 1.990 10.779 1.00 65.34 C ATOM 3386 C VAL B 97 6.576 1.721 11.555 1.00 4.12 C ATOM 3387 O VAL B 97 5.859 2.647 11.925 1.00 1.23 O ATOM 3388 CB VAL B 97 8.757 2.962 11.599 1.00 44.15 C ATOM 3389 CG1 VAL B 97 9.087 2.365 12.967 1.00 31.14 C ATOM 3390 CG2 VAL B 97 10.038 3.311 10.837 1.00 13.32 C ATOM 0 H VAL B 97 6.804 3.210 9.434 1.00 43.21 H new ATOM 0 HA VAL B 97 8.412 1.061 10.633 1.00 65.34 H new ATOM 0 HB VAL B 97 8.198 3.885 11.751 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.714 3.060 13.525 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.164 2.186 13.518 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.618 1.423 12.834 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.643 3.992 11.436 1.00 13.32 H new ATOM 0 HG22 VAL B 97 10.604 2.400 10.640 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.780 3.790 9.892 1.00 13.32 H new ATOM 3400 N GLU B 98 6.282 0.452 11.784 1.00 55.41 N ATOM 3401 CA GLU B 98 5.124 0.063 12.576 1.00 61.25 C ATOM 3402 C GLU B 98 5.560 -0.254 14.004 1.00 55.42 C ATOM 3403 O GLU B 98 6.271 -1.233 14.240 1.00 74.01 O ATOM 3404 CB GLU B 98 4.422 -1.143 11.937 1.00 43.20 C ATOM 3405 CG GLU B 98 3.951 -0.879 10.509 1.00 33.43 C ATOM 3406 CD GLU B 98 3.176 -2.041 9.909 1.00 35.25 C ATOM 3407 OE1 GLU B 98 3.741 -2.777 9.072 1.00 70.42 O ATOM 3408 OE2 GLU B 98 1.993 -2.220 10.269 1.00 74.42 O1- ATOM 0 H GLU B 98 6.832 -0.331 11.431 1.00 55.41 H new ATOM 0 HA GLU B 98 4.414 0.890 12.604 1.00 61.25 H new ATOM 0 HB2 GLU B 98 5.104 -1.993 11.936 1.00 43.20 H new ATOM 0 HB3 GLU B 98 3.565 -1.422 12.549 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.323 0.012 10.499 1.00 33.43 H new ATOM 0 HG3 GLU B 98 4.816 -0.665 9.882 1.00 33.43 H new ATOM 3415 N LEU B 99 5.149 0.589 14.948 1.00 61.12 N ATOM 3416 CA LEU B 99 5.525 0.428 16.350 1.00 54.24 C ATOM 3417 C LEU B 99 4.454 -0.362 17.088 1.00 51.12 C ATOM 3418 O LEU B 99 3.364 0.149 17.357 1.00 12.44 O ATOM 3419 CB LEU B 99 5.732 1.797 17.019 1.00 60.12 C ATOM 3420 CG LEU B 99 6.893 2.634 16.458 1.00 42.10 C ATOM 3421 CD1 LEU B 99 6.997 3.972 17.186 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.208 1.862 16.553 1.00 1.13 C ATOM 0 H LEU B 99 4.552 1.395 14.766 1.00 61.12 H new ATOM 0 HA LEU B 99 6.466 -0.120 16.395 1.00 54.24 H new ATOM 0 HB2 LEU B 99 4.811 2.373 16.923 1.00 60.12 H new ATOM 0 HB3 LEU B 99 5.900 1.640 18.084 1.00 60.12 H new ATOM 0 HG LEU B 99 6.691 2.836 15.406 1.00 42.10 H new ATOM 0 HD11 LEU B 99 7.825 4.548 16.773 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.069 4.529 17.058 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.172 3.796 18.247 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.017 2.471 16.151 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.416 1.625 17.596 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.130 0.938 15.980 1.00 1.13 H new ATOM 3434 N ARG B 100 4.779 -1.610 17.404 1.00 53.41 N ATOM 3435 CA ARG B 100 3.833 -2.544 18.005 1.00 2.45 C ATOM 3436 C ARG B 100 4.048 -2.625 19.512 1.00 14.01 C ATOM 3437 O ARG B 100 5.021 -3.211 19.981 1.00 24.14 O ATOM 3438 CB ARG B 100 4.006 -3.923 17.360 1.00 53.52 C ATOM 3439 CG ARG B 100 3.003 -4.973 17.819 1.00 13.43 C ATOM 3440 CD ARG B 100 3.276 -6.299 17.130 1.00 64.11 C ATOM 3441 NE ARG B 100 2.321 -7.340 17.509 1.00 3.43 N ATOM 3442 CZ ARG B 100 2.279 -8.550 16.955 1.00 52.33 C ATOM 3443 NH1 ARG B 100 3.102 -8.868 15.960 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 1.401 -9.441 17.393 1.00 11.32 N ATOM 0 H ARG B 100 5.707 -2.004 17.251 1.00 53.41 H new ATOM 0 HA ARG B 100 2.817 -2.191 17.830 1.00 2.45 H new ATOM 0 HB2 ARG B 100 3.928 -3.815 16.278 1.00 53.52 H new ATOM 0 HB3 ARG B 100 5.012 -4.284 17.573 1.00 53.52 H new ATOM 0 HG2 ARG B 100 3.065 -5.097 18.900 1.00 13.43 H new ATOM 0 HG3 ARG B 100 1.990 -4.640 17.594 1.00 13.43 H new ATOM 0 HD2 ARG B 100 3.242 -6.156 16.050 1.00 64.11 H new ATOM 0 HD3 ARG B 100 4.285 -6.630 17.376 1.00 64.11 H new ATOM 0 HE ARG B 100 1.646 -7.126 18.243 1.00 3.43 H new ATOM 0 HH11 ARG B 100 3.773 -8.182 15.615 1.00 41.53 H new ATOM 0 HH12 ARG B 100 3.062 -9.798 15.542 1.00 41.53 H new ATOM 0 HH21 ARG B 100 0.762 -9.198 18.150 1.00 11.32 H new ATOM 0 HH22 ARG B 100 1.364 -10.370 16.973 1.00 11.32 H new ATOM 3458 N VAL B 101 3.136 -2.039 20.269 1.00 41.00 N ATOM 3459 CA VAL B 101 3.278 -1.955 21.716 1.00 50.20 C ATOM 3460 C VAL B 101 2.491 -3.066 22.395 1.00 3.30 C ATOM 3461 O VAL B 101 1.277 -2.961 22.558 1.00 1.54 O ATOM 3462 CB VAL B 101 2.798 -0.582 22.246 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.893 -0.521 23.772 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.593 0.555 21.604 1.00 51.31 C ATOM 0 H VAL B 101 2.284 -1.612 19.905 1.00 41.00 H new ATOM 0 HA VAL B 101 4.336 -2.068 21.950 1.00 50.20 H new ATOM 0 HB VAL B 101 1.750 -0.461 21.970 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.550 0.454 24.119 1.00 22.35 H new ATOM 0 HG12 VAL B 101 2.269 -1.301 24.207 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.928 -0.672 24.078 1.00 22.35 H new ATOM 0 HG21 VAL B 101 3.239 1.510 21.991 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.651 0.438 21.840 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.457 0.529 20.523 1.00 51.31 H new ATOM 3474 N ALA B 102 3.181 -4.133 22.783 1.00 24.03 N ATOM 3475 CA ALA B 102 2.532 -5.236 23.471 1.00 53.32 C ATOM 3476 C ALA B 102 2.615 -5.012 24.973 1.00 44.40 C ATOM 3477 O ALA B 102 3.648 -5.257 25.597 1.00 4.42 O ATOM 3478 CB ALA B 102 3.176 -6.563 23.080 1.00 42.24 C ATOM 0 H ALA B 102 4.183 -4.255 22.633 1.00 24.03 H new ATOM 0 HA ALA B 102 1.483 -5.278 23.178 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.677 -7.378 23.605 1.00 42.24 H new ATOM 0 HB2 ALA B 102 3.080 -6.711 22.004 1.00 42.24 H new ATOM 0 HB3 ALA B 102 4.232 -6.549 23.351 1.00 42.24 H new ATOM 3484 N LEU B 103 1.512 -4.546 25.543 1.00 61.44 N ATOM 3485 CA LEU B 103 1.461 -4.173 26.948 1.00 72.24 C ATOM 3486 C LEU B 103 0.547 -5.143 27.699 1.00 41.41 C ATOM 3487 O LEU B 103 -0.640 -5.252 27.375 1.00 40.11 O ATOM 3488 CB LEU B 103 0.943 -2.727 27.063 1.00 55.34 C ATOM 3489 CG LEU B 103 1.451 -1.901 28.261 1.00 34.43 C ATOM 3490 CD1 LEU B 103 1.125 -2.561 29.594 1.00 40.33 C ATOM 3491 CD2 LEU B 103 2.942 -1.623 28.134 1.00 1.40 C ATOM 0 H LEU B 103 0.631 -4.417 25.046 1.00 61.44 H new ATOM 0 HA LEU B 103 2.455 -4.226 27.391 1.00 72.24 H new ATOM 0 HB2 LEU B 103 1.208 -2.197 26.148 1.00 55.34 H new ATOM 0 HB3 LEU B 103 -0.146 -2.759 27.109 1.00 55.34 H new ATOM 0 HG LEU B 103 0.923 -0.948 28.243 1.00 34.43 H new ATOM 0 HD11 LEU B 103 1.503 -1.942 30.408 1.00 40.33 H new ATOM 0 HD12 LEU B 103 0.045 -2.670 29.692 1.00 40.33 H new ATOM 0 HD13 LEU B 103 1.594 -3.544 29.638 1.00 40.33 H new ATOM 0 HD21 LEU B 103 3.277 -1.039 28.991 1.00 1.40 H new ATOM 0 HD22 LEU B 103 3.487 -2.567 28.103 1.00 1.40 H new ATOM 0 HD23 LEU B 103 3.131 -1.064 27.217 1.00 1.40 H new ATOM 3503 N PRO B 104 1.085 -5.881 28.687 1.00 3.11 N ATOM 3504 CA PRO B 104 0.297 -6.826 29.480 1.00 24.44 C ATOM 3505 C PRO B 104 -0.642 -6.127 30.459 1.00 5.10 C ATOM 3506 O PRO B 104 -0.353 -5.030 30.946 1.00 15.44 O ATOM 3507 CB PRO B 104 1.360 -7.630 30.229 1.00 10.11 C ATOM 3508 CG PRO B 104 2.515 -6.700 30.357 1.00 31.23 C ATOM 3509 CD PRO B 104 2.505 -5.865 29.104 1.00 74.24 C ATOM 0 HA PRO B 104 -0.356 -7.437 28.857 1.00 24.44 H new ATOM 0 HB2 PRO B 104 0.999 -7.950 31.206 1.00 10.11 H new ATOM 0 HB3 PRO B 104 1.635 -8.531 29.680 1.00 10.11 H new ATOM 0 HG2 PRO B 104 2.418 -6.075 31.245 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.451 -7.249 30.454 1.00 31.23 H new ATOM 0 HD2 PRO B 104 2.855 -4.851 29.295 1.00 74.24 H new ATOM 0 HD3 PRO B 104 3.153 -6.287 28.336 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.762 -6.779 30.742 1.00 72.34 N ATOM 3518 CA GLY B 105 -2.747 -6.239 31.670 1.00 21.00 C ATOM 3519 C GLY B 105 -3.391 -4.952 31.179 1.00 53.31 C ATOM 3520 O GLY B 105 -4.026 -4.232 31.956 1.00 21.33 O ATOM 0 H GLY B 105 -2.011 -7.683 30.342 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.524 -6.985 31.839 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.268 -6.054 32.631 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.233 -4.657 29.892 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.764 -3.430 29.303 1.00 45.21 C ATOM 3526 C LEU B 106 -4.663 -3.742 28.110 1.00 60.53 C ATOM 3527 O LEU B 106 -4.350 -4.603 27.284 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.614 -2.497 28.887 1.00 22.13 C ATOM 3529 CG LEU B 106 -3.004 -1.286 28.020 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -4.023 -0.397 28.728 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.764 -0.482 27.641 1.00 55.01 C ATOM 0 H LEU B 106 -2.737 -5.256 29.232 1.00 45.40 H new ATOM 0 HA LEU B 106 -4.369 -2.923 30.055 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -2.127 -2.130 29.790 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.875 -3.085 28.343 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.470 -1.663 27.110 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -4.276 0.448 28.088 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.923 -0.973 28.940 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.598 -0.030 29.662 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -2.056 0.371 27.028 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -1.270 -0.127 28.545 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -1.078 -1.115 27.078 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.790 -3.040 28.049 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.735 -3.156 26.942 1.00 50.41 C ATOM 3545 C ASP B 107 -6.265 -2.331 25.753 1.00 24.13 C ATOM 3546 O ASP B 107 -5.691 -1.256 25.929 1.00 45.41 O ATOM 3547 CB ASP B 107 -8.124 -2.667 27.376 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.886 -3.676 28.224 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -9.990 -4.098 27.812 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -8.393 -4.051 29.308 1.00 14.11 O1- ATOM 0 H ASP B 107 -6.075 -2.373 28.767 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.792 -4.205 26.652 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -8.014 -1.740 27.939 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -8.712 -2.433 26.488 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.539 -2.819 24.546 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.136 -2.132 23.322 1.00 21.33 C ATOM 3557 C ALA B 108 -6.791 -0.756 23.224 1.00 4.44 C ATOM 3558 O ALA B 108 -6.169 0.206 22.774 1.00 12.01 O ATOM 3559 CB ALA B 108 -6.479 -2.974 22.098 1.00 34.32 C ATOM 0 H ALA B 108 -7.041 -3.693 24.389 1.00 12.24 H new ATOM 0 HA ALA B 108 -5.056 -1.991 23.355 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -6.171 -2.446 21.195 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -5.957 -3.929 22.155 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.554 -3.150 22.067 1.00 34.32 H new ATOM 3565 N ALA B 109 -8.046 -0.670 23.666 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.803 0.583 23.622 1.00 64.51 C ATOM 3567 C ALA B 109 -8.061 1.696 24.363 1.00 34.40 C ATOM 3568 O ALA B 109 -7.932 2.819 23.862 1.00 22.24 O ATOM 3569 CB ALA B 109 -10.193 0.380 24.219 1.00 34.53 C ATOM 0 H ALA B 109 -8.562 -1.456 24.060 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.908 0.883 22.579 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.746 1.318 24.181 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.727 -0.379 23.648 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -10.100 0.056 25.256 1.00 34.53 H new ATOM 3575 N ALA B 110 -7.572 1.371 25.555 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.816 2.318 26.367 1.00 72.03 C ATOM 3577 C ALA B 110 -5.389 2.444 25.843 1.00 4.25 C ATOM 3578 O ALA B 110 -4.822 3.538 25.797 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.815 1.878 27.828 1.00 4.12 C ATOM 0 H ALA B 110 -7.687 0.452 25.983 1.00 13.42 H new ATOM 0 HA ALA B 110 -7.294 3.296 26.301 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -6.247 2.593 28.423 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.840 1.833 28.195 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -6.357 0.893 27.911 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.826 1.317 25.421 1.00 64.14 N ATOM 3586 CA ALA B 111 -3.456 1.275 24.920 1.00 51.51 C ATOM 3587 C ALA B 111 -3.255 2.275 23.788 1.00 2.23 C ATOM 3588 O ALA B 111 -2.219 2.934 23.709 1.00 42.41 O ATOM 3589 CB ALA B 111 -3.107 -0.134 24.458 1.00 4.22 C ATOM 0 H ALA B 111 -5.301 0.414 25.416 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.787 1.553 25.734 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -2.082 -0.152 24.087 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -3.201 -0.825 25.295 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.787 -0.434 23.661 1.00 4.22 H new ATOM 3595 N LYS B 112 -4.263 2.397 22.929 1.00 32.30 N ATOM 3596 CA LYS B 112 -4.214 3.338 21.817 1.00 34.20 C ATOM 3597 C LYS B 112 -4.002 4.764 22.317 1.00 24.41 C ATOM 3598 O LYS B 112 -3.174 5.499 21.778 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.494 3.248 20.972 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.633 1.928 20.219 1.00 74.45 C ATOM 3601 CD LYS B 112 -6.861 1.902 19.314 1.00 63.04 C ATOM 3602 CE LYS B 112 -6.959 0.590 18.537 1.00 72.33 C ATOM 3603 NZ LYS B 112 -8.101 0.582 17.584 1.00 62.21 N1+ ATOM 0 H LYS B 112 -5.125 1.854 22.983 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.366 3.070 21.187 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -6.359 3.380 21.622 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.506 4.069 20.255 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -4.739 1.759 19.619 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -5.695 1.109 20.935 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -7.760 2.037 19.915 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -6.816 2.737 18.615 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -6.031 0.424 17.990 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -7.068 -0.238 19.238 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -8.127 -0.328 17.080 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -8.990 0.713 18.107 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -7.986 1.355 16.897 1.00 62.21 H new ATOM 3617 N THR B 113 -4.725 5.147 23.367 1.00 71.03 N ATOM 3618 CA THR B 113 -4.629 6.503 23.890 1.00 12.30 C ATOM 3619 C THR B 113 -3.299 6.696 24.627 1.00 72.03 C ATOM 3620 O THR B 113 -2.708 7.775 24.579 1.00 34.03 O ATOM 3621 CB THR B 113 -5.820 6.859 24.824 1.00 51.23 C ATOM 3622 OG1 THR B 113 -6.070 8.270 24.785 1.00 15.33 O ATOM 3623 CG2 THR B 113 -5.559 6.450 26.269 1.00 55.23 C ATOM 0 H THR B 113 -5.377 4.542 23.867 1.00 71.03 H new ATOM 0 HA THR B 113 -4.671 7.182 23.038 1.00 12.30 H new ATOM 0 HB THR B 113 -6.686 6.306 24.461 1.00 51.23 H new ATOM 0 HG1 THR B 113 -6.823 8.485 25.375 1.00 15.33 H new ATOM 0 HG21 THR B 113 -6.418 6.719 26.884 1.00 55.23 H new ATOM 0 HG22 THR B 113 -5.399 5.373 26.319 1.00 55.23 H new ATOM 0 HG23 THR B 113 -4.673 6.966 26.639 1.00 55.23 H new ATOM 3631 N LEU B 114 -2.828 5.635 25.291 1.00 42.02 N ATOM 3632 CA LEU B 114 -1.569 5.691 26.035 1.00 34.43 C ATOM 3633 C LEU B 114 -0.394 5.905 25.080 1.00 70.23 C ATOM 3634 O LEU B 114 0.429 6.802 25.280 1.00 14.10 O ATOM 3635 CB LEU B 114 -1.364 4.412 26.868 1.00 61.41 C ATOM 3636 CG LEU B 114 -2.479 4.098 27.885 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -2.101 2.903 28.758 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -2.796 5.324 28.743 1.00 20.12 C ATOM 0 H LEU B 114 -3.299 4.731 25.327 1.00 42.02 H new ATOM 0 HA LEU B 114 -1.617 6.536 26.722 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -1.269 3.567 26.187 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -0.419 4.496 27.405 1.00 61.41 H new ATOM 0 HG LEU B 114 -3.378 3.835 27.328 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.904 2.702 29.467 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.945 2.027 28.128 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -1.184 3.126 29.303 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -3.586 5.077 29.453 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -1.902 5.629 29.287 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -3.127 6.141 28.102 1.00 20.12 H new ATOM 3650 N VAL B 115 -0.339 5.091 24.031 1.00 61.11 N ATOM 3651 CA VAL B 115 0.709 5.206 23.023 1.00 23.35 C ATOM 3652 C VAL B 115 0.599 6.542 22.294 1.00 63.55 C ATOM 3653 O VAL B 115 1.611 7.167 21.967 1.00 10.54 O ATOM 3654 CB VAL B 115 0.645 4.045 21.994 1.00 32.23 C ATOM 3655 CG1 VAL B 115 1.730 4.196 20.928 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.765 2.695 22.700 1.00 32.34 C ATOM 0 H VAL B 115 -1.010 4.343 23.856 1.00 61.11 H new ATOM 0 HA VAL B 115 1.667 5.150 23.540 1.00 23.35 H new ATOM 0 HB VAL B 115 -0.323 4.088 21.495 1.00 32.23 H new ATOM 0 HG11 VAL B 115 1.662 3.370 20.220 1.00 53.51 H new ATOM 0 HG12 VAL B 115 1.592 5.139 20.399 1.00 53.51 H new ATOM 0 HG13 VAL B 115 2.711 4.187 21.403 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.718 1.893 21.963 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.716 2.645 23.230 1.00 32.34 H new ATOM 0 HG23 VAL B 115 -0.053 2.582 23.411 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.636 6.980 22.054 1.00 33.05 N ATOM 3667 CA ASP B 116 -0.886 8.245 21.367 1.00 4.03 C ATOM 3668 C ASP B 116 -0.252 9.403 22.126 1.00 43.14 C ATOM 3669 O ASP B 116 0.573 10.138 21.576 1.00 21.31 O ATOM 3670 CB ASP B 116 -2.390 8.499 21.213 1.00 75.43 C ATOM 3671 CG ASP B 116 -2.679 9.717 20.343 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -2.411 9.659 19.121 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -3.179 10.736 20.872 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.480 6.476 22.326 1.00 33.05 H new ATOM 0 HA ASP B 116 -0.437 8.176 20.376 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -2.863 7.620 20.774 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.836 8.643 22.197 1.00 75.43 H new ATOM 3678 N ARG B 117 -0.622 9.545 23.399 1.00 65.05 N ATOM 3679 CA ARG B 117 -0.134 10.649 24.215 1.00 30.34 C ATOM 3680 C ARG B 117 1.373 10.537 24.440 1.00 41.22 C ATOM 3681 O ARG B 117 2.092 11.527 24.338 1.00 22.44 O ATOM 3682 CB ARG B 117 -0.885 10.684 25.552 1.00 5.33 C ATOM 3683 CG ARG B 117 -0.793 9.379 26.333 1.00 52.02 C ATOM 3684 CD ARG B 117 -1.747 9.343 27.514 1.00 70.20 C ATOM 3685 NE ARG B 117 -1.392 10.327 28.540 1.00 35.41 N ATOM 3686 CZ ARG B 117 -1.189 10.044 29.831 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -1.264 8.791 30.269 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -0.909 11.018 30.684 1.00 12.43 N ATOM 0 H ARG B 117 -1.256 8.910 23.883 1.00 65.05 H new ATOM 0 HA ARG B 117 -0.321 11.583 23.685 1.00 30.34 H new ATOM 0 HB2 ARG B 117 -0.486 11.493 26.163 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -1.934 10.914 25.365 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -1.012 8.544 25.667 1.00 52.02 H new ATOM 0 HG3 ARG B 117 0.228 9.243 26.690 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -2.762 9.534 27.165 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -1.743 8.345 27.953 1.00 70.20 H new ATOM 0 HE ARG B 117 -1.292 11.299 28.248 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -1.478 8.035 29.618 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -1.107 8.585 31.256 1.00 12.31 H new ATOM 0 HH21 ARG B 117 -0.849 11.982 30.356 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -0.754 10.804 31.669 1.00 12.43 H new ATOM 3702 N ALA B 118 1.846 9.324 24.717 1.00 61.11 N ATOM 3703 CA ALA B 118 3.270 9.091 24.961 1.00 4.01 C ATOM 3704 C ALA B 118 4.103 9.491 23.744 1.00 4.12 C ATOM 3705 O ALA B 118 5.096 10.213 23.858 1.00 22.32 O ATOM 3706 CB ALA B 118 3.513 7.629 25.316 1.00 4.44 C ATOM 0 H ALA B 118 1.266 8.487 24.778 1.00 61.11 H new ATOM 0 HA ALA B 118 3.579 9.711 25.802 1.00 4.01 H new ATOM 0 HB1 ALA B 118 4.576 7.470 25.495 1.00 4.44 H new ATOM 0 HB2 ALA B 118 2.952 7.375 26.215 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.185 6.995 24.492 1.00 4.44 H new ATOM 3712 N HIS B 119 3.662 9.039 22.575 1.00 53.54 N ATOM 3713 CA HIS B 119 4.362 9.294 21.317 1.00 31.05 C ATOM 3714 C HIS B 119 4.188 10.754 20.884 1.00 22.51 C ATOM 3715 O HIS B 119 4.857 11.219 19.960 1.00 73.21 O ATOM 3716 CB HIS B 119 3.823 8.341 20.236 1.00 24.30 C ATOM 3717 CG HIS B 119 4.606 8.329 18.956 1.00 50.32 C ATOM 3718 ND1 HIS B 119 5.546 7.364 18.662 1.00 33.22 N ATOM 3719 CD2 HIS B 119 4.560 9.143 17.872 1.00 55.12 C ATOM 3720 CE1 HIS B 119 6.043 7.583 17.461 1.00 74.31 C ATOM 3721 NE2 HIS B 119 5.460 8.654 16.958 1.00 22.51 N ATOM 0 H HIS B 119 2.811 8.486 22.471 1.00 53.54 H new ATOM 0 HA HIS B 119 5.428 9.115 21.458 1.00 31.05 H new ATOM 0 HB2 HIS B 119 3.802 7.330 20.642 1.00 24.30 H new ATOM 0 HB3 HIS B 119 2.792 8.615 20.012 1.00 24.30 H new ATOM 0 HD1 HIS B 119 5.815 6.598 19.279 1.00 33.22 H new ATOM 0 HD2 HIS B 119 3.932 10.013 17.751 1.00 55.12 H new ATOM 0 HE1 HIS B 119 6.799 6.987 16.972 1.00 74.31 H new ATOM 3730 N HIS B 120 3.284 11.466 21.555 1.00 35.12 N ATOM 3731 CA HIS B 120 2.991 12.862 21.224 1.00 61.52 C ATOM 3732 C HIS B 120 3.772 13.819 22.124 1.00 22.12 C ATOM 3733 O HIS B 120 4.357 14.792 21.646 1.00 21.30 O ATOM 3734 CB HIS B 120 1.488 13.141 21.366 1.00 61.10 C ATOM 3735 CG HIS B 120 1.091 14.524 20.947 1.00 45.20 C ATOM 3736 ND1 HIS B 120 0.972 15.580 21.825 1.00 23.40 N ATOM 3737 CD2 HIS B 120 0.784 15.019 19.727 1.00 61.34 C ATOM 3738 CE1 HIS B 120 0.608 16.662 21.162 1.00 14.23 C ATOM 3739 NE2 HIS B 120 0.487 16.349 19.886 1.00 33.30 N ATOM 0 H HIS B 120 2.739 11.098 22.335 1.00 35.12 H new ATOM 0 HA HIS B 120 3.296 13.028 20.191 1.00 61.52 H new ATOM 0 HB2 HIS B 120 0.935 12.417 20.768 1.00 61.10 H new ATOM 0 HB3 HIS B 120 1.195 12.987 22.405 1.00 61.10 H new ATOM 0 HD2 HIS B 120 0.774 14.469 18.798 1.00 61.34 H new ATOM 0 HE1 HIS B 120 0.438 17.638 21.591 1.00 14.23 H new ATOM 0 HE2 HIS B 120 0.217 16.990 19.140 1.00 33.30 H new ATOM 3748 N VAL B 121 3.768 13.534 23.425 1.00 53.34 N ATOM 3749 CA VAL B 121 4.378 14.422 24.416 1.00 2.11 C ATOM 3750 C VAL B 121 5.900 14.430 24.302 1.00 31.12 C ATOM 3751 O VAL B 121 6.538 15.466 24.504 1.00 43.14 O ATOM 3752 CB VAL B 121 3.971 14.039 25.867 1.00 52.03 C ATOM 3753 CG1 VAL B 121 2.461 14.171 26.061 1.00 41.33 C ATOM 3754 CG2 VAL B 121 4.440 12.626 26.220 1.00 63.42 C ATOM 0 H VAL B 121 3.348 12.692 23.819 1.00 53.34 H new ATOM 0 HA VAL B 121 4.002 15.422 24.202 1.00 2.11 H new ATOM 0 HB VAL B 121 4.466 14.735 26.545 1.00 52.03 H new ATOM 0 HG11 VAL B 121 2.200 13.898 27.083 1.00 41.33 H new ATOM 0 HG12 VAL B 121 2.159 15.201 25.872 1.00 41.33 H new ATOM 0 HG13 VAL B 121 1.946 13.508 25.366 1.00 41.33 H new ATOM 0 HG21 VAL B 121 4.140 12.388 27.241 1.00 63.42 H new ATOM 0 HG22 VAL B 121 3.989 11.910 25.533 1.00 63.42 H new ATOM 0 HG23 VAL B 121 5.526 12.572 26.139 1.00 63.42 H new ATOM 3764 N CYS B 122 6.482 13.282 23.972 1.00 64.23 N ATOM 3765 CA CYS B 122 7.930 13.175 23.854 1.00 24.42 C ATOM 3766 C CYS B 122 8.333 12.057 22.894 1.00 23.34 C ATOM 3767 O CYS B 122 8.665 10.948 23.318 1.00 74.53 O ATOM 3768 CB CYS B 122 8.567 12.951 25.234 1.00 15.34 C ATOM 3769 SG CYS B 122 10.370 12.809 25.198 1.00 14.44 S ATOM 0 H CYS B 122 5.976 12.417 23.783 1.00 64.23 H new ATOM 0 HA CYS B 122 8.299 14.115 23.444 1.00 24.42 H new ATOM 0 HB2 CYS B 122 8.291 13.778 25.889 1.00 15.34 H new ATOM 0 HB3 CYS B 122 8.150 12.044 25.672 1.00 15.34 H new ATOM 0 HG CYS B 122 10.815 12.624 26.405 1.00 14.44 H new ATOM 3775 N PRO B 123 8.271 12.324 21.579 1.00 45.45 N ATOM 3776 CA PRO B 123 8.801 11.421 20.567 1.00 1.30 C ATOM 3777 C PRO B 123 10.275 11.715 20.292 1.00 21.43 C ATOM 3778 O PRO B 123 10.780 12.782 20.660 1.00 1.12 O ATOM 3779 CB PRO B 123 7.940 11.752 19.347 1.00 65.25 C ATOM 3780 CG PRO B 123 7.636 13.212 19.484 1.00 12.41 C ATOM 3781 CD PRO B 123 7.659 13.527 20.967 1.00 30.51 C ATOM 0 HA PRO B 123 8.762 10.371 20.856 1.00 1.30 H new ATOM 0 HB2 PRO B 123 8.471 11.543 18.418 1.00 65.25 H new ATOM 0 HB3 PRO B 123 7.027 11.157 19.333 1.00 65.25 H new ATOM 0 HG2 PRO B 123 8.373 13.812 18.950 1.00 12.41 H new ATOM 0 HG3 PRO B 123 6.662 13.446 19.054 1.00 12.41 H new ATOM 0 HD2 PRO B 123 8.244 14.423 21.176 1.00 30.51 H new ATOM 0 HD3 PRO B 123 6.655 13.705 21.353 1.00 30.51 H new ATOM 3789 N TYR B 124 10.973 10.775 19.659 1.00 44.15 N ATOM 3790 CA TYR B 124 12.351 11.016 19.253 1.00 41.53 C ATOM 3791 C TYR B 124 12.339 11.951 18.047 1.00 41.03 C ATOM 3792 O TYR B 124 12.430 11.504 16.906 1.00 24.42 O ATOM 3793 CB TYR B 124 13.080 9.694 18.932 1.00 11.44 C ATOM 3794 CG TYR B 124 14.592 9.784 19.082 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.465 9.208 18.154 1.00 62.34 C ATOM 3796 CD2 TYR B 124 15.146 10.447 20.171 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.836 9.299 18.319 1.00 22.14 C ATOM 3798 CE2 TYR B 124 16.511 10.541 20.337 1.00 2.53 C ATOM 3799 CZ TYR B 124 17.353 9.965 19.413 1.00 65.35 C ATOM 3800 OH TYR B 124 18.717 10.057 19.586 1.00 21.31 O ATOM 0 H TYR B 124 10.611 9.852 19.420 1.00 44.15 H new ATOM 0 HA TYR B 124 12.899 11.482 20.072 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.703 8.911 19.590 1.00 11.44 H new ATOM 0 HB3 TYR B 124 12.841 9.395 17.912 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.064 8.686 17.298 1.00 62.34 H new ATOM 0 HD2 TYR B 124 14.493 10.898 20.903 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.500 8.851 17.595 1.00 22.14 H new ATOM 0 HE2 TYR B 124 16.918 11.065 21.189 1.00 2.53 H new ATOM 0 HH TYR B 124 19.171 9.758 18.771 1.00 21.31 H new ATOM 3845 N THR B 128 9.692 12.267 13.524 1.00 13.32 N ATOM 3846 CA THR B 128 9.814 10.818 13.581 1.00 55.14 C ATOM 3847 C THR B 128 8.476 10.208 13.214 1.00 13.14 C ATOM 3848 O THR B 128 8.369 9.022 12.928 1.00 21.45 O ATOM 3849 CB THR B 128 10.240 10.334 14.994 1.00 41.45 C ATOM 3850 OG1 THR B 128 10.712 8.979 14.941 1.00 41.22 O ATOM 3851 CG2 THR B 128 9.078 10.414 15.982 1.00 11.25 C ATOM 0 HA THR B 128 10.587 10.504 12.880 1.00 55.14 H new ATOM 0 HB THR B 128 11.041 10.991 15.334 1.00 41.45 H new ATOM 0 HG1 THR B 128 10.344 8.475 15.697 1.00 41.22 H new ATOM 0 HG21 THR B 128 9.409 10.068 16.961 1.00 11.25 H new ATOM 0 HG22 THR B 128 8.735 11.446 16.058 1.00 11.25 H new ATOM 0 HG23 THR B 128 8.259 9.785 15.633 1.00 11.25 H new ATOM 3859 N ARG B 129 7.453 11.055 13.227 1.00 41.51 N ATOM 3860 CA ARG B 129 6.095 10.630 12.976 1.00 75.21 C ATOM 3861 C ARG B 129 5.492 11.386 11.799 1.00 73.32 C ATOM 3862 O ARG B 129 4.784 10.810 10.981 1.00 44.41 O ATOM 3863 CB ARG B 129 5.264 10.853 14.235 1.00 21.01 C ATOM 3864 CG ARG B 129 5.323 12.272 14.792 1.00 45.10 C ATOM 3865 CD ARG B 129 4.389 12.418 15.978 1.00 21.21 C ATOM 3866 NE ARG B 129 4.434 13.750 16.590 1.00 2.44 N ATOM 3867 CZ ARG B 129 3.352 14.417 17.006 1.00 0.21 C ATOM 3868 NH1 ARG B 129 2.134 13.925 16.793 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 3.490 15.580 17.631 1.00 44.44 N ATOM 0 H ARG B 129 7.549 12.053 13.412 1.00 41.51 H new ATOM 0 HA ARG B 129 6.096 9.571 12.720 1.00 75.21 H new ATOM 0 HB2 ARG B 129 4.225 10.605 14.017 1.00 21.01 H new ATOM 0 HB3 ARG B 129 5.602 10.160 15.005 1.00 21.01 H new ATOM 0 HG2 ARG B 129 6.343 12.508 15.094 1.00 45.10 H new ATOM 0 HG3 ARG B 129 5.048 12.985 14.015 1.00 45.10 H new ATOM 0 HD2 ARG B 129 3.369 12.207 15.657 1.00 21.21 H new ATOM 0 HD3 ARG B 129 4.647 11.671 16.729 1.00 21.21 H new ATOM 0 HE ARG B 129 5.345 14.194 16.705 1.00 2.44 H new ATOM 0 HH11 ARG B 129 2.021 13.034 16.310 1.00 5.12 H new ATOM 0 HH12 ARG B 129 1.313 14.439 17.113 1.00 5.12 H new ATOM 0 HH21 ARG B 129 4.421 15.964 17.794 1.00 44.44 H new ATOM 0 HH22 ARG B 129 2.665 16.089 17.949 1.00 44.44 H new ATOM 3883 N ASN B 130 5.749 12.687 11.739 1.00 21.53 N ATOM 3884 CA ASN B 130 5.281 13.509 10.618 1.00 53.34 C ATOM 3885 C ASN B 130 6.090 13.234 9.351 1.00 22.35 C ATOM 3886 O ASN B 130 5.526 13.046 8.271 1.00 70.41 O ATOM 3887 CB ASN B 130 5.349 15.005 10.966 1.00 70.21 C ATOM 3888 CG ASN B 130 4.377 15.424 12.064 1.00 33.52 C ATOM 3889 OD1 ASN B 130 3.226 14.768 12.144 1.00 60.32 O flip ATOM 3890 ND2 ASN B 130 4.656 16.350 12.826 1.00 74.14 N flip ATOM 0 H ASN B 130 6.276 13.198 12.447 1.00 21.53 H new ATOM 0 HA ASN B 130 4.242 13.238 10.430 1.00 53.34 H new ATOM 0 HB2 ASN B 130 6.364 15.250 11.278 1.00 70.21 H new ATOM 0 HB3 ASN B 130 5.142 15.588 10.068 1.00 70.21 H new ATOM 0 HD21 ASN B 130 5.550 16.833 12.736 1.00 74.14 H new ATOM 0 HD22 ASN B 130 3.993 16.635 13.547 1.00 74.14 H new ATOM 3897 N ASN B 131 7.413 13.210 9.487 1.00 34.23 N ATOM 3898 CA ASN B 131 8.302 13.016 8.338 1.00 31.43 C ATOM 3899 C ASN B 131 8.348 11.542 7.939 1.00 54.44 C ATOM 3900 O ASN B 131 8.278 11.200 6.756 1.00 13.44 O ATOM 3901 CB ASN B 131 9.718 13.505 8.671 1.00 3.33 C ATOM 3902 CG ASN B 131 10.648 13.535 7.461 1.00 61.21 C ATOM 3903 OD1 ASN B 131 10.121 13.890 6.297 1.00 75.43 O flip ATOM 3904 ND2 ASN B 131 11.843 13.269 7.580 1.00 34.33 N flip ATOM 0 H ASN B 131 7.896 13.322 10.379 1.00 34.23 H new ATOM 0 HA ASN B 131 7.911 13.596 7.502 1.00 31.43 H new ATOM 0 HB2 ASN B 131 9.658 14.506 9.099 1.00 3.33 H new ATOM 0 HB3 ASN B 131 10.148 12.857 9.435 1.00 3.33 H new ATOM 0 HD21 ASN B 131 12.217 12.999 8.490 1.00 34.33 H new ATOM 0 HD22 ASN B 131 12.460 13.318 6.769 1.00 34.33 H new ATOM 3911 N VAL B 132 8.457 10.678 8.945 1.00 52.13 N ATOM 3912 CA VAL B 132 8.538 9.237 8.735 1.00 11.30 C ATOM 3913 C VAL B 132 7.154 8.604 8.860 1.00 11.32 C ATOM 3914 O VAL B 132 6.390 8.940 9.768 1.00 35.23 O ATOM 3915 CB VAL B 132 9.504 8.577 9.755 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.722 7.098 9.432 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.833 9.332 9.807 1.00 3.12 C ATOM 0 H VAL B 132 8.492 10.957 9.926 1.00 52.13 H new ATOM 0 HA VAL B 132 8.924 9.068 7.730 1.00 11.30 H new ATOM 0 HB VAL B 132 9.044 8.634 10.741 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.403 6.662 10.163 1.00 32.53 H new ATOM 0 HG12 VAL B 132 8.767 6.573 9.468 1.00 32.53 H new ATOM 0 HG13 VAL B 132 10.151 7.003 8.435 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.496 8.853 10.528 1.00 3.12 H new ATOM 0 HG22 VAL B 132 11.298 9.318 8.821 1.00 3.12 H new ATOM 0 HG23 VAL B 132 10.654 10.364 10.109 1.00 3.12 H new ATOM 3927 N ALA B 133 6.836 7.695 7.945 1.00 53.04 N ATOM 3928 CA ALA B 133 5.540 7.030 7.943 1.00 53.01 C ATOM 3929 C ALA B 133 5.489 5.945 9.005 1.00 72.23 C ATOM 3930 O ALA B 133 5.843 4.788 8.759 1.00 0.23 O ATOM 3931 CB ALA B 133 5.238 6.466 6.561 1.00 11.23 C ATOM 0 H ALA B 133 7.460 7.402 7.194 1.00 53.04 H new ATOM 0 HA ALA B 133 4.771 7.764 8.185 1.00 53.01 H new ATOM 0 HB1 ALA B 133 4.267 5.972 6.574 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.223 7.277 5.833 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.008 5.745 6.286 1.00 11.23 H new ATOM 3937 N VAL B 134 5.059 6.337 10.193 1.00 34.41 N ATOM 3938 CA VAL B 134 4.986 5.434 11.324 1.00 31.34 C ATOM 3939 C VAL B 134 3.543 5.035 11.605 1.00 33.12 C ATOM 3940 O VAL B 134 2.655 5.886 11.685 1.00 12.15 O ATOM 3941 CB VAL B 134 5.602 6.072 12.592 1.00 33.43 C ATOM 3942 CG1 VAL B 134 5.468 5.134 13.784 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.065 6.438 12.351 1.00 5.41 C ATOM 0 H VAL B 134 4.752 7.288 10.398 1.00 34.41 H new ATOM 0 HA VAL B 134 5.560 4.544 11.067 1.00 31.34 H new ATOM 0 HB VAL B 134 5.054 6.987 12.818 1.00 33.43 H new ATOM 0 HG11 VAL B 134 5.907 5.601 14.666 1.00 61.10 H new ATOM 0 HG12 VAL B 134 4.414 4.929 13.969 1.00 61.10 H new ATOM 0 HG13 VAL B 134 5.987 4.199 13.572 1.00 61.10 H new ATOM 0 HG21 VAL B 134 7.482 6.885 13.253 1.00 5.41 H new ATOM 0 HG22 VAL B 134 7.628 5.540 12.098 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.131 7.151 11.529 1.00 5.41 H new ATOM 3953 N ARG B 135 3.316 3.733 11.728 1.00 11.21 N ATOM 3954 CA ARG B 135 2.012 3.199 12.103 1.00 24.23 C ATOM 3955 C ARG B 135 2.053 2.783 13.566 1.00 24.22 C ATOM 3956 O ARG B 135 2.881 1.959 13.957 1.00 54.44 O ATOM 3957 CB ARG B 135 1.640 1.983 11.243 1.00 74.32 C ATOM 3958 CG ARG B 135 1.788 2.200 9.743 1.00 34.13 C ATOM 3959 CD ARG B 135 1.029 3.432 9.254 1.00 2.43 C ATOM 3960 NE ARG B 135 1.064 3.543 7.794 1.00 1.50 N ATOM 3961 CZ ARG B 135 2.182 3.657 7.073 1.00 23.13 C ATOM 3962 NH1 ARG B 135 3.361 3.765 7.673 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 2.113 3.682 5.749 1.00 14.33 N ATOM 0 H ARG B 135 4.028 3.019 11.571 1.00 11.21 H new ATOM 0 HA ARG B 135 1.261 3.973 11.944 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.265 1.140 11.539 1.00 74.32 H new ATOM 0 HB3 ARG B 135 0.608 1.705 11.457 1.00 74.32 H new ATOM 0 HG2 ARG B 135 2.844 2.306 9.497 1.00 34.13 H new ATOM 0 HG3 ARG B 135 1.424 1.319 9.214 1.00 34.13 H new ATOM 0 HD2 ARG B 135 -0.006 3.379 9.591 1.00 2.43 H new ATOM 0 HD3 ARG B 135 1.463 4.328 9.698 1.00 2.43 H new ATOM 0 HE ARG B 135 0.175 3.533 7.295 1.00 1.50 H new ATOM 0 HH11 ARG B 135 3.417 3.761 8.691 1.00 1.54 H new ATOM 0 HH12 ARG B 135 4.211 3.852 7.116 1.00 1.54 H new ATOM 0 HH21 ARG B 135 1.208 3.614 5.284 1.00 14.33 H new ATOM 0 HH22 ARG B 135 2.965 3.769 5.195 1.00 14.33 H new ATOM 3977 N LEU B 136 1.183 3.364 14.377 1.00 62.51 N ATOM 3978 CA LEU B 136 1.106 3.011 15.781 1.00 72.41 C ATOM 3979 C LEU B 136 0.137 1.854 15.972 1.00 41.21 C ATOM 3980 O LEU B 136 -1.073 1.999 15.793 1.00 33.52 O ATOM 3981 CB LEU B 136 0.705 4.233 16.610 1.00 60.04 C ATOM 3982 CG LEU B 136 1.801 5.308 16.722 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.313 6.516 17.516 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.062 4.714 17.350 1.00 0.00 C ATOM 0 H LEU B 136 0.521 4.082 14.084 1.00 62.51 H new ATOM 0 HA LEU B 136 2.086 2.685 16.130 1.00 72.41 H new ATOM 0 HB2 LEU B 136 -0.184 4.682 16.168 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.431 3.904 17.612 1.00 60.04 H new ATOM 0 HG LEU B 136 2.043 5.654 15.717 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.110 7.257 17.577 1.00 41.31 H new ATOM 0 HD12 LEU B 136 0.448 6.954 17.018 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.032 6.201 18.521 1.00 41.31 H new ATOM 0 HD21 LEU B 136 3.829 5.485 17.424 1.00 0.00 H new ATOM 0 HD22 LEU B 136 2.830 4.337 18.346 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.427 3.896 16.729 1.00 0.00 H new ATOM 3996 N VAL B 137 0.694 0.695 16.296 1.00 22.01 N ATOM 3997 CA VAL B 137 -0.071 -0.529 16.478 1.00 61.13 C ATOM 3998 C VAL B 137 0.057 -1.017 17.917 1.00 31.22 C ATOM 3999 O VAL B 137 1.145 -1.345 18.384 1.00 63.04 O ATOM 4000 CB VAL B 137 0.387 -1.633 15.475 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.879 -1.513 15.173 1.00 20.11 C ATOM 4002 CG2 VAL B 137 0.057 -3.040 15.991 1.00 5.14 C ATOM 0 H VAL B 137 1.697 0.578 16.441 1.00 22.01 H new ATOM 0 HA VAL B 137 -1.120 -0.313 16.274 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.168 -1.478 14.550 1.00 72.22 H new ATOM 0 HG11 VAL B 137 2.172 -2.294 14.472 1.00 20.11 H new ATOM 0 HG12 VAL B 137 2.084 -0.536 14.735 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.447 -1.623 16.097 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.391 -3.781 15.265 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.565 -3.208 16.941 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.020 -3.132 16.134 1.00 5.14 H new ATOM 4012 N VAL B 138 -1.059 -1.032 18.626 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.085 -1.484 20.009 1.00 24.22 C ATOM 4014 C VAL B 138 -1.477 -2.954 20.069 1.00 70.52 C ATOM 4015 O VAL B 138 -2.351 -3.414 19.328 1.00 62.24 O ATOM 4016 CB VAL B 138 -2.034 -0.651 20.895 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.787 0.838 20.691 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.486 -1.023 20.633 1.00 0.20 C ATOM 0 H VAL B 138 -1.965 -0.734 18.265 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.079 -1.349 20.405 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.824 -0.880 21.940 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.466 1.409 21.324 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.757 1.076 20.956 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -1.962 1.096 19.646 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -4.136 -0.422 21.269 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.727 -0.834 19.587 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.637 -2.080 20.855 1.00 0.20 H new ATOM 4028 N ALA B 139 -0.795 -3.682 20.923 1.00 41.23 N ATOM 4029 CA ALA B 139 -0.952 -5.125 21.017 1.00 52.34 C ATOM 4030 C ALA B 139 -1.466 -5.513 22.404 1.00 22.31 C ATOM 4031 O ALA B 139 -2.586 -6.054 22.496 1.00 10.42 O ATOM 4032 CB ALA B 139 0.366 -5.822 20.702 1.00 71.35 C ATOM 4033 OXT ALA B 139 -0.764 -5.244 23.403 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.113 -3.295 21.575 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.688 -5.450 20.282 1.00 52.34 H new ATOM 0 HB1 ALA B 139 0.234 -6.901 20.776 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.682 -5.564 19.691 1.00 71.35 H new ATOM 0 HB3 ALA B 139 1.127 -5.500 21.413 1.00 71.35 H new