USER MOD reduce.3.24.130724 H: found=0, std=0, add=1267, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1268 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 66 MET CE :methyl 136:sc= -4.47 (180deg=-10.5!) USER MOD Set 1.2: B 67 THR OG1 : rot 180:sc= -0.0107 USER MOD Set 2.1: B 62 THR OG1 : rot -76:sc= 0.266 USER MOD Set 2.2: B 76 GLN : amide:sc= -2.69! C(o=-2.4!,f=-3.8!) USER MOD Set 3.1: B 19 SER OG : rot 180:sc= 0.0449 USER MOD Set 3.2: B 22 GLN : amide:sc= -0.948 K(o=-0.9,f=-2.5!) USER MOD Set 4.1: A 66 MET CE :methyl -108:sc= -4.08 (180deg=-9.69!) USER MOD Set 4.2: A 67 THR OG1 : rot 180:sc= -0.247 USER MOD Set 5.1: A 62 THR OG1 : rot -59:sc= 0.0582 USER MOD Set 5.2: A 76 GLN : amide:sc= -1.33 X(o=-1.3,f=-1.4) USER MOD Set 6.1: A 51 ASN : amide:sc= -0.255 K(o=-2,f=-1.2) USER MOD Set 6.2: A 54 GLN : amide:sc= -1.74 K(o=-2,f=-1.2) USER MOD Set 7.1: A 50 MET CE :methyl -166:sc= -0.506 (180deg=-1.23) USER MOD Set 7.2: B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 8.1: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 8.2: B 50 MET CE :methyl -166:sc= -0.287 (180deg=-0.868) USER MOD Single : A 4 THR OG1 : rot 16:sc= 0.78 USER MOD Single : A 6 SER OG : rot 94:sc= 1.11 USER MOD Single : A 12 MET CE :methyl 170:sc= -0.0571 (180deg=-0.346) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot -160:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -0.993 K(o=-0.99,f=-4.1!) USER MOD Single : A 22 GLN : amide:sc= -0.195 K(o=-0.19,f=-1.1!) USER MOD Single : A 27 THR OG1 : rot -110:sc= -0.0245 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -170:sc= -0.812 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot -109:sc= 0.745 USER MOD Single : A 37 TYR OH : rot 165:sc= -0.0284 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.0391 USER MOD Single : A 46 THR OG1 : rot -170:sc= 0 USER MOD Single : A 49 MET CE :methyl 158:sc= -2.68 (180deg=-4.53!) USER MOD Single : A 55 THR OG1 : rot -87:sc= -0.432 USER MOD Single : A 57 GLN : amide:sc= -4.68! C(o=-4.7!,f=-6.1!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -148:sc= -0.173 (180deg=-0.812) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.145 X(o=-0.14,f=-0.14) USER MOD Single : A 69 GLN : amide:sc= -0.166 X(o=-0.17,f=0) USER MOD Single : A 74 SER OG : rot -120:sc= -0.0162 USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 4 THR OG1 : rot 23:sc= 0.676 USER MOD Single : B 6 SER OG : rot 113:sc= 1.03 USER MOD Single : B 12 MET CE :methyl 167:sc= -1.23 (180deg=-2.13) USER MOD Single : B 14 LYS NZ :NH3+ 160:sc= -0.0607 (180deg=-0.5) USER MOD Single : B 15 SER OG : rot -79:sc= 0.764 USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 21 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : B 27 THR OG1 : rot 10:sc= 0.193! USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc=-0.00461 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.14 USER MOD Single : B 46 THR OG1 : rot -150:sc= 0 USER MOD Single : B 49 MET CE :methyl 147:sc= -3.63 (180deg=-6.76!) USER MOD Single : B 51 ASN : amide:sc= -0.311 X(o=-0.31,f=-0.0023) USER MOD Single : B 54 GLN : amide:sc= -1.81 X(o=-1.8,f=-1.3) USER MOD Single : B 55 THR OG1 : rot -92:sc= 0.427 USER MOD Single : B 57 GLN : amide:sc= -2.2 K(o=-2.2,f=-9.9!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 60 LYS NZ :NH3+ -130:sc= -0.158 (180deg=-0.835) USER MOD Single : B 61 TYR OH : rot 180:sc= 0 USER MOD Single : B 68 ASN : amide:sc= -0.134 K(o=-0.13,f=-1.6!) USER MOD Single : B 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 SER OG : rot -170:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 43 N THR A 4 4.926 5.738 -6.977 1.00 55.11 N ATOM 44 CA THR A 4 5.944 6.603 -7.559 1.00 61.02 C ATOM 45 C THR A 4 5.526 8.068 -7.491 1.00 34.12 C ATOM 46 O THR A 4 4.349 8.379 -7.300 1.00 24.32 O ATOM 47 CB THR A 4 6.227 6.229 -9.026 1.00 65.03 C ATOM 48 OG1 THR A 4 5.680 4.939 -9.318 1.00 41.45 O ATOM 49 CG2 THR A 4 7.723 6.226 -9.305 1.00 24.23 C ATOM 0 HA THR A 4 6.852 6.460 -6.974 1.00 61.02 H new ATOM 0 HB THR A 4 5.755 6.976 -9.665 1.00 65.03 H new ATOM 0 HG1 THR A 4 5.036 4.691 -8.622 1.00 41.45 H new ATOM 0 HG21 THR A 4 7.898 5.959 -10.347 1.00 24.23 H new ATOM 0 HG22 THR A 4 8.131 7.218 -9.111 1.00 24.23 H new ATOM 0 HG23 THR A 4 8.213 5.499 -8.657 1.00 24.23 H new ATOM 57 N ILE A 5 6.494 8.963 -7.650 1.00 21.33 N ATOM 58 CA ILE A 5 6.225 10.395 -7.608 1.00 1.35 C ATOM 59 C ILE A 5 5.083 10.767 -8.548 1.00 62.20 C ATOM 60 O ILE A 5 4.166 11.495 -8.169 1.00 53.40 O ATOM 61 CB ILE A 5 7.474 11.214 -7.986 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.630 10.886 -7.040 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.161 12.702 -7.952 1.00 34.15 C ATOM 64 CD1 ILE A 5 9.968 10.773 -7.738 1.00 64.05 C ATOM 0 H ILE A 5 7.472 8.722 -7.809 1.00 21.33 H new ATOM 0 HA ILE A 5 5.941 10.633 -6.583 1.00 1.35 H new ATOM 0 HB ILE A 5 7.772 10.948 -9.000 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.693 11.659 -6.274 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.415 9.948 -6.529 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.053 13.268 -8.221 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.364 12.922 -8.662 1.00 34.15 H new ATOM 0 HG23 ILE A 5 6.842 12.984 -6.949 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.741 10.539 -7.006 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.923 9.980 -8.485 1.00 64.05 H new ATOM 0 HD13 ILE A 5 10.205 11.718 -8.226 1.00 64.05 H new ATOM 76 N SER A 6 5.145 10.260 -9.775 1.00 63.44 N ATOM 77 CA SER A 6 4.117 10.540 -10.770 1.00 34.41 C ATOM 78 C SER A 6 2.726 10.266 -10.207 1.00 2.22 C ATOM 79 O SER A 6 1.809 11.070 -10.374 1.00 53.23 O ATOM 80 CB SER A 6 4.348 9.695 -12.025 1.00 71.40 C ATOM 81 OG SER A 6 3.396 8.648 -12.116 1.00 42.32 O ATOM 0 H SER A 6 5.896 9.653 -10.104 1.00 63.44 H new ATOM 0 HA SER A 6 4.181 11.595 -11.035 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.284 10.328 -12.910 1.00 71.40 H new ATOM 0 HB3 SER A 6 5.354 9.276 -12.005 1.00 71.40 H new ATOM 0 HG SER A 6 2.638 8.942 -12.664 1.00 42.32 H new ATOM 87 N GLU A 7 2.578 9.127 -9.540 1.00 61.11 N ATOM 88 CA GLU A 7 1.299 8.745 -8.953 1.00 23.42 C ATOM 89 C GLU A 7 0.830 9.792 -7.946 1.00 40.04 C ATOM 90 O GLU A 7 -0.370 10.005 -7.769 1.00 33.31 O ATOM 91 CB GLU A 7 1.412 7.381 -8.270 1.00 72.32 C ATOM 92 CG GLU A 7 0.982 6.221 -9.151 1.00 53.22 C ATOM 93 CD GLU A 7 -0.521 6.028 -9.170 1.00 62.25 C ATOM 94 OE1 GLU A 7 -1.234 6.867 -8.579 1.00 50.32 O ATOM 95 OE2 GLU A 7 -0.986 5.040 -9.775 1.00 43.33 O ATOM 0 H GLU A 7 3.328 8.452 -9.392 1.00 61.11 H new ATOM 0 HA GLU A 7 0.565 8.681 -9.756 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.445 7.225 -7.957 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.802 7.385 -7.366 1.00 72.32 H new ATOM 0 HG2 GLU A 7 1.335 6.392 -10.168 1.00 53.22 H new ATOM 0 HG3 GLU A 7 1.457 5.306 -8.798 1.00 53.22 H new ATOM 102 N LYS A 8 1.783 10.444 -7.289 1.00 33.13 N ATOM 103 CA LYS A 8 1.471 11.469 -6.301 1.00 4.14 C ATOM 104 C LYS A 8 0.987 12.747 -6.978 1.00 74.14 C ATOM 105 O LYS A 8 0.553 13.687 -6.313 1.00 64.53 O ATOM 106 CB LYS A 8 2.699 11.768 -5.439 1.00 75.53 C ATOM 107 CG LYS A 8 3.523 10.537 -5.106 1.00 22.34 C ATOM 108 CD LYS A 8 4.493 10.807 -3.967 1.00 11.10 C ATOM 109 CE LYS A 8 4.135 10.001 -2.728 1.00 11.21 C ATOM 110 NZ LYS A 8 5.347 9.510 -2.016 1.00 5.33 N ATOM 0 H LYS A 8 2.781 10.280 -7.424 1.00 33.13 H new ATOM 0 HA LYS A 8 0.672 11.092 -5.663 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.331 12.488 -5.959 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.375 12.240 -4.511 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.859 9.717 -4.833 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.077 10.219 -5.989 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.506 10.559 -4.284 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.486 11.870 -3.726 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.542 10.618 -2.053 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.513 9.153 -3.014 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 5.060 8.965 -1.178 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.900 8.901 -2.652 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.928 10.320 -1.720 1.00 5.33 H new ATOM 124 N ILE A 9 1.066 12.775 -8.305 1.00 15.20 N ATOM 125 CA ILE A 9 0.634 13.937 -9.071 1.00 41.10 C ATOM 126 C ILE A 9 -0.581 13.607 -9.933 1.00 71.21 C ATOM 127 O ILE A 9 -1.066 14.449 -10.689 1.00 5.21 O ATOM 128 CB ILE A 9 1.762 14.466 -9.976 1.00 42.44 C ATOM 129 CG1 ILE A 9 3.085 14.502 -9.208 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.413 15.849 -10.504 1.00 73.14 C ATOM 131 CD1 ILE A 9 4.259 14.957 -10.047 1.00 55.24 C ATOM 0 H ILE A 9 1.425 12.006 -8.871 1.00 15.20 H new ATOM 0 HA ILE A 9 0.366 14.709 -8.349 1.00 41.10 H new ATOM 0 HB ILE A 9 1.873 13.792 -10.825 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.981 15.169 -8.352 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.294 13.507 -8.814 1.00 3.22 H new ATOM 0 HG21 ILE A 9 2.220 16.209 -11.142 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.490 15.796 -11.082 1.00 73.14 H new ATOM 0 HG23 ILE A 9 1.278 16.535 -9.667 1.00 73.14 H new ATOM 0 HD11 ILE A 9 5.163 14.958 -9.438 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.390 14.277 -10.889 1.00 55.24 H new ATOM 0 HD13 ILE A 9 4.071 15.964 -10.420 1.00 55.24 H new ATOM 143 N VAL A 10 -1.068 12.376 -9.814 1.00 4.30 N ATOM 144 CA VAL A 10 -2.228 11.935 -10.579 1.00 43.34 C ATOM 145 C VAL A 10 -3.439 11.735 -9.676 1.00 34.04 C ATOM 146 O VAL A 10 -4.527 12.237 -9.957 1.00 71.51 O ATOM 147 CB VAL A 10 -1.938 10.622 -11.329 1.00 22.34 C ATOM 148 CG1 VAL A 10 -3.089 10.272 -12.259 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.631 10.726 -12.102 1.00 51.14 C ATOM 0 H VAL A 10 -0.677 11.666 -9.195 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.446 12.719 -11.304 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.838 9.821 -10.596 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.866 9.341 -12.780 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -4.003 10.152 -11.677 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -3.225 11.072 -12.987 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -0.442 9.789 -12.626 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.700 11.538 -12.825 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.187 10.925 -11.409 1.00 51.14 H new ATOM 159 N LEU A 11 -3.243 10.997 -8.588 1.00 33.50 N ATOM 160 CA LEU A 11 -4.319 10.731 -7.640 1.00 22.11 C ATOM 161 C LEU A 11 -4.934 12.032 -7.134 1.00 23.40 C ATOM 162 O LEU A 11 -6.093 12.063 -6.721 1.00 73.14 O ATOM 163 CB LEU A 11 -3.796 9.907 -6.462 1.00 73.11 C ATOM 164 CG LEU A 11 -2.540 10.444 -5.774 1.00 24.02 C ATOM 165 CD1 LEU A 11 -2.915 11.348 -4.609 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.661 9.295 -5.299 1.00 62.13 C ATOM 0 H LEU A 11 -2.349 10.573 -8.341 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.093 10.163 -8.157 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.589 9.829 -5.718 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.589 8.896 -6.814 1.00 73.11 H new ATOM 0 HG LEU A 11 -1.975 11.033 -6.497 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.009 11.721 -4.131 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.504 12.189 -4.976 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.501 10.783 -3.884 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.772 9.695 -4.812 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.217 8.680 -4.591 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.364 8.687 -6.153 1.00 62.13 H new ATOM 178 N MET A 12 -4.150 13.104 -7.170 1.00 51.31 N ATOM 179 CA MET A 12 -4.619 14.408 -6.718 1.00 35.35 C ATOM 180 C MET A 12 -5.184 15.217 -7.881 1.00 14.33 C ATOM 181 O MET A 12 -6.192 15.908 -7.737 1.00 15.55 O ATOM 182 CB MET A 12 -3.479 15.181 -6.051 1.00 43.44 C ATOM 183 CG MET A 12 -2.138 15.006 -6.746 1.00 42.04 C ATOM 184 SD MET A 12 -1.032 16.406 -6.485 1.00 23.34 S ATOM 185 CE MET A 12 -1.281 17.322 -8.004 1.00 1.34 C ATOM 0 H MET A 12 -3.187 13.095 -7.507 1.00 51.31 H new ATOM 0 HA MET A 12 -5.415 14.247 -5.990 1.00 35.35 H new ATOM 0 HB2 MET A 12 -3.733 16.241 -6.030 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.387 14.855 -5.015 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.660 14.097 -6.381 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.302 14.872 -7.815 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.806 18.299 -7.922 1.00 1.34 H new ATOM 0 HE2 MET A 12 -0.840 16.773 -8.836 1.00 1.34 H new ATOM 0 HE3 MET A 12 -2.349 17.452 -8.180 1.00 1.34 H new ATOM 195 N ARG A 13 -4.528 15.125 -9.033 1.00 72.22 N ATOM 196 CA ARG A 13 -4.964 15.850 -10.221 1.00 43.34 C ATOM 197 C ARG A 13 -6.343 15.375 -10.671 1.00 25.20 C ATOM 198 O ARG A 13 -7.205 16.182 -11.022 1.00 32.00 O ATOM 199 CB ARG A 13 -3.955 15.666 -11.355 1.00 43.40 C ATOM 200 CG ARG A 13 -4.037 16.743 -12.425 1.00 23.54 C ATOM 201 CD ARG A 13 -4.340 16.150 -13.792 1.00 1.24 C ATOM 202 NE ARG A 13 -5.624 15.456 -13.815 1.00 13.15 N ATOM 203 CZ ARG A 13 -5.947 14.539 -14.721 1.00 62.43 C ATOM 204 NH1 ARG A 13 -5.084 14.208 -15.671 1.00 34.04 N ATOM 205 NH2 ARG A 13 -7.136 13.952 -14.677 1.00 3.12 N ATOM 0 H ARG A 13 -3.693 14.556 -9.169 1.00 72.22 H new ATOM 0 HA ARG A 13 -5.027 16.908 -9.968 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -2.949 15.658 -10.936 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -4.116 14.693 -11.818 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -4.812 17.462 -12.160 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -3.095 17.290 -12.465 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -4.344 16.944 -14.539 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -3.547 15.455 -14.069 1.00 1.24 H new ATOM 0 HE ARG A 13 -6.310 15.687 -13.097 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -4.169 14.657 -15.708 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -5.335 13.504 -16.365 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -7.803 14.204 -13.948 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -7.383 13.248 -15.373 1.00 3.12 H new ATOM 219 N LYS A 14 -6.545 14.062 -10.658 1.00 43.14 N ATOM 220 CA LYS A 14 -7.818 13.479 -11.063 1.00 24.33 C ATOM 221 C LYS A 14 -8.922 13.842 -10.074 1.00 14.43 C ATOM 222 O LYS A 14 -10.107 13.756 -10.394 1.00 20.12 O ATOM 223 CB LYS A 14 -7.695 11.957 -11.171 1.00 73.54 C ATOM 224 CG LYS A 14 -6.957 11.493 -12.415 1.00 21.53 C ATOM 225 CD LYS A 14 -6.942 9.978 -12.521 1.00 2.42 C ATOM 226 CE LYS A 14 -6.185 9.345 -11.363 1.00 1.21 C ATOM 227 NZ LYS A 14 -5.571 8.044 -11.747 1.00 3.32 N ATOM 0 H LYS A 14 -5.842 13.381 -10.371 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.081 13.886 -12.039 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -7.177 11.579 -10.289 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -8.693 11.519 -11.166 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -7.432 11.916 -13.300 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -5.934 11.867 -12.393 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -7.965 9.603 -12.536 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -6.481 9.683 -13.463 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -5.406 10.027 -11.022 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -6.865 9.192 -10.525 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -5.064 7.645 -10.931 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -6.316 7.384 -12.049 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -4.903 8.193 -12.530 1.00 3.32 H new ATOM 241 N SER A 15 -8.524 14.248 -8.874 1.00 0.52 N ATOM 242 CA SER A 15 -9.480 14.622 -7.837 1.00 34.52 C ATOM 243 C SER A 15 -10.246 15.880 -8.234 1.00 4.13 C ATOM 244 O SER A 15 -11.411 16.048 -7.874 1.00 42.32 O ATOM 245 CB SER A 15 -8.758 14.848 -6.506 1.00 23.33 C ATOM 246 OG SER A 15 -9.601 14.535 -5.411 1.00 1.04 O ATOM 0 H SER A 15 -7.546 14.327 -8.594 1.00 0.52 H new ATOM 0 HA SER A 15 -10.192 13.805 -7.721 1.00 34.52 H new ATOM 0 HB2 SER A 15 -7.860 14.231 -6.466 1.00 23.33 H new ATOM 0 HB3 SER A 15 -8.435 15.887 -6.435 1.00 23.33 H new ATOM 0 HG SER A 15 -9.261 14.971 -4.602 1.00 1.04 H new ATOM 252 N GLU A 16 -9.582 16.761 -8.976 1.00 24.43 N ATOM 253 CA GLU A 16 -10.200 18.004 -9.421 1.00 22.34 C ATOM 254 C GLU A 16 -11.102 17.762 -10.628 1.00 32.11 C ATOM 255 O GLU A 16 -11.808 18.664 -11.080 1.00 43.32 O ATOM 256 CB GLU A 16 -9.127 19.037 -9.771 1.00 13.35 C ATOM 257 CG GLU A 16 -9.691 20.399 -10.140 1.00 62.31 C ATOM 258 CD GLU A 16 -10.665 20.927 -9.105 1.00 2.34 C ATOM 259 OE1 GLU A 16 -10.525 20.564 -7.918 1.00 14.23 O ATOM 260 OE2 GLU A 16 -11.568 21.703 -9.482 1.00 72.53 O ATOM 0 H GLU A 16 -8.617 16.637 -9.281 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.811 18.388 -8.604 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.453 19.150 -8.922 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.531 18.662 -10.603 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.871 21.108 -10.257 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.194 20.331 -11.105 1.00 62.31 H new ATOM 267 N TYR A 17 -11.075 16.539 -11.143 1.00 34.24 N ATOM 268 CA TYR A 17 -11.886 16.178 -12.299 1.00 3.21 C ATOM 269 C TYR A 17 -11.489 17.000 -13.522 1.00 63.52 C ATOM 270 O TYR A 17 -12.287 17.193 -14.441 1.00 30.34 O ATOM 271 CB TYR A 17 -13.370 16.386 -11.992 1.00 21.42 C ATOM 272 CG TYR A 17 -13.811 15.761 -10.687 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.918 14.383 -10.555 1.00 22.22 C ATOM 274 CD2 TYR A 17 -14.119 16.550 -9.586 1.00 54.02 C ATOM 275 CE1 TYR A 17 -14.322 13.808 -9.365 1.00 21.13 C ATOM 276 CE2 TYR A 17 -14.521 15.985 -8.392 1.00 50.43 C ATOM 277 CZ TYR A 17 -14.622 14.613 -8.286 1.00 22.22 C ATOM 278 OH TYR A 17 -15.023 14.045 -7.099 1.00 41.24 O ATOM 0 H TYR A 17 -10.500 15.780 -10.778 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.711 15.125 -12.519 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.580 17.455 -11.963 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.963 15.967 -12.805 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -13.681 13.749 -11.397 1.00 22.22 H new ATOM 0 HD2 TYR A 17 -14.043 17.624 -9.665 1.00 54.02 H new ATOM 0 HE1 TYR A 17 -14.402 12.734 -9.280 1.00 21.13 H new ATOM 0 HE2 TYR A 17 -14.755 16.614 -7.546 1.00 50.43 H new ATOM 0 HH TYR A 17 -15.194 14.750 -6.440 1.00 41.24 H new ATOM 288 N LEU A 18 -10.251 17.481 -13.527 1.00 50.01 N ATOM 289 CA LEU A 18 -9.745 18.282 -14.635 1.00 55.21 C ATOM 290 C LEU A 18 -8.900 17.433 -15.580 1.00 11.42 C ATOM 291 O LEU A 18 -8.543 16.299 -15.260 1.00 23.51 O ATOM 292 CB LEU A 18 -8.917 19.455 -14.108 1.00 71.45 C ATOM 293 CG LEU A 18 -7.654 19.089 -13.328 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.496 18.831 -14.280 1.00 2.31 C ATOM 295 CD2 LEU A 18 -7.300 20.188 -12.338 1.00 52.43 C ATOM 0 H LEU A 18 -9.579 17.330 -12.775 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.600 18.669 -15.189 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.629 20.079 -14.954 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.553 20.063 -13.465 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.848 18.174 -12.768 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.605 18.572 -13.708 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.750 18.008 -14.948 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.301 19.728 -14.868 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -6.398 19.910 -11.792 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -7.125 21.120 -12.876 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -8.122 20.323 -11.635 1.00 52.43 H new ATOM 307 N SER A 19 -8.582 17.990 -16.745 1.00 75.14 N ATOM 308 CA SER A 19 -7.780 17.283 -17.736 1.00 42.32 C ATOM 309 C SER A 19 -6.311 17.679 -17.629 1.00 72.22 C ATOM 310 O SER A 19 -5.983 18.767 -17.154 1.00 2.13 O ATOM 311 CB SER A 19 -8.297 17.577 -19.145 1.00 3.34 C ATOM 312 OG SER A 19 -9.552 16.956 -19.367 1.00 61.02 O ATOM 0 H SER A 19 -8.868 18.928 -17.025 1.00 75.14 H new ATOM 0 HA SER A 19 -7.866 16.214 -17.541 1.00 42.32 H new ATOM 0 HB2 SER A 19 -8.391 18.654 -19.284 1.00 3.34 H new ATOM 0 HB3 SER A 19 -7.576 17.222 -19.882 1.00 3.34 H new ATOM 0 HG SER A 19 -9.862 17.160 -20.274 1.00 61.02 H new ATOM 318 N ARG A 20 -5.430 16.789 -18.074 1.00 71.01 N ATOM 319 CA ARG A 20 -3.996 17.045 -18.026 1.00 24.20 C ATOM 320 C ARG A 20 -3.663 18.395 -18.655 1.00 73.30 C ATOM 321 O ARG A 20 -2.717 19.065 -18.243 1.00 23.14 O ATOM 322 CB ARG A 20 -3.235 15.931 -18.750 1.00 14.35 C ATOM 323 CG ARG A 20 -2.610 14.912 -17.812 1.00 64.12 C ATOM 324 CD ARG A 20 -1.397 14.244 -18.442 1.00 52.12 C ATOM 325 NE ARG A 20 -1.280 12.842 -18.052 1.00 31.03 N ATOM 326 CZ ARG A 20 -2.065 11.880 -18.527 1.00 33.21 C ATOM 327 NH1 ARG A 20 -3.017 12.168 -19.403 1.00 13.10 N ATOM 328 NH2 ARG A 20 -1.897 10.627 -18.125 1.00 51.12 N ATOM 0 H ARG A 20 -5.684 15.885 -18.472 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.690 17.066 -16.980 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -3.917 15.418 -19.428 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -2.452 16.377 -19.363 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -2.315 15.403 -16.884 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -3.349 14.155 -17.551 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -1.468 14.314 -19.527 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.494 14.779 -18.147 1.00 52.12 H new ATOM 0 HE ARG A 20 -0.557 12.587 -17.379 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -3.149 13.130 -19.715 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -3.618 11.427 -19.765 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -1.165 10.401 -17.451 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -2.500 9.889 -18.490 1.00 51.12 H new ATOM 342 N GLN A 21 -4.447 18.785 -19.655 1.00 33.24 N ATOM 343 CA GLN A 21 -4.233 20.054 -20.341 1.00 62.13 C ATOM 344 C GLN A 21 -4.616 21.228 -19.446 1.00 32.54 C ATOM 345 O GLN A 21 -3.938 22.255 -19.430 1.00 15.25 O ATOM 346 CB GLN A 21 -5.045 20.100 -21.637 1.00 31.45 C ATOM 347 CG GLN A 21 -6.535 19.894 -21.429 1.00 12.41 C ATOM 348 CD GLN A 21 -7.296 21.201 -21.317 1.00 73.14 C ATOM 349 OE1 GLN A 21 -6.699 22.271 -21.194 1.00 3.42 O ATOM 350 NE2 GLN A 21 -8.621 21.121 -21.359 1.00 2.12 N ATOM 0 H GLN A 21 -5.235 18.242 -20.008 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.173 20.134 -20.581 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -4.884 21.063 -22.123 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -4.672 19.334 -22.317 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -6.937 19.314 -22.260 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -6.694 19.307 -20.524 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -9.074 20.213 -21.462 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -9.186 21.968 -21.288 1.00 2.12 H new ATOM 359 N GLN A 22 -5.705 21.067 -18.702 1.00 51.23 N ATOM 360 CA GLN A 22 -6.179 22.114 -17.805 1.00 0.45 C ATOM 361 C GLN A 22 -5.078 22.543 -16.841 1.00 51.31 C ATOM 362 O GLN A 22 -4.710 23.718 -16.784 1.00 43.21 O ATOM 363 CB GLN A 22 -7.399 21.631 -17.021 1.00 11.44 C ATOM 364 CG GLN A 22 -7.814 22.570 -15.899 1.00 2.14 C ATOM 365 CD GLN A 22 -9.317 22.745 -15.810 1.00 62.24 C ATOM 366 OE1 GLN A 22 -10.015 22.744 -16.824 1.00 71.22 O ATOM 367 NE2 GLN A 22 -9.825 22.897 -14.593 1.00 62.52 N ATOM 0 H GLN A 22 -6.276 20.222 -18.703 1.00 51.23 H new ATOM 0 HA GLN A 22 -6.464 22.974 -18.411 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -8.236 21.507 -17.708 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.184 20.649 -16.600 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -7.440 22.184 -14.951 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -7.347 23.543 -16.053 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -9.210 22.892 -13.779 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -10.830 23.019 -14.472 1.00 62.52 H new ATOM 376 N LEU A 23 -4.556 21.586 -16.082 1.00 1.25 N ATOM 377 CA LEU A 23 -3.495 21.864 -15.119 1.00 22.42 C ATOM 378 C LEU A 23 -2.265 22.435 -15.815 1.00 63.10 C ATOM 379 O LEU A 23 -1.669 23.406 -15.348 1.00 73.44 O ATOM 380 CB LEU A 23 -3.122 20.590 -14.360 1.00 64.12 C ATOM 381 CG LEU A 23 -1.754 20.593 -13.676 1.00 63.23 C ATOM 382 CD1 LEU A 23 -1.590 21.839 -12.819 1.00 72.12 C ATOM 383 CD2 LEU A 23 -1.576 19.338 -12.835 1.00 24.14 C ATOM 0 H LEU A 23 -4.850 20.610 -16.114 1.00 1.25 H new ATOM 0 HA LEU A 23 -3.865 22.605 -14.411 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -3.884 20.406 -13.603 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -3.156 19.753 -15.057 1.00 64.12 H new ATOM 0 HG LEU A 23 -0.983 20.602 -14.446 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -0.611 21.825 -12.340 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -1.674 22.726 -13.447 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -2.368 21.860 -12.055 1.00 72.12 H new ATOM 0 HD21 LEU A 23 -0.597 19.357 -12.356 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -2.353 19.298 -12.072 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -1.650 18.458 -13.474 1.00 24.14 H new ATOM 395 N ALA A 24 -1.888 21.827 -16.936 1.00 40.14 N ATOM 396 CA ALA A 24 -0.730 22.278 -17.698 1.00 33.11 C ATOM 397 C ALA A 24 -0.857 23.751 -18.068 1.00 23.23 C ATOM 398 O ALA A 24 0.143 24.464 -18.167 1.00 34.43 O ATOM 399 CB ALA A 24 -0.560 21.429 -18.950 1.00 43.12 C ATOM 0 H ALA A 24 -2.368 21.021 -17.336 1.00 40.14 H new ATOM 0 HA ALA A 24 0.155 22.163 -17.072 1.00 33.11 H new ATOM 0 HB1 ALA A 24 0.308 21.776 -19.510 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -0.415 20.387 -18.666 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -1.451 21.515 -19.572 1.00 43.12 H new ATOM 405 N ASP A 25 -2.089 24.202 -18.273 1.00 0.02 N ATOM 406 CA ASP A 25 -2.345 25.592 -18.633 1.00 72.22 C ATOM 407 C ASP A 25 -2.544 26.447 -17.385 1.00 62.10 C ATOM 408 O ASP A 25 -2.567 27.677 -17.460 1.00 11.21 O ATOM 409 CB ASP A 25 -3.577 25.689 -19.534 1.00 75.11 C ATOM 410 CG ASP A 25 -3.326 26.531 -20.769 1.00 52.02 C ATOM 411 OD1 ASP A 25 -2.857 27.679 -20.619 1.00 73.30 O ATOM 412 OD2 ASP A 25 -3.596 26.042 -21.885 1.00 32.35 O ATOM 0 H ASP A 25 -2.927 23.625 -18.196 1.00 0.02 H new ATOM 0 HA ASP A 25 -1.477 25.968 -19.176 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -3.882 24.687 -19.837 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.405 26.117 -18.968 1.00 75.11 H new ATOM 417 N LEU A 26 -2.687 25.790 -16.240 1.00 11.45 N ATOM 418 CA LEU A 26 -2.884 26.490 -14.975 1.00 42.33 C ATOM 419 C LEU A 26 -1.550 26.931 -14.382 1.00 31.40 C ATOM 420 O LEU A 26 -1.490 27.870 -13.587 1.00 63.25 O ATOM 421 CB LEU A 26 -3.625 25.593 -13.982 1.00 5.25 C ATOM 422 CG LEU A 26 -5.043 26.030 -13.610 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.057 24.986 -14.049 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.147 26.282 -12.112 1.00 64.15 C ATOM 0 H LEU A 26 -2.670 24.773 -16.161 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.485 27.378 -15.171 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.674 24.587 -14.399 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -3.034 25.531 -13.068 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.264 26.961 -14.131 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.060 25.315 -13.776 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -6.000 24.855 -15.130 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -5.839 24.038 -13.557 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -6.162 26.592 -11.865 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -4.905 25.367 -11.571 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -4.448 27.068 -11.826 1.00 64.15 H new ATOM 436 N THR A 27 -0.479 26.247 -14.775 1.00 4.14 N ATOM 437 CA THR A 27 0.855 26.567 -14.283 1.00 54.35 C ATOM 438 C THR A 27 1.781 26.966 -15.427 1.00 0.33 C ATOM 439 O THR A 27 2.985 27.126 -15.236 1.00 41.53 O ATOM 440 CB THR A 27 1.475 25.378 -13.526 1.00 71.31 C ATOM 441 OG1 THR A 27 1.893 24.372 -14.453 1.00 70.12 O ATOM 442 CG2 THR A 27 0.479 24.786 -12.541 1.00 31.12 C ATOM 0 H THR A 27 -0.510 25.468 -15.433 1.00 4.14 H new ATOM 0 HA THR A 27 0.746 27.407 -13.597 1.00 54.35 H new ATOM 0 HB THR A 27 2.340 25.740 -12.970 1.00 71.31 H new ATOM 0 HG1 THR A 27 1.310 23.589 -14.371 1.00 70.12 H new ATOM 0 HG21 THR A 27 0.939 23.948 -12.018 1.00 31.12 H new ATOM 0 HG22 THR A 27 0.185 25.547 -11.818 1.00 31.12 H new ATOM 0 HG23 THR A 27 -0.402 24.438 -13.080 1.00 31.12 H new ATOM 450 N GLY A 28 1.209 27.126 -16.617 1.00 71.14 N ATOM 451 CA GLY A 28 1.999 27.505 -17.773 1.00 55.42 C ATOM 452 C GLY A 28 2.907 26.386 -18.247 1.00 63.01 C ATOM 453 O GLY A 28 3.753 26.592 -19.118 1.00 24.43 O ATOM 0 H GLY A 28 0.214 27.000 -16.800 1.00 71.14 H new ATOM 0 HA2 GLY A 28 1.333 27.797 -18.585 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.602 28.379 -17.526 1.00 55.42 H new ATOM 457 N VAL A 29 2.733 25.201 -17.672 1.00 50.12 N ATOM 458 CA VAL A 29 3.544 24.047 -18.040 1.00 54.03 C ATOM 459 C VAL A 29 3.113 23.481 -19.389 1.00 24.12 C ATOM 460 O VAL A 29 1.925 23.369 -19.693 1.00 11.23 O ATOM 461 CB VAL A 29 3.454 22.936 -16.978 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.560 21.565 -17.627 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.535 23.120 -15.923 1.00 50.23 C ATOM 0 H VAL A 29 2.038 25.015 -16.949 1.00 50.12 H new ATOM 0 HA VAL A 29 4.575 24.393 -18.106 1.00 54.03 H new ATOM 0 HB VAL A 29 2.483 23.004 -16.488 1.00 3.24 H new ATOM 0 HG11 VAL A 29 3.494 20.793 -16.860 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.747 21.437 -18.341 1.00 14.34 H new ATOM 0 HG13 VAL A 29 4.515 21.481 -18.145 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.457 22.326 -15.180 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.516 23.079 -16.396 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.407 24.087 -15.436 1.00 50.23 H new ATOM 473 N PRO A 30 4.101 23.112 -20.219 1.00 5.34 N ATOM 474 CA PRO A 30 3.848 22.550 -21.548 1.00 54.13 C ATOM 475 C PRO A 30 3.250 21.149 -21.482 1.00 3.43 C ATOM 476 O PRO A 30 3.853 20.232 -20.923 1.00 5.21 O ATOM 477 CB PRO A 30 5.240 22.507 -22.185 1.00 44.23 C ATOM 478 CG PRO A 30 6.182 22.432 -21.034 1.00 71.13 C ATOM 479 CD PRO A 30 5.540 23.217 -19.922 1.00 14.15 C ATOM 0 HA PRO A 30 3.124 23.141 -22.109 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.348 21.644 -22.842 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.425 23.394 -22.791 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.351 21.398 -20.735 1.00 71.13 H new ATOM 0 HG3 PRO A 30 7.154 22.850 -21.297 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.780 22.799 -18.944 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.875 24.254 -19.917 1.00 14.15 H new ATOM 487 N TYR A 31 2.062 20.990 -22.055 1.00 25.44 N ATOM 488 CA TYR A 31 1.382 19.700 -22.058 1.00 32.30 C ATOM 489 C TYR A 31 2.256 18.624 -22.693 1.00 14.22 C ATOM 490 O TYR A 31 2.301 17.488 -22.225 1.00 34.33 O ATOM 491 CB TYR A 31 0.053 19.803 -22.809 1.00 63.02 C ATOM 492 CG TYR A 31 -0.694 18.493 -22.900 1.00 1.51 C ATOM 493 CD1 TYR A 31 -0.483 17.621 -23.962 1.00 12.33 C ATOM 494 CD2 TYR A 31 -1.613 18.124 -21.924 1.00 32.10 C ATOM 495 CE1 TYR A 31 -1.164 16.423 -24.049 1.00 62.12 C ATOM 496 CE2 TYR A 31 -2.297 16.928 -22.003 1.00 35.12 C ATOM 497 CZ TYR A 31 -2.069 16.080 -23.067 1.00 32.41 C ATOM 498 OH TYR A 31 -2.750 14.887 -23.149 1.00 11.03 O ATOM 0 H TYR A 31 1.550 21.738 -22.523 1.00 25.44 H new ATOM 0 HA TYR A 31 1.187 19.419 -21.023 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.580 20.538 -22.312 1.00 63.02 H new ATOM 0 HB3 TYR A 31 0.242 20.174 -23.816 1.00 63.02 H new ATOM 0 HD1 TYR A 31 0.226 17.885 -24.733 1.00 12.33 H new ATOM 0 HD2 TYR A 31 -1.795 18.785 -21.089 1.00 32.10 H new ATOM 0 HE1 TYR A 31 -0.989 15.758 -24.882 1.00 62.12 H new ATOM 0 HE2 TYR A 31 -3.007 16.657 -21.236 1.00 35.12 H new ATOM 0 HH TYR A 31 -3.348 14.798 -22.378 1.00 11.03 H new ATOM 508 N GLY A 32 2.952 18.993 -23.765 1.00 2.44 N ATOM 509 CA GLY A 32 3.818 18.050 -24.449 1.00 73.33 C ATOM 510 C GLY A 32 4.771 17.346 -23.502 1.00 15.40 C ATOM 511 O GLY A 32 5.085 16.169 -23.685 1.00 5.33 O ATOM 0 H GLY A 32 2.931 19.928 -24.172 1.00 2.44 H new ATOM 0 HA2 GLY A 32 3.208 17.308 -24.963 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.391 18.576 -25.212 1.00 73.33 H new ATOM 515 N THR A 33 5.235 18.069 -22.487 1.00 2.10 N ATOM 516 CA THR A 33 6.160 17.508 -21.511 1.00 33.22 C ATOM 517 C THR A 33 5.413 16.931 -20.313 1.00 41.20 C ATOM 518 O THR A 33 5.749 15.854 -19.820 1.00 25.30 O ATOM 519 CB THR A 33 7.162 18.568 -21.013 1.00 51.23 C ATOM 520 OG1 THR A 33 7.205 19.669 -21.928 1.00 63.51 O ATOM 521 CG2 THR A 33 8.553 17.970 -20.867 1.00 43.02 C ATOM 0 H THR A 33 4.985 19.044 -22.320 1.00 2.10 H new ATOM 0 HA THR A 33 6.705 16.710 -22.015 1.00 33.22 H new ATOM 0 HB THR A 33 6.830 18.920 -20.036 1.00 51.23 H new ATOM 0 HG1 THR A 33 7.951 20.260 -21.694 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.243 18.736 -20.514 1.00 43.02 H new ATOM 0 HG22 THR A 33 8.523 17.150 -20.149 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.891 17.594 -21.833 1.00 43.02 H new ATOM 529 N LEU A 34 4.397 17.652 -19.852 1.00 24.43 N ATOM 530 CA LEU A 34 3.601 17.211 -18.712 1.00 43.23 C ATOM 531 C LEU A 34 3.006 15.830 -18.966 1.00 50.10 C ATOM 532 O LEU A 34 2.687 15.099 -18.028 1.00 64.13 O ATOM 533 CB LEU A 34 2.484 18.216 -18.426 1.00 34.41 C ATOM 534 CG LEU A 34 1.355 17.724 -17.519 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.768 17.811 -16.058 1.00 3.32 C ATOM 536 CD2 LEU A 34 0.086 18.526 -17.765 1.00 12.32 C ATOM 0 H LEU A 34 4.105 18.545 -20.250 1.00 24.43 H new ATOM 0 HA LEU A 34 4.257 17.150 -17.844 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.927 19.102 -17.972 1.00 34.41 H new ATOM 0 HB3 LEU A 34 2.050 18.527 -19.376 1.00 34.41 H new ATOM 0 HG LEU A 34 1.153 16.680 -17.756 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.952 17.457 -15.428 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.650 17.192 -15.892 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.998 18.846 -15.806 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -0.707 18.162 -17.111 1.00 12.32 H new ATOM 0 HD22 LEU A 34 0.275 19.579 -17.556 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.221 18.412 -18.805 1.00 12.32 H new ATOM 548 N SER A 35 2.861 15.478 -20.239 1.00 63.13 N ATOM 549 CA SER A 35 2.303 14.185 -20.617 1.00 73.31 C ATOM 550 C SER A 35 3.074 13.047 -19.955 1.00 51.22 C ATOM 551 O SER A 35 2.482 12.084 -19.466 1.00 50.40 O ATOM 552 CB SER A 35 2.331 14.018 -22.138 1.00 42.24 C ATOM 553 OG SER A 35 2.320 12.648 -22.501 1.00 24.01 O ATOM 0 H SER A 35 3.122 16.071 -21.027 1.00 63.13 H new ATOM 0 HA SER A 35 1.269 14.149 -20.274 1.00 73.31 H new ATOM 0 HB2 SER A 35 1.470 14.521 -22.578 1.00 42.24 H new ATOM 0 HB3 SER A 35 3.222 14.498 -22.543 1.00 42.24 H new ATOM 0 HG SER A 35 2.337 12.568 -23.478 1.00 24.01 H new ATOM 559 N TYR A 36 4.397 13.165 -19.944 1.00 24.31 N ATOM 560 CA TYR A 36 5.250 12.145 -19.345 1.00 24.32 C ATOM 561 C TYR A 36 5.430 12.396 -17.851 1.00 10.31 C ATOM 562 O TYR A 36 5.698 11.472 -17.082 1.00 72.52 O ATOM 563 CB TYR A 36 6.613 12.120 -20.037 1.00 60.32 C ATOM 564 CG TYR A 36 7.663 12.955 -19.339 1.00 21.33 C ATOM 565 CD1 TYR A 36 8.228 12.536 -18.140 1.00 21.51 C ATOM 566 CD2 TYR A 36 8.090 14.162 -19.877 1.00 33.34 C ATOM 567 CE1 TYR A 36 9.187 13.296 -17.499 1.00 11.33 C ATOM 568 CE2 TYR A 36 9.049 14.929 -19.244 1.00 14.13 C ATOM 569 CZ TYR A 36 9.594 14.491 -18.054 1.00 3.04 C ATOM 570 OH TYR A 36 10.550 15.250 -17.418 1.00 45.51 O ATOM 0 H TYR A 36 4.902 13.956 -20.343 1.00 24.31 H new ATOM 0 HA TYR A 36 4.765 11.178 -19.477 1.00 24.32 H new ATOM 0 HB2 TYR A 36 6.962 11.089 -20.097 1.00 60.32 H new ATOM 0 HB3 TYR A 36 6.498 12.477 -21.060 1.00 60.32 H new ATOM 0 HD1 TYR A 36 7.912 11.601 -17.702 1.00 21.51 H new ATOM 0 HD2 TYR A 36 7.664 14.508 -20.808 1.00 33.34 H new ATOM 0 HE1 TYR A 36 9.616 12.956 -16.568 1.00 11.33 H new ATOM 0 HE2 TYR A 36 9.370 15.865 -19.677 1.00 14.13 H new ATOM 0 HH TYR A 36 10.135 16.057 -17.049 1.00 45.51 H new ATOM 580 N TYR A 37 5.281 13.652 -17.445 1.00 54.21 N ATOM 581 CA TYR A 37 5.430 14.026 -16.044 1.00 5.01 C ATOM 582 C TYR A 37 4.598 13.115 -15.146 1.00 44.23 C ATOM 583 O TYR A 37 5.134 12.423 -14.281 1.00 51.30 O ATOM 584 CB TYR A 37 5.012 15.484 -15.837 1.00 11.33 C ATOM 585 CG TYR A 37 6.146 16.468 -16.007 1.00 63.44 C ATOM 586 CD1 TYR A 37 7.119 16.276 -16.981 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.246 17.590 -15.194 1.00 44.14 C ATOM 588 CE1 TYR A 37 8.157 17.173 -17.139 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.280 18.493 -15.346 1.00 1.34 C ATOM 590 CZ TYR A 37 8.234 18.280 -16.319 1.00 71.32 C ATOM 591 OH TYR A 37 9.267 19.177 -16.475 1.00 40.12 O ATOM 0 H TYR A 37 5.057 14.429 -18.067 1.00 54.21 H new ATOM 0 HA TYR A 37 6.480 13.913 -15.773 1.00 5.01 H new ATOM 0 HB2 TYR A 37 4.220 15.730 -16.544 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.593 15.595 -14.837 1.00 11.33 H new ATOM 0 HD1 TYR A 37 7.062 15.411 -17.625 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.502 17.759 -14.430 1.00 44.14 H new ATOM 0 HE1 TYR A 37 8.905 17.009 -17.901 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.341 19.361 -14.706 1.00 1.34 H new ATOM 0 HH TYR A 37 9.054 20.007 -16.000 1.00 40.12 H new ATOM 601 N GLU A 38 3.286 13.120 -15.361 1.00 3.11 N ATOM 602 CA GLU A 38 2.380 12.294 -14.571 1.00 5.14 C ATOM 603 C GLU A 38 2.581 10.814 -14.885 1.00 64.14 C ATOM 604 O GLU A 38 2.272 9.948 -14.066 1.00 41.42 O ATOM 605 CB GLU A 38 0.927 12.692 -14.840 1.00 45.31 C ATOM 606 CG GLU A 38 0.721 14.191 -14.974 1.00 24.31 C ATOM 607 CD GLU A 38 -0.699 14.615 -14.654 1.00 34.22 C ATOM 608 OE1 GLU A 38 -1.639 13.999 -15.198 1.00 25.54 O ATOM 609 OE2 GLU A 38 -0.870 15.564 -13.860 1.00 33.41 O ATOM 0 H GLU A 38 2.827 13.686 -16.075 1.00 3.11 H new ATOM 0 HA GLU A 38 2.604 12.458 -13.517 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.589 12.204 -15.754 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.301 12.319 -14.029 1.00 45.31 H new ATOM 0 HG2 GLU A 38 1.410 14.710 -14.308 1.00 24.31 H new ATOM 0 HG3 GLU A 38 0.968 14.499 -15.990 1.00 24.31 H new ATOM 616 N SER A 39 3.097 10.532 -16.077 1.00 60.13 N ATOM 617 CA SER A 39 3.335 9.158 -16.501 1.00 34.13 C ATOM 618 C SER A 39 4.538 8.566 -15.774 1.00 11.41 C ATOM 619 O SER A 39 4.804 7.367 -15.864 1.00 14.05 O ATOM 620 CB SER A 39 3.559 9.100 -18.013 1.00 51.23 C ATOM 621 OG SER A 39 3.116 7.865 -18.547 1.00 13.01 O ATOM 0 H SER A 39 3.358 11.237 -16.766 1.00 60.13 H new ATOM 0 HA SER A 39 2.454 8.568 -16.249 1.00 34.13 H new ATOM 0 HB2 SER A 39 3.026 9.920 -18.494 1.00 51.23 H new ATOM 0 HB3 SER A 39 4.618 9.236 -18.232 1.00 51.23 H new ATOM 0 HG SER A 39 3.269 7.854 -19.515 1.00 13.01 H new ATOM 627 N GLY A 40 5.264 9.415 -15.054 1.00 14.52 N ATOM 628 CA GLY A 40 6.432 8.958 -14.322 1.00 24.23 C ATOM 629 C GLY A 40 7.571 8.559 -15.239 1.00 45.11 C ATOM 630 O GLY A 40 8.549 7.955 -14.797 1.00 74.53 O ATOM 0 H GLY A 40 5.065 10.411 -14.964 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.769 9.749 -13.652 1.00 24.23 H new ATOM 0 HA3 GLY A 40 6.156 8.107 -13.699 1.00 24.23 H new ATOM 634 N ARG A 41 7.444 8.894 -16.519 1.00 4.24 N ATOM 635 CA ARG A 41 8.470 8.564 -17.500 1.00 13.35 C ATOM 636 C ARG A 41 9.845 9.025 -17.025 1.00 52.13 C ATOM 637 O ARG A 41 10.832 8.300 -17.153 1.00 61.34 O ATOM 638 CB ARG A 41 8.142 9.209 -18.848 1.00 40.30 C ATOM 639 CG ARG A 41 8.588 8.380 -20.043 1.00 52.51 C ATOM 640 CD ARG A 41 7.625 7.236 -20.318 1.00 42.11 C ATOM 641 NE ARG A 41 8.154 6.300 -21.306 1.00 62.55 N ATOM 642 CZ ARG A 41 9.038 5.352 -21.020 1.00 34.51 C ATOM 643 NH1 ARG A 41 9.490 5.214 -19.781 1.00 62.54 N ATOM 644 NH2 ARG A 41 9.473 4.538 -21.974 1.00 43.33 N ATOM 0 H ARG A 41 6.641 9.394 -16.900 1.00 4.24 H new ATOM 0 HA ARG A 41 8.490 7.481 -17.618 1.00 13.35 H new ATOM 0 HB2 ARG A 41 7.066 9.373 -18.911 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.617 10.189 -18.898 1.00 40.30 H new ATOM 0 HG2 ARG A 41 8.658 9.018 -20.924 1.00 52.51 H new ATOM 0 HG3 ARG A 41 9.585 7.981 -19.858 1.00 52.51 H new ATOM 0 HD2 ARG A 41 7.419 6.704 -19.389 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.676 7.638 -20.672 1.00 42.11 H new ATOM 0 HE ARG A 41 7.826 6.379 -22.269 1.00 62.55 H new ATOM 0 HH11 ARG A 41 9.158 5.837 -19.045 1.00 62.54 H new ATOM 0 HH12 ARG A 41 10.169 4.485 -19.564 1.00 62.54 H new ATOM 0 HH21 ARG A 41 9.128 4.641 -22.928 1.00 43.33 H new ATOM 0 HH22 ARG A 41 10.152 3.810 -21.753 1.00 43.33 H new ATOM 658 N SER A 42 9.902 10.234 -16.476 1.00 70.41 N ATOM 659 CA SER A 42 11.156 10.793 -15.987 1.00 61.23 C ATOM 660 C SER A 42 10.916 11.682 -14.770 1.00 5.23 C ATOM 661 O SER A 42 9.779 12.044 -14.465 1.00 13.14 O ATOM 662 CB SER A 42 11.847 11.597 -17.090 1.00 24.10 C ATOM 663 OG SER A 42 13.167 11.132 -17.309 1.00 12.30 O ATOM 0 H SER A 42 9.094 10.845 -16.359 1.00 70.41 H new ATOM 0 HA SER A 42 11.802 9.966 -15.691 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.273 11.521 -18.014 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.870 12.652 -16.815 1.00 24.10 H new ATOM 0 HG SER A 42 13.586 11.661 -18.020 1.00 12.30 H new ATOM 669 N THR A 43 11.995 12.029 -14.076 1.00 12.02 N ATOM 670 CA THR A 43 11.904 12.874 -12.892 1.00 14.23 C ATOM 671 C THR A 43 11.981 14.351 -13.261 1.00 53.01 C ATOM 672 O THR A 43 13.015 14.850 -13.706 1.00 0.33 O ATOM 673 CB THR A 43 13.022 12.550 -11.883 1.00 21.52 C ATOM 674 OG1 THR A 43 13.736 11.381 -12.301 1.00 2.04 O ATOM 675 CG2 THR A 43 12.450 12.330 -10.491 1.00 51.25 C ATOM 0 H THR A 43 12.943 11.738 -14.314 1.00 12.02 H new ATOM 0 HA THR A 43 10.938 12.668 -12.432 1.00 14.23 H new ATOM 0 HB THR A 43 13.705 13.399 -11.847 1.00 21.52 H new ATOM 0 HG1 THR A 43 14.446 11.183 -11.655 1.00 2.04 H new ATOM 0 HG21 THR A 43 13.259 12.103 -9.797 1.00 51.25 H new ATOM 0 HG22 THR A 43 11.933 13.232 -10.163 1.00 51.25 H new ATOM 0 HG23 THR A 43 11.747 11.497 -10.514 1.00 51.25 H new ATOM 683 N PRO A 44 10.863 15.067 -13.075 1.00 21.02 N ATOM 684 CA PRO A 44 10.779 16.497 -13.383 1.00 52.42 C ATOM 685 C PRO A 44 11.600 17.347 -12.418 1.00 70.25 C ATOM 686 O PRO A 44 12.044 16.882 -11.368 1.00 3.54 O ATOM 687 CB PRO A 44 9.287 16.806 -13.230 1.00 71.00 C ATOM 688 CG PRO A 44 8.781 15.773 -12.285 1.00 72.24 C ATOM 689 CD PRO A 44 9.594 14.535 -12.551 1.00 61.30 C ATOM 0 HA PRO A 44 11.177 16.725 -14.372 1.00 52.42 H new ATOM 0 HB2 PRO A 44 9.129 17.811 -12.839 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.771 16.752 -14.189 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.895 16.100 -11.252 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.719 15.585 -12.445 1.00 72.24 H new ATOM 0 HD2 PRO A 44 9.747 13.952 -11.643 1.00 61.30 H new ATOM 0 HD3 PRO A 44 9.105 13.880 -13.272 1.00 61.30 H new ATOM 697 N PRO A 45 11.809 18.621 -12.781 1.00 71.15 N ATOM 698 CA PRO A 45 12.578 19.562 -11.960 1.00 45.31 C ATOM 699 C PRO A 45 11.847 19.943 -10.677 1.00 45.42 C ATOM 700 O PRO A 45 10.740 19.471 -10.416 1.00 14.40 O ATOM 701 CB PRO A 45 12.731 20.783 -12.871 1.00 13.01 C ATOM 702 CG PRO A 45 11.574 20.707 -13.805 1.00 51.14 C ATOM 703 CD PRO A 45 11.309 19.243 -14.019 1.00 25.43 C ATOM 0 HA PRO A 45 13.526 19.136 -11.631 1.00 45.31 H new ATOM 0 HB2 PRO A 45 12.716 21.709 -12.297 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.678 20.758 -13.411 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.700 21.204 -13.384 1.00 51.14 H new ATOM 0 HG3 PRO A 45 11.801 21.204 -14.748 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.248 19.044 -14.168 1.00 25.43 H new ATOM 0 HD3 PRO A 45 11.831 18.864 -14.898 1.00 25.43 H new ATOM 711 N THR A 46 12.472 20.802 -9.878 1.00 13.11 N ATOM 712 CA THR A 46 11.882 21.246 -8.622 1.00 31.11 C ATOM 713 C THR A 46 11.123 22.555 -8.803 1.00 24.32 C ATOM 714 O THR A 46 10.219 22.873 -8.029 1.00 10.01 O ATOM 715 CB THR A 46 12.955 21.435 -7.532 1.00 23.32 C ATOM 716 OG1 THR A 46 13.702 20.225 -7.366 1.00 51.14 O ATOM 717 CG2 THR A 46 12.318 21.830 -6.209 1.00 20.13 C ATOM 0 H THR A 46 13.388 21.204 -10.079 1.00 13.11 H new ATOM 0 HA THR A 46 11.188 20.467 -8.307 1.00 31.11 H new ATOM 0 HB THR A 46 13.625 22.235 -7.847 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.271 20.298 -6.571 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.095 21.958 -5.455 1.00 20.13 H new ATOM 0 HG22 THR A 46 11.774 22.767 -6.332 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.628 21.049 -5.890 1.00 20.13 H new ATOM 725 N ASP A 47 11.495 23.311 -9.831 1.00 42.22 N ATOM 726 CA ASP A 47 10.847 24.587 -10.115 1.00 11.00 C ATOM 727 C ASP A 47 9.448 24.370 -10.686 1.00 64.31 C ATOM 728 O ASP A 47 8.545 25.177 -10.463 1.00 65.11 O ATOM 729 CB ASP A 47 11.690 25.403 -11.096 1.00 53.22 C ATOM 730 CG ASP A 47 11.579 26.895 -10.851 1.00 65.03 C ATOM 731 OD1 ASP A 47 10.544 27.331 -10.306 1.00 61.13 O ATOM 732 OD2 ASP A 47 12.528 27.627 -11.206 1.00 21.44 O ATOM 0 H ASP A 47 12.241 23.063 -10.481 1.00 42.22 H new ATOM 0 HA ASP A 47 10.757 25.138 -9.179 1.00 11.00 H new ATOM 0 HB2 ASP A 47 12.734 25.101 -11.013 1.00 53.22 H new ATOM 0 HB3 ASP A 47 11.374 25.180 -12.115 1.00 53.22 H new ATOM 737 N VAL A 48 9.277 23.277 -11.422 1.00 60.11 N ATOM 738 CA VAL A 48 7.989 22.955 -12.024 1.00 45.24 C ATOM 739 C VAL A 48 7.114 22.163 -11.059 1.00 11.34 C ATOM 740 O VAL A 48 5.936 22.469 -10.880 1.00 1.53 O ATOM 741 CB VAL A 48 8.163 22.146 -13.323 1.00 14.52 C ATOM 742 CG1 VAL A 48 6.809 21.766 -13.902 1.00 74.34 C ATOM 743 CG2 VAL A 48 8.982 22.934 -14.335 1.00 62.30 C ATOM 0 H VAL A 48 10.014 22.599 -11.616 1.00 60.11 H new ATOM 0 HA VAL A 48 7.503 23.902 -12.257 1.00 45.24 H new ATOM 0 HB VAL A 48 8.701 21.228 -13.089 1.00 14.52 H new ATOM 0 HG11 VAL A 48 6.953 21.195 -14.819 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.261 21.161 -13.180 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.241 22.670 -14.123 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.095 22.348 -15.247 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.473 23.870 -14.566 1.00 62.30 H new ATOM 0 HG23 VAL A 48 9.966 23.150 -13.918 1.00 62.30 H new ATOM 753 N MET A 49 7.699 21.144 -10.438 1.00 23.51 N ATOM 754 CA MET A 49 6.973 20.308 -9.490 1.00 32.02 C ATOM 755 C MET A 49 6.227 21.164 -8.471 1.00 43.12 C ATOM 756 O MET A 49 5.069 20.900 -8.154 1.00 54.11 O ATOM 757 CB MET A 49 7.936 19.361 -8.770 1.00 51.33 C ATOM 758 CG MET A 49 7.278 18.552 -7.664 1.00 21.11 C ATOM 759 SD MET A 49 8.081 18.779 -6.065 1.00 71.53 S ATOM 760 CE MET A 49 7.427 20.374 -5.581 1.00 52.32 C ATOM 0 H MET A 49 8.674 20.878 -10.575 1.00 23.51 H new ATOM 0 HA MET A 49 6.244 19.719 -10.047 1.00 32.02 H new ATOM 0 HB2 MET A 49 8.373 18.678 -9.498 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.755 19.942 -8.346 1.00 51.33 H new ATOM 0 HG2 MET A 49 6.230 18.839 -7.584 1.00 21.11 H new ATOM 0 HG3 MET A 49 7.300 17.495 -7.930 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.497 20.483 -4.499 1.00 52.32 H new ATOM 0 HE2 MET A 49 8.002 21.165 -6.063 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.383 20.447 -5.886 1.00 52.32 H new ATOM 770 N MET A 50 6.900 22.192 -7.963 1.00 13.33 N ATOM 771 CA MET A 50 6.299 23.088 -6.981 1.00 63.34 C ATOM 772 C MET A 50 5.246 23.978 -7.630 1.00 13.15 C ATOM 773 O MET A 50 4.278 24.381 -6.986 1.00 31.51 O ATOM 774 CB MET A 50 7.376 23.950 -6.320 1.00 63.11 C ATOM 775 CG MET A 50 7.897 25.063 -7.215 1.00 51.43 C ATOM 776 SD MET A 50 9.481 25.721 -6.655 1.00 41.12 S ATOM 777 CE MET A 50 9.233 25.739 -4.881 1.00 52.14 C ATOM 0 H MET A 50 7.861 22.425 -8.215 1.00 13.33 H new ATOM 0 HA MET A 50 5.813 22.478 -6.219 1.00 63.34 H new ATOM 0 HB2 MET A 50 6.970 24.388 -5.408 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.209 23.313 -6.024 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.004 24.686 -8.232 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.165 25.869 -7.249 1.00 51.43 H new ATOM 0 HE1 MET A 50 10.010 26.342 -4.411 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.256 26.166 -4.655 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.282 24.720 -4.496 1.00 52.14 H new ATOM 787 N ASN A 51 5.441 24.283 -8.908 1.00 65.21 N ATOM 788 CA ASN A 51 4.507 25.127 -9.645 1.00 34.45 C ATOM 789 C ASN A 51 3.162 24.428 -9.818 1.00 20.22 C ATOM 790 O ASN A 51 2.167 25.057 -10.177 1.00 30.14 O ATOM 791 CB ASN A 51 5.086 25.491 -11.014 1.00 31.11 C ATOM 792 CG ASN A 51 5.740 26.859 -11.021 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.499 27.670 -11.914 1.00 22.00 O ATOM 794 ND2 ASN A 51 6.575 27.120 -10.021 1.00 22.11 N ATOM 0 H ASN A 51 6.238 23.958 -9.456 1.00 65.21 H new ATOM 0 HA ASN A 51 4.350 26.040 -9.070 1.00 34.45 H new ATOM 0 HB2 ASN A 51 5.819 24.739 -11.307 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.291 25.468 -11.759 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.046 28.023 -9.972 1.00 22.11 H new ATOM 0 HD22 ASN A 51 6.745 26.417 -9.302 1.00 22.11 H new ATOM 801 N ILE A 52 3.141 23.125 -9.560 1.00 3.55 N ATOM 802 CA ILE A 52 1.919 22.341 -9.687 1.00 73.42 C ATOM 803 C ILE A 52 1.201 22.224 -8.346 1.00 71.13 C ATOM 804 O ILE A 52 -0.022 22.092 -8.294 1.00 32.44 O ATOM 805 CB ILE A 52 2.209 20.928 -10.226 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.110 21.005 -11.460 1.00 74.14 C ATOM 807 CG2 ILE A 52 0.909 20.211 -10.557 1.00 33.12 C ATOM 808 CD1 ILE A 52 2.751 22.133 -12.401 1.00 62.23 C ATOM 0 H ILE A 52 3.956 22.590 -9.262 1.00 3.55 H new ATOM 0 HA ILE A 52 1.279 22.866 -10.396 1.00 73.42 H new ATOM 0 HB ILE A 52 2.729 20.360 -9.454 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.144 21.127 -11.138 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.054 20.060 -12.000 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.130 19.214 -10.937 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.299 20.130 -9.657 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.365 20.775 -11.314 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.431 22.127 -13.253 1.00 62.23 H new ATOM 0 HD12 ILE A 52 1.728 22.002 -12.753 1.00 62.23 H new ATOM 0 HD13 ILE A 52 2.835 23.085 -11.877 1.00 62.23 H new ATOM 820 N LEU A 53 1.969 22.275 -7.264 1.00 51.45 N ATOM 821 CA LEU A 53 1.406 22.177 -5.921 1.00 74.54 C ATOM 822 C LEU A 53 1.181 23.561 -5.322 1.00 34.01 C ATOM 823 O LEU A 53 0.486 23.707 -4.316 1.00 42.22 O ATOM 824 CB LEU A 53 2.334 21.363 -5.016 1.00 74.22 C ATOM 825 CG LEU A 53 1.842 19.965 -4.636 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.358 19.217 -5.867 1.00 53.22 C ATOM 827 CD2 LEU A 53 2.946 19.185 -3.936 1.00 13.23 C ATOM 0 H LEU A 53 2.983 22.384 -7.289 1.00 51.45 H new ATOM 0 HA LEU A 53 0.443 21.672 -5.994 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.299 21.264 -5.513 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.504 21.929 -4.100 1.00 74.22 H new ATOM 0 HG LEU A 53 1.004 20.070 -3.947 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.012 18.225 -5.577 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.538 19.767 -6.328 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.177 19.122 -6.580 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.580 18.193 -3.672 1.00 13.23 H new ATOM 0 HD22 LEU A 53 3.803 19.090 -4.603 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.247 19.713 -3.031 1.00 13.23 H new ATOM 839 N GLN A 54 1.770 24.575 -5.949 1.00 35.22 N ATOM 840 CA GLN A 54 1.631 25.948 -5.478 1.00 5.24 C ATOM 841 C GLN A 54 0.238 26.489 -5.782 1.00 40.02 C ATOM 842 O GLN A 54 -0.233 27.424 -5.132 1.00 11.30 O ATOM 843 CB GLN A 54 2.691 26.841 -6.126 1.00 13.40 C ATOM 844 CG GLN A 54 2.445 27.103 -7.603 1.00 75.21 C ATOM 845 CD GLN A 54 3.369 28.163 -8.170 1.00 20.35 C ATOM 846 OE1 GLN A 54 2.941 29.038 -8.923 1.00 45.45 O ATOM 847 NE2 GLN A 54 4.645 28.091 -7.809 1.00 73.44 N ATOM 0 H GLN A 54 2.347 24.471 -6.783 1.00 35.22 H new ATOM 0 HA GLN A 54 1.774 25.952 -4.397 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.724 27.794 -5.597 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.669 26.375 -6.006 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.578 26.175 -8.160 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.410 27.415 -7.745 1.00 75.21 H new ATOM 0 HE21 GLN A 54 4.957 27.349 -7.183 1.00 73.44 H new ATOM 0 HE22 GLN A 54 5.313 28.778 -8.158 1.00 73.44 H new ATOM 856 N THR A 55 -0.418 25.898 -6.776 1.00 23.53 N ATOM 857 CA THR A 55 -1.757 26.321 -7.167 1.00 24.25 C ATOM 858 C THR A 55 -2.725 26.239 -5.992 1.00 71.25 C ATOM 859 O THR A 55 -2.520 25.488 -5.039 1.00 30.33 O ATOM 860 CB THR A 55 -2.300 25.465 -8.327 1.00 54.30 C ATOM 861 OG1 THR A 55 -1.997 24.084 -8.101 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.704 25.910 -9.653 1.00 51.14 C ATOM 0 H THR A 55 -0.043 25.124 -7.325 1.00 23.53 H new ATOM 0 HA THR A 55 -1.678 27.357 -7.496 1.00 24.25 H new ATOM 0 HB THR A 55 -3.381 25.596 -8.371 1.00 54.30 H new ATOM 0 HG1 THR A 55 -1.108 23.881 -8.459 1.00 42.52 H new ATOM 0 HG21 THR A 55 -2.102 25.291 -10.457 1.00 51.14 H new ATOM 0 HG22 THR A 55 -1.962 26.953 -9.836 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.620 25.805 -9.618 1.00 51.14 H new ATOM 870 N PRO A 56 -3.807 27.029 -6.060 1.00 53.52 N ATOM 871 CA PRO A 56 -4.829 27.063 -5.010 1.00 12.33 C ATOM 872 C PRO A 56 -5.650 25.777 -4.959 1.00 31.34 C ATOM 873 O PRO A 56 -6.149 25.393 -3.902 1.00 43.31 O ATOM 874 CB PRO A 56 -5.713 28.246 -5.413 1.00 41.51 C ATOM 875 CG PRO A 56 -5.532 28.369 -6.887 1.00 31.12 C ATOM 876 CD PRO A 56 -4.115 27.950 -7.167 1.00 2.04 C ATOM 0 HA PRO A 56 -4.390 27.160 -4.017 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.757 28.066 -5.156 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.411 29.159 -4.899 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -6.239 27.735 -7.421 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.709 29.392 -7.218 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -4.025 27.458 -8.136 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.438 28.804 -7.179 1.00 2.04 H new ATOM 884 N GLN A 57 -5.782 25.120 -6.106 1.00 54.13 N ATOM 885 CA GLN A 57 -6.543 23.879 -6.191 1.00 35.45 C ATOM 886 C GLN A 57 -5.732 22.706 -5.649 1.00 15.23 C ATOM 887 O GLN A 57 -6.286 21.762 -5.084 1.00 55.15 O ATOM 888 CB GLN A 57 -6.954 23.604 -7.638 1.00 31.22 C ATOM 889 CG GLN A 57 -5.820 23.079 -8.503 1.00 70.00 C ATOM 890 CD GLN A 57 -6.044 23.337 -9.980 1.00 22.24 C ATOM 891 OE1 GLN A 57 -5.133 23.756 -10.694 1.00 74.05 O ATOM 892 NE2 GLN A 57 -7.262 23.088 -10.446 1.00 50.03 N ATOM 0 H GLN A 57 -5.372 25.426 -6.989 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.440 23.991 -5.582 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.769 22.881 -7.644 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -7.340 24.523 -8.078 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.886 23.548 -8.194 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.709 22.007 -8.338 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -7.987 22.741 -9.818 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -7.472 23.243 -11.432 1.00 50.03 H new ATOM 901 N PHE A 58 -4.416 22.771 -5.825 1.00 44.33 N ATOM 902 CA PHE A 58 -3.529 21.714 -5.355 1.00 12.11 C ATOM 903 C PHE A 58 -2.780 22.150 -4.100 1.00 32.20 C ATOM 904 O PHE A 58 -1.714 21.621 -3.782 1.00 14.11 O ATOM 905 CB PHE A 58 -2.532 21.331 -6.451 1.00 65.32 C ATOM 906 CG PHE A 58 -3.177 20.715 -7.660 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.071 19.666 -7.524 1.00 54.23 C ATOM 908 CD2 PHE A 58 -2.888 21.185 -8.930 1.00 14.53 C ATOM 909 CE1 PHE A 58 -4.666 19.096 -8.634 1.00 13.32 C ATOM 910 CE2 PHE A 58 -3.481 20.621 -10.044 1.00 51.05 C ATOM 911 CZ PHE A 58 -4.370 19.573 -9.896 1.00 14.14 C ATOM 0 H PHE A 58 -3.941 23.545 -6.290 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.139 20.845 -5.109 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -1.981 22.220 -6.757 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -1.805 20.631 -6.041 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.306 19.289 -6.540 1.00 54.23 H new ATOM 0 HD2 PHE A 58 -2.191 22.001 -9.052 1.00 14.53 H new ATOM 0 HE1 PHE A 58 -5.362 18.279 -8.515 1.00 13.32 H new ATOM 0 HE2 PHE A 58 -3.250 20.999 -11.029 1.00 51.05 H new ATOM 0 HZ PHE A 58 -4.832 19.128 -10.765 1.00 14.14 H new ATOM 921 N THR A 59 -3.344 23.122 -3.389 1.00 4.20 N ATOM 922 CA THR A 59 -2.729 23.632 -2.169 1.00 22.31 C ATOM 923 C THR A 59 -2.986 22.699 -0.992 1.00 21.11 C ATOM 924 O THR A 59 -2.166 22.591 -0.081 1.00 21.14 O ATOM 925 CB THR A 59 -3.257 25.036 -1.821 1.00 62.34 C ATOM 926 OG1 THR A 59 -2.483 25.599 -0.755 1.00 4.22 O ATOM 927 CG2 THR A 59 -4.722 24.980 -1.416 1.00 32.12 C ATOM 0 H THR A 59 -4.225 23.572 -3.637 1.00 4.20 H new ATOM 0 HA THR A 59 -1.657 23.690 -2.355 1.00 22.31 H new ATOM 0 HB THR A 59 -3.167 25.664 -2.707 1.00 62.34 H new ATOM 0 HG1 THR A 59 -2.823 26.492 -0.540 1.00 4.22 H new ATOM 0 HG21 THR A 59 -5.072 25.984 -1.175 1.00 32.12 H new ATOM 0 HG22 THR A 59 -5.312 24.578 -2.240 1.00 32.12 H new ATOM 0 HG23 THR A 59 -4.834 24.338 -0.543 1.00 32.12 H new ATOM 935 N LYS A 60 -4.130 22.023 -1.017 1.00 35.52 N ATOM 936 CA LYS A 60 -4.495 21.096 0.047 1.00 52.53 C ATOM 937 C LYS A 60 -3.645 19.831 -0.017 1.00 41.24 C ATOM 938 O LYS A 60 -3.522 19.103 0.967 1.00 22.22 O ATOM 939 CB LYS A 60 -5.978 20.731 -0.052 1.00 75.42 C ATOM 940 CG LYS A 60 -6.871 21.908 -0.404 1.00 41.34 C ATOM 941 CD LYS A 60 -8.342 21.533 -0.334 1.00 60.34 C ATOM 942 CE LYS A 60 -8.943 21.373 -1.722 1.00 4.52 C ATOM 943 NZ LYS A 60 -8.838 22.627 -2.519 1.00 64.02 N ATOM 0 H LYS A 60 -4.821 22.100 -1.764 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.311 21.589 1.002 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -6.103 19.953 -0.805 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.304 20.310 0.899 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.672 22.734 0.279 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -6.632 22.260 -1.407 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.455 20.602 0.222 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -8.889 22.300 0.214 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -8.434 20.565 -2.247 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -9.991 21.085 -1.633 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -9.652 22.699 -3.162 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -8.829 23.446 -1.878 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -7.959 22.613 -3.074 1.00 64.02 H new ATOM 957 N TYR A 61 -3.058 19.577 -1.182 1.00 14.05 N ATOM 958 CA TYR A 61 -2.220 18.400 -1.375 1.00 71.14 C ATOM 959 C TYR A 61 -0.779 18.801 -1.679 1.00 30.13 C ATOM 960 O TYR A 61 -0.301 18.641 -2.803 1.00 60.54 O ATOM 961 CB TYR A 61 -2.771 17.535 -2.510 1.00 71.25 C ATOM 962 CG TYR A 61 -4.278 17.578 -2.627 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.910 18.563 -3.375 1.00 71.04 C ATOM 964 CD2 TYR A 61 -5.070 16.631 -1.988 1.00 2.40 C ATOM 965 CE1 TYR A 61 -6.286 18.606 -3.483 1.00 44.31 C ATOM 966 CE2 TYR A 61 -6.448 16.665 -2.092 1.00 73.23 C ATOM 967 CZ TYR A 61 -7.050 17.654 -2.840 1.00 4.15 C ATOM 968 OH TYR A 61 -8.422 17.693 -2.946 1.00 1.43 O ATOM 0 H TYR A 61 -3.147 20.171 -2.007 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.230 17.823 -0.450 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.332 17.864 -3.452 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.456 16.503 -2.355 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.315 19.309 -3.881 1.00 71.04 H new ATOM 0 HD2 TYR A 61 -4.601 15.856 -1.400 1.00 2.40 H new ATOM 0 HE1 TYR A 61 -6.761 19.380 -4.067 1.00 44.31 H new ATOM 0 HE2 TYR A 61 -7.049 15.921 -1.590 1.00 73.23 H new ATOM 0 HH TYR A 61 -8.811 16.952 -2.435 1.00 1.43 H new ATOM 978 N THR A 62 -0.092 19.323 -0.669 1.00 71.44 N ATOM 979 CA THR A 62 1.294 19.748 -0.826 1.00 10.10 C ATOM 980 C THR A 62 2.254 18.727 -0.223 1.00 71.52 C ATOM 981 O THR A 62 3.038 18.102 -0.937 1.00 70.23 O ATOM 982 CB THR A 62 1.540 21.117 -0.167 1.00 54.41 C ATOM 983 OG1 THR A 62 0.291 21.717 0.199 1.00 54.14 O ATOM 984 CG2 THR A 62 2.295 22.044 -1.108 1.00 32.11 C ATOM 0 H THR A 62 -0.472 19.462 0.267 1.00 71.44 H new ATOM 0 HA THR A 62 1.480 19.830 -1.897 1.00 10.10 H new ATOM 0 HB THR A 62 2.144 20.961 0.727 1.00 54.41 H new ATOM 0 HG1 THR A 62 -0.263 21.833 -0.601 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.457 23.005 -0.620 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.257 21.600 -1.362 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.713 22.193 -2.017 1.00 32.11 H new ATOM 992 N LEU A 63 2.186 18.563 1.092 1.00 70.40 N ATOM 993 CA LEU A 63 3.049 17.617 1.791 1.00 22.45 C ATOM 994 C LEU A 63 2.270 16.371 2.202 1.00 21.32 C ATOM 995 O LEU A 63 2.828 15.446 2.794 1.00 24.35 O ATOM 996 CB LEU A 63 3.667 18.276 3.026 1.00 14.53 C ATOM 997 CG LEU A 63 2.870 18.149 4.325 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.413 17.010 5.174 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.902 19.458 5.100 1.00 34.14 C ATOM 0 H LEU A 63 1.542 19.073 1.697 1.00 70.40 H new ATOM 0 HA LEU A 63 3.845 17.318 1.110 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.656 17.846 3.186 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.811 19.335 2.814 1.00 14.53 H new ATOM 0 HG LEU A 63 1.833 17.925 4.073 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.834 16.934 6.094 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.337 16.075 4.619 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.458 17.204 5.417 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.330 19.349 6.021 1.00 34.14 H new ATOM 0 HD22 LEU A 63 3.934 19.713 5.342 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.465 20.251 4.493 1.00 34.14 H new ATOM 1011 N TRP A 64 0.981 16.353 1.883 1.00 4.53 N ATOM 1012 CA TRP A 64 0.127 15.219 2.218 1.00 50.12 C ATOM 1013 C TRP A 64 0.746 13.912 1.735 1.00 52.11 C ATOM 1014 O TRP A 64 0.469 12.844 2.282 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.260 15.400 1.599 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.422 14.696 0.286 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.250 13.644 0.017 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.737 14.993 -0.935 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.120 13.268 -1.298 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.199 14.081 -1.904 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.219 15.942 -1.306 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -0.735 14.091 -3.217 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.679 15.950 -2.609 1.00 55.11 C ATOM 1024 CH2 TRP A 64 0.201 15.031 -3.552 1.00 13.15 C ATOM 0 H TRP A 64 0.504 17.110 1.393 1.00 4.53 H new ATOM 0 HA TRP A 64 0.030 15.175 3.303 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.012 15.030 2.296 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.451 16.464 1.458 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -2.910 13.176 0.733 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.627 12.507 -1.750 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.592 16.657 -0.587 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.101 13.382 -3.945 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.420 16.678 -2.906 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.579 15.065 -4.563 1.00 13.15 H new ATOM 1035 N PHE A 65 1.584 14.001 0.708 1.00 21.42 N ATOM 1036 CA PHE A 65 2.241 12.824 0.152 1.00 54.41 C ATOM 1037 C PHE A 65 3.758 12.976 0.197 1.00 55.14 C ATOM 1038 O PHE A 65 4.488 11.993 0.328 1.00 43.01 O ATOM 1039 CB PHE A 65 1.783 12.592 -1.289 1.00 0.51 C ATOM 1040 CG PHE A 65 0.856 11.420 -1.443 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.118 11.161 -0.491 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.959 10.577 -2.537 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -0.972 10.084 -0.629 1.00 74.41 C ATOM 1044 CE2 PHE A 65 0.106 9.499 -2.681 1.00 63.43 C ATOM 1045 CZ PHE A 65 -0.860 9.251 -1.725 1.00 12.20 C ATOM 0 H PHE A 65 1.824 14.877 0.243 1.00 21.42 H new ATOM 0 HA PHE A 65 1.962 11.962 0.758 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.283 13.490 -1.652 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.659 12.438 -1.920 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.210 11.809 0.368 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.714 10.764 -3.286 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.727 9.893 0.120 1.00 74.41 H new ATOM 0 HE2 PHE A 65 0.195 8.851 -3.540 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.526 8.408 -1.834 1.00 12.20 H new ATOM 1055 N MET A 66 4.227 14.215 0.089 1.00 21.31 N ATOM 1056 CA MET A 66 5.658 14.496 0.118 1.00 54.24 C ATOM 1057 C MET A 66 6.314 13.849 1.334 1.00 62.12 C ATOM 1058 O MET A 66 7.437 13.351 1.254 1.00 43.23 O ATOM 1059 CB MET A 66 5.902 16.006 0.135 1.00 0.42 C ATOM 1060 CG MET A 66 7.107 16.437 -0.684 1.00 60.21 C ATOM 1061 SD MET A 66 8.253 17.468 0.252 1.00 74.33 S ATOM 1062 CE MET A 66 8.973 16.257 1.358 1.00 12.21 C ATOM 0 H MET A 66 3.637 15.040 -0.019 1.00 21.31 H new ATOM 0 HA MET A 66 6.105 14.073 -0.782 1.00 54.24 H new ATOM 0 HB2 MET A 66 5.015 16.513 -0.245 1.00 0.42 H new ATOM 0 HB3 MET A 66 6.039 16.332 1.166 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.632 15.552 -1.044 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.767 16.985 -1.563 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.600 16.420 2.369 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.700 15.255 1.028 1.00 12.21 H new ATOM 0 HE3 MET A 66 10.058 16.358 1.351 1.00 12.21 H new ATOM 1072 N THR A 67 5.606 13.860 2.459 1.00 35.53 N ATOM 1073 CA THR A 67 6.121 13.276 3.691 1.00 25.30 C ATOM 1074 C THR A 67 5.122 12.294 4.293 1.00 54.02 C ATOM 1075 O THR A 67 5.335 11.769 5.385 1.00 4.44 O ATOM 1076 CB THR A 67 6.448 14.362 4.733 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.111 15.463 4.102 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.328 13.801 5.840 1.00 3.14 C ATOM 0 H THR A 67 4.674 14.267 2.542 1.00 35.53 H new ATOM 0 HA THR A 67 7.037 12.745 3.431 1.00 25.30 H new ATOM 0 HB THR A 67 5.512 14.706 5.173 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.314 16.150 4.771 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.546 14.586 6.564 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.809 12.982 6.338 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.260 13.433 5.412 1.00 3.14 H new ATOM 1086 N ASN A 68 4.031 12.051 3.574 1.00 30.33 N ATOM 1087 CA ASN A 68 2.999 11.131 4.037 1.00 74.32 C ATOM 1088 C ASN A 68 2.354 11.641 5.323 1.00 52.13 C ATOM 1089 O ASN A 68 2.099 10.872 6.248 1.00 64.53 O ATOM 1090 CB ASN A 68 3.592 9.740 4.269 1.00 33.53 C ATOM 1091 CG ASN A 68 4.538 9.323 3.160 1.00 60.54 C ATOM 1092 OD1 ASN A 68 5.751 9.246 3.359 1.00 41.20 O ATOM 1093 ND2 ASN A 68 3.987 9.051 1.983 1.00 22.32 N ATOM 0 H ASN A 68 3.839 12.479 2.668 1.00 30.33 H new ATOM 0 HA ASN A 68 2.232 11.067 3.265 1.00 74.32 H new ATOM 0 HB2 ASN A 68 4.124 9.729 5.220 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.784 9.012 4.347 1.00 33.53 H new ATOM 0 HD21 ASN A 68 4.574 8.765 1.199 1.00 22.32 H new ATOM 0 HD22 ASN A 68 2.977 9.128 1.863 1.00 22.32 H new ATOM 1100 N GLN A 69 2.092 12.944 5.369 1.00 44.34 N ATOM 1101 CA GLN A 69 1.476 13.556 6.541 1.00 22.34 C ATOM 1102 C GLN A 69 0.395 14.550 6.130 1.00 11.24 C ATOM 1103 O GLN A 69 0.689 15.605 5.567 1.00 12.43 O ATOM 1104 CB GLN A 69 2.535 14.259 7.391 1.00 24.40 C ATOM 1105 CG GLN A 69 1.976 14.903 8.650 1.00 53.41 C ATOM 1106 CD GLN A 69 1.830 13.918 9.793 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.641 13.899 10.719 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.789 13.094 9.736 1.00 3.22 N ATOM 0 H GLN A 69 2.296 13.595 4.610 1.00 44.34 H new ATOM 0 HA GLN A 69 1.012 12.766 7.132 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.301 13.537 7.672 1.00 24.40 H new ATOM 0 HB3 GLN A 69 3.024 15.024 6.788 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.631 15.718 8.959 1.00 53.41 H new ATOM 0 HG3 GLN A 69 1.004 15.343 8.428 1.00 53.41 H new ATOM 0 HE21 GLN A 69 0.141 13.144 8.950 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.638 12.411 10.479 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.857 14.208 6.416 1.00 53.02 N ATOM 1118 CA ILE A 70 -1.981 15.071 6.077 1.00 1.12 C ATOM 1119 C ILE A 70 -2.149 16.185 7.105 1.00 5.32 C ATOM 1120 O ILE A 70 -2.246 15.926 8.304 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.296 14.273 5.981 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.544 13.501 7.279 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.253 13.324 4.794 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.763 13.975 8.039 1.00 41.24 C ATOM 0 H ILE A 70 -1.118 13.339 6.882 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.760 15.509 5.104 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.119 14.972 5.833 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.659 12.442 7.046 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.667 13.593 7.920 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.189 12.767 4.739 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.117 13.896 3.876 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.423 12.628 4.915 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.878 13.384 8.948 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.642 15.026 8.303 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.649 13.857 7.415 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.185 17.424 6.627 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.345 18.576 7.504 1.00 71.32 C ATOM 1138 C ALA A 71 -3.694 19.253 7.281 1.00 23.44 C ATOM 1139 O ALA A 71 -3.790 20.307 6.652 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.212 19.569 7.285 1.00 72.44 C ATOM 0 H ALA A 71 -2.105 17.655 5.637 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.310 18.223 8.535 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.345 20.425 7.947 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.259 19.087 7.502 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.220 19.907 6.249 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.762 18.634 7.806 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.123 19.159 7.677 1.00 40.23 C ATOM 1148 C PRO A 72 -6.336 20.429 8.494 1.00 33.14 C ATOM 1149 O PRO A 72 -7.206 21.241 8.181 1.00 11.03 O ATOM 1150 CB PRO A 72 -6.995 18.023 8.220 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.103 17.274 9.149 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.720 17.374 8.568 1.00 55.43 C ATOM 0 HA PRO A 72 -6.354 19.440 6.650 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.872 18.410 8.739 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.357 17.382 7.416 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.137 17.701 10.151 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.415 16.233 9.235 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -3.958 17.400 9.347 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.491 16.523 7.926 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.533 20.596 9.540 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.635 21.768 10.401 1.00 5.13 C ATOM 1162 C GLU A 73 -5.441 23.051 9.598 1.00 20.24 C ATOM 1163 O GLU A 73 -5.912 24.118 9.991 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.597 21.695 11.524 1.00 31.42 C ATOM 1165 CG GLU A 73 -5.194 21.838 12.914 1.00 1.34 C ATOM 1166 CD GLU A 73 -5.706 20.523 13.468 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -4.984 19.510 13.356 1.00 50.44 O ATOM 1168 OE2 GLU A 73 -6.829 20.507 14.013 1.00 62.13 O ATOM 0 H GLU A 73 -4.805 19.935 9.811 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.633 21.780 10.838 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -4.071 20.743 11.460 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -3.855 22.480 11.374 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -4.440 22.243 13.589 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -6.012 22.557 12.881 1.00 1.34 H new ATOM 1175 N SER A 74 -4.745 22.938 8.472 1.00 3.44 N ATOM 1176 CA SER A 74 -4.486 24.089 7.615 1.00 51.31 C ATOM 1177 C SER A 74 -5.195 23.938 6.273 1.00 0.10 C ATOM 1178 O SER A 74 -5.003 24.743 5.363 1.00 72.23 O ATOM 1179 CB SER A 74 -2.982 24.257 7.394 1.00 74.54 C ATOM 1180 OG SER A 74 -2.259 24.003 8.586 1.00 24.41 O ATOM 0 H SER A 74 -4.350 22.061 8.132 1.00 3.44 H new ATOM 0 HA SER A 74 -4.875 24.977 8.113 1.00 51.31 H new ATOM 0 HB2 SER A 74 -2.648 23.576 6.611 1.00 74.54 H new ATOM 0 HB3 SER A 74 -2.773 25.269 7.047 1.00 74.54 H new ATOM 0 HG SER A 74 -1.752 24.803 8.838 1.00 24.41 H new ATOM 1186 N GLY A 75 -6.017 22.898 6.158 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.743 22.659 4.924 1.00 41.33 C ATOM 1188 C GLY A 75 -5.959 21.806 3.947 1.00 61.32 C ATOM 1189 O GLY A 75 -5.889 22.119 2.758 1.00 21.02 O ATOM 0 H GLY A 75 -6.193 22.217 6.897 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.689 22.168 5.152 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -6.983 23.614 4.457 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.367 20.726 4.448 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.582 19.828 3.610 1.00 71.34 C ATOM 1195 C GLN A 76 -4.896 18.370 3.932 1.00 22.20 C ATOM 1196 O GLN A 76 -4.678 17.912 5.054 1.00 15.14 O ATOM 1197 CB GLN A 76 -3.088 20.094 3.799 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.737 21.572 3.861 1.00 0.22 C ATOM 1199 CD GLN A 76 -1.370 21.872 3.277 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -0.404 21.152 3.528 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -1.283 22.939 2.491 1.00 55.24 N ATOM 0 H GLN A 76 -5.416 20.452 5.429 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.848 20.017 2.570 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.755 19.611 4.717 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.538 19.633 2.979 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -3.492 22.144 3.321 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -2.766 21.905 4.898 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -2.110 23.508 2.310 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -0.389 23.190 2.068 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.408 17.648 2.942 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.751 16.243 3.121 1.00 50.55 C ATOM 1212 C ILE A 77 -5.507 15.450 1.842 1.00 25.22 C ATOM 1213 O ILE A 77 -5.091 16.005 0.825 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.222 16.071 3.546 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.145 16.227 2.335 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.582 17.078 4.627 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -8.018 17.568 1.648 1.00 65.21 C ATOM 0 H ILE A 77 -5.595 18.012 2.008 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.106 15.860 3.912 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.354 15.069 3.954 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -7.925 15.437 1.616 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.178 16.088 2.655 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.624 16.944 4.917 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -6.941 16.924 5.495 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.439 18.089 4.245 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.701 17.608 0.799 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.267 18.362 2.352 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.995 17.702 1.297 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.771 14.148 1.899 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.584 13.279 0.744 1.00 35.42 C ATOM 1231 C ALA A 78 -6.874 13.147 -0.059 1.00 61.12 C ATOM 1232 O ALA A 78 -7.975 13.133 0.490 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.093 11.909 1.187 1.00 72.54 C ATOM 0 H ALA A 78 -6.115 13.672 2.733 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.830 13.731 0.099 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -4.958 11.271 0.314 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.142 12.015 1.710 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.826 11.458 1.856 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.736 13.048 -1.389 1.00 45.11 N ATOM 1240 CA PRO A 79 -7.882 12.916 -2.295 1.00 73.10 C ATOM 1241 C PRO A 79 -8.568 11.560 -2.167 1.00 74.34 C ATOM 1242 O PRO A 79 -8.284 10.795 -1.246 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.254 13.068 -3.683 1.00 3.43 C ATOM 1244 CG PRO A 79 -5.836 12.649 -3.507 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.453 13.058 -2.112 1.00 54.14 C ATOM 0 HA PRO A 79 -8.659 13.649 -2.080 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -7.763 12.444 -4.418 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.321 14.097 -4.037 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -5.728 11.573 -3.642 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.193 13.129 -4.245 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.738 12.363 -1.671 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -4.990 14.045 -2.095 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.472 11.269 -3.097 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.196 10.005 -3.089 1.00 34.34 C ATOM 1255 C ALA A 80 -9.439 8.933 -3.866 1.00 51.31 C ATOM 1256 O ALA A 80 -9.650 7.737 -3.660 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.591 10.192 -3.668 1.00 63.50 C ATOM 0 H ALA A 80 -9.720 11.892 -3.865 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.285 9.673 -2.055 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.121 9.239 -3.656 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.139 10.920 -3.069 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.514 10.551 -4.694 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.557 9.369 -4.759 1.00 5.22 N ATOM 1264 CA LEU A 81 -7.768 8.446 -5.568 1.00 2.43 C ATOM 1265 C LEU A 81 -6.447 8.112 -4.882 1.00 54.42 C ATOM 1266 O LEU A 81 -5.815 7.102 -5.189 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.502 9.047 -6.949 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.731 9.521 -7.724 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -8.550 10.959 -8.185 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.997 8.608 -8.912 1.00 41.44 C ATOM 0 H LEU A 81 -8.370 10.355 -4.941 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.338 7.524 -5.684 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -6.824 9.892 -6.831 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -6.982 8.303 -7.552 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.594 9.480 -7.059 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -9.435 11.279 -8.735 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -8.409 11.604 -7.318 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -7.676 11.026 -8.833 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.876 8.961 -9.452 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -8.134 8.616 -9.578 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -9.172 7.592 -8.558 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.039 8.967 -3.950 1.00 61.40 N ATOM 1283 CA ALA A 82 -4.796 8.761 -3.217 1.00 42.42 C ATOM 1284 C ALA A 82 -4.731 7.355 -2.630 1.00 41.25 C ATOM 1285 O ALA A 82 -3.732 6.651 -2.786 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.654 9.801 -2.116 1.00 60.33 C ATOM 0 H ALA A 82 -6.551 9.808 -3.685 1.00 61.40 H new ATOM 0 HA ALA A 82 -3.968 8.873 -3.917 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -3.721 9.635 -1.577 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.646 10.798 -2.556 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.493 9.716 -1.425 1.00 60.33 H new ATOM 1292 N HIS A 83 -5.802 6.950 -1.954 1.00 52.44 N ATOM 1293 CA HIS A 83 -5.867 5.627 -1.344 1.00 62.14 C ATOM 1294 C HIS A 83 -4.810 5.481 -0.253 1.00 43.04 C ATOM 1295 O HIS A 83 -4.423 4.369 0.105 1.00 74.24 O ATOM 1296 CB HIS A 83 -5.674 4.543 -2.405 1.00 52.01 C ATOM 1297 CG HIS A 83 -6.833 3.601 -2.515 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -7.093 2.615 -1.587 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -7.805 3.500 -3.452 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -8.174 1.946 -1.948 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -8.625 2.463 -3.076 1.00 35.44 N ATOM 0 H HIS A 83 -6.637 7.520 -1.815 1.00 52.44 H new ATOM 0 HA HIS A 83 -6.851 5.510 -0.891 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -5.509 5.018 -3.372 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -4.774 3.974 -2.172 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -7.915 4.118 -4.330 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -8.613 1.118 -1.412 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -9.449 2.144 -3.586 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.348 6.611 0.272 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.336 6.608 1.322 1.00 21.02 C ATOM 1311 C PHE A 84 -3.896 7.183 2.619 1.00 45.34 C ATOM 1312 O PHE A 84 -4.114 6.458 3.590 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.112 7.413 0.881 1.00 72.42 C ATOM 1314 CG PHE A 84 -0.861 6.588 0.768 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -0.740 5.620 -0.216 1.00 20.34 C ATOM 1316 CD2 PHE A 84 0.193 6.781 1.647 1.00 43.32 C ATOM 1317 CE1 PHE A 84 0.410 4.861 -0.323 1.00 14.32 C ATOM 1318 CE2 PHE A 84 1.345 6.024 1.545 1.00 15.34 C ATOM 1319 CZ PHE A 84 1.453 5.063 0.560 1.00 4.42 C ATOM 0 H PHE A 84 -4.658 7.540 -0.012 1.00 61.54 H new ATOM 0 HA PHE A 84 -3.038 5.575 1.502 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.320 7.877 -0.083 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -1.942 8.220 1.593 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -1.554 5.457 -0.907 1.00 20.34 H new ATOM 0 HD2 PHE A 84 0.113 7.531 2.420 1.00 43.32 H new ATOM 0 HE1 PHE A 84 0.493 4.111 -1.096 1.00 14.32 H new ATOM 0 HE2 PHE A 84 2.160 6.184 2.235 1.00 15.34 H new ATOM 0 HZ PHE A 84 2.352 4.470 0.480 1.00 4.42 H new ATOM 1573 N THR B 4 15.620 31.642 -5.057 1.00 72.34 N ATOM 1574 CA THR B 4 15.824 30.460 -5.884 1.00 42.42 C ATOM 1575 C THR B 4 15.477 29.187 -5.120 1.00 52.45 C ATOM 1576 O THR B 4 15.528 29.158 -3.890 1.00 62.33 O ATOM 1577 CB THR B 4 17.278 30.366 -6.384 1.00 14.31 C ATOM 1578 OG1 THR B 4 17.893 31.658 -6.345 1.00 24.44 O ATOM 1579 CG2 THR B 4 17.328 29.818 -7.802 1.00 44.11 C ATOM 0 HA THR B 4 15.159 30.558 -6.742 1.00 42.42 H new ATOM 0 HB THR B 4 17.821 29.685 -5.729 1.00 14.31 H new ATOM 0 HG1 THR B 4 17.422 32.225 -5.699 1.00 24.44 H new ATOM 0 HG21 THR B 4 18.365 29.761 -8.134 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.885 28.822 -7.823 1.00 44.11 H new ATOM 0 HG23 THR B 4 16.770 30.478 -8.467 1.00 44.11 H new ATOM 1587 N ILE B 5 15.128 28.137 -5.854 1.00 72.43 N ATOM 1588 CA ILE B 5 14.776 26.861 -5.244 1.00 60.40 C ATOM 1589 C ILE B 5 15.845 26.412 -4.254 1.00 73.52 C ATOM 1590 O ILE B 5 15.554 26.151 -3.087 1.00 14.01 O ATOM 1591 CB ILE B 5 14.583 25.763 -6.307 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.483 26.163 -7.292 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.250 24.435 -5.642 1.00 64.43 C ATOM 1594 CD1 ILE B 5 13.794 25.798 -8.726 1.00 71.13 C ATOM 0 H ILE B 5 15.081 28.144 -6.873 1.00 72.43 H new ATOM 0 HA ILE B 5 13.835 27.013 -4.715 1.00 60.40 H new ATOM 0 HB ILE B 5 15.515 25.646 -6.861 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.550 25.682 -6.997 1.00 41.00 H new ATOM 0 HG13 ILE B 5 13.321 27.239 -7.226 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.116 23.669 -6.406 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.064 24.147 -4.977 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.330 24.537 -5.066 1.00 64.43 H new ATOM 0 HD11 ILE B 5 12.971 26.111 -9.368 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.710 26.300 -9.039 1.00 71.13 H new ATOM 0 HD13 ILE B 5 13.926 24.719 -8.806 1.00 71.13 H new ATOM 1606 N SER B 6 17.085 26.326 -4.727 1.00 1.32 N ATOM 1607 CA SER B 6 18.197 25.907 -3.883 1.00 35.53 C ATOM 1608 C SER B 6 18.257 26.742 -2.608 1.00 22.31 C ATOM 1609 O SER B 6 18.453 26.212 -1.515 1.00 0.21 O ATOM 1610 CB SER B 6 19.517 26.028 -4.647 1.00 41.32 C ATOM 1611 OG SER B 6 20.167 27.252 -4.354 1.00 21.35 O ATOM 0 H SER B 6 17.344 26.541 -5.690 1.00 1.32 H new ATOM 0 HA SER B 6 18.038 24.865 -3.606 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.169 25.195 -4.386 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.328 25.961 -5.718 1.00 41.32 H new ATOM 0 HG SER B 6 20.991 27.073 -3.855 1.00 21.35 H new ATOM 1617 N GLU B 7 18.086 28.053 -2.757 1.00 32.11 N ATOM 1618 CA GLU B 7 18.121 28.962 -1.618 1.00 62.35 C ATOM 1619 C GLU B 7 17.097 28.552 -0.563 1.00 42.41 C ATOM 1620 O GLU B 7 17.303 28.760 0.633 1.00 11.21 O ATOM 1621 CB GLU B 7 17.854 30.397 -2.074 1.00 23.21 C ATOM 1622 CG GLU B 7 19.117 31.211 -2.295 1.00 1.43 C ATOM 1623 CD GLU B 7 18.901 32.696 -2.073 1.00 1.34 C ATOM 1624 OE1 GLU B 7 18.356 33.359 -2.980 1.00 64.22 O ATOM 1625 OE2 GLU B 7 19.277 33.194 -0.991 1.00 2.32 O ATOM 0 H GLU B 7 17.922 28.508 -3.655 1.00 32.11 H new ATOM 0 HA GLU B 7 19.115 28.909 -1.174 1.00 62.35 H new ATOM 0 HB2 GLU B 7 17.280 30.374 -3.000 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.236 30.897 -1.328 1.00 23.21 H new ATOM 0 HG2 GLU B 7 19.896 30.856 -1.620 1.00 1.43 H new ATOM 0 HG3 GLU B 7 19.477 31.048 -3.311 1.00 1.43 H new ATOM 1632 N LYS B 8 15.993 27.968 -1.015 1.00 33.03 N ATOM 1633 CA LYS B 8 14.935 27.528 -0.112 1.00 74.20 C ATOM 1634 C LYS B 8 15.417 26.382 0.771 1.00 72.42 C ATOM 1635 O LYS B 8 14.937 26.205 1.892 1.00 55.43 O ATOM 1636 CB LYS B 8 13.706 27.089 -0.910 1.00 61.22 C ATOM 1637 CG LYS B 8 13.349 28.032 -2.046 1.00 10.12 C ATOM 1638 CD LYS B 8 11.887 27.902 -2.441 1.00 72.53 C ATOM 1639 CE LYS B 8 11.159 29.232 -2.329 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.316 29.507 -3.526 1.00 44.13 N ATOM 0 H LYS B 8 15.807 27.788 -2.002 1.00 33.03 H new ATOM 0 HA LYS B 8 14.664 28.368 0.528 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.884 26.094 -1.318 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.854 27.009 -0.234 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.556 29.059 -1.746 1.00 10.12 H new ATOM 0 HG3 LYS B 8 13.980 27.819 -2.909 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.817 27.533 -3.464 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.401 27.165 -1.802 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.533 29.229 -1.437 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.886 30.034 -2.205 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 9.837 30.423 -3.410 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 10.917 29.535 -4.375 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 9.605 28.755 -3.630 1.00 44.13 H new ATOM 1654 N ILE B 9 16.367 25.606 0.260 1.00 12.54 N ATOM 1655 CA ILE B 9 16.915 24.478 1.005 1.00 14.12 C ATOM 1656 C ILE B 9 18.207 24.865 1.716 1.00 2.44 C ATOM 1657 O ILE B 9 18.817 24.048 2.407 1.00 32.42 O ATOM 1658 CB ILE B 9 17.189 23.275 0.083 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.007 23.047 -0.860 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.462 22.028 0.909 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.217 21.904 -1.828 1.00 4.43 C ATOM 0 H ILE B 9 16.773 25.737 -0.666 1.00 12.54 H new ATOM 0 HA ILE B 9 16.167 24.195 1.745 1.00 14.12 H new ATOM 0 HB ILE B 9 18.072 23.491 -0.518 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.113 22.851 -0.268 1.00 2.42 H new ATOM 0 HG13 ILE B 9 15.822 23.961 -1.424 1.00 2.42 H new ATOM 0 HG21 ILE B 9 17.654 21.186 0.244 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.332 22.195 1.543 1.00 21.54 H new ATOM 0 HG23 ILE B 9 16.596 21.808 1.533 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.339 21.801 -2.465 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.092 22.107 -2.446 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.372 20.980 -1.271 1.00 4.43 H new ATOM 1673 N VAL B 10 18.619 26.117 1.545 1.00 31.43 N ATOM 1674 CA VAL B 10 19.838 26.614 2.172 1.00 4.14 C ATOM 1675 C VAL B 10 19.527 27.345 3.473 1.00 20.24 C ATOM 1676 O VAL B 10 20.099 27.042 4.521 1.00 25.00 O ATOM 1677 CB VAL B 10 20.606 27.563 1.234 1.00 14.00 C ATOM 1678 CG1 VAL B 10 21.897 28.032 1.888 1.00 0.51 C ATOM 1679 CG2 VAL B 10 20.890 26.881 -0.097 1.00 13.31 C ATOM 0 H VAL B 10 18.126 26.806 0.977 1.00 31.43 H new ATOM 0 HA VAL B 10 20.461 25.745 2.386 1.00 4.14 H new ATOM 0 HB VAL B 10 19.985 28.438 1.043 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.426 28.702 1.210 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.665 28.561 2.813 1.00 0.51 H new ATOM 0 HG13 VAL B 10 22.526 27.170 2.111 1.00 0.51 H new ATOM 0 HG21 VAL B 10 21.433 27.566 -0.748 1.00 13.31 H new ATOM 0 HG22 VAL B 10 21.491 25.988 0.073 1.00 13.31 H new ATOM 0 HG23 VAL B 10 19.949 26.600 -0.570 1.00 13.31 H new ATOM 1689 N LEU B 11 18.616 28.310 3.400 1.00 4.44 N ATOM 1690 CA LEU B 11 18.228 29.087 4.573 1.00 2.34 C ATOM 1691 C LEU B 11 17.788 28.171 5.710 1.00 45.43 C ATOM 1692 O LEU B 11 18.310 28.250 6.821 1.00 75.44 O ATOM 1693 CB LEU B 11 17.099 30.055 4.216 1.00 4.21 C ATOM 1694 CG LEU B 11 15.960 29.478 3.373 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.752 29.176 4.245 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.586 30.438 2.254 1.00 42.24 C ATOM 0 H LEU B 11 18.132 28.573 2.541 1.00 4.44 H new ATOM 0 HA LEU B 11 19.095 29.657 4.905 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.677 30.446 5.142 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.529 30.901 3.679 1.00 4.21 H new ATOM 0 HG LEU B 11 16.301 28.545 2.925 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.952 28.766 3.629 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.028 28.451 5.010 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.409 30.094 4.722 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.774 30.011 1.665 1.00 42.24 H new ATOM 0 HD22 LEU B 11 15.264 31.387 2.682 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.452 30.604 1.613 1.00 42.24 H new ATOM 1708 N MET B 12 16.825 27.300 5.423 1.00 15.32 N ATOM 1709 CA MET B 12 16.317 26.367 6.421 1.00 4.44 C ATOM 1710 C MET B 12 17.440 25.490 6.967 1.00 75.53 C ATOM 1711 O MET B 12 17.607 25.364 8.180 1.00 31.24 O ATOM 1712 CB MET B 12 15.217 25.490 5.819 1.00 24.25 C ATOM 1713 CG MET B 12 15.585 24.897 4.469 1.00 13.14 C ATOM 1714 SD MET B 12 15.987 23.142 4.569 1.00 25.25 S ATOM 1715 CE MET B 12 14.350 22.426 4.709 1.00 64.33 C ATOM 0 H MET B 12 16.382 27.222 4.508 1.00 15.32 H new ATOM 0 HA MET B 12 15.899 26.947 7.244 1.00 4.44 H new ATOM 0 HB2 MET B 12 14.989 24.681 6.512 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.309 26.083 5.711 1.00 24.25 H new ATOM 0 HG2 MET B 12 14.755 25.037 3.776 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.437 25.438 4.059 1.00 13.14 H new ATOM 0 HE1 MET B 12 14.409 21.349 4.549 1.00 64.33 H new ATOM 0 HE2 MET B 12 13.950 22.623 5.704 1.00 64.33 H new ATOM 0 HE3 MET B 12 13.694 22.869 3.960 1.00 64.33 H new ATOM 1725 N ARG B 13 18.206 24.887 6.064 1.00 31.24 N ATOM 1726 CA ARG B 13 19.312 24.021 6.456 1.00 74.51 C ATOM 1727 C ARG B 13 20.211 24.715 7.475 1.00 20.12 C ATOM 1728 O ARG B 13 20.502 24.167 8.538 1.00 41.34 O ATOM 1729 CB ARG B 13 20.130 23.617 5.228 1.00 32.34 C ATOM 1730 CG ARG B 13 21.450 22.946 5.571 1.00 45.45 C ATOM 1731 CD ARG B 13 22.017 22.190 4.379 1.00 63.05 C ATOM 1732 NE ARG B 13 23.112 22.915 3.741 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.295 23.110 4.312 1.00 41.31 C ATOM 1734 NH1 ARG B 13 24.535 22.635 5.527 1.00 23.35 N ATOM 1735 NH2 ARG B 13 25.242 23.780 3.668 1.00 12.23 N ATOM 0 H ARG B 13 18.081 24.982 5.056 1.00 31.24 H new ATOM 0 HA ARG B 13 18.895 23.126 6.917 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.537 22.940 4.613 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.328 24.504 4.626 1.00 32.34 H new ATOM 0 HG2 ARG B 13 22.167 23.698 5.901 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.304 22.258 6.404 1.00 45.45 H new ATOM 0 HD2 ARG B 13 22.371 21.212 4.705 1.00 63.05 H new ATOM 0 HD3 ARG B 13 21.225 22.015 3.651 1.00 63.05 H new ATOM 0 HE ARG B 13 22.960 23.292 2.806 1.00 42.01 H new ATOM 0 HH11 ARG B 13 23.810 22.119 6.025 1.00 23.35 H new ATOM 0 HH12 ARG B 13 25.445 22.786 5.963 1.00 23.35 H new ATOM 0 HH21 ARG B 13 25.062 24.146 2.733 1.00 12.23 H new ATOM 0 HH22 ARG B 13 26.150 23.929 4.108 1.00 12.23 H new ATOM 1749 N LYS B 14 20.649 25.924 7.141 1.00 12.22 N ATOM 1750 CA LYS B 14 21.516 26.695 8.026 1.00 65.30 C ATOM 1751 C LYS B 14 20.796 27.041 9.326 1.00 55.42 C ATOM 1752 O LYS B 14 21.431 27.308 10.346 1.00 72.04 O ATOM 1753 CB LYS B 14 21.979 27.977 7.330 1.00 13.55 C ATOM 1754 CG LYS B 14 23.339 27.851 6.667 1.00 13.50 C ATOM 1755 CD LYS B 14 23.233 27.941 5.153 1.00 31.23 C ATOM 1756 CE LYS B 14 22.694 29.293 4.713 1.00 22.12 C ATOM 1757 NZ LYS B 14 23.604 29.965 3.744 1.00 72.34 N ATOM 0 H LYS B 14 20.418 26.392 6.264 1.00 12.22 H new ATOM 0 HA LYS B 14 22.386 26.084 8.265 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.242 28.259 6.578 1.00 13.55 H new ATOM 0 HB3 LYS B 14 22.014 28.785 8.061 1.00 13.55 H new ATOM 0 HG2 LYS B 14 23.998 28.638 7.034 1.00 13.50 H new ATOM 0 HG3 LYS B 14 23.793 26.900 6.945 1.00 13.50 H new ATOM 0 HD2 LYS B 14 24.214 27.777 4.708 1.00 31.23 H new ATOM 0 HD3 LYS B 14 22.580 27.150 4.785 1.00 31.23 H new ATOM 0 HE2 LYS B 14 21.712 29.162 4.258 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.558 29.931 5.586 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 23.076 30.690 3.218 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 24.389 30.413 4.258 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 23.983 29.261 3.079 1.00 72.34 H new ATOM 1771 N SER B 15 19.467 27.034 9.282 1.00 70.12 N ATOM 1772 CA SER B 15 18.662 27.349 10.455 1.00 60.13 C ATOM 1773 C SER B 15 18.799 26.261 11.516 1.00 64.13 C ATOM 1774 O SER B 15 18.620 26.515 12.707 1.00 73.31 O ATOM 1775 CB SER B 15 17.192 27.512 10.062 1.00 63.31 C ATOM 1776 OG SER B 15 16.437 26.369 10.426 1.00 42.11 O ATOM 0 H SER B 15 18.926 26.813 8.446 1.00 70.12 H new ATOM 0 HA SER B 15 19.025 28.288 10.873 1.00 60.13 H new ATOM 0 HB2 SER B 15 16.778 28.395 10.548 1.00 63.31 H new ATOM 0 HB3 SER B 15 17.116 27.675 8.987 1.00 63.31 H new ATOM 0 HG SER B 15 16.579 25.659 9.765 1.00 42.11 H new ATOM 1782 N GLU B 16 19.117 25.049 11.075 1.00 40.41 N ATOM 1783 CA GLU B 16 19.277 23.921 11.986 1.00 13.44 C ATOM 1784 C GLU B 16 20.682 23.898 12.580 1.00 32.01 C ATOM 1785 O GLU B 16 20.975 23.109 13.479 1.00 23.44 O ATOM 1786 CB GLU B 16 18.996 22.605 11.258 1.00 54.12 C ATOM 1787 CG GLU B 16 18.250 21.589 12.106 1.00 50.43 C ATOM 1788 CD GLU B 16 16.745 21.696 11.954 1.00 43.22 C ATOM 1789 OE1 GLU B 16 16.212 21.178 10.950 1.00 35.53 O ATOM 1790 OE2 GLU B 16 16.100 22.298 12.839 1.00 51.44 O ATOM 0 H GLU B 16 19.269 24.822 10.092 1.00 40.41 H new ATOM 0 HA GLU B 16 18.560 24.038 12.798 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.415 22.813 10.360 1.00 54.12 H new ATOM 0 HB3 GLU B 16 19.941 22.170 10.932 1.00 54.12 H new ATOM 0 HG2 GLU B 16 18.569 20.585 11.828 1.00 50.43 H new ATOM 0 HG3 GLU B 16 18.517 21.730 13.153 1.00 50.43 H new ATOM 1797 N TYR B 17 21.549 24.766 12.070 1.00 34.32 N ATOM 1798 CA TYR B 17 22.924 24.844 12.548 1.00 12.14 C ATOM 1799 C TYR B 17 23.675 23.548 12.259 1.00 53.41 C ATOM 1800 O TYR B 17 24.535 23.127 13.034 1.00 71.22 O ATOM 1801 CB TYR B 17 22.950 25.137 14.049 1.00 12.25 C ATOM 1802 CG TYR B 17 22.021 26.255 14.462 1.00 11.31 C ATOM 1803 CD1 TYR B 17 22.332 27.581 14.186 1.00 4.33 C ATOM 1804 CD2 TYR B 17 20.833 25.987 15.132 1.00 24.11 C ATOM 1805 CE1 TYR B 17 21.487 28.607 14.563 1.00 21.33 C ATOM 1806 CE2 TYR B 17 19.981 27.006 15.512 1.00 12.34 C ATOM 1807 CZ TYR B 17 20.312 28.314 15.225 1.00 21.44 C ATOM 1808 OH TYR B 17 19.467 29.332 15.603 1.00 40.42 O ATOM 0 H TYR B 17 21.324 25.426 11.325 1.00 34.32 H new ATOM 0 HA TYR B 17 23.420 25.657 12.018 1.00 12.14 H new ATOM 0 HB2 TYR B 17 22.680 24.232 14.592 1.00 12.25 H new ATOM 0 HB3 TYR B 17 23.968 25.394 14.343 1.00 12.25 H new ATOM 0 HD1 TYR B 17 23.250 27.814 13.668 1.00 4.33 H new ATOM 0 HD2 TYR B 17 20.571 24.964 15.360 1.00 24.11 H new ATOM 0 HE1 TYR B 17 21.744 29.632 14.341 1.00 21.33 H new ATOM 0 HE2 TYR B 17 19.061 26.780 16.031 1.00 12.34 H new ATOM 0 HH TYR B 17 18.684 28.956 16.057 1.00 40.42 H new ATOM 1818 N LEU B 18 23.344 22.918 11.136 1.00 12.20 N ATOM 1819 CA LEU B 18 23.987 21.668 10.742 1.00 24.40 C ATOM 1820 C LEU B 18 24.872 21.875 9.517 1.00 52.21 C ATOM 1821 O LEU B 18 24.756 22.880 8.817 1.00 53.11 O ATOM 1822 CB LEU B 18 22.932 20.600 10.449 1.00 20.43 C ATOM 1823 CG LEU B 18 22.009 20.876 9.261 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.659 20.421 7.964 1.00 73.11 C ATOM 1825 CD2 LEU B 18 20.666 20.187 9.457 1.00 4.13 C ATOM 0 H LEU B 18 22.635 23.252 10.483 1.00 12.20 H new ATOM 0 HA LEU B 18 24.614 21.333 11.568 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.442 19.652 10.275 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.317 20.472 11.339 1.00 20.43 H new ATOM 0 HG LEU B 18 21.838 21.951 9.201 1.00 13.14 H new ATOM 0 HD11 LEU B 18 21.988 20.625 7.130 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.595 20.960 7.817 1.00 73.11 H new ATOM 0 HD13 LEU B 18 22.861 19.351 8.014 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.022 20.395 8.602 1.00 4.13 H new ATOM 0 HD22 LEU B 18 20.818 19.111 9.544 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.194 20.561 10.366 1.00 4.13 H new ATOM 1837 N SER B 19 25.755 20.914 9.263 1.00 12.41 N ATOM 1838 CA SER B 19 26.662 20.991 8.123 1.00 64.34 C ATOM 1839 C SER B 19 26.145 20.150 6.960 1.00 33.32 C ATOM 1840 O SER B 19 25.265 19.306 7.133 1.00 1.23 O ATOM 1841 CB SER B 19 28.061 20.520 8.525 1.00 15.24 C ATOM 1842 OG SER B 19 28.024 19.787 9.737 1.00 63.44 O ATOM 0 H SER B 19 25.862 20.073 9.831 1.00 12.41 H new ATOM 0 HA SER B 19 26.715 22.031 7.802 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.480 19.899 7.733 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.720 21.381 8.637 1.00 15.24 H new ATOM 0 HG SER B 19 28.930 19.496 9.971 1.00 63.44 H new ATOM 1848 N ARG B 20 26.697 20.387 5.775 1.00 0.34 N ATOM 1849 CA ARG B 20 26.291 19.654 4.582 1.00 13.34 C ATOM 1850 C ARG B 20 26.410 18.149 4.803 1.00 61.45 C ATOM 1851 O ARG B 20 25.607 17.371 4.287 1.00 32.35 O ATOM 1852 CB ARG B 20 27.145 20.074 3.384 1.00 32.01 C ATOM 1853 CG ARG B 20 26.461 21.077 2.471 1.00 12.30 C ATOM 1854 CD ARG B 20 26.776 20.804 1.009 1.00 43.42 C ATOM 1855 NE ARG B 20 28.089 21.317 0.626 1.00 33.34 N ATOM 1856 CZ ARG B 20 28.336 22.601 0.390 1.00 13.22 C ATOM 1857 NH1 ARG B 20 27.364 23.498 0.498 1.00 45.34 N ATOM 1858 NH2 ARG B 20 29.557 22.991 0.046 1.00 44.43 N ATOM 0 H ARG B 20 27.427 21.081 5.615 1.00 0.34 H new ATOM 0 HA ARG B 20 25.247 19.893 4.376 1.00 13.34 H new ATOM 0 HB2 ARG B 20 28.079 20.504 3.747 1.00 32.01 H new ATOM 0 HB3 ARG B 20 27.406 19.188 2.806 1.00 32.01 H new ATOM 0 HG2 ARG B 20 25.383 21.036 2.626 1.00 12.30 H new ATOM 0 HG3 ARG B 20 26.782 22.086 2.731 1.00 12.30 H new ATOM 0 HD2 ARG B 20 26.739 19.730 0.825 1.00 43.42 H new ATOM 0 HD3 ARG B 20 26.011 21.262 0.382 1.00 43.42 H new ATOM 0 HE ARG B 20 28.858 20.653 0.535 1.00 33.34 H new ATOM 0 HH11 ARG B 20 26.424 23.202 0.763 1.00 45.34 H new ATOM 0 HH12 ARG B 20 27.557 24.483 0.316 1.00 45.34 H new ATOM 0 HH21 ARG B 20 30.307 22.305 -0.037 1.00 44.43 H new ATOM 0 HH22 ARG B 20 29.745 23.977 -0.135 1.00 44.43 H new ATOM 1872 N GLN B 21 27.416 17.746 5.572 1.00 14.43 N ATOM 1873 CA GLN B 21 27.640 16.334 5.860 1.00 43.34 C ATOM 1874 C GLN B 21 26.586 15.802 6.824 1.00 62.14 C ATOM 1875 O GLN B 21 26.313 14.601 6.857 1.00 41.54 O ATOM 1876 CB GLN B 21 29.037 16.128 6.448 1.00 2.32 C ATOM 1877 CG GLN B 21 29.241 16.815 7.788 1.00 23.52 C ATOM 1878 CD GLN B 21 30.518 16.380 8.479 1.00 53.34 C ATOM 1879 OE1 GLN B 21 31.414 15.812 7.854 1.00 14.14 O ATOM 1880 NE2 GLN B 21 30.609 16.644 9.778 1.00 71.20 N ATOM 0 H GLN B 21 28.089 18.377 6.007 1.00 14.43 H new ATOM 0 HA GLN B 21 27.562 15.781 4.924 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.219 15.060 6.566 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.778 16.501 5.741 1.00 2.32 H new ATOM 0 HG2 GLN B 21 29.263 17.895 7.639 1.00 23.52 H new ATOM 0 HG3 GLN B 21 28.391 16.600 8.435 1.00 23.52 H new ATOM 0 HE21 GLN B 21 29.843 17.117 10.257 1.00 71.20 H new ATOM 0 HE22 GLN B 21 31.445 16.374 10.296 1.00 71.20 H new ATOM 1889 N GLN B 22 25.998 16.701 7.606 1.00 33.40 N ATOM 1890 CA GLN B 22 24.973 16.319 8.571 1.00 53.02 C ATOM 1891 C GLN B 22 23.710 15.839 7.865 1.00 53.44 C ATOM 1892 O GLN B 22 23.239 14.726 8.100 1.00 72.23 O ATOM 1893 CB GLN B 22 24.642 17.498 9.488 1.00 4.03 C ATOM 1894 CG GLN B 22 24.615 17.132 10.964 1.00 5.22 C ATOM 1895 CD GLN B 22 24.873 18.324 11.865 1.00 40.14 C ATOM 1896 OE1 GLN B 22 25.853 19.049 11.690 1.00 24.31 O ATOM 1897 NE2 GLN B 22 23.991 18.534 12.835 1.00 70.34 N ATOM 0 H GLN B 22 26.213 17.698 7.591 1.00 33.40 H new ATOM 0 HA GLN B 22 25.364 15.498 9.172 1.00 53.02 H new ATOM 0 HB2 GLN B 22 25.377 18.287 9.331 1.00 4.03 H new ATOM 0 HB3 GLN B 22 23.672 17.906 9.206 1.00 4.03 H new ATOM 0 HG2 GLN B 22 23.645 16.699 11.209 1.00 5.22 H new ATOM 0 HG3 GLN B 22 25.365 16.365 11.158 1.00 5.22 H new ATOM 0 HE21 GLN B 22 23.193 17.908 12.943 1.00 70.34 H new ATOM 0 HE22 GLN B 22 24.111 19.322 13.472 1.00 70.34 H new ATOM 1906 N LEU B 23 23.167 16.686 6.996 1.00 15.24 N ATOM 1907 CA LEU B 23 21.957 16.348 6.254 1.00 60.42 C ATOM 1908 C LEU B 23 22.215 15.198 5.286 1.00 74.31 C ATOM 1909 O LEU B 23 21.349 14.352 5.066 1.00 34.01 O ATOM 1910 CB LEU B 23 21.447 17.570 5.488 1.00 62.13 C ATOM 1911 CG LEU B 23 20.333 17.309 4.474 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.175 18.271 4.694 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.866 17.430 3.053 1.00 12.23 C ATOM 0 H LEU B 23 23.545 17.610 6.788 1.00 15.24 H new ATOM 0 HA LEU B 23 21.198 16.032 6.970 1.00 60.42 H new ATOM 0 HB2 LEU B 23 21.089 18.303 6.210 1.00 62.13 H new ATOM 0 HB3 LEU B 23 22.289 18.023 4.964 1.00 62.13 H new ATOM 0 HG LEU B 23 19.967 16.292 4.619 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.392 18.070 3.963 1.00 33.53 H new ATOM 0 HD12 LEU B 23 18.776 18.137 5.700 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.526 19.296 4.577 1.00 33.53 H new ATOM 0 HD21 LEU B 23 20.059 17.241 2.345 1.00 12.23 H new ATOM 0 HD22 LEU B 23 21.259 18.435 2.896 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.662 16.701 2.900 1.00 12.23 H new ATOM 1925 N ALA B 24 23.413 15.173 4.710 1.00 31.24 N ATOM 1926 CA ALA B 24 23.787 14.125 3.769 1.00 75.43 C ATOM 1927 C ALA B 24 23.598 12.742 4.383 1.00 63.14 C ATOM 1928 O ALA B 24 23.435 11.752 3.669 1.00 31.23 O ATOM 1929 CB ALA B 24 25.228 14.312 3.317 1.00 65.45 C ATOM 0 H ALA B 24 24.141 15.867 4.879 1.00 31.24 H new ATOM 0 HA ALA B 24 23.132 14.200 2.901 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.494 13.522 2.614 1.00 65.45 H new ATOM 0 HB2 ALA B 24 25.334 15.282 2.830 1.00 65.45 H new ATOM 0 HB3 ALA B 24 25.890 14.266 4.182 1.00 65.45 H new ATOM 1935 N ASP B 25 23.622 12.681 5.710 1.00 53.33 N ATOM 1936 CA ASP B 25 23.453 11.419 6.421 1.00 63.20 C ATOM 1937 C ASP B 25 21.996 11.212 6.820 1.00 41.34 C ATOM 1938 O ASP B 25 21.541 10.078 6.987 1.00 55.50 O ATOM 1939 CB ASP B 25 24.345 11.385 7.663 1.00 35.03 C ATOM 1940 CG ASP B 25 25.058 10.058 7.827 1.00 31.34 C ATOM 1941 OD1 ASP B 25 26.102 9.860 7.171 1.00 43.25 O ATOM 1942 OD2 ASP B 25 24.572 9.216 8.611 1.00 75.51 O ATOM 0 H ASP B 25 23.757 13.491 6.315 1.00 53.33 H new ATOM 0 HA ASP B 25 23.746 10.611 5.751 1.00 63.20 H new ATOM 0 HB2 ASP B 25 25.083 12.185 7.599 1.00 35.03 H new ATOM 0 HB3 ASP B 25 23.739 11.580 8.548 1.00 35.03 H new ATOM 1947 N LEU B 26 21.266 12.312 6.973 1.00 71.41 N ATOM 1948 CA LEU B 26 19.860 12.251 7.355 1.00 64.24 C ATOM 1949 C LEU B 26 19.000 11.781 6.186 1.00 43.13 C ATOM 1950 O LEU B 26 17.953 11.161 6.381 1.00 10.22 O ATOM 1951 CB LEU B 26 19.382 13.622 7.835 1.00 4.31 C ATOM 1952 CG LEU B 26 19.427 13.856 9.346 1.00 10.30 C ATOM 1953 CD1 LEU B 26 18.226 13.212 10.022 1.00 61.54 C ATOM 1954 CD2 LEU B 26 20.724 13.316 9.931 1.00 62.25 C ATOM 0 H LEU B 26 21.625 13.257 6.838 1.00 71.41 H new ATOM 0 HA LEU B 26 19.760 11.533 8.169 1.00 64.24 H new ATOM 0 HB2 LEU B 26 19.989 14.387 7.351 1.00 4.31 H new ATOM 0 HB3 LEU B 26 18.356 13.767 7.495 1.00 4.31 H new ATOM 0 HG LEU B 26 19.389 14.930 9.529 1.00 10.30 H new ATOM 0 HD11 LEU B 26 18.275 13.389 11.096 1.00 61.54 H new ATOM 0 HD12 LEU B 26 17.309 13.646 9.624 1.00 61.54 H new ATOM 0 HD13 LEU B 26 18.233 12.139 9.830 1.00 61.54 H new ATOM 0 HD21 LEU B 26 20.739 13.491 11.007 1.00 62.25 H new ATOM 0 HD22 LEU B 26 20.793 12.246 9.737 1.00 62.25 H new ATOM 0 HD23 LEU B 26 21.571 13.824 9.469 1.00 62.25 H new ATOM 1966 N THR B 27 19.447 12.078 4.970 1.00 72.41 N ATOM 1967 CA THR B 27 18.719 11.685 3.770 1.00 53.05 C ATOM 1968 C THR B 27 19.514 10.673 2.952 1.00 51.22 C ATOM 1969 O THR B 27 18.995 10.082 2.006 1.00 32.24 O ATOM 1970 CB THR B 27 18.397 12.904 2.885 1.00 52.21 C ATOM 1971 OG1 THR B 27 18.063 12.473 1.561 1.00 2.43 O ATOM 1972 CG2 THR B 27 19.577 13.861 2.830 1.00 64.34 C ATOM 0 H THR B 27 20.311 12.590 4.790 1.00 72.41 H new ATOM 0 HA THR B 27 17.786 11.228 4.101 1.00 53.05 H new ATOM 0 HB THR B 27 17.547 13.427 3.322 1.00 52.21 H new ATOM 0 HG1 THR B 27 17.959 11.499 1.551 1.00 2.43 H new ATOM 0 HG21 THR B 27 19.325 14.713 2.199 1.00 64.34 H new ATOM 0 HG22 THR B 27 19.809 14.210 3.836 1.00 64.34 H new ATOM 0 HG23 THR B 27 20.444 13.346 2.415 1.00 64.34 H new ATOM 1980 N GLY B 28 20.775 10.478 3.324 1.00 31.12 N ATOM 1981 CA GLY B 28 21.620 9.535 2.613 1.00 0.51 C ATOM 1982 C GLY B 28 22.110 10.082 1.287 1.00 21.43 C ATOM 1983 O GLY B 28 22.793 9.386 0.535 1.00 31.15 O ATOM 0 H GLY B 28 21.227 10.955 4.104 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.477 9.278 3.236 1.00 0.51 H new ATOM 0 HA3 GLY B 28 21.065 8.613 2.440 1.00 0.51 H new ATOM 1987 N VAL B 29 21.761 11.331 0.998 1.00 41.33 N ATOM 1988 CA VAL B 29 22.169 11.971 -0.247 1.00 64.40 C ATOM 1989 C VAL B 29 23.685 12.119 -0.317 1.00 1.32 C ATOM 1990 O VAL B 29 24.368 12.268 0.697 1.00 12.41 O ATOM 1991 CB VAL B 29 21.522 13.360 -0.404 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.590 14.431 -0.568 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.560 13.369 -1.581 1.00 55.14 C ATOM 0 H VAL B 29 21.196 11.920 1.609 1.00 41.33 H new ATOM 0 HA VAL B 29 21.831 11.327 -1.059 1.00 64.40 H new ATOM 0 HB VAL B 29 20.955 13.582 0.500 1.00 61.44 H new ATOM 0 HG11 VAL B 29 22.114 15.406 -0.678 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.235 14.439 0.310 1.00 50.43 H new ATOM 0 HG13 VAL B 29 23.187 14.217 -1.455 1.00 50.43 H new ATOM 0 HG21 VAL B 29 20.112 14.358 -1.677 1.00 55.14 H new ATOM 0 HG22 VAL B 29 21.101 13.125 -2.495 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.776 12.630 -1.416 1.00 55.14 H new ATOM 2003 N PRO B 30 24.228 12.075 -1.543 1.00 64.31 N ATOM 2004 CA PRO B 30 25.670 12.204 -1.776 1.00 44.21 C ATOM 2005 C PRO B 30 26.180 13.612 -1.493 1.00 55.44 C ATOM 2006 O PRO B 30 25.635 14.594 -1.999 1.00 52.10 O ATOM 2007 CB PRO B 30 25.820 11.870 -3.262 1.00 72.05 C ATOM 2008 CG PRO B 30 24.496 12.198 -3.860 1.00 25.14 C ATOM 2009 CD PRO B 30 23.475 11.900 -2.797 1.00 2.43 C ATOM 0 HA PRO B 30 26.248 11.555 -1.118 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.617 12.455 -3.721 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.071 10.819 -3.408 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.452 13.245 -4.160 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.313 11.602 -4.754 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.625 12.580 -2.854 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.080 10.888 -2.891 1.00 2.43 H new ATOM 2017 N TYR B 31 27.227 13.705 -0.681 1.00 55.04 N ATOM 2018 CA TYR B 31 27.809 14.995 -0.329 1.00 73.24 C ATOM 2019 C TYR B 31 28.461 15.648 -1.543 1.00 50.10 C ATOM 2020 O TYR B 31 28.424 16.868 -1.702 1.00 14.12 O ATOM 2021 CB TYR B 31 28.842 14.824 0.788 1.00 71.51 C ATOM 2022 CG TYR B 31 29.544 16.109 1.164 1.00 71.30 C ATOM 2023 CD1 TYR B 31 30.677 16.531 0.480 1.00 4.21 C ATOM 2024 CD2 TYR B 31 29.074 16.901 2.206 1.00 11.35 C ATOM 2025 CE1 TYR B 31 31.322 17.704 0.821 1.00 23.24 C ATOM 2026 CE2 TYR B 31 29.712 18.075 2.553 1.00 75.30 C ATOM 2027 CZ TYR B 31 30.836 18.472 1.858 1.00 13.24 C ATOM 2028 OH TYR B 31 31.475 19.642 2.201 1.00 2.20 O ATOM 0 H TYR B 31 27.690 12.903 -0.254 1.00 55.04 H new ATOM 0 HA TYR B 31 27.006 15.643 0.022 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.347 14.418 1.670 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.586 14.091 0.475 1.00 71.51 H new ATOM 0 HD1 TYR B 31 31.060 15.932 -0.333 1.00 4.21 H new ATOM 0 HD2 TYR B 31 28.195 16.592 2.753 1.00 11.35 H new ATOM 0 HE1 TYR B 31 32.202 18.018 0.279 1.00 23.24 H new ATOM 0 HE2 TYR B 31 29.333 18.679 3.364 1.00 75.30 H new ATOM 0 HH TYR B 31 31.005 20.064 2.951 1.00 2.20 H new ATOM 2038 N GLY B 32 29.059 14.825 -2.401 1.00 45.13 N ATOM 2039 CA GLY B 32 29.711 15.339 -3.591 1.00 74.01 C ATOM 2040 C GLY B 32 28.753 16.083 -4.500 1.00 73.43 C ATOM 2041 O GLY B 32 29.157 16.989 -5.232 1.00 1.33 O ATOM 0 H GLY B 32 29.103 13.812 -2.292 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.522 16.006 -3.298 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.161 14.513 -4.141 1.00 74.01 H new ATOM 2045 N THR B 33 27.481 15.701 -4.457 1.00 10.04 N ATOM 2046 CA THR B 33 26.463 16.336 -5.286 1.00 11.04 C ATOM 2047 C THR B 33 25.646 17.340 -4.481 1.00 2.51 C ATOM 2048 O THR B 33 25.202 18.361 -5.008 1.00 23.25 O ATOM 2049 CB THR B 33 25.513 15.294 -5.905 1.00 3.23 C ATOM 2050 OG1 THR B 33 26.211 14.065 -6.127 1.00 14.15 O ATOM 2051 CG2 THR B 33 24.936 15.802 -7.218 1.00 42.22 C ATOM 0 H THR B 33 27.130 14.955 -3.857 1.00 10.04 H new ATOM 0 HA THR B 33 26.987 16.858 -6.086 1.00 11.04 H new ATOM 0 HB THR B 33 24.693 15.123 -5.208 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.599 13.408 -6.519 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.268 15.050 -7.637 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.380 16.722 -7.039 1.00 42.22 H new ATOM 0 HG23 THR B 33 25.747 15.999 -7.920 1.00 42.22 H new ATOM 2059 N LEU B 34 25.450 17.043 -3.201 1.00 5.42 N ATOM 2060 CA LEU B 34 24.685 17.920 -2.320 1.00 11.23 C ATOM 2061 C LEU B 34 25.204 19.353 -2.395 1.00 53.41 C ATOM 2062 O LEU B 34 24.424 20.303 -2.466 1.00 25.43 O ATOM 2063 CB LEU B 34 24.754 17.415 -0.879 1.00 44.11 C ATOM 2064 CG LEU B 34 24.101 18.308 0.177 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.620 17.990 0.303 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.800 18.143 1.520 1.00 54.42 C ATOM 0 H LEU B 34 25.810 16.202 -2.750 1.00 5.42 H new ATOM 0 HA LEU B 34 23.647 17.911 -2.651 1.00 11.23 H new ATOM 0 HB2 LEU B 34 24.284 16.433 -0.836 1.00 44.11 H new ATOM 0 HB3 LEU B 34 25.802 17.278 -0.613 1.00 44.11 H new ATOM 0 HG LEU B 34 24.203 19.346 -0.139 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.172 18.635 1.059 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.129 18.159 -0.655 1.00 30.33 H new ATOM 0 HD13 LEU B 34 22.495 16.948 0.596 1.00 30.33 H new ATOM 0 HD21 LEU B 34 24.323 18.786 2.260 1.00 54.42 H new ATOM 0 HD22 LEU B 34 24.729 17.104 1.842 1.00 54.42 H new ATOM 0 HD23 LEU B 34 25.849 18.421 1.421 1.00 54.42 H new ATOM 2078 N SER B 35 26.525 19.500 -2.379 1.00 61.31 N ATOM 2079 CA SER B 35 27.148 20.816 -2.444 1.00 34.14 C ATOM 2080 C SER B 35 26.600 21.620 -3.619 1.00 4.52 C ATOM 2081 O SER B 35 26.480 22.844 -3.546 1.00 30.41 O ATOM 2082 CB SER B 35 28.666 20.680 -2.569 1.00 14.21 C ATOM 2083 OG SER B 35 29.251 21.884 -3.034 1.00 62.41 O ATOM 0 H SER B 35 27.184 18.724 -2.322 1.00 61.31 H new ATOM 0 HA SER B 35 26.913 21.347 -1.522 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.091 20.416 -1.601 1.00 14.21 H new ATOM 0 HB3 SER B 35 28.906 19.867 -3.255 1.00 14.21 H new ATOM 0 HG SER B 35 30.222 21.770 -3.103 1.00 62.41 H new ATOM 2089 N TYR B 36 26.267 20.924 -4.700 1.00 41.34 N ATOM 2090 CA TYR B 36 25.733 21.572 -5.893 1.00 34.30 C ATOM 2091 C TYR B 36 24.215 21.692 -5.814 1.00 45.21 C ATOM 2092 O TYR B 36 23.616 22.567 -6.440 1.00 45.01 O ATOM 2093 CB TYR B 36 26.130 20.789 -7.145 1.00 40.31 C ATOM 2094 CG TYR B 36 27.580 20.361 -7.157 1.00 34.30 C ATOM 2095 CD1 TYR B 36 28.586 21.233 -6.757 1.00 32.43 C ATOM 2096 CD2 TYR B 36 27.946 19.086 -7.570 1.00 45.14 C ATOM 2097 CE1 TYR B 36 29.912 20.847 -6.768 1.00 62.53 C ATOM 2098 CE2 TYR B 36 29.270 18.690 -7.583 1.00 64.54 C ATOM 2099 CZ TYR B 36 30.249 19.575 -7.180 1.00 62.20 C ATOM 2100 OH TYR B 36 31.568 19.185 -7.193 1.00 51.03 O ATOM 0 H TYR B 36 26.357 19.911 -4.775 1.00 41.34 H new ATOM 0 HA TYR B 36 26.156 22.575 -5.951 1.00 34.30 H new ATOM 0 HB2 TYR B 36 25.498 19.904 -7.226 1.00 40.31 H new ATOM 0 HB3 TYR B 36 25.934 21.402 -8.024 1.00 40.31 H new ATOM 0 HD1 TYR B 36 28.326 22.230 -6.432 1.00 32.43 H new ATOM 0 HD2 TYR B 36 27.182 18.392 -7.887 1.00 45.14 H new ATOM 0 HE1 TYR B 36 30.681 21.538 -6.456 1.00 62.53 H new ATOM 0 HE2 TYR B 36 29.537 17.695 -7.906 1.00 64.54 H new ATOM 0 HH TYR B 36 31.632 18.259 -7.508 1.00 51.03 H new ATOM 2110 N TYR B 37 23.598 20.806 -5.040 1.00 23.03 N ATOM 2111 CA TYR B 37 22.149 20.810 -4.879 1.00 71.53 C ATOM 2112 C TYR B 37 21.672 22.122 -4.262 1.00 1.34 C ATOM 2113 O TYR B 37 21.009 22.923 -4.919 1.00 12.02 O ATOM 2114 CB TYR B 37 21.708 19.634 -4.006 1.00 44.25 C ATOM 2115 CG TYR B 37 21.491 18.353 -4.780 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.191 18.101 -5.954 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.589 17.394 -4.336 1.00 15.42 C ATOM 2118 CE1 TYR B 37 21.996 16.933 -6.665 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.389 16.223 -5.040 1.00 0.41 C ATOM 2120 CZ TYR B 37 21.094 15.997 -6.203 1.00 71.12 C ATOM 2121 OH TYR B 37 20.898 14.830 -6.907 1.00 2.50 O ATOM 0 H TYR B 37 24.079 20.076 -4.514 1.00 23.03 H new ATOM 0 HA TYR B 37 21.700 20.709 -5.867 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.461 19.461 -3.237 1.00 44.25 H new ATOM 0 HB3 TYR B 37 20.784 19.900 -3.493 1.00 44.25 H new ATOM 0 HD1 TYR B 37 22.900 18.831 -6.317 1.00 52.14 H new ATOM 0 HD2 TYR B 37 20.035 17.567 -3.425 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.546 16.754 -7.577 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.684 15.488 -4.681 1.00 0.41 H new ATOM 0 HH TYR B 37 20.232 14.278 -6.447 1.00 2.50 H new ATOM 2131 N GLU B 38 22.017 22.333 -2.996 1.00 43.22 N ATOM 2132 CA GLU B 38 21.625 23.547 -2.290 1.00 44.31 C ATOM 2133 C GLU B 38 22.196 24.785 -2.976 1.00 24.45 C ATOM 2134 O GLU B 38 21.717 25.898 -2.771 1.00 42.22 O ATOM 2135 CB GLU B 38 22.097 23.493 -0.835 1.00 11.21 C ATOM 2136 CG GLU B 38 21.853 22.151 -0.166 1.00 54.50 C ATOM 2137 CD GLU B 38 21.152 22.286 1.172 1.00 35.11 C ATOM 2138 OE1 GLU B 38 21.247 23.368 1.787 1.00 70.20 O ATOM 2139 OE2 GLU B 38 20.506 21.307 1.603 1.00 63.32 O ATOM 0 H GLU B 38 22.567 21.679 -2.438 1.00 43.22 H new ATOM 0 HA GLU B 38 20.537 23.612 -2.309 1.00 44.31 H new ATOM 0 HB2 GLU B 38 23.163 23.719 -0.799 1.00 11.21 H new ATOM 0 HB3 GLU B 38 21.587 24.271 -0.267 1.00 11.21 H new ATOM 0 HG2 GLU B 38 21.252 21.524 -0.825 1.00 54.50 H new ATOM 0 HG3 GLU B 38 22.806 21.642 -0.023 1.00 54.50 H new ATOM 2146 N SER B 39 23.225 24.578 -3.792 1.00 53.34 N ATOM 2147 CA SER B 39 23.867 25.677 -4.506 1.00 70.11 C ATOM 2148 C SER B 39 23.061 26.065 -5.743 1.00 24.54 C ATOM 2149 O SER B 39 23.278 27.124 -6.331 1.00 41.42 O ATOM 2150 CB SER B 39 25.290 25.287 -4.912 1.00 1.22 C ATOM 2151 OG SER B 39 25.828 26.218 -5.835 1.00 11.15 O ATOM 0 H SER B 39 23.632 23.661 -3.975 1.00 53.34 H new ATOM 0 HA SER B 39 23.910 26.537 -3.837 1.00 70.11 H new ATOM 0 HB2 SER B 39 25.924 25.239 -4.027 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.286 24.291 -5.355 1.00 1.22 H new ATOM 0 HG SER B 39 26.738 25.949 -6.078 1.00 11.15 H new ATOM 2157 N GLY B 40 22.131 25.198 -6.130 1.00 41.23 N ATOM 2158 CA GLY B 40 21.306 25.467 -7.294 1.00 73.32 C ATOM 2159 C GLY B 40 22.058 25.268 -8.595 1.00 71.50 C ATOM 2160 O GLY B 40 21.636 25.755 -9.645 1.00 64.32 O ATOM 0 H GLY B 40 21.934 24.315 -5.659 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.435 24.812 -7.277 1.00 73.32 H new ATOM 0 HA3 GLY B 40 20.936 26.491 -7.245 1.00 73.32 H new ATOM 2164 N ARG B 41 23.175 24.551 -8.528 1.00 73.33 N ATOM 2165 CA ARG B 41 23.989 24.291 -9.709 1.00 73.31 C ATOM 2166 C ARG B 41 23.203 23.492 -10.745 1.00 30.24 C ATOM 2167 O ARG B 41 23.455 23.596 -11.945 1.00 23.15 O ATOM 2168 CB ARG B 41 25.260 23.534 -9.323 1.00 2.45 C ATOM 2169 CG ARG B 41 26.472 23.913 -10.158 1.00 71.20 C ATOM 2170 CD ARG B 41 27.111 25.200 -9.661 1.00 3.45 C ATOM 2171 NE ARG B 41 28.497 25.329 -10.103 1.00 73.34 N ATOM 2172 CZ ARG B 41 29.319 26.280 -9.674 1.00 44.45 C ATOM 2173 NH1 ARG B 41 28.897 27.179 -8.795 1.00 73.10 N ATOM 2174 NH2 ARG B 41 30.567 26.332 -10.123 1.00 72.43 N ATOM 0 H ARG B 41 23.537 24.140 -7.668 1.00 73.33 H new ATOM 0 HA ARG B 41 24.265 25.250 -10.147 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.480 23.723 -8.272 1.00 2.45 H new ATOM 0 HB3 ARG B 41 25.080 22.464 -9.424 1.00 2.45 H new ATOM 0 HG2 ARG B 41 27.204 23.106 -10.126 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.175 24.032 -11.200 1.00 71.20 H new ATOM 0 HD2 ARG B 41 26.535 26.053 -10.020 1.00 3.45 H new ATOM 0 HD3 ARG B 41 27.074 25.226 -8.572 1.00 3.45 H new ATOM 0 HE ARG B 41 28.853 24.652 -10.778 1.00 73.34 H new ATOM 0 HH11 ARG B 41 27.939 27.141 -8.447 1.00 73.10 H new ATOM 0 HH12 ARG B 41 29.530 27.908 -8.467 1.00 73.10 H new ATOM 0 HH21 ARG B 41 30.895 25.641 -10.798 1.00 72.43 H new ATOM 0 HH22 ARG B 41 31.198 27.063 -9.793 1.00 72.43 H new ATOM 2188 N SER B 42 22.251 22.695 -10.272 1.00 53.33 N ATOM 2189 CA SER B 42 21.431 21.875 -11.157 1.00 23.23 C ATOM 2190 C SER B 42 20.158 21.419 -10.450 1.00 3.44 C ATOM 2191 O SER B 42 20.210 20.825 -9.372 1.00 55.33 O ATOM 2192 CB SER B 42 22.224 20.658 -11.639 1.00 33.02 C ATOM 2193 OG SER B 42 22.311 20.634 -13.053 1.00 14.24 O ATOM 0 H SER B 42 22.028 22.599 -9.281 1.00 53.33 H new ATOM 0 HA SER B 42 21.150 22.482 -12.018 1.00 23.23 H new ATOM 0 HB2 SER B 42 23.226 20.680 -11.210 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.745 19.745 -11.285 1.00 33.02 H new ATOM 0 HG SER B 42 22.824 19.848 -13.336 1.00 14.24 H new ATOM 2199 N THR B 43 19.014 21.700 -11.066 1.00 54.02 N ATOM 2200 CA THR B 43 17.726 21.322 -10.497 1.00 44.13 C ATOM 2201 C THR B 43 17.662 19.821 -10.233 1.00 62.42 C ATOM 2202 O THR B 43 17.633 19.005 -11.156 1.00 42.45 O ATOM 2203 CB THR B 43 16.563 21.718 -11.425 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.045 22.551 -12.486 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.479 22.452 -10.651 1.00 51.13 C ATOM 0 H THR B 43 18.953 22.188 -11.959 1.00 54.02 H new ATOM 0 HA THR B 43 17.627 21.860 -9.554 1.00 44.13 H new ATOM 0 HB THR B 43 16.135 20.807 -11.844 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.300 22.797 -13.073 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.668 22.722 -11.328 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.094 21.806 -9.862 1.00 51.13 H new ATOM 0 HG23 THR B 43 15.897 23.356 -10.208 1.00 51.13 H new ATOM 2213 N PRO B 44 17.639 19.446 -8.946 1.00 34.10 N ATOM 2214 CA PRO B 44 17.576 18.041 -8.531 1.00 64.22 C ATOM 2215 C PRO B 44 16.226 17.404 -8.844 1.00 65.12 C ATOM 2216 O PRO B 44 15.252 18.085 -9.167 1.00 43.23 O ATOM 2217 CB PRO B 44 17.801 18.107 -7.019 1.00 42.35 C ATOM 2218 CG PRO B 44 17.350 19.472 -6.628 1.00 43.14 C ATOM 2219 CD PRO B 44 17.672 20.364 -7.795 1.00 4.14 C ATOM 0 HA PRO B 44 18.307 17.427 -9.057 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.230 17.337 -6.500 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.850 17.949 -6.768 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.282 19.483 -6.411 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.862 19.809 -5.726 1.00 43.14 H new ATOM 0 HD2 PRO B 44 16.942 21.167 -7.900 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.649 20.834 -7.684 1.00 4.14 H new ATOM 2227 N PRO B 45 16.164 16.068 -8.744 1.00 22.42 N ATOM 2228 CA PRO B 45 14.937 15.311 -9.010 1.00 43.51 C ATOM 2229 C PRO B 45 13.872 15.538 -7.943 1.00 62.05 C ATOM 2230 O PRO B 45 14.084 16.288 -6.989 1.00 14.40 O ATOM 2231 CB PRO B 45 15.409 13.855 -8.995 1.00 65.34 C ATOM 2232 CG PRO B 45 16.628 13.860 -8.138 1.00 42.52 C ATOM 2233 CD PRO B 45 17.286 15.194 -8.364 1.00 44.51 C ATOM 0 HA PRO B 45 14.467 15.612 -9.947 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.643 13.195 -8.589 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.634 13.502 -10.001 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.368 13.726 -7.088 1.00 42.52 H new ATOM 0 HG3 PRO B 45 17.298 13.043 -8.407 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.788 15.552 -7.465 1.00 44.51 H new ATOM 0 HD3 PRO B 45 18.039 15.142 -9.150 1.00 44.51 H new ATOM 2241 N THR B 46 12.727 14.885 -8.107 1.00 11.44 N ATOM 2242 CA THR B 46 11.629 15.016 -7.158 1.00 63.42 C ATOM 2243 C THR B 46 11.694 13.931 -6.088 1.00 5.13 C ATOM 2244 O THR B 46 11.176 14.102 -4.985 1.00 4.01 O ATOM 2245 CB THR B 46 10.262 14.941 -7.865 1.00 52.33 C ATOM 2246 OG1 THR B 46 10.218 15.879 -8.946 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.131 15.229 -6.890 1.00 3.02 C ATOM 0 H THR B 46 12.535 14.259 -8.889 1.00 11.44 H new ATOM 0 HA THR B 46 11.734 15.994 -6.688 1.00 63.42 H new ATOM 0 HB THR B 46 10.135 13.931 -8.255 1.00 52.33 H new ATOM 0 HG1 THR B 46 9.296 16.182 -9.079 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.176 15.170 -7.413 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.149 14.495 -6.084 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.256 16.228 -6.473 1.00 3.02 H new ATOM 2255 N ASP B 47 12.335 12.817 -6.422 1.00 1.43 N ATOM 2256 CA ASP B 47 12.470 11.704 -5.488 1.00 54.30 C ATOM 2257 C ASP B 47 13.450 12.048 -4.371 1.00 63.03 C ATOM 2258 O ASP B 47 13.311 11.578 -3.241 1.00 32.00 O ATOM 2259 CB ASP B 47 12.936 10.447 -6.223 1.00 61.00 C ATOM 2260 CG ASP B 47 14.442 10.400 -6.394 1.00 74.43 C ATOM 2261 OD1 ASP B 47 14.951 11.037 -7.340 1.00 53.32 O ATOM 2262 OD2 ASP B 47 15.111 9.727 -5.583 1.00 4.34 O ATOM 0 H ASP B 47 12.769 12.660 -7.331 1.00 1.43 H new ATOM 0 HA ASP B 47 11.493 11.514 -5.044 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.608 9.565 -5.672 1.00 61.00 H new ATOM 0 HB3 ASP B 47 12.461 10.406 -7.203 1.00 61.00 H new ATOM 2267 N VAL B 48 14.444 12.871 -4.695 1.00 74.22 N ATOM 2268 CA VAL B 48 15.448 13.278 -3.719 1.00 22.51 C ATOM 2269 C VAL B 48 15.004 14.522 -2.960 1.00 4.50 C ATOM 2270 O VAL B 48 15.101 14.583 -1.734 1.00 11.21 O ATOM 2271 CB VAL B 48 16.804 13.558 -4.394 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.807 14.085 -3.379 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.331 12.303 -5.073 1.00 54.21 C ATOM 0 H VAL B 48 14.575 13.268 -5.625 1.00 74.22 H new ATOM 0 HA VAL B 48 15.563 12.451 -3.018 1.00 22.51 H new ATOM 0 HB VAL B 48 16.659 14.323 -5.157 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.759 14.277 -3.874 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.431 15.011 -2.943 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.950 13.345 -2.591 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.290 12.520 -5.544 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.461 11.515 -4.331 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.620 11.974 -5.831 1.00 54.21 H new ATOM 2283 N MET B 49 14.515 15.516 -3.696 1.00 33.43 N ATOM 2284 CA MET B 49 14.053 16.759 -3.092 1.00 40.22 C ATOM 2285 C MET B 49 13.123 16.479 -1.915 1.00 4.22 C ATOM 2286 O MET B 49 13.291 17.042 -0.833 1.00 1.31 O ATOM 2287 CB MET B 49 13.334 17.621 -4.132 1.00 44.14 C ATOM 2288 CG MET B 49 12.695 18.871 -3.548 1.00 51.34 C ATOM 2289 SD MET B 49 10.922 18.957 -3.867 1.00 51.12 S ATOM 2290 CE MET B 49 10.285 17.992 -2.499 1.00 51.15 C ATOM 0 H MET B 49 14.429 15.484 -4.712 1.00 33.43 H new ATOM 0 HA MET B 49 14.924 17.300 -2.723 1.00 40.22 H new ATOM 0 HB2 MET B 49 14.046 17.913 -4.904 1.00 44.14 H new ATOM 0 HB3 MET B 49 12.564 17.022 -4.618 1.00 44.14 H new ATOM 0 HG2 MET B 49 12.868 18.895 -2.472 1.00 51.34 H new ATOM 0 HG3 MET B 49 13.179 19.752 -3.968 1.00 51.34 H new ATOM 0 HE1 MET B 49 9.318 18.391 -2.191 1.00 51.15 H new ATOM 0 HE2 MET B 49 10.167 16.954 -2.810 1.00 51.15 H new ATOM 0 HE3 MET B 49 10.982 18.043 -1.662 1.00 51.15 H new ATOM 2300 N MET B 50 12.144 15.609 -2.134 1.00 73.41 N ATOM 2301 CA MET B 50 11.189 15.254 -1.091 1.00 53.21 C ATOM 2302 C MET B 50 11.868 14.465 0.023 1.00 3.12 C ATOM 2303 O MET B 50 11.449 14.517 1.178 1.00 20.05 O ATOM 2304 CB MET B 50 10.036 14.439 -1.680 1.00 34.20 C ATOM 2305 CG MET B 50 10.427 13.021 -2.061 1.00 34.23 C ATOM 2306 SD MET B 50 9.301 12.288 -3.263 1.00 14.43 S ATOM 2307 CE MET B 50 7.721 12.843 -2.630 1.00 65.11 C ATOM 0 H MET B 50 11.991 15.136 -3.025 1.00 73.41 H new ATOM 0 HA MET B 50 10.792 16.177 -0.668 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.222 14.401 -0.956 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.654 14.951 -2.563 1.00 34.20 H new ATOM 0 HG2 MET B 50 11.437 13.025 -2.471 1.00 34.23 H new ATOM 0 HG3 MET B 50 10.449 12.401 -1.165 1.00 34.23 H new ATOM 0 HE1 MET B 50 6.920 12.278 -3.106 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.685 12.685 -1.552 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.595 13.904 -2.846 1.00 65.11 H new ATOM 2317 N ASN B 51 12.918 13.732 -0.333 1.00 10.42 N ATOM 2318 CA ASN B 51 13.655 12.930 0.638 1.00 73.03 C ATOM 2319 C ASN B 51 14.404 13.823 1.623 1.00 51.31 C ATOM 2320 O ASN B 51 14.885 13.355 2.656 1.00 61.22 O ATOM 2321 CB ASN B 51 14.640 12.004 -0.079 1.00 41.34 C ATOM 2322 CG ASN B 51 14.092 10.600 -0.251 1.00 53.40 C ATOM 2323 OD1 ASN B 51 14.779 9.615 0.025 1.00 40.12 O ATOM 2324 ND2 ASN B 51 12.849 10.502 -0.708 1.00 25.24 N ATOM 0 H ASN B 51 13.278 13.677 -1.286 1.00 10.42 H new ATOM 0 HA ASN B 51 12.938 12.327 1.195 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.879 12.420 -1.058 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.571 11.961 0.486 1.00 41.34 H new ATOM 0 HD21 ASN B 51 12.426 9.584 -0.843 1.00 25.24 H new ATOM 0 HD22 ASN B 51 12.317 11.345 -0.924 1.00 25.24 H new ATOM 2331 N ILE B 52 14.498 15.107 1.297 1.00 15.14 N ATOM 2332 CA ILE B 52 15.186 16.064 2.154 1.00 71.33 C ATOM 2333 C ILE B 52 14.208 16.771 3.086 1.00 63.34 C ATOM 2334 O ILE B 52 14.547 17.109 4.221 1.00 22.32 O ATOM 2335 CB ILE B 52 15.943 17.119 1.326 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.789 16.441 0.246 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.816 17.976 2.231 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.471 15.176 0.719 1.00 3.43 C ATOM 0 H ILE B 52 14.106 15.509 0.445 1.00 15.14 H new ATOM 0 HA ILE B 52 15.903 15.497 2.747 1.00 71.33 H new ATOM 0 HB ILE B 52 15.215 17.767 0.837 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.153 16.204 -0.607 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.546 17.143 -0.105 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.345 18.717 1.631 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.191 18.483 2.966 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.539 17.343 2.745 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.053 14.749 -0.098 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.133 15.410 1.553 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.719 14.457 1.043 1.00 3.43 H new ATOM 2350 N LEU B 53 12.991 16.991 2.600 1.00 63.51 N ATOM 2351 CA LEU B 53 11.960 17.656 3.389 1.00 30.02 C ATOM 2352 C LEU B 53 11.163 16.645 4.208 1.00 3.01 C ATOM 2353 O LEU B 53 10.592 16.984 5.244 1.00 32.54 O ATOM 2354 CB LEU B 53 11.020 18.444 2.475 1.00 71.32 C ATOM 2355 CG LEU B 53 11.148 19.967 2.533 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.607 20.384 2.437 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.332 20.614 1.423 1.00 70.41 C ATOM 0 H LEU B 53 12.694 16.718 1.663 1.00 63.51 H new ATOM 0 HA LEU B 53 12.451 18.345 4.076 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.192 18.124 1.447 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.993 18.176 2.725 1.00 71.32 H new ATOM 0 HG LEU B 53 10.756 20.309 3.491 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.678 21.471 2.480 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.165 19.951 3.267 1.00 64.42 H new ATOM 0 HD13 LEU B 53 13.025 20.030 1.495 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.435 21.698 1.480 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.693 20.265 0.455 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.282 20.343 1.538 1.00 70.41 H new ATOM 2369 N GLN B 54 11.131 15.403 3.735 1.00 45.30 N ATOM 2370 CA GLN B 54 10.405 14.343 4.425 1.00 4.44 C ATOM 2371 C GLN B 54 10.982 14.104 5.816 1.00 73.55 C ATOM 2372 O GLN B 54 10.322 13.535 6.685 1.00 22.03 O ATOM 2373 CB GLN B 54 10.455 13.049 3.610 1.00 31.43 C ATOM 2374 CG GLN B 54 11.829 12.399 3.582 1.00 54.24 C ATOM 2375 CD GLN B 54 11.806 11.013 2.970 1.00 53.44 C ATOM 2376 OE1 GLN B 54 12.415 10.080 3.494 1.00 62.11 O ATOM 2377 NE2 GLN B 54 11.101 10.870 1.853 1.00 32.34 N ATOM 0 H GLN B 54 11.598 15.106 2.878 1.00 45.30 H new ATOM 0 HA GLN B 54 9.367 14.658 4.532 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.736 12.341 4.023 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.142 13.261 2.588 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.514 13.031 3.016 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.218 12.337 4.598 1.00 54.24 H new ATOM 0 HE21 GLN B 54 10.611 11.670 1.453 1.00 32.34 H new ATOM 0 HE22 GLN B 54 11.049 9.960 1.396 1.00 32.34 H new ATOM 2386 N THR B 55 12.221 14.542 6.021 1.00 55.12 N ATOM 2387 CA THR B 55 12.888 14.374 7.306 1.00 13.51 C ATOM 2388 C THR B 55 12.088 15.023 8.430 1.00 42.11 C ATOM 2389 O THR B 55 11.348 15.984 8.223 1.00 72.25 O ATOM 2390 CB THR B 55 14.305 14.978 7.286 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.280 16.267 6.660 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.271 14.067 6.544 1.00 63.21 C ATOM 0 H THR B 55 12.782 15.016 5.313 1.00 55.12 H new ATOM 0 HA THR B 55 12.960 13.302 7.487 1.00 13.51 H new ATOM 0 HB THR B 55 14.646 15.082 8.316 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.456 16.168 5.701 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.265 14.514 6.543 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.310 13.097 7.040 1.00 63.21 H new ATOM 0 HG23 THR B 55 14.931 13.936 5.517 1.00 63.21 H new ATOM 2400 N PRO B 56 12.237 14.487 9.649 1.00 31.25 N ATOM 2401 CA PRO B 56 11.538 14.999 10.831 1.00 41.22 C ATOM 2402 C PRO B 56 12.052 16.367 11.263 1.00 3.50 C ATOM 2403 O PRO B 56 11.316 17.159 11.849 1.00 61.54 O ATOM 2404 CB PRO B 56 11.841 13.950 11.905 1.00 43.23 C ATOM 2405 CG PRO B 56 13.122 13.325 11.474 1.00 22.11 C ATOM 2406 CD PRO B 56 13.103 13.339 9.970 1.00 60.25 C ATOM 0 HA PRO B 56 10.474 15.143 10.644 1.00 41.22 H new ATOM 0 HB2 PRO B 56 11.936 14.408 12.890 1.00 43.23 H new ATOM 0 HB3 PRO B 56 11.043 13.211 11.972 1.00 43.23 H new ATOM 0 HG2 PRO B 56 13.977 13.881 11.859 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.207 12.307 11.854 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.104 13.463 9.557 1.00 60.25 H new ATOM 0 HD3 PRO B 56 12.704 12.409 9.565 1.00 60.25 H new ATOM 2414 N GLN B 57 13.320 16.638 10.967 1.00 42.31 N ATOM 2415 CA GLN B 57 13.932 17.911 11.325 1.00 55.32 C ATOM 2416 C GLN B 57 13.486 19.016 10.374 1.00 1.51 C ATOM 2417 O GLN B 57 13.320 20.168 10.777 1.00 23.51 O ATOM 2418 CB GLN B 57 15.457 17.791 11.308 1.00 61.00 C ATOM 2419 CG GLN B 57 16.039 17.635 9.913 1.00 72.54 C ATOM 2420 CD GLN B 57 17.240 16.711 9.882 1.00 74.05 C ATOM 2421 OE1 GLN B 57 17.354 15.850 9.009 1.00 63.42 O ATOM 2422 NE2 GLN B 57 18.147 16.887 10.837 1.00 41.13 N ATOM 0 H GLN B 57 13.942 15.993 10.480 1.00 42.31 H new ATOM 0 HA GLN B 57 13.607 18.171 12.332 1.00 55.32 H new ATOM 0 HB2 GLN B 57 15.888 18.676 11.776 1.00 61.00 H new ATOM 0 HB3 GLN B 57 15.753 16.934 11.914 1.00 61.00 H new ATOM 0 HG2 GLN B 57 15.270 17.248 9.244 1.00 72.54 H new ATOM 0 HG3 GLN B 57 16.329 18.615 9.533 1.00 72.54 H new ATOM 0 HE21 GLN B 57 18.012 17.613 11.541 1.00 41.13 H new ATOM 0 HE22 GLN B 57 18.978 16.296 10.866 1.00 41.13 H new ATOM 2431 N PHE B 58 13.295 18.658 9.108 1.00 72.25 N ATOM 2432 CA PHE B 58 12.869 19.621 8.098 1.00 73.52 C ATOM 2433 C PHE B 58 11.402 19.415 7.735 1.00 1.21 C ATOM 2434 O PHE B 58 10.939 19.868 6.687 1.00 54.13 O ATOM 2435 CB PHE B 58 13.739 19.493 6.844 1.00 21.34 C ATOM 2436 CG PHE B 58 15.179 19.855 7.075 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.540 21.156 7.385 1.00 54.32 C ATOM 2438 CD2 PHE B 58 16.171 18.893 6.982 1.00 51.33 C ATOM 2439 CE1 PHE B 58 16.863 21.491 7.597 1.00 23.24 C ATOM 2440 CE2 PHE B 58 17.497 19.221 7.193 1.00 4.43 C ATOM 2441 CZ PHE B 58 17.843 20.522 7.503 1.00 13.33 C ATOM 0 H PHE B 58 13.428 17.709 8.757 1.00 72.25 H new ATOM 0 HA PHE B 58 12.985 20.622 8.513 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.685 18.468 6.476 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.332 20.134 6.062 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.778 21.917 7.462 1.00 54.32 H new ATOM 0 HD2 PHE B 58 15.905 17.874 6.742 1.00 51.33 H new ATOM 0 HE1 PHE B 58 17.131 22.510 7.836 1.00 23.24 H new ATOM 0 HE2 PHE B 58 18.261 18.462 7.116 1.00 4.43 H new ATOM 0 HZ PHE B 58 18.878 20.781 7.672 1.00 13.33 H new ATOM 2451 N THR B 59 10.673 18.728 8.609 1.00 3.42 N ATOM 2452 CA THR B 59 9.258 18.460 8.381 1.00 32.14 C ATOM 2453 C THR B 59 8.427 19.730 8.530 1.00 21.44 C ATOM 2454 O THR B 59 7.339 19.841 7.965 1.00 24.22 O ATOM 2455 CB THR B 59 8.724 17.394 9.356 1.00 53.35 C ATOM 2456 OG1 THR B 59 7.399 17.004 8.977 1.00 50.44 O ATOM 2457 CG2 THR B 59 8.717 17.920 10.782 1.00 63.52 C ATOM 0 H THR B 59 11.039 18.347 9.481 1.00 3.42 H new ATOM 0 HA THR B 59 9.167 18.087 7.361 1.00 32.14 H new ATOM 0 HB THR B 59 9.384 16.527 9.310 1.00 53.35 H new ATOM 0 HG1 THR B 59 7.067 16.325 9.601 1.00 50.44 H new ATOM 0 HG21 THR B 59 8.336 17.149 11.452 1.00 63.52 H new ATOM 0 HG22 THR B 59 9.732 18.187 11.076 1.00 63.52 H new ATOM 0 HG23 THR B 59 8.078 18.801 10.842 1.00 63.52 H new ATOM 2465 N LYS B 60 8.947 20.685 9.293 1.00 13.34 N ATOM 2466 CA LYS B 60 8.255 21.949 9.514 1.00 2.41 C ATOM 2467 C LYS B 60 8.388 22.863 8.301 1.00 33.42 C ATOM 2468 O LYS B 60 7.551 23.737 8.076 1.00 21.23 O ATOM 2469 CB LYS B 60 8.812 22.648 10.757 1.00 14.22 C ATOM 2470 CG LYS B 60 9.118 21.699 11.902 1.00 61.42 C ATOM 2471 CD LYS B 60 9.589 22.450 13.137 1.00 54.34 C ATOM 2472 CE LYS B 60 11.089 22.296 13.344 1.00 31.41 C ATOM 2473 NZ LYS B 60 11.482 20.868 13.509 1.00 31.11 N ATOM 0 H LYS B 60 9.846 20.608 9.769 1.00 13.34 H new ATOM 0 HA LYS B 60 7.198 21.733 9.669 1.00 2.41 H new ATOM 0 HB2 LYS B 60 9.722 23.182 10.486 1.00 14.22 H new ATOM 0 HB3 LYS B 60 8.094 23.394 11.097 1.00 14.22 H new ATOM 0 HG2 LYS B 60 8.227 21.120 12.145 1.00 61.42 H new ATOM 0 HG3 LYS B 60 9.885 20.989 11.592 1.00 61.42 H new ATOM 0 HD2 LYS B 60 9.341 23.507 13.038 1.00 54.34 H new ATOM 0 HD3 LYS B 60 9.059 22.079 14.014 1.00 54.34 H new ATOM 0 HE2 LYS B 60 11.619 22.723 12.492 1.00 31.41 H new ATOM 0 HE3 LYS B 60 11.394 22.861 14.225 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 12.080 20.768 14.354 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 10.629 20.283 13.617 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 12.012 20.555 12.671 1.00 31.11 H new ATOM 2487 N TYR B 61 9.444 22.655 7.522 1.00 63.31 N ATOM 2488 CA TYR B 61 9.687 23.461 6.332 1.00 12.35 C ATOM 2489 C TYR B 61 9.410 22.658 5.064 1.00 43.03 C ATOM 2490 O TYR B 61 10.317 22.379 4.281 1.00 15.42 O ATOM 2491 CB TYR B 61 11.129 23.971 6.321 1.00 51.41 C ATOM 2492 CG TYR B 61 11.698 24.207 7.702 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.355 25.340 8.432 1.00 24.22 C ATOM 2494 CD2 TYR B 61 12.579 23.299 8.277 1.00 43.25 C ATOM 2495 CE1 TYR B 61 11.873 25.560 9.693 1.00 72.43 C ATOM 2496 CE2 TYR B 61 13.101 23.511 9.539 1.00 20.34 C ATOM 2497 CZ TYR B 61 12.745 24.643 10.243 1.00 62.03 C ATOM 2498 OH TYR B 61 13.263 24.858 11.499 1.00 73.32 O ATOM 0 H TYR B 61 10.145 21.935 7.694 1.00 63.31 H new ATOM 0 HA TYR B 61 9.008 24.313 6.357 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.757 23.250 5.797 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.172 24.902 5.755 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.672 26.060 8.006 1.00 24.22 H new ATOM 0 HD2 TYR B 61 12.861 22.412 7.728 1.00 43.25 H new ATOM 0 HE1 TYR B 61 11.597 26.446 10.246 1.00 72.43 H new ATOM 0 HE2 TYR B 61 13.784 22.795 9.972 1.00 20.34 H new ATOM 0 HH TYR B 61 13.859 24.118 11.738 1.00 73.32 H new ATOM 2508 N THR B 62 8.148 22.290 4.870 1.00 34.42 N ATOM 2509 CA THR B 62 7.748 21.519 3.698 1.00 72.42 C ATOM 2510 C THR B 62 7.206 22.427 2.601 1.00 31.24 C ATOM 2511 O THR B 62 7.833 22.594 1.554 1.00 31.52 O ATOM 2512 CB THR B 62 6.680 20.468 4.055 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.388 20.522 5.456 1.00 23.01 O ATOM 2514 CG2 THR B 62 7.150 19.070 3.683 1.00 4.41 C ATOM 0 H THR B 62 7.385 22.513 5.509 1.00 34.42 H new ATOM 0 HA THR B 62 8.641 21.010 3.335 1.00 72.42 H new ATOM 0 HB THR B 62 5.777 20.693 3.487 1.00 33.53 H new ATOM 0 HG1 THR B 62 7.116 20.100 5.958 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.379 18.345 3.945 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.342 19.024 2.611 1.00 4.41 H new ATOM 0 HG23 THR B 62 8.066 18.837 4.226 1.00 4.41 H new ATOM 2522 N LEU B 63 6.039 23.013 2.847 1.00 12.13 N ATOM 2523 CA LEU B 63 5.413 23.906 1.879 1.00 1.11 C ATOM 2524 C LEU B 63 5.561 25.363 2.307 1.00 22.24 C ATOM 2525 O LEU B 63 5.072 26.270 1.634 1.00 42.13 O ATOM 2526 CB LEU B 63 3.931 23.559 1.719 1.00 73.21 C ATOM 2527 CG LEU B 63 2.974 24.238 2.699 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.277 25.414 2.034 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.952 23.239 3.225 1.00 54.43 C ATOM 0 H LEU B 63 5.508 22.886 3.708 1.00 12.13 H new ATOM 0 HA LEU B 63 5.917 23.774 0.922 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.625 23.818 0.705 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.818 22.480 1.821 1.00 73.21 H new ATOM 0 HG LEU B 63 3.553 24.614 3.542 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.600 25.885 2.746 1.00 21.21 H new ATOM 0 HD12 LEU B 63 3.021 26.140 1.706 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.710 25.061 1.173 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.279 23.739 3.921 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.377 22.834 2.392 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.467 22.427 3.739 1.00 54.43 H new ATOM 2541 N TRP B 64 6.241 25.579 3.426 1.00 1.21 N ATOM 2542 CA TRP B 64 6.458 26.926 3.942 1.00 43.23 C ATOM 2543 C TRP B 64 7.035 27.836 2.863 1.00 72.02 C ATOM 2544 O TRP B 64 6.852 29.052 2.901 1.00 64.33 O ATOM 2545 CB TRP B 64 7.394 26.888 5.151 1.00 62.22 C ATOM 2546 CG TRP B 64 8.819 27.201 4.807 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.533 28.299 5.193 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.702 26.407 4.007 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.806 28.236 4.681 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.936 27.085 3.951 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.571 25.189 3.335 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 12.028 26.584 3.248 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.657 24.694 2.638 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.872 25.390 2.599 1.00 30.42 C ATOM 0 H TRP B 64 6.652 24.839 3.994 1.00 1.21 H new ATOM 0 HA TRP B 64 5.494 27.329 4.252 1.00 43.23 H new ATOM 0 HB2 TRP B 64 7.042 27.601 5.897 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.346 25.900 5.608 1.00 62.22 H new ATOM 0 HD1 TRP B 64 9.153 29.099 5.810 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.536 28.934 4.822 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.639 24.645 3.360 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.966 27.119 3.216 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.567 23.754 2.114 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.702 24.976 2.046 1.00 30.42 H new ATOM 2565 N PHE B 65 7.734 27.238 1.903 1.00 3.22 N ATOM 2566 CA PHE B 65 8.339 27.996 0.814 1.00 51.24 C ATOM 2567 C PHE B 65 7.835 27.501 -0.538 1.00 44.13 C ATOM 2568 O PHE B 65 7.733 28.271 -1.493 1.00 61.53 O ATOM 2569 CB PHE B 65 9.864 27.885 0.874 1.00 33.14 C ATOM 2570 CG PHE B 65 10.537 29.135 1.363 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.965 29.898 2.368 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.743 29.546 0.818 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.582 31.049 2.820 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.365 30.696 1.267 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.783 31.448 2.269 1.00 1.24 C ATOM 0 H PHE B 65 7.895 26.232 1.857 1.00 3.22 H new ATOM 0 HA PHE B 65 8.052 29.041 0.928 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.135 27.056 1.529 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.242 27.643 -0.119 1.00 33.14 H new ATOM 0 HD1 PHE B 65 9.026 29.590 2.803 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.202 28.962 0.034 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.125 31.636 3.603 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.305 31.006 0.835 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.267 32.347 2.621 1.00 1.24 H new ATOM 2585 N MET B 66 7.520 26.212 -0.611 1.00 55.55 N ATOM 2586 CA MET B 66 7.026 25.615 -1.846 1.00 63.34 C ATOM 2587 C MET B 66 5.857 26.419 -2.408 1.00 2.10 C ATOM 2588 O MET B 66 5.684 26.514 -3.624 1.00 23.20 O ATOM 2589 CB MET B 66 6.593 24.168 -1.600 1.00 52.14 C ATOM 2590 CG MET B 66 6.960 23.224 -2.733 1.00 45.22 C ATOM 2591 SD MET B 66 5.564 22.224 -3.284 1.00 33.32 S ATOM 2592 CE MET B 66 4.557 23.465 -4.093 1.00 54.53 C ATOM 0 H MET B 66 7.598 25.561 0.170 1.00 55.55 H new ATOM 0 HA MET B 66 7.836 25.626 -2.575 1.00 63.34 H new ATOM 0 HB2 MET B 66 7.052 23.812 -0.678 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.514 24.141 -1.450 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.341 23.803 -3.574 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.766 22.567 -2.407 1.00 45.22 H new ATOM 0 HE1 MET B 66 4.186 23.072 -5.039 1.00 54.53 H new ATOM 0 HE2 MET B 66 3.714 23.724 -3.452 1.00 54.53 H new ATOM 0 HE3 MET B 66 5.157 24.355 -4.280 1.00 54.53 H new ATOM 2602 N THR B 67 5.056 26.994 -1.517 1.00 4.01 N ATOM 2603 CA THR B 67 3.904 27.788 -1.924 1.00 64.01 C ATOM 2604 C THR B 67 3.849 29.109 -1.165 1.00 4.11 C ATOM 2605 O THR B 67 2.856 29.830 -1.226 1.00 25.32 O ATOM 2606 CB THR B 67 2.586 27.023 -1.696 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.744 25.650 -2.074 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.452 27.647 -2.496 1.00 73.01 C ATOM 0 H THR B 67 5.184 26.924 -0.507 1.00 4.01 H new ATOM 0 HA THR B 67 4.020 27.989 -2.989 1.00 64.01 H new ATOM 0 HB THR B 67 2.337 27.081 -0.636 1.00 50.32 H new ATOM 0 HG1 THR B 67 1.902 25.171 -1.924 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.532 27.090 -2.319 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.314 28.683 -2.185 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.696 27.616 -3.558 1.00 73.01 H new ATOM 2616 N ASN B 68 4.926 29.419 -0.449 1.00 11.41 N ATOM 2617 CA ASN B 68 5.000 30.654 0.322 1.00 74.22 C ATOM 2618 C ASN B 68 3.853 30.740 1.325 1.00 14.40 C ATOM 2619 O ASN B 68 3.227 31.789 1.477 1.00 0.14 O ATOM 2620 CB ASN B 68 4.968 31.866 -0.611 1.00 72.14 C ATOM 2621 CG ASN B 68 5.524 33.116 0.044 1.00 24.42 C ATOM 2622 OD1 ASN B 68 6.315 33.038 0.985 1.00 31.00 O ATOM 2623 ND2 ASN B 68 5.110 34.276 -0.450 1.00 25.24 N ATOM 0 H ASN B 68 5.758 28.832 -0.387 1.00 11.41 H new ATOM 0 HA ASN B 68 5.941 30.652 0.872 1.00 74.22 H new ATOM 0 HB2 ASN B 68 5.543 31.644 -1.510 1.00 72.14 H new ATOM 0 HB3 ASN B 68 3.941 32.051 -0.927 1.00 72.14 H new ATOM 0 HD21 ASN B 68 5.448 35.151 -0.049 1.00 25.24 H new ATOM 0 HD22 ASN B 68 4.454 34.293 -1.231 1.00 25.24 H new ATOM 2630 N GLN B 69 3.583 29.630 2.004 1.00 42.21 N ATOM 2631 CA GLN B 69 2.512 29.580 2.991 1.00 70.13 C ATOM 2632 C GLN B 69 2.929 28.760 4.207 1.00 10.34 C ATOM 2633 O GLN B 69 3.174 27.558 4.102 1.00 41.40 O ATOM 2634 CB GLN B 69 1.246 28.986 2.370 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.031 29.392 3.088 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.554 30.740 2.631 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -1.039 30.882 1.508 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.456 31.739 3.500 1.00 14.11 N ATOM 0 H GLN B 69 4.091 28.753 1.888 1.00 42.21 H new ATOM 0 HA GLN B 69 2.305 30.599 3.317 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.182 29.298 1.328 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.325 27.899 2.373 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.795 28.634 2.919 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.155 29.423 4.162 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.047 31.576 4.420 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -0.790 32.669 3.247 1.00 14.11 H new ATOM 2647 N ILE B 70 3.008 29.418 5.359 1.00 24.34 N ATOM 2648 CA ILE B 70 3.396 28.749 6.595 1.00 24.43 C ATOM 2649 C ILE B 70 2.198 28.073 7.253 1.00 41.10 C ATOM 2650 O ILE B 70 1.155 28.695 7.455 1.00 43.13 O ATOM 2651 CB ILE B 70 4.027 29.736 7.594 1.00 12.12 C ATOM 2652 CG1 ILE B 70 3.089 30.920 7.838 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.376 30.219 7.083 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.585 31.010 9.261 1.00 23.21 C ATOM 0 H ILE B 70 2.809 30.413 5.462 1.00 24.34 H new ATOM 0 HA ILE B 70 4.135 27.993 6.327 1.00 24.43 H new ATOM 0 HB ILE B 70 4.183 29.219 8.541 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.611 31.844 7.587 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.236 30.842 7.164 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.809 30.916 7.801 1.00 40.03 H new ATOM 0 HG22 ILE B 70 6.044 29.367 6.957 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.244 30.721 6.125 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.926 31.873 9.360 1.00 23.21 H new ATOM 0 HD12 ILE B 70 2.035 30.103 9.510 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.430 31.120 9.940 1.00 23.21 H new ATOM 2666 N ALA B 71 2.355 26.796 7.586 1.00 31.41 N ATOM 2667 CA ALA B 71 1.288 26.037 8.224 1.00 42.14 C ATOM 2668 C ALA B 71 1.661 25.662 9.655 1.00 13.21 C ATOM 2669 O ALA B 71 1.989 24.515 9.956 1.00 44.11 O ATOM 2670 CB ALA B 71 0.972 24.787 7.415 1.00 21.42 C ATOM 0 H ALA B 71 3.211 26.266 7.424 1.00 31.41 H new ATOM 0 HA ALA B 71 0.400 26.667 8.260 1.00 42.14 H new ATOM 0 HB1 ALA B 71 0.173 24.230 7.904 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.654 25.073 6.412 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.862 24.162 7.349 1.00 21.42 H new ATOM 2676 N PRO B 72 1.610 26.652 10.559 1.00 64.10 N ATOM 2677 CA PRO B 72 1.940 26.450 11.973 1.00 11.04 C ATOM 2678 C PRO B 72 0.898 25.604 12.696 1.00 33.42 C ATOM 2679 O PRO B 72 1.171 25.037 13.754 1.00 25.43 O ATOM 2680 CB PRO B 72 1.960 27.872 12.538 1.00 2.43 C ATOM 2681 CG PRO B 72 1.067 28.652 11.636 1.00 51.11 C ATOM 2682 CD PRO B 72 1.226 28.044 10.269 1.00 31.23 C ATOM 0 HA PRO B 72 2.880 25.913 12.100 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.600 27.894 13.567 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.970 28.281 12.545 1.00 2.43 H new ATOM 0 HG2 PRO B 72 0.031 28.597 11.970 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.344 29.706 11.629 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.300 28.095 9.696 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.990 28.559 9.686 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.297 25.524 12.119 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.380 24.747 12.710 1.00 61.34 C ATOM 2692 C GLU B 73 -0.974 23.285 12.874 1.00 54.44 C ATOM 2693 O GLU B 73 -1.532 22.563 13.701 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.639 24.844 11.846 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.931 24.768 12.642 1.00 64.33 C ATOM 2696 CD GLU B 73 -4.445 26.135 13.051 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -5.107 26.793 12.221 1.00 33.02 O ATOM 2698 OE2 GLU B 73 -4.185 26.546 14.200 1.00 41.10 O ATOM 0 H GLU B 73 -0.539 25.988 11.243 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.593 25.160 13.696 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.618 25.783 11.292 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -2.627 24.040 11.110 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -4.691 24.261 12.047 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -3.769 24.163 13.534 1.00 64.33 H new ATOM 2705 N SER B 74 0.001 22.855 12.079 1.00 3.13 N ATOM 2706 CA SER B 74 0.479 21.479 12.131 1.00 54.43 C ATOM 2707 C SER B 74 1.957 21.431 12.509 1.00 41.34 C ATOM 2708 O SER B 74 2.570 20.365 12.527 1.00 62.25 O ATOM 2709 CB SER B 74 0.264 20.789 10.783 1.00 12.33 C ATOM 2710 OG SER B 74 -0.855 19.920 10.827 1.00 21.43 O ATOM 0 H SER B 74 0.475 23.440 11.391 1.00 3.13 H new ATOM 0 HA SER B 74 -0.092 20.952 12.895 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.115 21.539 10.007 1.00 12.33 H new ATOM 0 HB3 SER B 74 1.157 20.224 10.514 1.00 12.33 H new ATOM 0 HG SER B 74 -0.879 19.376 10.012 1.00 21.43 H new ATOM 2716 N GLY B 75 2.522 22.596 12.811 1.00 32.12 N ATOM 2717 CA GLY B 75 3.923 22.667 13.184 1.00 40.12 C ATOM 2718 C GLY B 75 4.822 22.973 12.003 1.00 61.53 C ATOM 2719 O GLY B 75 5.896 22.388 11.866 1.00 74.03 O ATOM 0 H GLY B 75 2.035 23.492 12.804 1.00 32.12 H new ATOM 0 HA2 GLY B 75 4.055 23.436 13.946 1.00 40.12 H new ATOM 0 HA3 GLY B 75 4.225 21.720 13.631 1.00 40.12 H new ATOM 2723 N GLN B 76 4.383 23.891 11.149 1.00 5.14 N ATOM 2724 CA GLN B 76 5.156 24.271 9.972 1.00 30.43 C ATOM 2725 C GLN B 76 5.292 25.788 9.878 1.00 1.04 C ATOM 2726 O GLN B 76 4.300 26.502 9.734 1.00 20.13 O ATOM 2727 CB GLN B 76 4.495 23.727 8.704 1.00 34.10 C ATOM 2728 CG GLN B 76 3.943 22.319 8.863 1.00 32.22 C ATOM 2729 CD GLN B 76 4.024 21.514 7.580 1.00 51.40 C ATOM 2730 OE1 GLN B 76 3.513 21.930 6.539 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.666 20.354 7.649 1.00 72.22 N ATOM 0 H GLN B 76 3.497 24.386 11.249 1.00 5.14 H new ATOM 0 HA GLN B 76 6.152 23.840 10.067 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.685 24.395 8.411 1.00 34.10 H new ATOM 0 HB3 GLN B 76 5.223 23.734 7.893 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.496 21.802 9.648 1.00 32.22 H new ATOM 0 HG3 GLN B 76 2.904 22.374 9.188 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.074 20.049 8.533 1.00 72.22 H new ATOM 0 HE22 GLN B 76 4.751 19.768 6.818 1.00 72.22 H new ATOM 2740 N ILE B 77 6.527 26.272 9.960 1.00 41.52 N ATOM 2741 CA ILE B 77 6.793 27.703 9.883 1.00 50.31 C ATOM 2742 C ILE B 77 8.092 27.981 9.136 1.00 5.22 C ATOM 2743 O ILE B 77 8.759 27.060 8.663 1.00 61.33 O ATOM 2744 CB ILE B 77 6.874 28.337 11.284 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.245 28.070 11.911 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.765 27.797 12.175 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.581 26.599 12.023 1.00 2.32 C ATOM 0 H ILE B 77 7.359 25.694 10.080 1.00 41.52 H new ATOM 0 HA ILE B 77 5.961 28.150 9.339 1.00 50.31 H new ATOM 0 HB ILE B 77 6.743 29.415 11.186 1.00 44.11 H new ATOM 0 HG12 ILE B 77 9.011 28.565 11.315 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.275 28.518 12.904 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.836 28.255 13.162 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.797 28.033 11.734 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.867 26.716 12.268 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.566 26.484 12.476 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.836 26.102 12.644 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.584 26.150 11.030 1.00 2.32 H new ATOM 2759 N ALA B 78 8.448 29.257 9.034 1.00 60.23 N ATOM 2760 CA ALA B 78 9.670 29.657 8.348 1.00 30.33 C ATOM 2761 C ALA B 78 10.825 29.816 9.330 1.00 42.43 C ATOM 2762 O ALA B 78 10.666 30.340 10.433 1.00 1.45 O ATOM 2763 CB ALA B 78 9.446 30.951 7.580 1.00 22.31 C ATOM 0 H ALA B 78 7.907 30.032 9.418 1.00 60.23 H new ATOM 0 HA ALA B 78 9.934 28.870 7.642 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.367 31.237 7.073 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.656 30.805 6.843 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.153 31.740 8.273 1.00 22.31 H new ATOM 2769 N PRO B 79 12.018 29.355 8.924 1.00 54.52 N ATOM 2770 CA PRO B 79 13.222 29.434 9.755 1.00 53.33 C ATOM 2771 C PRO B 79 13.722 30.866 9.915 1.00 52.42 C ATOM 2772 O PRO B 79 13.122 31.805 9.393 1.00 11.10 O ATOM 2773 CB PRO B 79 14.242 28.595 8.981 1.00 0.21 C ATOM 2774 CG PRO B 79 13.781 28.648 7.566 1.00 1.12 C ATOM 2775 CD PRO B 79 12.280 28.718 7.623 1.00 63.55 C ATOM 0 HA PRO B 79 13.041 29.081 10.770 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.248 29.001 9.085 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.272 27.570 9.349 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.193 29.517 7.053 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.110 27.767 7.015 1.00 1.12 H new ATOM 0 HD2 PRO B 79 11.873 29.305 6.799 1.00 63.55 H new ATOM 0 HD3 PRO B 79 11.829 27.728 7.562 1.00 63.55 H new ATOM 2783 N ALA B 80 14.825 31.025 10.640 1.00 25.42 N ATOM 2784 CA ALA B 80 15.406 32.343 10.866 1.00 0.54 C ATOM 2785 C ALA B 80 15.944 32.935 9.568 1.00 35.22 C ATOM 2786 O ALA B 80 15.513 34.005 9.137 1.00 62.14 O ATOM 2787 CB ALA B 80 16.511 32.260 11.909 1.00 73.13 C ATOM 0 H ALA B 80 15.334 30.258 11.080 1.00 25.42 H new ATOM 0 HA ALA B 80 14.620 33.001 11.237 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.936 33.251 12.068 1.00 73.13 H new ATOM 0 HB2 ALA B 80 16.099 31.887 12.847 1.00 73.13 H new ATOM 0 HB3 ALA B 80 17.290 31.582 11.560 1.00 73.13 H new ATOM 2793 N LEU B 81 16.889 32.235 8.951 1.00 30.02 N ATOM 2794 CA LEU B 81 17.487 32.692 7.701 1.00 34.04 C ATOM 2795 C LEU B 81 16.412 33.029 6.674 1.00 42.43 C ATOM 2796 O LEU B 81 16.580 33.934 5.857 1.00 23.42 O ATOM 2797 CB LEU B 81 18.426 31.623 7.141 1.00 64.45 C ATOM 2798 CG LEU B 81 19.671 31.319 7.975 1.00 64.45 C ATOM 2799 CD1 LEU B 81 19.478 30.041 8.777 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.898 31.210 7.083 1.00 62.22 C ATOM 0 H LEU B 81 17.258 31.349 9.296 1.00 30.02 H new ATOM 0 HA LEU B 81 18.059 33.596 7.910 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.861 30.699 7.019 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.746 31.934 6.147 1.00 64.45 H new ATOM 0 HG LEU B 81 19.826 32.142 8.673 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.374 29.841 9.364 1.00 35.40 H new ATOM 0 HD12 LEU B 81 18.625 30.156 9.445 1.00 35.40 H new ATOM 0 HD13 LEU B 81 19.297 29.209 8.097 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.774 30.993 7.694 1.00 62.22 H new ATOM 0 HD22 LEU B 81 20.752 30.407 6.360 1.00 62.22 H new ATOM 0 HD23 LEU B 81 21.048 32.151 6.554 1.00 62.22 H new ATOM 2812 N ALA B 82 15.304 32.296 6.722 1.00 60.51 N ATOM 2813 CA ALA B 82 14.199 32.519 5.798 1.00 44.45 C ATOM 2814 C ALA B 82 13.790 33.988 5.777 1.00 20.32 C ATOM 2815 O ALA B 82 13.961 34.676 4.770 1.00 2.23 O ATOM 2816 CB ALA B 82 13.012 31.645 6.173 1.00 40.20 C ATOM 0 H ALA B 82 15.148 31.542 7.391 1.00 60.51 H new ATOM 0 HA ALA B 82 14.534 32.247 4.797 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.194 31.822 5.474 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.305 30.596 6.130 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.685 31.890 7.184 1.00 40.20 H new