USER MOD reduce.3.24.130724 H: found=0, std=0, add=1086, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1086 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 95 ASN : amide:sc= -2.86! C(o=-2.9!,f=-6.5!) USER MOD Set 1.2: A 103 LYS NZ :NH3+ -164:sc= -0.023 (180deg=-0.353) USER MOD Set 2.1: A 65 ASN : amide:sc= -0.36 K(o=-0.66,f=-3.1!) USER MOD Set 2.2: A 69 GLN : amide:sc= -0.3 X(o=-0.66,f=-1) USER MOD Set 3.1: A 13 ASN : amide:sc= 0.206 X(o=-0.2,f=-0.67) USER MOD Set 3.2: A 46 TYR OH : rot 157:sc= -0.406 USER MOD Set 4.1: A 9 THR OG1 : rot 180:sc= 0.0134 USER MOD Set 4.2: A 42 MET CE :methyl -170:sc= -1.44 (180deg=-1.31) USER MOD Single : A 5 SER OG : rot -27:sc= 0.118 USER MOD Single : A 7 GLN : amide:sc= -0.0339 X(o=-0.034,f=-0.1) USER MOD Single : A 10 THR OG1 : rot 77:sc= 0.605 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -41:sc= 1.1 USER MOD Single : A 18 SER OG : rot 180:sc= 0.0287 USER MOD Single : A 19 GLN : amide:sc= 0.255 X(o=0.25,f=-0.014) USER MOD Single : A 21 SER OG : rot 150:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 170:sc= -0.214 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= -0.298 K(o=-0.3,f=-1) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 151:sc= -0.0968 (180deg=-0.553) USER MOD Single : A 44 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.0293) USER MOD Single : A 47 MET CE :methyl -135:sc= -3.81! (180deg=-6.56!) USER MOD Single : A 51 SER OG : rot 180:sc= 0.00228 USER MOD Single : A 53 ASN : amide:sc= -0.279 K(o=-0.28,f=-4.7!) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.076 USER MOD Single : A 57 LYS NZ :NH3+ -149:sc= -1.12 (180deg=-2.42) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl -138:sc= -0.917 (180deg=-1.88) USER MOD Single : A 66 HIS : no HD1:sc= -0.153 X(o=-0.15,f=-0.24) USER MOD Single : A 70 GLN : amide:sc=-0.00763 X(o=-0.0076,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00482) USER MOD Single : A 74 GLN : amide:sc= -1.73 K(o=-1.7,f=-5.1!) USER MOD Single : A 75 LYS NZ :NH3+ 161:sc= -0.41 (180deg=-0.943) USER MOD Single : A 78 GLN : amide:sc= -1.41 X(o=-1.4,f=-1.1) USER MOD Single : A 80 GLN : amide:sc= -0.0888 X(o=-0.089,f=-0.0057) USER MOD Single : A 82 SER OG : rot -36:sc= -0.501 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc=-0.00322 X(o=-0.0032,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN :FLIP amide:sc= 0 F(o=-0.97,f=0) USER MOD Single : A 114 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.033) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0.053) USER MOD Single : A 120 SER OG : rot 180:sc= -0.118 USER MOD Single : A 121 LYS NZ :NH3+ -147:sc= -0.221 (180deg=-1.31) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.072) USER MOD Single : A 125 ASN : amide:sc= -0.866 K(o=-0.87,f=-1.6!) USER MOD Single : A 130 SER OG : rot 150:sc= -0.695 USER MOD ----------------------------------------------------------------- ATOM 42 N SER A 5 1.861 -6.739 1.431 1.00 31.35 N ATOM 43 CA SER A 5 1.183 -6.235 2.620 1.00 74.41 C ATOM 44 C SER A 5 0.649 -7.385 3.469 1.00 13.02 C ATOM 45 O SER A 5 0.488 -7.251 4.682 1.00 73.53 O ATOM 46 CB SER A 5 0.035 -5.305 2.222 1.00 4.31 C ATOM 47 OG SER A 5 -0.850 -5.944 1.319 1.00 42.34 O ATOM 0 HA SER A 5 1.907 -5.675 3.211 1.00 74.41 H new ATOM 0 HB2 SER A 5 -0.511 -4.995 3.113 1.00 4.31 H new ATOM 0 HB3 SER A 5 0.437 -4.401 1.764 1.00 4.31 H new ATOM 0 HG SER A 5 -0.364 -6.629 0.814 1.00 42.34 H new ATOM 53 N GLU A 6 0.376 -8.514 2.822 1.00 42.21 N ATOM 54 CA GLU A 6 -0.140 -9.687 3.517 1.00 14.34 C ATOM 55 C GLU A 6 0.978 -10.421 4.251 1.00 2.32 C ATOM 56 O GLU A 6 0.758 -11.008 5.310 1.00 71.53 O ATOM 57 CB GLU A 6 -0.824 -10.634 2.529 1.00 42.54 C ATOM 58 CG GLU A 6 0.140 -11.309 1.568 1.00 60.42 C ATOM 59 CD GLU A 6 -0.572 -12.087 0.478 1.00 21.00 C ATOM 60 OE1 GLU A 6 -1.549 -11.555 -0.090 1.00 22.35 O ATOM 61 OE2 GLU A 6 -0.151 -13.228 0.193 1.00 53.13 O ATOM 0 H GLU A 6 0.504 -8.641 1.818 1.00 42.21 H new ATOM 0 HA GLU A 6 -0.872 -9.349 4.251 1.00 14.34 H new ATOM 0 HB2 GLU A 6 -1.364 -11.399 3.086 1.00 42.54 H new ATOM 0 HB3 GLU A 6 -1.564 -10.075 1.956 1.00 42.54 H new ATOM 0 HG2 GLU A 6 0.780 -10.554 1.111 1.00 60.42 H new ATOM 0 HG3 GLU A 6 0.790 -11.984 2.125 1.00 60.42 H new ATOM 68 N GLN A 7 2.178 -10.382 3.680 1.00 53.11 N ATOM 69 CA GLN A 7 3.330 -11.044 4.279 1.00 63.33 C ATOM 70 C GLN A 7 3.645 -10.455 5.650 1.00 44.13 C ATOM 71 O GLN A 7 3.883 -11.186 6.611 1.00 10.04 O ATOM 72 CB GLN A 7 4.550 -10.918 3.364 1.00 72.31 C ATOM 73 CG GLN A 7 4.799 -12.150 2.509 1.00 75.24 C ATOM 74 CD GLN A 7 5.334 -13.320 3.311 1.00 15.33 C ATOM 75 OE1 GLN A 7 4.573 -14.172 3.771 1.00 12.21 O ATOM 76 NE2 GLN A 7 6.649 -13.367 3.484 1.00 3.22 N ATOM 0 H GLN A 7 2.377 -9.899 2.804 1.00 53.11 H new ATOM 0 HA GLN A 7 3.086 -12.099 4.405 1.00 63.33 H new ATOM 0 HB2 GLN A 7 4.417 -10.054 2.712 1.00 72.31 H new ATOM 0 HB3 GLN A 7 5.433 -10.725 3.974 1.00 72.31 H new ATOM 0 HG2 GLN A 7 3.869 -12.443 2.022 1.00 75.24 H new ATOM 0 HG3 GLN A 7 5.508 -11.902 1.719 1.00 75.24 H new ATOM 0 HE21 GLN A 7 7.242 -12.639 3.085 1.00 3.22 H new ATOM 0 HE22 GLN A 7 7.066 -14.131 4.016 1.00 3.22 H new ATOM 85 N PHE A 8 3.646 -9.129 5.732 1.00 11.41 N ATOM 86 CA PHE A 8 3.933 -8.441 6.985 1.00 2.44 C ATOM 87 C PHE A 8 2.965 -8.878 8.080 1.00 14.13 C ATOM 88 O PHE A 8 3.361 -9.096 9.226 1.00 53.02 O ATOM 89 CB PHE A 8 3.850 -6.925 6.791 1.00 61.34 C ATOM 90 CG PHE A 8 4.156 -6.143 8.036 1.00 73.21 C ATOM 91 CD1 PHE A 8 5.389 -6.258 8.657 1.00 30.40 C ATOM 92 CD2 PHE A 8 3.210 -5.292 8.585 1.00 22.31 C ATOM 93 CE1 PHE A 8 5.672 -5.540 9.803 1.00 23.55 C ATOM 94 CE2 PHE A 8 3.488 -4.571 9.731 1.00 20.43 C ATOM 95 CZ PHE A 8 4.721 -4.695 10.341 1.00 63.04 C ATOM 0 H PHE A 8 3.451 -8.509 4.946 1.00 11.41 H new ATOM 0 HA PHE A 8 4.945 -8.706 7.292 1.00 2.44 H new ATOM 0 HB2 PHE A 8 4.545 -6.629 6.006 1.00 61.34 H new ATOM 0 HB3 PHE A 8 2.849 -6.665 6.445 1.00 61.34 H new ATOM 0 HD1 PHE A 8 6.137 -6.916 8.241 1.00 30.40 H new ATOM 0 HD2 PHE A 8 2.244 -5.191 8.112 1.00 22.31 H new ATOM 0 HE1 PHE A 8 6.637 -5.639 10.278 1.00 23.55 H new ATOM 0 HE2 PHE A 8 2.742 -3.911 10.149 1.00 20.43 H new ATOM 0 HZ PHE A 8 4.941 -4.133 11.236 1.00 63.04 H new ATOM 105 N THR A 9 1.691 -9.004 7.720 1.00 40.31 N ATOM 106 CA THR A 9 0.665 -9.413 8.670 1.00 13.23 C ATOM 107 C THR A 9 0.789 -10.894 9.010 1.00 55.32 C ATOM 108 O THR A 9 0.850 -11.270 10.181 1.00 65.44 O ATOM 109 CB THR A 9 -0.749 -9.140 8.123 1.00 41.24 C ATOM 110 OG1 THR A 9 -0.715 -8.042 7.203 1.00 23.43 O ATOM 111 CG2 THR A 9 -1.717 -8.830 9.254 1.00 12.12 C ATOM 0 H THR A 9 1.346 -8.828 6.776 1.00 40.31 H new ATOM 0 HA THR A 9 0.817 -8.822 9.573 1.00 13.23 H new ATOM 0 HB THR A 9 -1.094 -10.036 7.607 1.00 41.24 H new ATOM 0 HG1 THR A 9 -1.617 -7.876 6.858 1.00 23.43 H new ATOM 0 HG21 THR A 9 -2.709 -8.641 8.843 1.00 12.12 H new ATOM 0 HG22 THR A 9 -1.763 -9.679 9.936 1.00 12.12 H new ATOM 0 HG23 THR A 9 -1.374 -7.948 9.795 1.00 12.12 H new ATOM 119 N THR A 10 0.825 -11.732 7.978 1.00 11.32 N ATOM 120 CA THR A 10 0.941 -13.172 8.167 1.00 21.14 C ATOM 121 C THR A 10 2.184 -13.522 8.977 1.00 2.25 C ATOM 122 O THR A 10 2.187 -14.484 9.746 1.00 42.14 O ATOM 123 CB THR A 10 0.996 -13.913 6.818 1.00 22.22 C ATOM 124 OG1 THR A 10 -0.185 -13.636 6.058 1.00 13.22 O ATOM 125 CG2 THR A 10 1.128 -15.414 7.030 1.00 2.21 C ATOM 0 H THR A 10 0.775 -11.437 7.003 1.00 11.32 H new ATOM 0 HA THR A 10 0.053 -13.491 8.713 1.00 21.14 H new ATOM 0 HB THR A 10 1.870 -13.561 6.271 1.00 22.22 H new ATOM 0 HG1 THR A 10 -0.120 -12.739 5.668 1.00 13.22 H new ATOM 0 HG21 THR A 10 1.165 -15.916 6.063 1.00 2.21 H new ATOM 0 HG22 THR A 10 2.043 -15.624 7.583 1.00 2.21 H new ATOM 0 HG23 THR A 10 0.270 -15.778 7.596 1.00 2.21 H new ATOM 133 N LYS A 11 3.240 -12.734 8.802 1.00 31.20 N ATOM 134 CA LYS A 11 4.490 -12.959 9.518 1.00 11.32 C ATOM 135 C LYS A 11 4.378 -12.495 10.967 1.00 33.21 C ATOM 136 O LYS A 11 4.782 -13.204 11.890 1.00 61.25 O ATOM 137 CB LYS A 11 5.639 -12.223 8.824 1.00 75.41 C ATOM 138 CG LYS A 11 6.201 -12.968 7.625 1.00 13.41 C ATOM 139 CD LYS A 11 7.669 -12.643 7.406 1.00 72.14 C ATOM 140 CE LYS A 11 8.556 -13.370 8.405 1.00 13.31 C ATOM 141 NZ LYS A 11 8.867 -14.758 7.964 1.00 14.34 N ATOM 0 H LYS A 11 3.255 -11.934 8.170 1.00 31.20 H new ATOM 0 HA LYS A 11 4.695 -14.029 9.512 1.00 11.32 H new ATOM 0 HB2 LYS A 11 5.289 -11.243 8.501 1.00 75.41 H new ATOM 0 HB3 LYS A 11 6.439 -12.054 9.544 1.00 75.41 H new ATOM 0 HG2 LYS A 11 6.083 -14.041 7.774 1.00 13.41 H new ATOM 0 HG3 LYS A 11 5.632 -12.706 6.733 1.00 13.41 H new ATOM 0 HD2 LYS A 11 7.957 -12.921 6.392 1.00 72.14 H new ATOM 0 HD3 LYS A 11 7.822 -11.568 7.497 1.00 72.14 H new ATOM 0 HE2 LYS A 11 9.484 -12.815 8.538 1.00 13.31 H new ATOM 0 HE3 LYS A 11 8.061 -13.400 9.376 1.00 13.31 H new ATOM 0 HZ1 LYS A 11 9.473 -15.219 8.672 1.00 14.34 H new ATOM 0 HZ2 LYS A 11 7.983 -15.296 7.862 1.00 14.34 H new ATOM 0 HZ3 LYS A 11 9.362 -14.729 7.050 1.00 14.34 H new ATOM 155 N LEU A 12 3.825 -11.303 11.161 1.00 44.33 N ATOM 156 CA LEU A 12 3.658 -10.745 12.498 1.00 23.03 C ATOM 157 C LEU A 12 2.932 -11.728 13.411 1.00 12.31 C ATOM 158 O LEU A 12 3.150 -11.743 14.622 1.00 51.13 O ATOM 159 CB LEU A 12 2.884 -9.427 12.430 1.00 65.31 C ATOM 160 CG LEU A 12 3.715 -8.175 12.147 1.00 61.13 C ATOM 161 CD1 LEU A 12 2.830 -7.055 11.623 1.00 42.33 C ATOM 162 CD2 LEU A 12 4.455 -7.731 13.400 1.00 12.02 C ATOM 0 H LEU A 12 3.484 -10.704 10.409 1.00 44.33 H new ATOM 0 HA LEU A 12 4.648 -10.556 12.912 1.00 23.03 H new ATOM 0 HB2 LEU A 12 2.122 -9.516 11.656 1.00 65.31 H new ATOM 0 HB3 LEU A 12 2.362 -9.286 13.376 1.00 65.31 H new ATOM 0 HG LEU A 12 4.452 -8.417 11.381 1.00 61.13 H new ATOM 0 HD11 LEU A 12 3.438 -6.172 11.427 1.00 42.33 H new ATOM 0 HD12 LEU A 12 2.347 -7.375 10.700 1.00 42.33 H new ATOM 0 HD13 LEU A 12 2.070 -6.814 12.366 1.00 42.33 H new ATOM 0 HD21 LEU A 12 5.041 -6.839 13.180 1.00 12.02 H new ATOM 0 HD22 LEU A 12 3.735 -7.507 14.187 1.00 12.02 H new ATOM 0 HD23 LEU A 12 5.120 -8.529 13.732 1.00 12.02 H new ATOM 174 N ASN A 13 2.069 -12.548 12.821 1.00 33.31 N ATOM 175 CA ASN A 13 1.311 -13.536 13.581 1.00 1.11 C ATOM 176 C ASN A 13 2.175 -14.750 13.909 1.00 2.31 C ATOM 177 O ASN A 13 2.099 -15.302 15.007 1.00 71.40 O ATOM 178 CB ASN A 13 0.073 -13.974 12.796 1.00 62.21 C ATOM 179 CG ASN A 13 -1.116 -13.064 13.036 1.00 30.53 C ATOM 180 OD1 ASN A 13 -1.637 -12.987 14.149 1.00 54.22 O ATOM 181 ND2 ASN A 13 -1.551 -12.371 11.991 1.00 42.32 N ATOM 0 H ASN A 13 1.877 -12.548 11.819 1.00 33.31 H new ATOM 0 HA ASN A 13 0.995 -13.074 14.516 1.00 1.11 H new ATOM 0 HB2 ASN A 13 0.307 -13.988 11.732 1.00 62.21 H new ATOM 0 HB3 ASN A 13 -0.191 -14.993 13.078 1.00 62.21 H new ATOM 0 HD21 ASN A 13 -2.348 -11.743 12.092 1.00 42.32 H new ATOM 0 HD22 ASN A 13 -1.088 -12.467 11.087 1.00 42.32 H new ATOM 188 N THR A 14 2.999 -15.160 12.949 1.00 34.03 N ATOM 189 CA THR A 14 3.877 -16.308 13.135 1.00 70.11 C ATOM 190 C THR A 14 5.265 -15.871 13.588 1.00 43.43 C ATOM 191 O THR A 14 6.241 -16.607 13.433 1.00 53.20 O ATOM 192 CB THR A 14 4.008 -17.131 11.839 1.00 14.22 C ATOM 193 OG1 THR A 14 4.787 -18.307 12.082 1.00 34.45 O ATOM 194 CG2 THR A 14 4.656 -16.306 10.738 1.00 72.15 C ATOM 0 H THR A 14 3.076 -14.714 12.035 1.00 34.03 H new ATOM 0 HA THR A 14 3.425 -16.930 13.908 1.00 70.11 H new ATOM 0 HB THR A 14 3.008 -17.419 11.515 1.00 14.22 H new ATOM 0 HG1 THR A 14 5.549 -18.082 12.655 1.00 34.45 H new ATOM 0 HG21 THR A 14 4.738 -16.908 9.833 1.00 72.15 H new ATOM 0 HG22 THR A 14 4.045 -15.426 10.535 1.00 72.15 H new ATOM 0 HG23 THR A 14 5.650 -15.992 11.056 1.00 72.15 H new ATOM 202 N LEU A 15 5.348 -14.669 14.148 1.00 22.12 N ATOM 203 CA LEU A 15 6.619 -14.133 14.625 1.00 74.40 C ATOM 204 C LEU A 15 7.021 -14.781 15.946 1.00 42.00 C ATOM 205 O LEU A 15 6.173 -15.269 16.692 1.00 23.21 O ATOM 206 CB LEU A 15 6.523 -12.616 14.796 1.00 72.31 C ATOM 207 CG LEU A 15 7.161 -11.775 13.690 1.00 1.44 C ATOM 208 CD1 LEU A 15 6.987 -10.292 13.981 1.00 45.14 C ATOM 209 CD2 LEU A 15 8.635 -12.121 13.540 1.00 61.53 C ATOM 0 H LEU A 15 4.551 -14.047 14.283 1.00 22.12 H new ATOM 0 HA LEU A 15 7.383 -14.361 13.882 1.00 74.40 H new ATOM 0 HB2 LEU A 15 5.470 -12.345 14.870 1.00 72.31 H new ATOM 0 HB3 LEU A 15 6.989 -12.347 15.744 1.00 72.31 H new ATOM 0 HG LEU A 15 6.658 -12.002 12.750 1.00 1.44 H new ATOM 0 HD11 LEU A 15 7.447 -9.708 13.184 1.00 45.14 H new ATOM 0 HD12 LEU A 15 5.925 -10.055 14.038 1.00 45.14 H new ATOM 0 HD13 LEU A 15 7.464 -10.049 14.930 1.00 45.14 H new ATOM 0 HD21 LEU A 15 9.073 -11.513 12.748 1.00 61.53 H new ATOM 0 HD22 LEU A 15 9.153 -11.922 14.478 1.00 61.53 H new ATOM 0 HD23 LEU A 15 8.737 -13.176 13.286 1.00 61.53 H new ATOM 221 N GLU A 16 8.320 -14.779 16.229 1.00 62.05 N ATOM 222 CA GLU A 16 8.834 -15.365 17.461 1.00 62.53 C ATOM 223 C GLU A 16 9.891 -14.464 18.093 1.00 70.23 C ATOM 224 O GLU A 16 10.322 -13.480 17.492 1.00 4.11 O ATOM 225 CB GLU A 16 9.427 -16.749 17.185 1.00 51.13 C ATOM 226 CG GLU A 16 10.370 -16.781 15.994 1.00 51.42 C ATOM 227 CD GLU A 16 11.112 -18.097 15.872 1.00 31.30 C ATOM 228 OE1 GLU A 16 10.654 -19.093 16.471 1.00 61.10 O ATOM 229 OE2 GLU A 16 12.150 -18.132 15.179 1.00 72.33 O ATOM 0 H GLU A 16 9.035 -14.378 15.622 1.00 62.05 H new ATOM 0 HA GLU A 16 8.003 -15.466 18.159 1.00 62.53 H new ATOM 0 HB2 GLU A 16 9.963 -17.089 18.071 1.00 51.13 H new ATOM 0 HB3 GLU A 16 8.615 -17.455 17.014 1.00 51.13 H new ATOM 0 HG2 GLU A 16 9.802 -16.603 15.081 1.00 51.42 H new ATOM 0 HG3 GLU A 16 11.091 -15.969 16.085 1.00 51.42 H new ATOM 236 N ASP A 17 10.303 -14.808 19.308 1.00 14.21 N ATOM 237 CA ASP A 17 11.309 -14.031 20.023 1.00 40.05 C ATOM 238 C ASP A 17 12.707 -14.585 19.765 1.00 31.12 C ATOM 239 O ASP A 17 13.216 -15.396 20.539 1.00 2.41 O ATOM 240 CB ASP A 17 11.015 -14.033 21.523 1.00 14.54 C ATOM 241 CG ASP A 17 11.898 -13.066 22.288 1.00 63.53 C ATOM 242 OD1 ASP A 17 11.870 -11.859 21.971 1.00 2.51 O ATOM 243 OD2 ASP A 17 12.617 -13.518 23.203 1.00 24.11 O ATOM 0 H ASP A 17 9.956 -15.620 19.819 1.00 14.21 H new ATOM 0 HA ASP A 17 11.270 -13.006 19.655 1.00 40.05 H new ATOM 0 HB2 ASP A 17 9.969 -13.772 21.686 1.00 14.54 H new ATOM 0 HB3 ASP A 17 11.157 -15.039 21.917 1.00 14.54 H new ATOM 248 N SER A 18 13.321 -14.143 18.673 1.00 63.25 N ATOM 249 CA SER A 18 14.658 -14.599 18.310 1.00 3.43 C ATOM 250 C SER A 18 15.456 -13.475 17.655 1.00 20.12 C ATOM 251 O SER A 18 14.908 -12.665 16.908 1.00 70.40 O ATOM 252 CB SER A 18 14.573 -15.798 17.364 1.00 53.42 C ATOM 253 OG SER A 18 15.738 -15.900 16.564 1.00 53.25 O ATOM 0 H SER A 18 12.914 -13.470 18.024 1.00 63.25 H new ATOM 0 HA SER A 18 15.171 -14.902 19.223 1.00 3.43 H new ATOM 0 HB2 SER A 18 14.444 -16.713 17.942 1.00 53.42 H new ATOM 0 HB3 SER A 18 13.696 -15.699 16.724 1.00 53.42 H new ATOM 0 HG SER A 18 15.660 -16.675 15.969 1.00 53.25 H new ATOM 259 N GLN A 19 16.753 -13.434 17.942 1.00 42.10 N ATOM 260 CA GLN A 19 17.627 -12.410 17.382 1.00 53.33 C ATOM 261 C GLN A 19 17.596 -12.442 15.857 1.00 33.32 C ATOM 262 O GLN A 19 17.664 -11.402 15.204 1.00 50.21 O ATOM 263 CB GLN A 19 19.060 -12.604 17.879 1.00 62.43 C ATOM 264 CG GLN A 19 20.041 -11.586 17.320 1.00 23.41 C ATOM 265 CD GLN A 19 19.790 -10.186 17.843 1.00 4.13 C ATOM 266 OE1 GLN A 19 20.353 -9.781 18.861 1.00 10.10 O ATOM 267 NE2 GLN A 19 18.942 -9.437 17.148 1.00 31.24 N ATOM 0 H GLN A 19 17.222 -14.098 18.559 1.00 42.10 H new ATOM 0 HA GLN A 19 17.264 -11.437 17.714 1.00 53.33 H new ATOM 0 HB2 GLN A 19 19.069 -12.545 18.967 1.00 62.43 H new ATOM 0 HB3 GLN A 19 19.396 -13.606 17.611 1.00 62.43 H new ATOM 0 HG2 GLN A 19 21.057 -11.888 17.575 1.00 23.41 H new ATOM 0 HG3 GLN A 19 19.973 -11.581 16.232 1.00 23.41 H new ATOM 0 HE21 GLN A 19 18.498 -9.813 16.310 1.00 31.24 H new ATOM 0 HE22 GLN A 19 18.735 -8.486 17.452 1.00 31.24 H new ATOM 276 N GLU A 20 17.493 -13.644 15.298 1.00 52.23 N ATOM 277 CA GLU A 20 17.454 -13.811 13.850 1.00 41.44 C ATOM 278 C GLU A 20 16.086 -13.425 13.294 1.00 44.32 C ATOM 279 O GLU A 20 15.981 -12.893 12.189 1.00 42.14 O ATOM 280 CB GLU A 20 17.781 -15.257 13.472 1.00 52.13 C ATOM 281 CG GLU A 20 19.235 -15.632 13.700 1.00 24.02 C ATOM 282 CD GLU A 20 19.495 -16.130 15.109 1.00 61.34 C ATOM 283 OE1 GLU A 20 18.792 -17.065 15.547 1.00 3.51 O ATOM 284 OE2 GLU A 20 20.402 -15.585 15.772 1.00 21.41 O ATOM 0 H GLU A 20 17.435 -14.515 15.825 1.00 52.23 H new ATOM 0 HA GLU A 20 18.204 -13.151 13.414 1.00 41.44 H new ATOM 0 HB2 GLU A 20 17.147 -15.927 14.052 1.00 52.13 H new ATOM 0 HB3 GLU A 20 17.535 -15.414 12.422 1.00 52.13 H new ATOM 0 HG2 GLU A 20 19.523 -16.404 12.987 1.00 24.02 H new ATOM 0 HG3 GLU A 20 19.865 -14.765 13.503 1.00 24.02 H new ATOM 291 N SER A 21 15.041 -13.697 14.068 1.00 21.13 N ATOM 292 CA SER A 21 13.679 -13.383 13.653 1.00 42.15 C ATOM 293 C SER A 21 13.473 -11.874 13.562 1.00 1.15 C ATOM 294 O SER A 21 12.979 -11.363 12.557 1.00 32.00 O ATOM 295 CB SER A 21 12.672 -13.989 14.631 1.00 32.15 C ATOM 296 OG SER A 21 11.342 -13.774 14.193 1.00 74.43 O ATOM 0 H SER A 21 15.111 -14.135 14.987 1.00 21.13 H new ATOM 0 HA SER A 21 13.518 -13.814 12.665 1.00 42.15 H new ATOM 0 HB2 SER A 21 12.857 -15.059 14.731 1.00 32.15 H new ATOM 0 HB3 SER A 21 12.809 -13.548 15.618 1.00 32.15 H new ATOM 0 HG SER A 21 10.773 -14.510 14.501 1.00 74.43 H new ATOM 302 N ILE A 22 13.856 -11.167 14.620 1.00 15.24 N ATOM 303 CA ILE A 22 13.714 -9.717 14.661 1.00 1.32 C ATOM 304 C ILE A 22 14.584 -9.050 13.602 1.00 43.55 C ATOM 305 O ILE A 22 14.214 -8.020 13.037 1.00 33.22 O ATOM 306 CB ILE A 22 14.087 -9.153 16.045 1.00 23.31 C ATOM 307 CG1 ILE A 22 13.278 -9.852 17.140 1.00 65.54 C ATOM 308 CG2 ILE A 22 13.855 -7.650 16.085 1.00 31.33 C ATOM 309 CD1 ILE A 22 11.792 -9.584 17.057 1.00 1.04 C ATOM 0 H ILE A 22 14.267 -11.575 15.460 1.00 15.24 H new ATOM 0 HA ILE A 22 12.666 -9.497 14.459 1.00 1.32 H new ATOM 0 HB ILE A 22 15.145 -9.342 16.225 1.00 23.31 H new ATOM 0 HG12 ILE A 22 13.449 -10.927 17.077 1.00 65.54 H new ATOM 0 HG13 ILE A 22 13.644 -9.527 18.114 1.00 65.54 H new ATOM 0 HG21 ILE A 22 14.123 -7.267 17.069 1.00 31.33 H new ATOM 0 HG22 ILE A 22 14.471 -7.166 15.327 1.00 31.33 H new ATOM 0 HG23 ILE A 22 12.804 -7.439 15.887 1.00 31.33 H new ATOM 0 HD11 ILE A 22 11.282 -10.111 17.863 1.00 1.04 H new ATOM 0 HD12 ILE A 22 11.610 -8.513 17.150 1.00 1.04 H new ATOM 0 HD13 ILE A 22 11.412 -9.934 16.097 1.00 1.04 H new ATOM 321 N SER A 23 15.743 -9.644 13.335 1.00 71.01 N ATOM 322 CA SER A 23 16.668 -9.106 12.344 1.00 73.51 C ATOM 323 C SER A 23 16.157 -9.363 10.929 1.00 2.21 C ATOM 324 O SER A 23 16.135 -8.460 10.092 1.00 33.25 O ATOM 325 CB SER A 23 18.054 -9.729 12.519 1.00 62.15 C ATOM 326 OG SER A 23 18.979 -9.182 11.594 1.00 31.25 O ATOM 0 H SER A 23 16.064 -10.498 13.791 1.00 71.01 H new ATOM 0 HA SER A 23 16.740 -8.029 12.496 1.00 73.51 H new ATOM 0 HB2 SER A 23 18.407 -9.558 13.536 1.00 62.15 H new ATOM 0 HB3 SER A 23 17.991 -10.808 12.381 1.00 62.15 H new ATOM 0 HG SER A 23 19.858 -9.595 11.727 1.00 31.25 H new ATOM 332 N SER A 24 15.748 -10.600 10.670 1.00 60.54 N ATOM 333 CA SER A 24 15.241 -10.978 9.356 1.00 61.34 C ATOM 334 C SER A 24 14.048 -10.112 8.964 1.00 42.52 C ATOM 335 O SER A 24 13.831 -9.832 7.785 1.00 12.23 O ATOM 336 CB SER A 24 14.839 -12.454 9.346 1.00 74.21 C ATOM 337 OG SER A 24 14.794 -12.962 8.024 1.00 65.13 O ATOM 0 H SER A 24 15.758 -11.358 11.352 1.00 60.54 H new ATOM 0 HA SER A 24 16.037 -10.821 8.628 1.00 61.34 H new ATOM 0 HB2 SER A 24 15.550 -13.032 9.937 1.00 74.21 H new ATOM 0 HB3 SER A 24 13.863 -12.571 9.817 1.00 74.21 H new ATOM 0 HG SER A 24 14.536 -13.907 8.045 1.00 65.13 H new ATOM 343 N ALA A 25 13.278 -9.690 9.961 1.00 2.25 N ATOM 344 CA ALA A 25 12.109 -8.853 9.723 1.00 75.42 C ATOM 345 C ALA A 25 12.502 -7.387 9.582 1.00 13.23 C ATOM 346 O ALA A 25 12.045 -6.696 8.671 1.00 23.41 O ATOM 347 CB ALA A 25 11.098 -9.026 10.847 1.00 2.43 C ATOM 0 H ALA A 25 13.443 -9.914 10.942 1.00 2.25 H new ATOM 0 HA ALA A 25 11.651 -9.170 8.786 1.00 75.42 H new ATOM 0 HB1 ALA A 25 10.230 -8.395 10.656 1.00 2.43 H new ATOM 0 HB2 ALA A 25 10.784 -10.069 10.897 1.00 2.43 H new ATOM 0 HB3 ALA A 25 11.554 -8.738 11.794 1.00 2.43 H new ATOM 353 N SER A 26 13.351 -6.917 10.491 1.00 54.22 N ATOM 354 CA SER A 26 13.802 -5.530 10.471 1.00 74.35 C ATOM 355 C SER A 26 14.377 -5.166 9.105 1.00 31.12 C ATOM 356 O SER A 26 14.053 -4.121 8.540 1.00 20.32 O ATOM 357 CB SER A 26 14.852 -5.298 11.558 1.00 43.41 C ATOM 358 OG SER A 26 15.151 -3.919 11.692 1.00 14.22 O ATOM 0 H SER A 26 13.740 -7.476 11.250 1.00 54.22 H new ATOM 0 HA SER A 26 12.941 -4.890 10.666 1.00 74.35 H new ATOM 0 HB2 SER A 26 14.488 -5.689 12.508 1.00 43.41 H new ATOM 0 HB3 SER A 26 15.761 -5.848 11.314 1.00 43.41 H new ATOM 0 HG SER A 26 15.698 -3.779 12.493 1.00 14.22 H new ATOM 364 N LYS A 27 15.233 -6.036 8.580 1.00 1.21 N ATOM 365 CA LYS A 27 15.854 -5.809 7.281 1.00 65.14 C ATOM 366 C LYS A 27 14.804 -5.762 6.176 1.00 73.01 C ATOM 367 O LYS A 27 14.963 -5.048 5.186 1.00 75.12 O ATOM 368 CB LYS A 27 16.875 -6.909 6.981 1.00 23.35 C ATOM 369 CG LYS A 27 16.258 -8.172 6.407 1.00 75.41 C ATOM 370 CD LYS A 27 17.109 -9.395 6.705 1.00 43.05 C ATOM 371 CE LYS A 27 18.130 -9.644 5.605 1.00 72.44 C ATOM 372 NZ LYS A 27 18.672 -11.030 5.655 1.00 22.42 N ATOM 0 H LYS A 27 15.512 -6.905 9.035 1.00 1.21 H new ATOM 0 HA LYS A 27 16.364 -4.847 7.315 1.00 65.14 H new ATOM 0 HB2 LYS A 27 17.615 -6.525 6.279 1.00 23.35 H new ATOM 0 HB3 LYS A 27 17.407 -7.159 7.899 1.00 23.35 H new ATOM 0 HG2 LYS A 27 15.260 -8.312 6.823 1.00 75.41 H new ATOM 0 HG3 LYS A 27 16.141 -8.063 5.329 1.00 75.41 H new ATOM 0 HD2 LYS A 27 17.623 -9.259 7.656 1.00 43.05 H new ATOM 0 HD3 LYS A 27 16.467 -10.269 6.812 1.00 43.05 H new ATOM 0 HE2 LYS A 27 17.667 -9.470 4.634 1.00 72.44 H new ATOM 0 HE3 LYS A 27 18.948 -8.930 5.701 1.00 72.44 H new ATOM 0 HZ1 LYS A 27 19.364 -11.160 4.890 1.00 22.42 H new ATOM 0 HZ2 LYS A 27 19.136 -11.188 6.572 1.00 22.42 H new ATOM 0 HZ3 LYS A 27 17.895 -11.711 5.538 1.00 22.42 H new ATOM 386 N TRP A 28 13.731 -6.525 6.353 1.00 23.02 N ATOM 387 CA TRP A 28 12.654 -6.569 5.371 1.00 13.52 C ATOM 388 C TRP A 28 11.950 -5.219 5.275 1.00 62.31 C ATOM 389 O TRP A 28 11.810 -4.657 4.188 1.00 71.31 O ATOM 390 CB TRP A 28 11.645 -7.658 5.738 1.00 23.52 C ATOM 391 CG TRP A 28 10.748 -8.045 4.601 1.00 2.24 C ATOM 392 CD1 TRP A 28 11.131 -8.395 3.338 1.00 33.21 C ATOM 393 CD2 TRP A 28 9.319 -8.118 4.625 1.00 55.44 C ATOM 394 NE1 TRP A 28 10.025 -8.682 2.574 1.00 12.54 N ATOM 395 CE2 TRP A 28 8.901 -8.520 3.341 1.00 40.43 C ATOM 396 CE3 TRP A 28 8.351 -7.885 5.605 1.00 14.52 C ATOM 397 CZ2 TRP A 28 7.558 -8.691 3.015 1.00 63.33 C ATOM 398 CZ3 TRP A 28 7.018 -8.055 5.280 1.00 25.10 C ATOM 399 CH2 TRP A 28 6.632 -8.456 3.994 1.00 21.12 C ATOM 0 H TRP A 28 13.584 -7.121 7.167 1.00 23.02 H new ATOM 0 HA TRP A 28 13.091 -6.801 4.400 1.00 13.52 H new ATOM 0 HB2 TRP A 28 12.183 -8.541 6.083 1.00 23.52 H new ATOM 0 HB3 TRP A 28 11.034 -7.311 6.571 1.00 23.52 H new ATOM 0 HD1 TRP A 28 12.153 -8.440 2.990 1.00 33.21 H new ATOM 0 HE1 TRP A 28 10.039 -8.969 1.595 1.00 12.54 H new ATOM 0 HE3 TRP A 28 8.639 -7.577 6.599 1.00 14.52 H new ATOM 0 HZ2 TRP A 28 7.258 -8.998 2.024 1.00 63.33 H new ATOM 0 HZ3 TRP A 28 6.262 -7.876 6.030 1.00 25.10 H new ATOM 0 HH2 TRP A 28 5.583 -8.582 3.771 1.00 21.12 H new ATOM 410 N LEU A 29 11.510 -4.704 6.417 1.00 13.13 N ATOM 411 CA LEU A 29 10.820 -3.419 6.461 1.00 23.04 C ATOM 412 C LEU A 29 11.786 -2.273 6.176 1.00 34.00 C ATOM 413 O LEU A 29 11.388 -1.225 5.666 1.00 43.33 O ATOM 414 CB LEU A 29 10.162 -3.218 7.827 1.00 13.03 C ATOM 415 CG LEU A 29 9.006 -4.162 8.161 1.00 61.23 C ATOM 416 CD1 LEU A 29 9.021 -4.523 9.638 1.00 71.20 C ATOM 417 CD2 LEU A 29 7.675 -3.532 7.777 1.00 20.21 C ATOM 0 H LEU A 29 11.618 -5.156 7.325 1.00 13.13 H new ATOM 0 HA LEU A 29 10.049 -3.421 5.690 1.00 23.04 H new ATOM 0 HB2 LEU A 29 10.927 -3.327 8.596 1.00 13.03 H new ATOM 0 HB3 LEU A 29 9.796 -2.193 7.884 1.00 13.03 H new ATOM 0 HG LEU A 29 9.132 -5.078 7.583 1.00 61.23 H new ATOM 0 HD11 LEU A 29 8.191 -5.195 9.857 1.00 71.20 H new ATOM 0 HD12 LEU A 29 9.962 -5.016 9.882 1.00 71.20 H new ATOM 0 HD13 LEU A 29 8.921 -3.617 10.235 1.00 71.20 H new ATOM 0 HD21 LEU A 29 6.864 -4.218 8.022 1.00 20.21 H new ATOM 0 HD22 LEU A 29 7.541 -2.601 8.327 1.00 20.21 H new ATOM 0 HD23 LEU A 29 7.665 -3.326 6.707 1.00 20.21 H new ATOM 429 N LEU A 30 13.056 -2.480 6.506 1.00 35.14 N ATOM 430 CA LEU A 30 14.079 -1.465 6.284 1.00 64.15 C ATOM 431 C LEU A 30 14.100 -1.024 4.823 1.00 25.34 C ATOM 432 O LEU A 30 14.390 0.133 4.517 1.00 3.13 O ATOM 433 CB LEU A 30 15.454 -2.002 6.686 1.00 60.21 C ATOM 434 CG LEU A 30 16.153 -1.268 7.831 1.00 54.11 C ATOM 435 CD1 LEU A 30 15.207 -1.093 9.009 1.00 54.34 C ATOM 436 CD2 LEU A 30 17.406 -2.017 8.258 1.00 4.14 C ATOM 0 H LEU A 30 13.402 -3.342 6.928 1.00 35.14 H new ATOM 0 HA LEU A 30 13.838 -0.600 6.902 1.00 64.15 H new ATOM 0 HB2 LEU A 30 15.345 -3.050 6.966 1.00 60.21 H new ATOM 0 HB3 LEU A 30 16.104 -1.972 5.811 1.00 60.21 H new ATOM 0 HG LEU A 30 16.447 -0.280 7.478 1.00 54.11 H new ATOM 0 HD11 LEU A 30 15.722 -0.569 9.814 1.00 54.34 H new ATOM 0 HD12 LEU A 30 14.339 -0.513 8.695 1.00 54.34 H new ATOM 0 HD13 LEU A 30 14.882 -2.071 9.363 1.00 54.34 H new ATOM 0 HD21 LEU A 30 17.891 -1.480 9.074 1.00 4.14 H new ATOM 0 HD22 LEU A 30 17.135 -3.018 8.593 1.00 4.14 H new ATOM 0 HD23 LEU A 30 18.092 -2.090 7.414 1.00 4.14 H new ATOM 448 N LEU A 31 13.790 -1.953 3.926 1.00 33.10 N ATOM 449 CA LEU A 31 13.770 -1.660 2.497 1.00 25.20 C ATOM 450 C LEU A 31 12.374 -1.247 2.045 1.00 54.04 C ATOM 451 O LEU A 31 12.076 -1.238 0.851 1.00 54.23 O ATOM 452 CB LEU A 31 14.237 -2.880 1.700 1.00 1.31 C ATOM 453 CG LEU A 31 15.596 -3.460 2.095 1.00 52.42 C ATOM 454 CD1 LEU A 31 15.706 -4.910 1.652 1.00 60.31 C ATOM 455 CD2 LEU A 31 16.723 -2.631 1.497 1.00 4.54 C ATOM 0 H LEU A 31 13.549 -2.915 4.163 1.00 33.10 H new ATOM 0 HA LEU A 31 14.452 -0.830 2.312 1.00 25.20 H new ATOM 0 HB2 LEU A 31 13.487 -3.664 1.801 1.00 1.31 H new ATOM 0 HB3 LEU A 31 14.273 -2.608 0.645 1.00 1.31 H new ATOM 0 HG LEU A 31 15.683 -3.426 3.181 1.00 52.42 H new ATOM 0 HD11 LEU A 31 16.679 -5.306 1.941 1.00 60.31 H new ATOM 0 HD12 LEU A 31 14.920 -5.496 2.127 1.00 60.31 H new ATOM 0 HD13 LEU A 31 15.598 -4.969 0.569 1.00 60.31 H new ATOM 0 HD21 LEU A 31 17.683 -3.058 1.788 1.00 4.54 H new ATOM 0 HD22 LEU A 31 16.639 -2.634 0.410 1.00 4.54 H new ATOM 0 HD23 LEU A 31 16.655 -1.607 1.864 1.00 4.54 H new ATOM 467 N GLN A 32 11.523 -0.904 3.007 1.00 70.05 N ATOM 468 CA GLN A 32 10.158 -0.488 2.706 1.00 21.21 C ATOM 469 C GLN A 32 9.917 0.950 3.152 1.00 53.33 C ATOM 470 O GLN A 32 8.843 1.283 3.654 1.00 2.14 O ATOM 471 CB GLN A 32 9.156 -1.421 3.389 1.00 63.03 C ATOM 472 CG GLN A 32 9.114 -2.815 2.785 1.00 61.43 C ATOM 473 CD GLN A 32 8.441 -3.825 3.693 1.00 14.13 C ATOM 474 OE1 GLN A 32 7.345 -3.585 4.202 1.00 22.53 O ATOM 475 NE2 GLN A 32 9.093 -4.962 3.902 1.00 65.22 N ATOM 0 H GLN A 32 11.754 -0.906 4.000 1.00 70.05 H new ATOM 0 HA GLN A 32 10.018 -0.543 1.626 1.00 21.21 H new ATOM 0 HB2 GLN A 32 9.408 -1.500 4.447 1.00 63.03 H new ATOM 0 HB3 GLN A 32 8.162 -0.978 3.330 1.00 63.03 H new ATOM 0 HG2 GLN A 32 8.584 -2.778 1.833 1.00 61.43 H new ATOM 0 HG3 GLN A 32 10.131 -3.145 2.572 1.00 61.43 H new ATOM 0 HE21 GLN A 32 9.999 -5.119 3.460 1.00 65.22 H new ATOM 0 HE22 GLN A 32 8.688 -5.679 4.504 1.00 65.22 H new ATOM 484 N TYR A 33 10.921 1.799 2.965 1.00 65.35 N ATOM 485 CA TYR A 33 10.819 3.201 3.350 1.00 44.21 C ATOM 486 C TYR A 33 9.674 3.887 2.612 1.00 35.11 C ATOM 487 O TYR A 33 9.176 4.927 3.045 1.00 71.44 O ATOM 488 CB TYR A 33 12.134 3.928 3.061 1.00 10.14 C ATOM 489 CG TYR A 33 12.673 3.676 1.671 1.00 13.23 C ATOM 490 CD1 TYR A 33 12.016 4.170 0.551 1.00 43.43 C ATOM 491 CD2 TYR A 33 13.837 2.943 1.478 1.00 2.52 C ATOM 492 CE1 TYR A 33 12.504 3.942 -0.721 1.00 43.35 C ATOM 493 CE2 TYR A 33 14.333 2.712 0.210 1.00 63.30 C ATOM 494 CZ TYR A 33 13.663 3.213 -0.887 1.00 23.14 C ATOM 495 OH TYR A 33 14.153 2.983 -2.152 1.00 24.13 O ATOM 0 H TYR A 33 11.816 1.540 2.549 1.00 65.35 H new ATOM 0 HA TYR A 33 10.615 3.243 4.420 1.00 44.21 H new ATOM 0 HB2 TYR A 33 11.984 4.999 3.195 1.00 10.14 H new ATOM 0 HB3 TYR A 33 12.880 3.617 3.793 1.00 10.14 H new ATOM 0 HD1 TYR A 33 11.109 4.742 0.677 1.00 43.43 H new ATOM 0 HD2 TYR A 33 14.363 2.547 2.334 1.00 2.52 H new ATOM 0 HE1 TYR A 33 11.981 4.333 -1.581 1.00 43.35 H new ATOM 0 HE2 TYR A 33 15.241 2.142 0.078 1.00 63.30 H new ATOM 0 HH TYR A 33 14.976 2.455 -2.093 1.00 24.13 H new ATOM 505 N ARG A 34 9.260 3.296 1.496 1.00 53.11 N ATOM 506 CA ARG A 34 8.173 3.849 0.696 1.00 1.15 C ATOM 507 C ARG A 34 6.823 3.582 1.355 1.00 31.14 C ATOM 508 O ARG A 34 5.882 4.362 1.205 1.00 63.33 O ATOM 509 CB ARG A 34 8.192 3.252 -0.712 1.00 24.22 C ATOM 510 CG ARG A 34 8.090 1.735 -0.732 1.00 3.44 C ATOM 511 CD ARG A 34 8.116 1.194 -2.152 1.00 61.14 C ATOM 512 NE ARG A 34 9.479 1.000 -2.640 1.00 22.15 N ATOM 513 CZ ARG A 34 9.776 0.734 -3.907 1.00 11.22 C ATOM 514 NH1 ARG A 34 8.810 0.632 -4.810 1.00 25.13 N ATOM 515 NH2 ARG A 34 11.041 0.571 -4.273 1.00 72.21 N ATOM 0 H ARG A 34 9.661 2.434 1.125 1.00 53.11 H new ATOM 0 HA ARG A 34 8.318 4.927 0.628 1.00 1.15 H new ATOM 0 HB2 ARG A 34 7.366 3.671 -1.286 1.00 24.22 H new ATOM 0 HB3 ARG A 34 9.113 3.552 -1.212 1.00 24.22 H new ATOM 0 HG2 ARG A 34 8.915 1.306 -0.163 1.00 3.44 H new ATOM 0 HG3 ARG A 34 7.168 1.425 -0.240 1.00 3.44 H new ATOM 0 HD2 ARG A 34 7.580 0.246 -2.188 1.00 61.14 H new ATOM 0 HD3 ARG A 34 7.590 1.883 -2.812 1.00 61.14 H new ATOM 0 HE ARG A 34 10.245 1.073 -1.971 1.00 22.15 H new ATOM 0 HH11 ARG A 34 7.837 0.758 -4.532 1.00 25.13 H new ATOM 0 HH12 ARG A 34 9.040 0.428 -5.782 1.00 25.13 H new ATOM 0 HH21 ARG A 34 11.786 0.650 -3.581 1.00 72.21 H new ATOM 0 HH22 ARG A 34 11.268 0.367 -5.246 1.00 72.21 H new ATOM 529 N ASP A 35 6.735 2.475 2.085 1.00 4.30 N ATOM 530 CA ASP A 35 5.501 2.105 2.768 1.00 51.15 C ATOM 531 C ASP A 35 5.529 2.557 4.224 1.00 21.44 C ATOM 532 O ASP A 35 5.019 1.868 5.108 1.00 50.23 O ATOM 533 CB ASP A 35 5.286 0.593 2.693 1.00 31.44 C ATOM 534 CG ASP A 35 5.783 0.000 1.389 1.00 12.43 C ATOM 535 OD1 ASP A 35 5.179 0.294 0.337 1.00 74.43 O ATOM 536 OD2 ASP A 35 6.776 -0.757 1.421 1.00 35.03 O ATOM 0 H ASP A 35 7.504 1.818 2.219 1.00 4.30 H new ATOM 0 HA ASP A 35 4.673 2.607 2.268 1.00 51.15 H new ATOM 0 HB2 ASP A 35 5.801 0.114 3.526 1.00 31.44 H new ATOM 0 HB3 ASP A 35 4.224 0.374 2.807 1.00 31.44 H new ATOM 541 N ALA A 36 6.130 3.717 4.467 1.00 15.05 N ATOM 542 CA ALA A 36 6.223 4.261 5.817 1.00 64.34 C ATOM 543 C ALA A 36 4.851 4.326 6.479 1.00 43.42 C ATOM 544 O ALA A 36 4.605 3.708 7.515 1.00 40.14 O ATOM 545 CB ALA A 36 6.863 5.641 5.786 1.00 25.31 C ATOM 0 H ALA A 36 6.560 4.298 3.747 1.00 15.05 H new ATOM 0 HA ALA A 36 6.851 3.594 6.409 1.00 64.34 H new ATOM 0 HB1 ALA A 36 6.926 6.036 6.800 1.00 25.31 H new ATOM 0 HB2 ALA A 36 7.864 5.568 5.362 1.00 25.31 H new ATOM 0 HB3 ALA A 36 6.257 6.309 5.174 1.00 25.31 H new ATOM 551 N PRO A 37 3.935 5.094 5.869 1.00 24.43 N ATOM 552 CA PRO A 37 2.572 5.258 6.383 1.00 43.30 C ATOM 553 C PRO A 37 1.743 3.986 6.243 1.00 13.55 C ATOM 554 O PRO A 37 0.856 3.719 7.055 1.00 61.22 O ATOM 555 CB PRO A 37 1.995 6.372 5.506 1.00 10.21 C ATOM 556 CG PRO A 37 2.777 6.301 4.240 1.00 51.40 C ATOM 557 CD PRO A 37 4.160 5.859 4.632 1.00 53.15 C ATOM 0 HA PRO A 37 2.562 5.487 7.449 1.00 43.30 H new ATOM 0 HB2 PRO A 37 0.931 6.221 5.323 1.00 10.21 H new ATOM 0 HB3 PRO A 37 2.101 7.346 5.983 1.00 10.21 H new ATOM 0 HG2 PRO A 37 2.326 5.597 3.541 1.00 51.40 H new ATOM 0 HG3 PRO A 37 2.803 7.271 3.743 1.00 51.40 H new ATOM 0 HD2 PRO A 37 4.620 5.245 3.858 1.00 53.15 H new ATOM 0 HD3 PRO A 37 4.821 6.709 4.800 1.00 53.15 H new ATOM 565 N LYS A 38 2.036 3.205 5.210 1.00 61.40 N ATOM 566 CA LYS A 38 1.319 1.959 4.964 1.00 11.23 C ATOM 567 C LYS A 38 1.577 0.953 6.082 1.00 51.25 C ATOM 568 O LYS A 38 0.642 0.440 6.697 1.00 41.23 O ATOM 569 CB LYS A 38 1.738 1.362 3.619 1.00 2.01 C ATOM 570 CG LYS A 38 0.939 1.894 2.442 1.00 62.00 C ATOM 571 CD LYS A 38 -0.221 0.976 2.096 1.00 54.45 C ATOM 572 CE LYS A 38 -1.534 1.503 2.654 1.00 13.05 C ATOM 573 NZ LYS A 38 -1.911 2.810 2.048 1.00 71.22 N ATOM 0 H LYS A 38 2.766 3.413 4.528 1.00 61.40 H new ATOM 0 HA LYS A 38 0.252 2.182 4.939 1.00 11.23 H new ATOM 0 HB2 LYS A 38 2.795 1.569 3.453 1.00 2.01 H new ATOM 0 HB3 LYS A 38 1.628 0.278 3.662 1.00 2.01 H new ATOM 0 HG2 LYS A 38 0.560 2.888 2.678 1.00 62.00 H new ATOM 0 HG3 LYS A 38 1.592 1.999 1.576 1.00 62.00 H new ATOM 0 HD2 LYS A 38 -0.298 0.877 1.013 1.00 54.45 H new ATOM 0 HD3 LYS A 38 -0.029 -0.020 2.494 1.00 54.45 H new ATOM 0 HE2 LYS A 38 -2.325 0.776 2.469 1.00 13.05 H new ATOM 0 HE3 LYS A 38 -1.450 1.615 3.735 1.00 13.05 H new ATOM 0 HZ1 LYS A 38 -2.947 2.904 2.043 1.00 71.22 H new ATOM 0 HZ2 LYS A 38 -1.495 3.584 2.605 1.00 71.22 H new ATOM 0 HZ3 LYS A 38 -1.555 2.856 1.072 1.00 71.22 H new ATOM 587 N VAL A 39 2.851 0.676 6.340 1.00 41.41 N ATOM 588 CA VAL A 39 3.232 -0.266 7.385 1.00 30.21 C ATOM 589 C VAL A 39 2.850 0.259 8.764 1.00 2.04 C ATOM 590 O VAL A 39 2.443 -0.504 9.640 1.00 71.35 O ATOM 591 CB VAL A 39 4.745 -0.553 7.358 1.00 70.22 C ATOM 592 CG1 VAL A 39 5.101 -1.637 8.364 1.00 62.23 C ATOM 593 CG2 VAL A 39 5.187 -0.948 5.957 1.00 73.51 C ATOM 0 H VAL A 39 3.637 1.091 5.839 1.00 41.41 H new ATOM 0 HA VAL A 39 2.691 -1.192 7.189 1.00 30.21 H new ATOM 0 HB VAL A 39 5.275 0.357 7.638 1.00 70.22 H new ATOM 0 HG11 VAL A 39 6.174 -1.826 8.331 1.00 62.23 H new ATOM 0 HG12 VAL A 39 4.821 -1.310 9.365 1.00 62.23 H new ATOM 0 HG13 VAL A 39 4.563 -2.553 8.118 1.00 62.23 H new ATOM 0 HG21 VAL A 39 6.259 -1.147 5.956 1.00 73.51 H new ATOM 0 HG22 VAL A 39 4.651 -1.845 5.646 1.00 73.51 H new ATOM 0 HG23 VAL A 39 4.968 -0.136 5.264 1.00 73.51 H new ATOM 603 N ALA A 40 2.984 1.568 8.951 1.00 23.01 N ATOM 604 CA ALA A 40 2.651 2.196 10.223 1.00 10.34 C ATOM 605 C ALA A 40 1.161 2.070 10.525 1.00 65.35 C ATOM 606 O ALA A 40 0.772 1.714 11.636 1.00 3.24 O ATOM 607 CB ALA A 40 3.067 3.660 10.214 1.00 21.23 C ATOM 0 H ALA A 40 3.321 2.214 8.237 1.00 23.01 H new ATOM 0 HA ALA A 40 3.200 1.678 11.010 1.00 10.34 H new ATOM 0 HB1 ALA A 40 2.812 4.117 11.170 1.00 21.23 H new ATOM 0 HB2 ALA A 40 4.143 3.732 10.053 1.00 21.23 H new ATOM 0 HB3 ALA A 40 2.544 4.182 9.412 1.00 21.23 H new ATOM 613 N GLU A 41 0.334 2.364 9.527 1.00 75.11 N ATOM 614 CA GLU A 41 -1.114 2.284 9.687 1.00 24.03 C ATOM 615 C GLU A 41 -1.558 0.841 9.909 1.00 64.11 C ATOM 616 O GLU A 41 -2.368 0.558 10.791 1.00 40.42 O ATOM 617 CB GLU A 41 -1.818 2.863 8.458 1.00 20.24 C ATOM 618 CG GLU A 41 -3.287 3.175 8.690 1.00 60.25 C ATOM 619 CD GLU A 41 -3.886 4.017 7.580 1.00 71.00 C ATOM 620 OE1 GLU A 41 -3.111 4.586 6.784 1.00 44.44 O ATOM 621 OE2 GLU A 41 -5.129 4.107 7.508 1.00 14.00 O ATOM 0 H GLU A 41 0.641 2.659 8.600 1.00 75.11 H new ATOM 0 HA GLU A 41 -1.390 2.870 10.564 1.00 24.03 H new ATOM 0 HB2 GLU A 41 -1.305 3.775 8.152 1.00 20.24 H new ATOM 0 HB3 GLU A 41 -1.731 2.156 7.633 1.00 20.24 H new ATOM 0 HG2 GLU A 41 -3.844 2.242 8.774 1.00 60.25 H new ATOM 0 HG3 GLU A 41 -3.398 3.699 9.639 1.00 60.25 H new ATOM 628 N MET A 42 -1.021 -0.068 9.101 1.00 2.22 N ATOM 629 CA MET A 42 -1.361 -1.482 9.209 1.00 1.21 C ATOM 630 C MET A 42 -0.897 -2.052 10.546 1.00 63.14 C ATOM 631 O MET A 42 -1.664 -2.707 11.251 1.00 2.13 O ATOM 632 CB MET A 42 -0.731 -2.269 8.059 1.00 64.12 C ATOM 633 CG MET A 42 -1.604 -3.404 7.549 1.00 23.32 C ATOM 634 SD MET A 42 -1.854 -4.696 8.782 1.00 4.23 S ATOM 635 CE MET A 42 -0.238 -5.469 8.794 1.00 32.55 C ATOM 0 H MET A 42 -0.349 0.149 8.365 1.00 2.22 H new ATOM 0 HA MET A 42 -2.446 -1.575 9.152 1.00 1.21 H new ATOM 0 HB2 MET A 42 -0.519 -1.587 7.236 1.00 64.12 H new ATOM 0 HB3 MET A 42 0.224 -2.677 8.389 1.00 64.12 H new ATOM 0 HG2 MET A 42 -2.572 -3.005 7.246 1.00 23.32 H new ATOM 0 HG3 MET A 42 -1.146 -3.839 6.661 1.00 23.32 H new ATOM 0 HE1 MET A 42 -0.281 -6.393 9.371 1.00 32.55 H new ATOM 0 HE2 MET A 42 0.065 -5.694 7.771 1.00 32.55 H new ATOM 0 HE3 MET A 42 0.486 -4.791 9.247 1.00 32.55 H new ATOM 645 N TRP A 43 0.362 -1.799 10.886 1.00 32.41 N ATOM 646 CA TRP A 43 0.928 -2.289 12.138 1.00 15.33 C ATOM 647 C TRP A 43 0.117 -1.795 13.331 1.00 34.24 C ATOM 648 O TRP A 43 -0.271 -2.579 14.199 1.00 44.33 O ATOM 649 CB TRP A 43 2.383 -1.839 12.274 1.00 22.12 C ATOM 650 CG TRP A 43 3.066 -2.394 13.488 1.00 74.44 C ATOM 651 CD1 TRP A 43 3.658 -3.619 13.606 1.00 34.43 C ATOM 652 CD2 TRP A 43 3.224 -1.746 14.754 1.00 42.51 C ATOM 653 NE1 TRP A 43 4.175 -3.771 14.870 1.00 33.13 N ATOM 654 CE2 TRP A 43 3.923 -2.635 15.593 1.00 32.33 C ATOM 655 CE3 TRP A 43 2.846 -0.499 15.260 1.00 41.02 C ATOM 656 CZ2 TRP A 43 4.248 -2.317 16.909 1.00 43.50 C ATOM 657 CZ3 TRP A 43 3.170 -0.184 16.566 1.00 74.31 C ATOM 658 CH2 TRP A 43 3.866 -1.089 17.378 1.00 34.32 C ATOM 0 H TRP A 43 1.010 -1.258 10.313 1.00 32.41 H new ATOM 0 HA TRP A 43 0.892 -3.378 12.123 1.00 15.33 H new ATOM 0 HB2 TRP A 43 2.935 -2.144 11.385 1.00 22.12 H new ATOM 0 HB3 TRP A 43 2.417 -0.750 12.313 1.00 22.12 H new ATOM 0 HD1 TRP A 43 3.712 -4.359 12.821 1.00 34.43 H new ATOM 0 HE1 TRP A 43 4.667 -4.596 15.214 1.00 33.13 H new ATOM 0 HE3 TRP A 43 2.310 0.206 14.641 1.00 41.02 H new ATOM 0 HZ2 TRP A 43 4.782 -3.014 17.537 1.00 43.50 H new ATOM 0 HZ3 TRP A 43 2.882 0.776 16.968 1.00 74.31 H new ATOM 0 HH2 TRP A 43 4.106 -0.812 18.394 1.00 34.32 H new ATOM 669 N LYS A 44 -0.138 -0.492 13.370 1.00 2.30 N ATOM 670 CA LYS A 44 -0.904 0.107 14.456 1.00 34.13 C ATOM 671 C LYS A 44 -2.303 -0.498 14.533 1.00 4.11 C ATOM 672 O LYS A 44 -2.680 -1.083 15.548 1.00 51.14 O ATOM 673 CB LYS A 44 -1.002 1.622 14.264 1.00 14.03 C ATOM 674 CG LYS A 44 -1.835 2.317 15.328 1.00 51.25 C ATOM 675 CD LYS A 44 -3.254 2.570 14.847 1.00 13.12 C ATOM 676 CE LYS A 44 -3.826 3.847 15.445 1.00 63.23 C ATOM 677 NZ LYS A 44 -3.603 5.022 14.558 1.00 55.23 N ATOM 0 H LYS A 44 0.175 0.171 12.661 1.00 2.30 H new ATOM 0 HA LYS A 44 -0.385 -0.101 15.391 1.00 34.13 H new ATOM 0 HB2 LYS A 44 0.002 2.046 14.266 1.00 14.03 H new ATOM 0 HB3 LYS A 44 -1.433 1.829 13.284 1.00 14.03 H new ATOM 0 HG2 LYS A 44 -1.859 1.705 16.230 1.00 51.25 H new ATOM 0 HG3 LYS A 44 -1.367 3.264 15.597 1.00 51.25 H new ATOM 0 HD2 LYS A 44 -3.264 2.640 13.759 1.00 13.12 H new ATOM 0 HD3 LYS A 44 -3.887 1.725 15.117 1.00 13.12 H new ATOM 0 HE2 LYS A 44 -4.895 3.720 15.618 1.00 63.23 H new ATOM 0 HE3 LYS A 44 -3.365 4.032 16.416 1.00 63.23 H new ATOM 0 HZ1 LYS A 44 -3.770 5.898 15.093 1.00 55.23 H new ATOM 0 HZ2 LYS A 44 -2.624 5.012 14.208 1.00 55.23 H new ATOM 0 HZ3 LYS A 44 -4.259 4.978 13.753 1.00 55.23 H new ATOM 691 N GLU A 45 -3.065 -0.354 13.454 1.00 52.52 N ATOM 692 CA GLU A 45 -4.421 -0.887 13.400 1.00 13.25 C ATOM 693 C GLU A 45 -4.438 -2.368 13.768 1.00 14.34 C ATOM 694 O GLU A 45 -5.406 -2.864 14.345 1.00 74.10 O ATOM 695 CB GLU A 45 -5.016 -0.690 12.004 1.00 10.05 C ATOM 696 CG GLU A 45 -5.706 0.651 11.820 1.00 3.33 C ATOM 697 CD GLU A 45 -6.821 0.598 10.794 1.00 23.00 C ATOM 698 OE1 GLU A 45 -7.729 -0.244 10.950 1.00 75.54 O ATOM 699 OE2 GLU A 45 -6.785 1.398 9.836 1.00 64.33 O ATOM 0 H GLU A 45 -2.767 0.127 12.606 1.00 52.52 H new ATOM 0 HA GLU A 45 -5.027 -0.343 14.125 1.00 13.25 H new ATOM 0 HB2 GLU A 45 -4.222 -0.785 11.263 1.00 10.05 H new ATOM 0 HB3 GLU A 45 -5.732 -1.488 11.808 1.00 10.05 H new ATOM 0 HG2 GLU A 45 -6.113 0.980 12.776 1.00 3.33 H new ATOM 0 HG3 GLU A 45 -4.970 1.395 11.513 1.00 3.33 H new ATOM 706 N TYR A 46 -3.361 -3.067 13.430 1.00 31.53 N ATOM 707 CA TYR A 46 -3.253 -4.492 13.722 1.00 44.02 C ATOM 708 C TYR A 46 -2.953 -4.724 15.200 1.00 71.55 C ATOM 709 O TYR A 46 -3.438 -5.683 15.799 1.00 34.31 O ATOM 710 CB TYR A 46 -2.159 -5.128 12.862 1.00 1.11 C ATOM 711 CG TYR A 46 -1.740 -6.502 13.334 1.00 2.22 C ATOM 712 CD1 TYR A 46 -0.717 -6.657 14.261 1.00 4.15 C ATOM 713 CD2 TYR A 46 -2.366 -7.645 12.853 1.00 50.34 C ATOM 714 CE1 TYR A 46 -0.330 -7.910 14.695 1.00 23.24 C ATOM 715 CE2 TYR A 46 -1.987 -8.902 13.282 1.00 42.31 C ATOM 716 CZ TYR A 46 -0.968 -9.029 14.203 1.00 31.41 C ATOM 717 OH TYR A 46 -0.586 -10.280 14.632 1.00 15.11 O ATOM 0 H TYR A 46 -2.550 -2.671 12.954 1.00 31.53 H new ATOM 0 HA TYR A 46 -4.209 -4.959 13.486 1.00 44.02 H new ATOM 0 HB2 TYR A 46 -2.512 -5.199 11.833 1.00 1.11 H new ATOM 0 HB3 TYR A 46 -1.287 -4.474 12.856 1.00 1.11 H new ATOM 0 HD1 TYR A 46 -0.216 -5.783 14.649 1.00 4.15 H new ATOM 0 HD2 TYR A 46 -3.163 -7.549 12.131 1.00 50.34 H new ATOM 0 HE1 TYR A 46 0.468 -8.013 15.416 1.00 23.24 H new ATOM 0 HE2 TYR A 46 -2.485 -9.780 12.899 1.00 42.31 H new ATOM 0 HH TYR A 46 -1.325 -10.910 14.501 1.00 15.11 H new ATOM 727 N MET A 47 -2.150 -3.839 15.780 1.00 13.33 N ATOM 728 CA MET A 47 -1.787 -3.945 17.189 1.00 61.45 C ATOM 729 C MET A 47 -2.937 -3.493 18.083 1.00 42.34 C ATOM 730 O MET A 47 -2.995 -3.843 19.262 1.00 4.01 O ATOM 731 CB MET A 47 -0.539 -3.109 17.480 1.00 32.30 C ATOM 732 CG MET A 47 0.712 -3.624 16.788 1.00 45.22 C ATOM 733 SD MET A 47 1.573 -4.880 17.753 1.00 5.01 S ATOM 734 CE MET A 47 2.371 -3.865 18.995 1.00 70.01 C ATOM 0 H MET A 47 -1.738 -3.041 15.297 1.00 13.33 H new ATOM 0 HA MET A 47 -1.573 -4.992 17.406 1.00 61.45 H new ATOM 0 HB2 MET A 47 -0.720 -2.080 17.168 1.00 32.30 H new ATOM 0 HB3 MET A 47 -0.367 -3.090 18.556 1.00 32.30 H new ATOM 0 HG2 MET A 47 0.441 -4.040 15.818 1.00 45.22 H new ATOM 0 HG3 MET A 47 1.388 -2.790 16.600 1.00 45.22 H new ATOM 0 HE1 MET A 47 3.406 -4.185 19.116 1.00 70.01 H new ATOM 0 HE2 MET A 47 2.348 -2.821 18.681 1.00 70.01 H new ATOM 0 HE3 MET A 47 1.845 -3.970 19.944 1.00 70.01 H new ATOM 744 N LEU A 48 -3.850 -2.713 17.515 1.00 40.42 N ATOM 745 CA LEU A 48 -4.999 -2.212 18.261 1.00 50.41 C ATOM 746 C LEU A 48 -6.240 -3.052 17.979 1.00 72.14 C ATOM 747 O LEU A 48 -7.364 -2.550 18.016 1.00 44.14 O ATOM 748 CB LEU A 48 -5.267 -0.749 17.902 1.00 70.14 C ATOM 749 CG LEU A 48 -4.107 0.221 18.128 1.00 41.14 C ATOM 750 CD1 LEU A 48 -4.492 1.625 17.689 1.00 51.33 C ATOM 751 CD2 LEU A 48 -3.683 0.214 19.589 1.00 12.52 C ATOM 0 H LEU A 48 -3.817 -2.414 16.540 1.00 40.42 H new ATOM 0 HA LEU A 48 -4.769 -2.283 19.324 1.00 50.41 H new ATOM 0 HB2 LEU A 48 -5.556 -0.700 16.852 1.00 70.14 H new ATOM 0 HB3 LEU A 48 -6.122 -0.404 18.484 1.00 70.14 H new ATOM 0 HG LEU A 48 -3.261 -0.107 17.524 1.00 41.14 H new ATOM 0 HD11 LEU A 48 -3.654 2.301 17.857 1.00 51.33 H new ATOM 0 HD12 LEU A 48 -4.745 1.618 16.629 1.00 51.33 H new ATOM 0 HD13 LEU A 48 -5.353 1.963 18.266 1.00 51.33 H new ATOM 0 HD21 LEU A 48 -2.856 0.910 19.731 1.00 12.52 H new ATOM 0 HD22 LEU A 48 -4.524 0.517 20.213 1.00 12.52 H new ATOM 0 HD23 LEU A 48 -3.365 -0.790 19.871 1.00 12.52 H new ATOM 763 N ARG A 49 -6.029 -4.334 17.699 1.00 72.13 N ATOM 764 CA ARG A 49 -7.131 -5.245 17.411 1.00 0.44 C ATOM 765 C ARG A 49 -7.243 -6.319 18.489 1.00 72.32 C ATOM 766 O ARG A 49 -6.246 -6.801 19.026 1.00 63.10 O ATOM 767 CB ARG A 49 -6.936 -5.898 16.042 1.00 34.51 C ATOM 768 CG ARG A 49 -7.564 -5.117 14.899 1.00 31.24 C ATOM 769 CD ARG A 49 -7.091 -5.630 13.548 1.00 12.01 C ATOM 770 NE ARG A 49 -8.120 -5.494 12.521 1.00 71.34 N ATOM 771 CZ ARG A 49 -7.877 -5.600 11.219 1.00 73.31 C ATOM 772 NH1 ARG A 49 -6.647 -5.843 10.788 1.00 0.33 N ATOM 773 NH2 ARG A 49 -8.867 -5.464 10.345 1.00 25.50 N ATOM 0 H ARG A 49 -5.105 -4.765 17.665 1.00 72.13 H new ATOM 0 HA ARG A 49 -8.055 -4.667 17.401 1.00 0.44 H new ATOM 0 HB2 ARG A 49 -5.869 -6.010 15.851 1.00 34.51 H new ATOM 0 HB3 ARG A 49 -7.363 -6.901 16.063 1.00 34.51 H new ATOM 0 HG2 ARG A 49 -8.650 -5.193 14.958 1.00 31.24 H new ATOM 0 HG3 ARG A 49 -7.312 -4.061 14.997 1.00 31.24 H new ATOM 0 HD2 ARG A 49 -6.200 -5.081 13.243 1.00 12.01 H new ATOM 0 HD3 ARG A 49 -6.805 -6.678 13.638 1.00 12.01 H new ATOM 0 HE ARG A 49 -9.077 -5.307 12.819 1.00 71.34 H new ATOM 0 HH11 ARG A 49 -5.884 -5.949 11.457 1.00 0.33 H new ATOM 0 HH12 ARG A 49 -6.464 -5.924 9.788 1.00 0.33 H new ATOM 0 HH21 ARG A 49 -9.815 -5.278 10.673 1.00 25.50 H new ATOM 0 HH22 ARG A 49 -8.680 -5.545 9.346 1.00 25.50 H new ATOM 787 N PRO A 50 -8.486 -6.704 18.814 1.00 73.55 N ATOM 788 CA PRO A 50 -8.759 -7.726 19.829 1.00 3.11 C ATOM 789 C PRO A 50 -8.340 -9.120 19.376 1.00 62.22 C ATOM 790 O PRO A 50 -7.748 -9.881 20.142 1.00 42.42 O ATOM 791 CB PRO A 50 -10.278 -7.655 20.005 1.00 5.34 C ATOM 792 CG PRO A 50 -10.784 -7.113 18.713 1.00 2.23 C ATOM 793 CD PRO A 50 -9.722 -6.173 18.214 1.00 43.21 C ATOM 0 HA PRO A 50 -8.201 -7.546 20.748 1.00 3.11 H new ATOM 0 HB2 PRO A 50 -10.699 -8.639 20.214 1.00 5.34 H new ATOM 0 HB3 PRO A 50 -10.550 -7.008 20.839 1.00 5.34 H new ATOM 0 HG2 PRO A 50 -10.963 -7.915 17.997 1.00 2.23 H new ATOM 0 HG3 PRO A 50 -11.732 -6.593 18.852 1.00 2.23 H new ATOM 0 HD2 PRO A 50 -9.670 -6.167 17.125 1.00 43.21 H new ATOM 0 HD3 PRO A 50 -9.913 -5.147 18.529 1.00 43.21 H new ATOM 801 N SER A 51 -8.650 -9.449 18.126 1.00 34.51 N ATOM 802 CA SER A 51 -8.309 -10.754 17.572 1.00 62.31 C ATOM 803 C SER A 51 -6.840 -11.082 17.820 1.00 24.22 C ATOM 804 O SER A 51 -6.486 -12.228 18.100 1.00 41.31 O ATOM 805 CB SER A 51 -8.604 -10.788 16.071 1.00 10.32 C ATOM 806 OG SER A 51 -9.904 -10.295 15.796 1.00 61.10 O ATOM 0 H SER A 51 -9.137 -8.830 17.478 1.00 34.51 H new ATOM 0 HA SER A 51 -8.921 -11.505 18.072 1.00 62.31 H new ATOM 0 HB2 SER A 51 -7.865 -10.190 15.538 1.00 10.32 H new ATOM 0 HB3 SER A 51 -8.513 -11.810 15.702 1.00 10.32 H new ATOM 0 HG SER A 51 -10.068 -10.325 14.830 1.00 61.10 H new ATOM 812 N VAL A 52 -5.987 -10.067 17.716 1.00 74.44 N ATOM 813 CA VAL A 52 -4.556 -10.246 17.929 1.00 13.25 C ATOM 814 C VAL A 52 -4.263 -10.663 19.366 1.00 31.41 C ATOM 815 O VAL A 52 -4.801 -10.090 20.312 1.00 54.21 O ATOM 816 CB VAL A 52 -3.776 -8.956 17.612 1.00 73.20 C ATOM 817 CG1 VAL A 52 -2.279 -9.193 17.737 1.00 0.14 C ATOM 818 CG2 VAL A 52 -4.130 -8.449 16.222 1.00 4.10 C ATOM 0 H VAL A 52 -6.263 -9.112 17.485 1.00 74.44 H new ATOM 0 HA VAL A 52 -4.231 -11.035 17.251 1.00 13.25 H new ATOM 0 HB VAL A 52 -4.060 -8.192 18.336 1.00 73.20 H new ATOM 0 HG11 VAL A 52 -1.744 -8.271 17.509 1.00 0.14 H new ATOM 0 HG12 VAL A 52 -2.044 -9.507 18.754 1.00 0.14 H new ATOM 0 HG13 VAL A 52 -1.974 -9.971 17.037 1.00 0.14 H new ATOM 0 HG21 VAL A 52 -3.570 -7.537 16.014 1.00 4.10 H new ATOM 0 HG22 VAL A 52 -3.875 -9.208 15.482 1.00 4.10 H new ATOM 0 HG23 VAL A 52 -5.198 -8.238 16.173 1.00 4.10 H new ATOM 828 N ASN A 53 -3.405 -11.666 19.522 1.00 71.54 N ATOM 829 CA ASN A 53 -3.040 -12.162 20.844 1.00 42.42 C ATOM 830 C ASN A 53 -1.928 -11.313 21.454 1.00 32.53 C ATOM 831 O ASN A 53 -1.158 -10.671 20.740 1.00 64.32 O ATOM 832 CB ASN A 53 -2.594 -13.623 20.759 1.00 45.32 C ATOM 833 CG ASN A 53 -3.501 -14.453 19.872 1.00 64.53 C ATOM 834 OD1 ASN A 53 -3.482 -14.321 18.648 1.00 43.21 O ATOM 835 ND2 ASN A 53 -4.301 -15.316 20.487 1.00 20.20 N ATOM 0 H ASN A 53 -2.949 -12.151 18.749 1.00 71.54 H new ATOM 0 HA ASN A 53 -3.919 -12.095 21.486 1.00 42.42 H new ATOM 0 HB2 ASN A 53 -1.575 -13.667 20.375 1.00 45.32 H new ATOM 0 HB3 ASN A 53 -2.576 -14.054 21.760 1.00 45.32 H new ATOM 0 HD21 ASN A 53 -4.933 -15.903 19.942 1.00 20.20 H new ATOM 0 HD22 ASN A 53 -4.283 -15.392 21.504 1.00 20.20 H new ATOM 842 N THR A 54 -1.850 -11.316 22.782 1.00 52.05 N ATOM 843 CA THR A 54 -0.834 -10.547 23.489 1.00 71.21 C ATOM 844 C THR A 54 0.556 -10.825 22.927 1.00 34.04 C ATOM 845 O THR A 54 1.351 -9.906 22.731 1.00 61.22 O ATOM 846 CB THR A 54 -0.839 -10.863 24.996 1.00 22.15 C ATOM 847 OG1 THR A 54 -1.514 -12.103 25.235 1.00 22.30 O ATOM 848 CG2 THR A 54 -1.519 -9.751 25.780 1.00 2.24 C ATOM 0 H THR A 54 -2.479 -11.843 23.389 1.00 52.05 H new ATOM 0 HA THR A 54 -1.077 -9.494 23.345 1.00 71.21 H new ATOM 0 HB THR A 54 0.195 -10.942 25.331 1.00 22.15 H new ATOM 0 HG1 THR A 54 -1.511 -12.297 26.196 1.00 22.30 H new ATOM 0 HG21 THR A 54 -1.510 -9.997 26.842 1.00 2.24 H new ATOM 0 HG22 THR A 54 -0.985 -8.814 25.620 1.00 2.24 H new ATOM 0 HG23 THR A 54 -2.549 -9.644 25.441 1.00 2.24 H new ATOM 856 N ARG A 55 0.841 -12.097 22.670 1.00 24.24 N ATOM 857 CA ARG A 55 2.136 -12.496 22.132 1.00 42.45 C ATOM 858 C ARG A 55 2.493 -11.664 20.903 1.00 51.01 C ATOM 859 O ARG A 55 3.583 -11.099 20.819 1.00 44.10 O ATOM 860 CB ARG A 55 2.126 -13.982 21.769 1.00 3.12 C ATOM 861 CG ARG A 55 2.567 -14.889 22.907 1.00 53.15 C ATOM 862 CD ARG A 55 2.937 -16.275 22.402 1.00 4.21 C ATOM 863 NE ARG A 55 3.788 -16.992 23.348 1.00 30.20 N ATOM 864 CZ ARG A 55 5.077 -16.725 23.526 1.00 11.02 C ATOM 865 NH1 ARG A 55 5.661 -15.762 22.827 1.00 55.42 N ATOM 866 NH2 ARG A 55 5.785 -17.422 24.406 1.00 13.21 N ATOM 0 H ARG A 55 0.193 -12.869 22.826 1.00 24.24 H new ATOM 0 HA ARG A 55 2.890 -12.322 22.900 1.00 42.45 H new ATOM 0 HB2 ARG A 55 1.120 -14.265 21.459 1.00 3.12 H new ATOM 0 HB3 ARG A 55 2.781 -14.143 20.913 1.00 3.12 H new ATOM 0 HG2 ARG A 55 3.422 -14.446 23.417 1.00 53.15 H new ATOM 0 HG3 ARG A 55 1.765 -14.970 23.641 1.00 53.15 H new ATOM 0 HD2 ARG A 55 2.029 -16.850 22.223 1.00 4.21 H new ATOM 0 HD3 ARG A 55 3.452 -16.187 21.445 1.00 4.21 H new ATOM 0 HE ARG A 55 3.369 -17.739 23.902 1.00 30.20 H new ATOM 0 HH11 ARG A 55 5.120 -15.224 22.150 1.00 55.42 H new ATOM 0 HH12 ARG A 55 6.651 -15.559 22.966 1.00 55.42 H new ATOM 0 HH21 ARG A 55 5.339 -18.164 24.946 1.00 13.21 H new ATOM 0 HH22 ARG A 55 6.775 -17.216 24.542 1.00 13.21 H new ATOM 880 N ARG A 56 1.567 -11.594 19.953 1.00 74.55 N ATOM 881 CA ARG A 56 1.784 -10.834 18.728 1.00 50.30 C ATOM 882 C ARG A 56 2.159 -9.389 19.045 1.00 51.02 C ATOM 883 O ARG A 56 2.910 -8.754 18.304 1.00 23.23 O ATOM 884 CB ARG A 56 0.530 -10.866 17.853 1.00 73.13 C ATOM 885 CG ARG A 56 0.366 -12.159 17.071 1.00 33.42 C ATOM 886 CD ARG A 56 -0.358 -13.217 17.890 1.00 71.02 C ATOM 887 NE ARG A 56 0.572 -14.115 18.568 1.00 22.43 N ATOM 888 CZ ARG A 56 0.236 -15.320 19.017 1.00 51.41 C ATOM 889 NH1 ARG A 56 -1.002 -15.767 18.859 1.00 30.52 N ATOM 890 NH2 ARG A 56 1.139 -16.079 19.624 1.00 11.23 N ATOM 0 H ARG A 56 0.659 -12.055 20.008 1.00 74.55 H new ATOM 0 HA ARG A 56 2.609 -11.296 18.185 1.00 50.30 H new ATOM 0 HB2 ARG A 56 -0.347 -10.719 18.484 1.00 73.13 H new ATOM 0 HB3 ARG A 56 0.563 -10.030 17.154 1.00 73.13 H new ATOM 0 HG2 ARG A 56 -0.190 -11.963 16.154 1.00 33.42 H new ATOM 0 HG3 ARG A 56 1.346 -12.534 16.775 1.00 33.42 H new ATOM 0 HD2 ARG A 56 -0.995 -12.731 18.628 1.00 71.02 H new ATOM 0 HD3 ARG A 56 -1.011 -13.797 17.237 1.00 71.02 H new ATOM 0 HE ARG A 56 1.533 -13.800 18.705 1.00 22.43 H new ATOM 0 HH11 ARG A 56 -1.698 -15.186 18.392 1.00 30.52 H new ATOM 0 HH12 ARG A 56 -1.258 -16.692 19.204 1.00 30.52 H new ATOM 0 HH21 ARG A 56 2.092 -15.738 19.747 1.00 11.23 H new ATOM 0 HH22 ARG A 56 0.880 -17.004 19.968 1.00 11.23 H new ATOM 904 N LYS A 57 1.630 -8.875 20.150 1.00 40.31 N ATOM 905 CA LYS A 57 1.909 -7.505 20.567 1.00 74.45 C ATOM 906 C LYS A 57 3.342 -7.371 21.071 1.00 32.33 C ATOM 907 O LYS A 57 4.104 -6.530 20.592 1.00 75.42 O ATOM 908 CB LYS A 57 0.929 -7.074 21.660 1.00 10.02 C ATOM 909 CG LYS A 57 -0.507 -7.486 21.387 1.00 13.13 C ATOM 910 CD LYS A 57 -1.010 -6.917 20.071 1.00 12.33 C ATOM 911 CE LYS A 57 -2.500 -6.616 20.127 1.00 32.40 C ATOM 912 NZ LYS A 57 -3.279 -7.771 20.655 1.00 53.42 N ATOM 0 H LYS A 57 1.005 -9.386 20.774 1.00 40.31 H new ATOM 0 HA LYS A 57 1.786 -6.855 19.701 1.00 74.45 H new ATOM 0 HB2 LYS A 57 1.247 -7.503 22.611 1.00 10.02 H new ATOM 0 HB3 LYS A 57 0.973 -5.990 21.769 1.00 10.02 H new ATOM 0 HG2 LYS A 57 -0.576 -8.574 21.364 1.00 13.13 H new ATOM 0 HG3 LYS A 57 -1.146 -7.143 22.201 1.00 13.13 H new ATOM 0 HD2 LYS A 57 -0.462 -6.005 19.835 1.00 12.33 H new ATOM 0 HD3 LYS A 57 -0.811 -7.626 19.267 1.00 12.33 H new ATOM 0 HE2 LYS A 57 -2.671 -5.744 20.758 1.00 32.40 H new ATOM 0 HE3 LYS A 57 -2.857 -6.363 19.129 1.00 32.40 H new ATOM 0 HZ1 LYS A 57 -4.225 -7.778 20.223 1.00 53.42 H new ATOM 0 HZ2 LYS A 57 -2.786 -8.657 20.424 1.00 53.42 H new ATOM 0 HZ3 LYS A 57 -3.371 -7.685 21.687 1.00 53.42 H new ATOM 926 N LEU A 58 3.703 -8.205 22.040 1.00 64.31 N ATOM 927 CA LEU A 58 5.047 -8.181 22.609 1.00 55.22 C ATOM 928 C LEU A 58 6.104 -8.275 21.513 1.00 34.43 C ATOM 929 O LEU A 58 7.105 -7.558 21.538 1.00 54.01 O ATOM 930 CB LEU A 58 5.222 -9.330 23.603 1.00 74.21 C ATOM 931 CG LEU A 58 6.591 -9.433 24.275 1.00 21.42 C ATOM 932 CD1 LEU A 58 7.567 -10.188 23.386 1.00 72.13 C ATOM 933 CD2 LEU A 58 7.129 -8.049 24.605 1.00 10.32 C ATOM 0 H LEU A 58 3.085 -8.906 22.448 1.00 64.31 H new ATOM 0 HA LEU A 58 5.177 -7.234 23.132 1.00 55.22 H new ATOM 0 HB2 LEU A 58 4.465 -9.230 24.380 1.00 74.21 H new ATOM 0 HB3 LEU A 58 5.023 -10.267 23.083 1.00 74.21 H new ATOM 0 HG LEU A 58 6.476 -9.988 25.206 1.00 21.42 H new ATOM 0 HD11 LEU A 58 8.536 -10.251 23.881 1.00 72.13 H new ATOM 0 HD12 LEU A 58 7.188 -11.193 23.201 1.00 72.13 H new ATOM 0 HD13 LEU A 58 7.678 -9.662 22.438 1.00 72.13 H new ATOM 0 HD21 LEU A 58 8.104 -8.142 25.083 1.00 10.32 H new ATOM 0 HD22 LEU A 58 7.228 -7.469 23.688 1.00 10.32 H new ATOM 0 HD23 LEU A 58 6.440 -7.543 25.281 1.00 10.32 H new ATOM 945 N LEU A 59 5.874 -9.163 20.552 1.00 21.21 N ATOM 946 CA LEU A 59 6.806 -9.350 19.445 1.00 33.42 C ATOM 947 C LEU A 59 6.752 -8.168 18.483 1.00 62.33 C ATOM 948 O LEU A 59 7.786 -7.650 18.062 1.00 14.10 O ATOM 949 CB LEU A 59 6.486 -10.646 18.698 1.00 64.33 C ATOM 950 CG LEU A 59 6.652 -11.940 19.496 1.00 42.10 C ATOM 951 CD1 LEU A 59 6.095 -13.122 18.718 1.00 32.05 C ATOM 952 CD2 LEU A 59 8.116 -12.169 19.842 1.00 63.22 C ATOM 0 H LEU A 59 5.051 -9.764 20.517 1.00 21.21 H new ATOM 0 HA LEU A 59 7.813 -9.414 19.856 1.00 33.42 H new ATOM 0 HB2 LEU A 59 5.457 -10.592 18.342 1.00 64.33 H new ATOM 0 HB3 LEU A 59 7.126 -10.701 17.817 1.00 64.33 H new ATOM 0 HG LEU A 59 6.090 -11.846 20.425 1.00 42.10 H new ATOM 0 HD11 LEU A 59 6.222 -14.034 19.301 1.00 32.05 H new ATOM 0 HD12 LEU A 59 5.035 -12.961 18.522 1.00 32.05 H new ATOM 0 HD13 LEU A 59 6.628 -13.219 17.772 1.00 32.05 H new ATOM 0 HD21 LEU A 59 8.215 -13.094 20.410 1.00 63.22 H new ATOM 0 HD22 LEU A 59 8.700 -12.242 18.924 1.00 63.22 H new ATOM 0 HD23 LEU A 59 8.483 -11.335 20.440 1.00 63.22 H new ATOM 964 N GLY A 60 5.539 -7.745 18.139 1.00 22.53 N ATOM 965 CA GLY A 60 5.373 -6.626 17.231 1.00 64.13 C ATOM 966 C GLY A 60 6.135 -5.396 17.682 1.00 42.44 C ATOM 967 O GLY A 60 6.781 -4.725 16.875 1.00 72.55 O ATOM 0 H GLY A 60 4.668 -8.158 18.473 1.00 22.53 H new ATOM 0 HA2 GLY A 60 5.712 -6.916 16.236 1.00 64.13 H new ATOM 0 HA3 GLY A 60 4.314 -6.383 17.148 1.00 64.13 H new ATOM 971 N LEU A 61 6.060 -5.096 18.973 1.00 13.45 N ATOM 972 CA LEU A 61 6.747 -3.936 19.531 1.00 54.41 C ATOM 973 C LEU A 61 8.249 -4.020 19.280 1.00 12.22 C ATOM 974 O LEU A 61 8.875 -3.044 18.865 1.00 72.20 O ATOM 975 CB LEU A 61 6.474 -3.830 21.032 1.00 13.53 C ATOM 976 CG LEU A 61 6.287 -2.415 21.582 1.00 34.02 C ATOM 977 CD1 LEU A 61 6.140 -2.446 23.096 1.00 54.24 C ATOM 978 CD2 LEU A 61 7.453 -1.526 21.176 1.00 70.22 C ATOM 0 H LEU A 61 5.530 -5.640 19.654 1.00 13.45 H new ATOM 0 HA LEU A 61 6.364 -3.044 19.035 1.00 54.41 H new ATOM 0 HB2 LEU A 61 5.578 -4.408 21.260 1.00 13.53 H new ATOM 0 HB3 LEU A 61 7.301 -4.299 21.565 1.00 13.53 H new ATOM 0 HG LEU A 61 5.374 -1.999 21.157 1.00 34.02 H new ATOM 0 HD11 LEU A 61 6.008 -1.431 23.470 1.00 54.24 H new ATOM 0 HD12 LEU A 61 5.272 -3.047 23.365 1.00 54.24 H new ATOM 0 HD13 LEU A 61 7.035 -2.882 23.540 1.00 54.24 H new ATOM 0 HD21 LEU A 61 7.303 -0.523 21.576 1.00 70.22 H new ATOM 0 HD22 LEU A 61 8.381 -1.939 21.572 1.00 70.22 H new ATOM 0 HD23 LEU A 61 7.512 -1.478 20.089 1.00 70.22 H new ATOM 990 N TYR A 62 8.821 -5.192 19.533 1.00 14.31 N ATOM 991 CA TYR A 62 10.250 -5.404 19.335 1.00 15.52 C ATOM 992 C TYR A 62 10.621 -5.269 17.862 1.00 43.34 C ATOM 993 O TYR A 62 11.709 -4.800 17.524 1.00 40.23 O ATOM 994 CB TYR A 62 10.658 -6.784 19.851 1.00 22.24 C ATOM 995 CG TYR A 62 11.161 -6.773 21.277 1.00 33.14 C ATOM 996 CD1 TYR A 62 12.236 -5.976 21.650 1.00 61.22 C ATOM 997 CD2 TYR A 62 10.559 -7.559 22.253 1.00 61.13 C ATOM 998 CE1 TYR A 62 12.699 -5.964 22.951 1.00 11.33 C ATOM 999 CE2 TYR A 62 11.014 -7.552 23.557 1.00 3.20 C ATOM 1000 CZ TYR A 62 12.085 -6.753 23.901 1.00 13.13 C ATOM 1001 OH TYR A 62 12.542 -6.742 25.199 1.00 32.11 O ATOM 0 H TYR A 62 8.317 -6.010 19.876 1.00 14.31 H new ATOM 0 HA TYR A 62 10.787 -4.640 19.898 1.00 15.52 H new ATOM 0 HB2 TYR A 62 9.803 -7.456 19.782 1.00 22.24 H new ATOM 0 HB3 TYR A 62 11.435 -7.189 19.203 1.00 22.24 H new ATOM 0 HD1 TYR A 62 12.718 -5.355 20.910 1.00 61.22 H new ATOM 0 HD2 TYR A 62 9.721 -8.186 21.987 1.00 61.13 H new ATOM 0 HE1 TYR A 62 13.537 -5.340 23.223 1.00 11.33 H new ATOM 0 HE2 TYR A 62 10.534 -8.168 24.303 1.00 3.20 H new ATOM 0 HH TYR A 62 12.000 -7.352 25.742 1.00 32.11 H new ATOM 1011 N LEU A 63 9.710 -5.682 16.988 1.00 32.53 N ATOM 1012 CA LEU A 63 9.939 -5.608 15.550 1.00 65.14 C ATOM 1013 C LEU A 63 10.026 -4.157 15.086 1.00 21.43 C ATOM 1014 O LEU A 63 11.012 -3.749 14.473 1.00 73.44 O ATOM 1015 CB LEU A 63 8.821 -6.330 14.797 1.00 54.04 C ATOM 1016 CG LEU A 63 8.874 -6.244 13.271 1.00 63.01 C ATOM 1017 CD1 LEU A 63 8.187 -4.978 12.783 1.00 34.40 C ATOM 1018 CD2 LEU A 63 10.315 -6.292 12.784 1.00 4.54 C ATOM 0 H LEU A 63 8.805 -6.072 17.251 1.00 32.53 H new ATOM 0 HA LEU A 63 10.889 -6.097 15.333 1.00 65.14 H new ATOM 0 HB2 LEU A 63 8.839 -7.382 15.082 1.00 54.04 H new ATOM 0 HB3 LEU A 63 7.865 -5.925 15.131 1.00 54.04 H new ATOM 0 HG LEU A 63 8.343 -7.102 12.860 1.00 63.01 H new ATOM 0 HD11 LEU A 63 8.235 -4.934 11.695 1.00 34.40 H new ATOM 0 HD12 LEU A 63 7.144 -4.984 13.100 1.00 34.40 H new ATOM 0 HD13 LEU A 63 8.689 -4.107 13.203 1.00 34.40 H new ATOM 0 HD21 LEU A 63 10.334 -6.230 11.696 1.00 4.54 H new ATOM 0 HD22 LEU A 63 10.869 -5.453 13.205 1.00 4.54 H new ATOM 0 HD23 LEU A 63 10.775 -7.227 13.102 1.00 4.54 H new ATOM 1030 N MET A 64 8.989 -3.383 15.386 1.00 14.13 N ATOM 1031 CA MET A 64 8.949 -1.976 15.003 1.00 24.33 C ATOM 1032 C MET A 64 10.077 -1.199 15.674 1.00 1.44 C ATOM 1033 O MET A 64 10.575 -0.215 15.129 1.00 13.51 O ATOM 1034 CB MET A 64 7.599 -1.362 15.375 1.00 13.23 C ATOM 1035 CG MET A 64 7.515 -0.909 16.824 1.00 22.31 C ATOM 1036 SD MET A 64 7.928 0.834 17.032 1.00 33.54 S ATOM 1037 CE MET A 64 7.331 1.126 18.696 1.00 51.34 C ATOM 0 H MET A 64 8.165 -3.706 15.893 1.00 14.13 H new ATOM 0 HA MET A 64 9.081 -1.915 13.923 1.00 24.33 H new ATOM 0 HB2 MET A 64 7.406 -0.509 14.725 1.00 13.23 H new ATOM 0 HB3 MET A 64 6.812 -2.092 15.185 1.00 13.23 H new ATOM 0 HG2 MET A 64 6.507 -1.087 17.198 1.00 22.31 H new ATOM 0 HG3 MET A 64 8.191 -1.513 17.429 1.00 22.31 H new ATOM 0 HE1 MET A 64 6.821 2.089 18.736 1.00 51.34 H new ATOM 0 HE2 MET A 64 6.635 0.335 18.977 1.00 51.34 H new ATOM 0 HE3 MET A 64 8.173 1.132 19.389 1.00 51.34 H new ATOM 1047 N ASN A 65 10.475 -1.647 16.861 1.00 50.14 N ATOM 1048 CA ASN A 65 11.544 -0.992 17.606 1.00 14.11 C ATOM 1049 C ASN A 65 12.887 -1.176 16.907 1.00 70.22 C ATOM 1050 O ASN A 65 13.648 -0.223 16.740 1.00 5.11 O ATOM 1051 CB ASN A 65 11.616 -1.549 19.029 1.00 3.44 C ATOM 1052 CG ASN A 65 12.388 -0.640 19.967 1.00 71.00 C ATOM 1053 OD1 ASN A 65 12.486 0.566 19.740 1.00 70.15 O ATOM 1054 ND2 ASN A 65 12.940 -1.217 21.028 1.00 44.21 N ATOM 0 H ASN A 65 10.073 -2.461 17.327 1.00 50.14 H new ATOM 0 HA ASN A 65 11.322 0.074 17.651 1.00 14.11 H new ATOM 0 HB2 ASN A 65 10.606 -1.689 19.413 1.00 3.44 H new ATOM 0 HB3 ASN A 65 12.088 -2.531 19.008 1.00 3.44 H new ATOM 0 HD21 ASN A 65 13.471 -0.657 21.695 1.00 44.21 H new ATOM 0 HD22 ASN A 65 12.833 -2.220 21.176 1.00 44.21 H new ATOM 1061 N HIS A 66 13.171 -2.409 16.499 1.00 63.03 N ATOM 1062 CA HIS A 66 14.422 -2.719 15.816 1.00 44.22 C ATOM 1063 C HIS A 66 14.470 -2.056 14.443 1.00 44.25 C ATOM 1064 O HIS A 66 15.535 -1.652 13.973 1.00 34.25 O ATOM 1065 CB HIS A 66 14.588 -4.232 15.671 1.00 55.14 C ATOM 1066 CG HIS A 66 16.017 -4.678 15.639 1.00 31.14 C ATOM 1067 ND1 HIS A 66 16.958 -4.253 16.553 1.00 30.44 N ATOM 1068 CD2 HIS A 66 16.664 -5.518 14.798 1.00 31.32 C ATOM 1069 CE1 HIS A 66 18.122 -4.812 16.275 1.00 44.33 C ATOM 1070 NE2 HIS A 66 17.971 -5.584 15.214 1.00 31.32 N ATOM 0 H HIS A 66 12.552 -3.209 16.629 1.00 63.03 H new ATOM 0 HA HIS A 66 15.242 -2.328 16.418 1.00 44.22 H new ATOM 0 HB2 HIS A 66 14.080 -4.726 16.500 1.00 55.14 H new ATOM 0 HB3 HIS A 66 14.094 -4.557 14.755 1.00 55.14 H new ATOM 0 HD2 HIS A 66 16.233 -6.039 13.956 1.00 31.32 H new ATOM 0 HE1 HIS A 66 19.041 -4.663 16.822 1.00 44.33 H new ATOM 0 HE2 HIS A 66 18.706 -6.139 14.775 1.00 31.32 H new ATOM 1078 N VAL A 67 13.311 -1.947 13.802 1.00 35.22 N ATOM 1079 CA VAL A 67 13.220 -1.333 12.483 1.00 61.11 C ATOM 1080 C VAL A 67 13.521 0.160 12.550 1.00 12.01 C ATOM 1081 O VAL A 67 14.410 0.657 11.859 1.00 52.14 O ATOM 1082 CB VAL A 67 11.825 -1.537 11.863 1.00 30.32 C ATOM 1083 CG1 VAL A 67 11.732 -0.839 10.515 1.00 60.21 C ATOM 1084 CG2 VAL A 67 11.515 -3.020 11.727 1.00 34.34 C ATOM 0 H VAL A 67 12.421 -2.276 14.175 1.00 35.22 H new ATOM 0 HA VAL A 67 13.963 -1.823 11.854 1.00 61.11 H new ATOM 0 HB VAL A 67 11.083 -1.093 12.527 1.00 30.32 H new ATOM 0 HG11 VAL A 67 10.739 -0.994 10.093 1.00 60.21 H new ATOM 0 HG12 VAL A 67 11.908 0.229 10.645 1.00 60.21 H new ATOM 0 HG13 VAL A 67 12.482 -1.250 9.840 1.00 60.21 H new ATOM 0 HG21 VAL A 67 10.526 -3.146 11.287 1.00 34.34 H new ATOM 0 HG22 VAL A 67 12.260 -3.490 11.085 1.00 34.34 H new ATOM 0 HG23 VAL A 67 11.537 -3.488 12.711 1.00 34.34 H new ATOM 1094 N VAL A 68 12.774 0.871 13.388 1.00 13.53 N ATOM 1095 CA VAL A 68 12.961 2.309 13.548 1.00 72.42 C ATOM 1096 C VAL A 68 14.349 2.625 14.093 1.00 61.21 C ATOM 1097 O VAL A 68 14.943 3.646 13.748 1.00 24.24 O ATOM 1098 CB VAL A 68 11.902 2.911 14.490 1.00 51.41 C ATOM 1099 CG1 VAL A 68 10.503 2.683 13.937 1.00 43.51 C ATOM 1100 CG2 VAL A 68 12.035 2.323 15.886 1.00 35.52 C ATOM 0 H VAL A 68 12.033 0.475 13.967 1.00 13.53 H new ATOM 0 HA VAL A 68 12.852 2.755 12.559 1.00 72.42 H new ATOM 0 HB VAL A 68 12.069 3.986 14.556 1.00 51.41 H new ATOM 0 HG11 VAL A 68 9.768 3.115 14.616 1.00 43.51 H new ATOM 0 HG12 VAL A 68 10.416 3.157 12.959 1.00 43.51 H new ATOM 0 HG13 VAL A 68 10.321 1.613 13.839 1.00 43.51 H new ATOM 0 HG21 VAL A 68 11.279 2.760 16.538 1.00 35.52 H new ATOM 0 HG22 VAL A 68 11.895 1.243 15.841 1.00 35.52 H new ATOM 0 HG23 VAL A 68 13.027 2.544 16.281 1.00 35.52 H new ATOM 1110 N GLN A 69 14.860 1.742 14.945 1.00 74.42 N ATOM 1111 CA GLN A 69 16.179 1.927 15.538 1.00 54.32 C ATOM 1112 C GLN A 69 17.275 1.753 14.492 1.00 20.31 C ATOM 1113 O GLN A 69 18.321 2.397 14.563 1.00 1.05 O ATOM 1114 CB GLN A 69 16.389 0.938 16.685 1.00 63.40 C ATOM 1115 CG GLN A 69 15.834 1.421 18.015 1.00 73.40 C ATOM 1116 CD GLN A 69 16.145 0.473 19.156 1.00 23.14 C ATOM 1117 OE1 GLN A 69 17.220 -0.126 19.205 1.00 31.33 O ATOM 1118 NE2 GLN A 69 15.205 0.332 20.083 1.00 55.01 N ATOM 0 H GLN A 69 14.381 0.891 15.240 1.00 74.42 H new ATOM 0 HA GLN A 69 16.235 2.943 15.930 1.00 54.32 H new ATOM 0 HB2 GLN A 69 15.917 -0.010 16.427 1.00 63.40 H new ATOM 0 HB3 GLN A 69 17.456 0.744 16.795 1.00 63.40 H new ATOM 0 HG2 GLN A 69 16.247 2.404 18.241 1.00 73.40 H new ATOM 0 HG3 GLN A 69 14.754 1.541 17.932 1.00 73.40 H new ATOM 0 HE21 GLN A 69 14.329 0.848 20.003 1.00 55.01 H new ATOM 0 HE22 GLN A 69 15.359 -0.292 20.875 1.00 55.01 H new ATOM 1127 N GLN A 70 17.028 0.877 13.523 1.00 13.50 N ATOM 1128 CA GLN A 70 17.995 0.618 12.463 1.00 2.04 C ATOM 1129 C GLN A 70 18.025 1.766 11.460 1.00 1.54 C ATOM 1130 O GLN A 70 19.082 2.122 10.941 1.00 44.21 O ATOM 1131 CB GLN A 70 17.660 -0.692 11.747 1.00 2.54 C ATOM 1132 CG GLN A 70 18.267 -1.919 12.408 1.00 11.23 C ATOM 1133 CD GLN A 70 19.733 -2.099 12.069 1.00 23.31 C ATOM 1134 OE1 GLN A 70 20.609 -1.861 12.901 1.00 11.45 O ATOM 1135 NE2 GLN A 70 20.009 -2.523 10.841 1.00 25.24 N ATOM 0 H GLN A 70 16.167 0.335 13.450 1.00 13.50 H new ATOM 0 HA GLN A 70 18.981 0.533 12.919 1.00 2.04 H new ATOM 0 HB2 GLN A 70 16.577 -0.809 11.708 1.00 2.54 H new ATOM 0 HB3 GLN A 70 18.011 -0.633 10.717 1.00 2.54 H new ATOM 0 HG2 GLN A 70 18.155 -1.837 13.489 1.00 11.23 H new ATOM 0 HG3 GLN A 70 17.714 -2.806 12.097 1.00 11.23 H new ATOM 0 HE21 GLN A 70 19.252 -2.708 10.183 1.00 25.24 H new ATOM 0 HE22 GLN A 70 20.978 -2.663 10.556 1.00 25.24 H new ATOM 1144 N ALA A 71 16.858 2.342 11.193 1.00 53.33 N ATOM 1145 CA ALA A 71 16.751 3.452 10.253 1.00 33.42 C ATOM 1146 C ALA A 71 17.715 4.575 10.618 1.00 64.12 C ATOM 1147 O ALA A 71 18.150 5.339 9.756 1.00 55.13 O ATOM 1148 CB ALA A 71 15.322 3.973 10.213 1.00 72.25 C ATOM 0 H ALA A 71 15.973 2.059 11.614 1.00 53.33 H new ATOM 0 HA ALA A 71 17.021 3.085 9.263 1.00 33.42 H new ATOM 0 HB1 ALA A 71 15.256 4.801 9.507 1.00 72.25 H new ATOM 0 HB2 ALA A 71 14.652 3.173 9.897 1.00 72.25 H new ATOM 0 HB3 ALA A 71 15.033 4.318 11.206 1.00 72.25 H new ATOM 1154 N LYS A 72 18.047 4.670 11.901 1.00 40.41 N ATOM 1155 CA LYS A 72 18.961 5.700 12.381 1.00 61.01 C ATOM 1156 C LYS A 72 20.268 5.676 11.595 1.00 3.22 C ATOM 1157 O LYS A 72 20.868 6.719 11.337 1.00 13.01 O ATOM 1158 CB LYS A 72 19.246 5.503 13.872 1.00 51.54 C ATOM 1159 CG LYS A 72 18.228 6.172 14.779 1.00 54.23 C ATOM 1160 CD LYS A 72 18.855 6.618 16.089 1.00 65.32 C ATOM 1161 CE LYS A 72 19.576 7.949 15.937 1.00 34.25 C ATOM 1162 NZ LYS A 72 18.625 9.095 15.919 1.00 73.25 N ATOM 0 H LYS A 72 17.697 4.046 12.628 1.00 40.41 H new ATOM 0 HA LYS A 72 18.486 6.670 12.233 1.00 61.01 H new ATOM 0 HB2 LYS A 72 19.269 4.435 14.091 1.00 51.54 H new ATOM 0 HB3 LYS A 72 20.237 5.897 14.099 1.00 51.54 H new ATOM 0 HG2 LYS A 72 17.796 7.034 14.270 1.00 54.23 H new ATOM 0 HG3 LYS A 72 17.411 5.480 14.983 1.00 54.23 H new ATOM 0 HD2 LYS A 72 18.082 6.707 16.852 1.00 65.32 H new ATOM 0 HD3 LYS A 72 19.558 5.860 16.434 1.00 65.32 H new ATOM 0 HE2 LYS A 72 20.282 8.076 16.758 1.00 34.25 H new ATOM 0 HE3 LYS A 72 20.157 7.944 15.015 1.00 34.25 H new ATOM 0 HZ1 LYS A 72 19.158 9.988 15.882 1.00 73.25 H new ATOM 0 HZ2 LYS A 72 18.011 9.024 15.083 1.00 73.25 H new ATOM 0 HZ3 LYS A 72 18.041 9.075 16.780 1.00 73.25 H new ATOM 1176 N GLY A 73 20.704 4.478 11.216 1.00 3.53 N ATOM 1177 CA GLY A 73 21.937 4.342 10.463 1.00 51.14 C ATOM 1178 C GLY A 73 21.745 4.610 8.983 1.00 35.41 C ATOM 1179 O GLY A 73 22.709 4.860 8.261 1.00 2.53 O ATOM 0 H GLY A 73 20.225 3.600 11.417 1.00 3.53 H new ATOM 0 HA2 GLY A 73 22.680 5.033 10.861 1.00 51.14 H new ATOM 0 HA3 GLY A 73 22.333 3.335 10.599 1.00 51.14 H new ATOM 1183 N GLN A 74 20.496 4.554 8.531 1.00 50.42 N ATOM 1184 CA GLN A 74 20.182 4.791 7.127 1.00 75.43 C ATOM 1185 C GLN A 74 19.535 6.159 6.936 1.00 32.43 C ATOM 1186 O GLN A 74 19.522 6.984 7.850 1.00 43.12 O ATOM 1187 CB GLN A 74 19.252 3.696 6.599 1.00 1.13 C ATOM 1188 CG GLN A 74 19.792 2.290 6.803 1.00 72.45 C ATOM 1189 CD GLN A 74 18.706 1.294 7.160 1.00 60.23 C ATOM 1190 OE1 GLN A 74 18.179 0.595 6.294 1.00 63.25 O ATOM 1191 NE2 GLN A 74 18.365 1.224 8.441 1.00 30.41 N ATOM 0 H GLN A 74 19.686 4.347 9.116 1.00 50.42 H new ATOM 0 HA GLN A 74 21.115 4.769 6.564 1.00 75.43 H new ATOM 0 HB2 GLN A 74 18.285 3.781 7.096 1.00 1.13 H new ATOM 0 HB3 GLN A 74 19.079 3.859 5.535 1.00 1.13 H new ATOM 0 HG2 GLN A 74 20.295 1.963 5.893 1.00 72.45 H new ATOM 0 HG3 GLN A 74 20.541 2.304 7.594 1.00 72.45 H new ATOM 0 HE21 GLN A 74 18.828 1.822 9.125 1.00 30.41 H new ATOM 0 HE22 GLN A 74 17.640 0.572 8.741 1.00 30.41 H new ATOM 1200 N LYS A 75 18.998 6.393 5.744 1.00 44.04 N ATOM 1201 CA LYS A 75 18.349 7.661 5.432 1.00 34.41 C ATOM 1202 C LYS A 75 16.830 7.517 5.467 1.00 64.33 C ATOM 1203 O LYS A 75 16.147 7.817 4.487 1.00 31.33 O ATOM 1204 CB LYS A 75 18.793 8.160 4.056 1.00 51.44 C ATOM 1205 CG LYS A 75 20.255 8.570 4.000 1.00 74.53 C ATOM 1206 CD LYS A 75 20.814 8.450 2.592 1.00 73.11 C ATOM 1207 CE LYS A 75 21.424 7.078 2.349 1.00 33.12 C ATOM 1208 NZ LYS A 75 20.380 6.037 2.134 1.00 44.32 N ATOM 0 H LYS A 75 18.999 5.721 4.977 1.00 44.04 H new ATOM 0 HA LYS A 75 18.645 8.388 6.188 1.00 34.41 H new ATOM 0 HB2 LYS A 75 18.616 7.376 3.320 1.00 51.44 H new ATOM 0 HB3 LYS A 75 18.175 9.011 3.770 1.00 51.44 H new ATOM 0 HG2 LYS A 75 20.359 9.598 4.347 1.00 74.53 H new ATOM 0 HG3 LYS A 75 20.836 7.944 4.678 1.00 74.53 H new ATOM 0 HD2 LYS A 75 20.020 8.630 1.868 1.00 73.11 H new ATOM 0 HD3 LYS A 75 21.570 9.219 2.433 1.00 73.11 H new ATOM 0 HE2 LYS A 75 22.079 7.121 1.479 1.00 33.12 H new ATOM 0 HE3 LYS A 75 22.044 6.800 3.201 1.00 33.12 H new ATOM 0 HZ1 LYS A 75 20.804 5.212 1.664 1.00 44.32 H new ATOM 0 HZ2 LYS A 75 19.984 5.748 3.051 1.00 44.32 H new ATOM 0 HZ3 LYS A 75 19.622 6.424 1.536 1.00 44.32 H new ATOM 1222 N ILE A 76 16.310 7.058 6.600 1.00 71.33 N ATOM 1223 CA ILE A 76 14.873 6.877 6.761 1.00 15.25 C ATOM 1224 C ILE A 76 14.321 7.798 7.845 1.00 24.31 C ATOM 1225 O ILE A 76 14.673 7.671 9.019 1.00 52.45 O ATOM 1226 CB ILE A 76 14.525 5.419 7.116 1.00 14.51 C ATOM 1227 CG1 ILE A 76 15.664 4.485 6.704 1.00 43.40 C ATOM 1228 CG2 ILE A 76 13.224 5.006 6.443 1.00 43.50 C ATOM 1229 CD1 ILE A 76 15.357 3.021 6.928 1.00 54.43 C ATOM 0 H ILE A 76 16.862 6.805 7.420 1.00 71.33 H new ATOM 0 HA ILE A 76 14.414 7.129 5.805 1.00 15.25 H new ATOM 0 HB ILE A 76 14.392 5.345 8.195 1.00 14.51 H new ATOM 0 HG12 ILE A 76 15.889 4.643 5.649 1.00 43.40 H new ATOM 0 HG13 ILE A 76 16.561 4.750 7.265 1.00 43.40 H new ATOM 0 HG21 ILE A 76 12.991 3.973 6.703 1.00 43.50 H new ATOM 0 HG22 ILE A 76 12.417 5.656 6.781 1.00 43.50 H new ATOM 0 HG23 ILE A 76 13.330 5.092 5.362 1.00 43.50 H new ATOM 0 HD11 ILE A 76 16.209 2.418 6.613 1.00 54.43 H new ATOM 0 HD12 ILE A 76 15.161 2.848 7.986 1.00 54.43 H new ATOM 0 HD13 ILE A 76 14.479 2.740 6.346 1.00 54.43 H new ATOM 1241 N ILE A 77 13.455 8.722 7.444 1.00 21.13 N ATOM 1242 CA ILE A 77 12.853 9.662 8.382 1.00 71.42 C ATOM 1243 C ILE A 77 11.337 9.498 8.427 1.00 25.34 C ATOM 1244 O ILE A 77 10.688 9.910 9.388 1.00 40.01 O ATOM 1245 CB ILE A 77 13.190 11.119 8.013 1.00 75.50 C ATOM 1246 CG1 ILE A 77 14.704 11.302 7.901 1.00 44.21 C ATOM 1247 CG2 ILE A 77 12.610 12.074 9.045 1.00 33.34 C ATOM 1248 CD1 ILE A 77 15.440 11.062 9.201 1.00 60.14 C ATOM 0 H ILE A 77 13.154 8.840 6.476 1.00 21.13 H new ATOM 0 HA ILE A 77 13.270 9.439 9.364 1.00 71.42 H new ATOM 0 HB ILE A 77 12.743 11.346 7.045 1.00 75.50 H new ATOM 0 HG12 ILE A 77 15.089 10.619 7.144 1.00 44.21 H new ATOM 0 HG13 ILE A 77 14.915 12.314 7.555 1.00 44.21 H new ATOM 0 HG21 ILE A 77 12.856 13.100 8.771 1.00 33.34 H new ATOM 0 HG22 ILE A 77 11.527 11.958 9.080 1.00 33.34 H new ATOM 0 HG23 ILE A 77 13.031 11.850 10.025 1.00 33.34 H new ATOM 0 HD11 ILE A 77 16.509 11.209 9.047 1.00 60.14 H new ATOM 0 HD12 ILE A 77 15.082 11.762 9.956 1.00 60.14 H new ATOM 0 HD13 ILE A 77 15.260 10.041 9.538 1.00 60.14 H new ATOM 1260 N GLN A 78 10.782 8.892 7.383 1.00 33.43 N ATOM 1261 CA GLN A 78 9.342 8.672 7.305 1.00 3.22 C ATOM 1262 C GLN A 78 8.910 7.554 8.248 1.00 1.44 C ATOM 1263 O GLN A 78 7.851 7.629 8.873 1.00 45.34 O ATOM 1264 CB GLN A 78 8.934 8.332 5.871 1.00 61.41 C ATOM 1265 CG GLN A 78 9.134 9.478 4.893 1.00 41.11 C ATOM 1266 CD GLN A 78 10.590 9.684 4.525 1.00 42.01 C ATOM 1267 OE1 GLN A 78 11.120 10.790 4.634 1.00 13.42 O ATOM 1268 NE2 GLN A 78 11.247 8.617 4.086 1.00 72.42 N ATOM 0 H GLN A 78 11.306 8.545 6.580 1.00 33.43 H new ATOM 0 HA GLN A 78 8.842 9.592 7.609 1.00 3.22 H new ATOM 0 HB2 GLN A 78 9.511 7.472 5.532 1.00 61.41 H new ATOM 0 HB3 GLN A 78 7.885 8.036 5.861 1.00 61.41 H new ATOM 0 HG2 GLN A 78 8.559 9.283 3.988 1.00 41.11 H new ATOM 0 HG3 GLN A 78 8.740 10.396 5.329 1.00 41.11 H new ATOM 0 HE21 GLN A 78 10.769 7.719 4.011 1.00 72.42 H new ATOM 0 HE22 GLN A 78 12.230 8.695 3.824 1.00 72.42 H new ATOM 1277 N PHE A 79 9.736 6.518 8.347 1.00 31.12 N ATOM 1278 CA PHE A 79 9.438 5.383 9.214 1.00 44.24 C ATOM 1279 C PHE A 79 9.454 5.801 10.681 1.00 35.21 C ATOM 1280 O PHE A 79 8.589 5.400 11.459 1.00 33.15 O ATOM 1281 CB PHE A 79 10.449 4.258 8.981 1.00 1.23 C ATOM 1282 CG PHE A 79 9.846 3.029 8.363 1.00 4.04 C ATOM 1283 CD1 PHE A 79 8.680 2.482 8.874 1.00 64.41 C ATOM 1284 CD2 PHE A 79 10.445 2.421 7.272 1.00 45.31 C ATOM 1285 CE1 PHE A 79 8.124 1.350 8.308 1.00 43.13 C ATOM 1286 CE2 PHE A 79 9.894 1.290 6.701 1.00 33.21 C ATOM 1287 CZ PHE A 79 8.731 0.754 7.219 1.00 11.22 C ATOM 0 H PHE A 79 10.617 6.440 7.838 1.00 31.12 H new ATOM 0 HA PHE A 79 8.439 5.022 8.969 1.00 44.24 H new ATOM 0 HB2 PHE A 79 11.247 4.625 8.336 1.00 1.23 H new ATOM 0 HB3 PHE A 79 10.907 3.989 9.933 1.00 1.23 H new ATOM 0 HD1 PHE A 79 8.200 2.945 9.724 1.00 64.41 H new ATOM 0 HD2 PHE A 79 11.354 2.836 6.863 1.00 45.31 H new ATOM 0 HE1 PHE A 79 7.216 0.932 8.717 1.00 43.13 H new ATOM 0 HE2 PHE A 79 10.372 0.826 5.851 1.00 33.21 H new ATOM 0 HZ PHE A 79 8.297 -0.129 6.774 1.00 11.22 H new ATOM 1297 N GLN A 80 10.443 6.608 11.050 1.00 31.23 N ATOM 1298 CA GLN A 80 10.572 7.079 12.424 1.00 33.43 C ATOM 1299 C GLN A 80 9.323 7.839 12.859 1.00 72.44 C ATOM 1300 O GLN A 80 8.796 7.615 13.949 1.00 52.14 O ATOM 1301 CB GLN A 80 11.803 7.975 12.565 1.00 23.34 C ATOM 1302 CG GLN A 80 13.118 7.213 12.521 1.00 1.13 C ATOM 1303 CD GLN A 80 14.282 8.027 13.051 1.00 43.35 C ATOM 1304 OE1 GLN A 80 14.446 9.197 12.702 1.00 11.02 O ATOM 1305 NE2 GLN A 80 15.099 7.412 13.897 1.00 20.24 N ATOM 0 H GLN A 80 11.166 6.949 10.417 1.00 31.23 H new ATOM 0 HA GLN A 80 10.689 6.209 13.070 1.00 33.43 H new ATOM 0 HB2 GLN A 80 11.796 8.717 11.766 1.00 23.34 H new ATOM 0 HB3 GLN A 80 11.740 8.520 13.507 1.00 23.34 H new ATOM 0 HG2 GLN A 80 13.023 6.298 13.106 1.00 1.13 H new ATOM 0 HG3 GLN A 80 13.326 6.914 11.494 1.00 1.13 H new ATOM 0 HE21 GLN A 80 14.926 6.442 14.159 1.00 20.24 H new ATOM 0 HE22 GLN A 80 15.900 7.910 14.285 1.00 20.24 H new ATOM 1314 N ASP A 81 8.855 8.737 12.000 1.00 53.34 N ATOM 1315 CA ASP A 81 7.667 9.530 12.294 1.00 12.32 C ATOM 1316 C ASP A 81 6.406 8.678 12.192 1.00 55.30 C ATOM 1317 O ASP A 81 5.524 8.752 13.048 1.00 54.25 O ATOM 1318 CB ASP A 81 7.572 10.720 11.338 1.00 1.52 C ATOM 1319 CG ASP A 81 6.248 11.451 11.452 1.00 64.40 C ATOM 1320 OD1 ASP A 81 5.896 11.868 12.575 1.00 61.22 O ATOM 1321 OD2 ASP A 81 5.564 11.604 10.418 1.00 22.03 O ATOM 0 H ASP A 81 9.280 8.934 11.094 1.00 53.34 H new ATOM 0 HA ASP A 81 7.752 9.901 13.316 1.00 12.32 H new ATOM 0 HB2 ASP A 81 8.386 11.415 11.545 1.00 1.52 H new ATOM 0 HB3 ASP A 81 7.704 10.371 10.314 1.00 1.52 H new ATOM 1326 N SER A 82 6.327 7.871 11.139 1.00 33.32 N ATOM 1327 CA SER A 82 5.171 7.008 10.922 1.00 2.14 C ATOM 1328 C SER A 82 4.946 6.091 12.120 1.00 34.33 C ATOM 1329 O SER A 82 3.818 5.924 12.586 1.00 40.22 O ATOM 1330 CB SER A 82 5.362 6.173 9.655 1.00 63.01 C ATOM 1331 OG SER A 82 6.322 5.150 9.858 1.00 40.31 O ATOM 0 H SER A 82 7.049 7.796 10.423 1.00 33.32 H new ATOM 0 HA SER A 82 4.293 7.642 10.801 1.00 2.14 H new ATOM 0 HB2 SER A 82 4.411 5.730 9.361 1.00 63.01 H new ATOM 0 HB3 SER A 82 5.680 6.817 8.836 1.00 63.01 H new ATOM 0 HG SER A 82 7.034 5.481 10.445 1.00 40.31 H new ATOM 1337 N PHE A 83 6.027 5.497 12.615 1.00 51.31 N ATOM 1338 CA PHE A 83 5.949 4.595 13.758 1.00 14.42 C ATOM 1339 C PHE A 83 5.828 5.379 15.062 1.00 45.11 C ATOM 1340 O PHE A 83 5.314 4.873 16.058 1.00 21.22 O ATOM 1341 CB PHE A 83 7.181 3.690 13.806 1.00 41.02 C ATOM 1342 CG PHE A 83 7.002 2.394 13.068 1.00 51.22 C ATOM 1343 CD1 PHE A 83 5.900 1.590 13.311 1.00 62.13 C ATOM 1344 CD2 PHE A 83 7.936 1.980 12.131 1.00 14.15 C ATOM 1345 CE1 PHE A 83 5.732 0.397 12.633 1.00 21.10 C ATOM 1346 CE2 PHE A 83 7.773 0.789 11.451 1.00 74.45 C ATOM 1347 CZ PHE A 83 6.670 -0.005 11.702 1.00 2.44 C ATOM 0 H PHE A 83 6.968 5.624 12.242 1.00 51.31 H new ATOM 0 HA PHE A 83 5.058 3.978 13.642 1.00 14.42 H new ATOM 0 HB2 PHE A 83 8.032 4.225 13.384 1.00 41.02 H new ATOM 0 HB3 PHE A 83 7.424 3.476 14.847 1.00 41.02 H new ATOM 0 HD1 PHE A 83 5.164 1.899 14.038 1.00 62.13 H new ATOM 0 HD2 PHE A 83 8.801 2.595 11.931 1.00 14.15 H new ATOM 0 HE1 PHE A 83 4.868 -0.220 12.831 1.00 21.10 H new ATOM 0 HE2 PHE A 83 8.508 0.478 10.723 1.00 74.45 H new ATOM 0 HZ PHE A 83 6.542 -0.937 11.172 1.00 2.44 H new ATOM 1357 N GLY A 84 6.308 6.619 15.047 1.00 43.14 N ATOM 1358 CA GLY A 84 6.246 7.453 16.233 1.00 44.24 C ATOM 1359 C GLY A 84 4.859 8.012 16.476 1.00 13.43 C ATOM 1360 O GLY A 84 4.422 8.135 17.621 1.00 63.30 O ATOM 0 H GLY A 84 6.739 7.061 14.235 1.00 43.14 H new ATOM 0 HA2 GLY A 84 6.557 6.870 17.100 1.00 44.24 H new ATOM 0 HA3 GLY A 84 6.954 8.276 16.132 1.00 44.24 H new ATOM 1364 N LYS A 85 4.163 8.355 15.397 1.00 32.05 N ATOM 1365 CA LYS A 85 2.816 8.905 15.498 1.00 43.21 C ATOM 1366 C LYS A 85 1.816 7.825 15.897 1.00 54.24 C ATOM 1367 O LYS A 85 0.684 8.124 16.279 1.00 22.21 O ATOM 1368 CB LYS A 85 2.400 9.535 14.167 1.00 72.23 C ATOM 1369 CG LYS A 85 2.013 8.517 13.107 1.00 1.52 C ATOM 1370 CD LYS A 85 0.504 8.402 12.970 1.00 62.23 C ATOM 1371 CE LYS A 85 -0.095 9.650 12.341 1.00 54.21 C ATOM 1372 NZ LYS A 85 -1.444 9.389 11.766 1.00 61.53 N ATOM 0 H LYS A 85 4.510 8.262 14.442 1.00 32.05 H new ATOM 0 HA LYS A 85 2.821 9.674 16.271 1.00 43.21 H new ATOM 0 HB2 LYS A 85 1.558 10.206 14.339 1.00 72.23 H new ATOM 0 HB3 LYS A 85 3.221 10.145 13.791 1.00 72.23 H new ATOM 0 HG2 LYS A 85 2.445 8.805 12.149 1.00 1.52 H new ATOM 0 HG3 LYS A 85 2.431 7.544 13.365 1.00 1.52 H new ATOM 0 HD2 LYS A 85 0.258 7.532 12.361 1.00 62.23 H new ATOM 0 HD3 LYS A 85 0.060 8.239 13.952 1.00 62.23 H new ATOM 0 HE2 LYS A 85 -0.166 10.437 13.092 1.00 54.21 H new ATOM 0 HE3 LYS A 85 0.569 10.016 11.558 1.00 54.21 H new ATOM 0 HZ1 LYS A 85 -1.818 10.264 11.347 1.00 61.53 H new ATOM 0 HZ2 LYS A 85 -1.372 8.656 11.031 1.00 61.53 H new ATOM 0 HZ3 LYS A 85 -2.085 9.064 12.518 1.00 61.53 H new ATOM 1386 N VAL A 86 2.240 6.569 15.806 1.00 22.20 N ATOM 1387 CA VAL A 86 1.382 5.444 16.160 1.00 40.42 C ATOM 1388 C VAL A 86 1.965 4.654 17.326 1.00 53.00 C ATOM 1389 O VAL A 86 1.351 3.706 17.815 1.00 13.53 O ATOM 1390 CB VAL A 86 1.177 4.497 14.963 1.00 33.32 C ATOM 1391 CG1 VAL A 86 0.454 5.213 13.832 1.00 22.14 C ATOM 1392 CG2 VAL A 86 2.511 3.943 14.488 1.00 64.23 C ATOM 0 H VAL A 86 3.173 6.304 15.490 1.00 22.20 H new ATOM 0 HA VAL A 86 0.418 5.860 16.453 1.00 40.42 H new ATOM 0 HB VAL A 86 0.557 3.661 15.286 1.00 33.32 H new ATOM 0 HG11 VAL A 86 0.318 4.528 12.995 1.00 22.14 H new ATOM 0 HG12 VAL A 86 -0.520 5.556 14.182 1.00 22.14 H new ATOM 0 HG13 VAL A 86 1.045 6.070 13.507 1.00 22.14 H new ATOM 0 HG21 VAL A 86 2.347 3.276 13.642 1.00 64.23 H new ATOM 0 HG22 VAL A 86 3.158 4.765 14.182 1.00 64.23 H new ATOM 0 HG23 VAL A 86 2.985 3.390 15.299 1.00 64.23 H new ATOM 1402 N ALA A 87 3.154 5.051 17.767 1.00 30.20 N ATOM 1403 CA ALA A 87 3.819 4.381 18.878 1.00 41.22 C ATOM 1404 C ALA A 87 3.126 4.691 20.200 1.00 12.22 C ATOM 1405 O ALA A 87 2.688 3.786 20.910 1.00 64.24 O ATOM 1406 CB ALA A 87 5.284 4.789 18.939 1.00 33.02 C ATOM 0 H ALA A 87 3.676 5.833 17.372 1.00 30.20 H new ATOM 0 HA ALA A 87 3.759 3.306 18.710 1.00 41.22 H new ATOM 0 HB1 ALA A 87 5.769 4.281 19.773 1.00 33.02 H new ATOM 0 HB2 ALA A 87 5.778 4.511 18.008 1.00 33.02 H new ATOM 0 HB3 ALA A 87 5.356 5.868 19.079 1.00 33.02 H new ATOM 1412 N ALA A 88 3.030 5.976 20.526 1.00 50.12 N ATOM 1413 CA ALA A 88 2.389 6.405 21.762 1.00 33.05 C ATOM 1414 C ALA A 88 0.990 5.812 21.890 1.00 55.14 C ATOM 1415 O ALA A 88 0.507 5.570 22.995 1.00 31.13 O ATOM 1416 CB ALA A 88 2.328 7.924 21.826 1.00 21.03 C ATOM 0 H ALA A 88 3.388 6.738 19.950 1.00 50.12 H new ATOM 0 HA ALA A 88 2.987 6.041 22.597 1.00 33.05 H new ATOM 0 HB1 ALA A 88 1.847 8.230 22.755 1.00 21.03 H new ATOM 0 HB2 ALA A 88 3.339 8.331 21.790 1.00 21.03 H new ATOM 0 HB3 ALA A 88 1.755 8.301 20.979 1.00 21.03 H new ATOM 1422 N GLU A 89 0.344 5.582 20.751 1.00 73.52 N ATOM 1423 CA GLU A 89 -1.001 5.018 20.737 1.00 53.33 C ATOM 1424 C GLU A 89 -0.965 3.515 20.999 1.00 5.41 C ATOM 1425 O GLU A 89 -1.579 3.024 21.945 1.00 35.15 O ATOM 1426 CB GLU A 89 -1.681 5.296 19.394 1.00 5.20 C ATOM 1427 CG GLU A 89 -3.198 5.323 19.473 1.00 24.24 C ATOM 1428 CD GLU A 89 -3.713 6.361 20.452 1.00 65.14 C ATOM 1429 OE1 GLU A 89 -3.646 7.565 20.127 1.00 3.24 O ATOM 1430 OE2 GLU A 89 -4.182 5.970 21.541 1.00 63.45 O ATOM 0 H GLU A 89 0.730 5.777 19.827 1.00 73.52 H new ATOM 0 HA GLU A 89 -1.574 5.494 21.533 1.00 53.33 H new ATOM 0 HB2 GLU A 89 -1.329 6.253 19.009 1.00 5.20 H new ATOM 0 HB3 GLU A 89 -1.377 4.533 18.678 1.00 5.20 H new ATOM 0 HG2 GLU A 89 -3.606 5.528 18.483 1.00 24.24 H new ATOM 0 HG3 GLU A 89 -3.560 4.339 19.769 1.00 24.24 H new ATOM 1437 N VAL A 90 -0.239 2.791 20.153 1.00 31.53 N ATOM 1438 CA VAL A 90 -0.121 1.344 20.293 1.00 41.11 C ATOM 1439 C VAL A 90 0.459 0.969 21.652 1.00 63.32 C ATOM 1440 O VAL A 90 -0.157 0.228 22.419 1.00 63.40 O ATOM 1441 CB VAL A 90 0.765 0.744 19.185 1.00 21.21 C ATOM 1442 CG1 VAL A 90 0.918 -0.757 19.378 1.00 20.21 C ATOM 1443 CG2 VAL A 90 0.187 1.057 17.813 1.00 5.22 C ATOM 0 H VAL A 90 0.276 3.182 19.364 1.00 31.53 H new ATOM 0 HA VAL A 90 -1.127 0.934 20.205 1.00 41.11 H new ATOM 0 HB VAL A 90 1.754 1.197 19.249 1.00 21.21 H new ATOM 0 HG11 VAL A 90 1.547 -1.163 18.586 1.00 20.21 H new ATOM 0 HG12 VAL A 90 1.380 -0.954 20.345 1.00 20.21 H new ATOM 0 HG13 VAL A 90 -0.063 -1.230 19.341 1.00 20.21 H new ATOM 0 HG21 VAL A 90 0.826 0.626 17.042 1.00 5.22 H new ATOM 0 HG22 VAL A 90 -0.814 0.633 17.734 1.00 5.22 H new ATOM 0 HG23 VAL A 90 0.135 2.137 17.678 1.00 5.22 H new ATOM 1453 N LEU A 91 1.648 1.485 21.944 1.00 12.03 N ATOM 1454 CA LEU A 91 2.313 1.205 23.212 1.00 35.13 C ATOM 1455 C LEU A 91 1.395 1.520 24.389 1.00 30.14 C ATOM 1456 O LEU A 91 1.401 0.818 25.400 1.00 70.34 O ATOM 1457 CB LEU A 91 3.603 2.019 23.325 1.00 70.41 C ATOM 1458 CG LEU A 91 4.820 1.451 22.595 1.00 64.35 C ATOM 1459 CD1 LEU A 91 4.737 1.750 21.106 1.00 45.21 C ATOM 1460 CD2 LEU A 91 6.106 2.014 23.183 1.00 71.31 C ATOM 0 H LEU A 91 2.171 2.099 21.320 1.00 12.03 H new ATOM 0 HA LEU A 91 2.557 0.143 23.239 1.00 35.13 H new ATOM 0 HB2 LEU A 91 3.411 3.022 22.944 1.00 70.41 H new ATOM 0 HB3 LEU A 91 3.853 2.122 24.381 1.00 70.41 H new ATOM 0 HG LEU A 91 4.827 0.369 22.728 1.00 64.35 H new ATOM 0 HD11 LEU A 91 5.612 1.338 20.603 1.00 45.21 H new ATOM 0 HD12 LEU A 91 3.835 1.298 20.694 1.00 45.21 H new ATOM 0 HD13 LEU A 91 4.705 2.829 20.953 1.00 45.21 H new ATOM 0 HD21 LEU A 91 6.962 1.599 22.651 1.00 71.31 H new ATOM 0 HD22 LEU A 91 6.108 3.099 23.082 1.00 71.31 H new ATOM 0 HD23 LEU A 91 6.171 1.748 24.238 1.00 71.31 H new ATOM 1472 N GLY A 92 0.605 2.580 24.250 1.00 11.33 N ATOM 1473 CA GLY A 92 -0.309 2.968 25.309 1.00 40.43 C ATOM 1474 C GLY A 92 -1.523 2.064 25.387 1.00 52.42 C ATOM 1475 O GLY A 92 -2.093 1.870 26.461 1.00 41.42 O ATOM 0 H GLY A 92 0.581 3.177 23.423 1.00 11.33 H new ATOM 0 HA2 GLY A 92 0.217 2.948 26.264 1.00 40.43 H new ATOM 0 HA3 GLY A 92 -0.635 3.995 25.145 1.00 40.43 H new ATOM 1479 N ARG A 93 -1.921 1.511 24.246 1.00 53.00 N ATOM 1480 CA ARG A 93 -3.078 0.625 24.189 1.00 23.03 C ATOM 1481 C ARG A 93 -2.708 -0.781 24.652 1.00 71.44 C ATOM 1482 O ARG A 93 -3.513 -1.471 25.278 1.00 74.13 O ATOM 1483 CB ARG A 93 -3.639 0.575 22.767 1.00 33.22 C ATOM 1484 CG ARG A 93 -4.701 1.628 22.494 1.00 22.20 C ATOM 1485 CD ARG A 93 -5.941 1.402 23.344 1.00 74.30 C ATOM 1486 NE ARG A 93 -7.101 2.118 22.820 1.00 35.24 N ATOM 1487 CZ ARG A 93 -7.266 3.431 22.931 1.00 43.31 C ATOM 1488 NH1 ARG A 93 -6.349 4.168 23.543 1.00 41.33 N ATOM 1489 NH2 ARG A 93 -8.349 4.010 22.428 1.00 2.45 N ATOM 0 H ARG A 93 -1.460 1.661 23.349 1.00 53.00 H new ATOM 0 HA ARG A 93 -3.841 1.021 24.859 1.00 23.03 H new ATOM 0 HB2 ARG A 93 -2.821 0.704 22.058 1.00 33.22 H new ATOM 0 HB3 ARG A 93 -4.064 -0.413 22.588 1.00 33.22 H new ATOM 0 HG2 ARG A 93 -4.294 2.618 22.698 1.00 22.20 H new ATOM 0 HG3 ARG A 93 -4.973 1.607 21.439 1.00 22.20 H new ATOM 0 HD2 ARG A 93 -6.162 0.335 23.387 1.00 74.30 H new ATOM 0 HD3 ARG A 93 -5.745 1.728 24.365 1.00 74.30 H new ATOM 0 HE ARG A 93 -7.824 1.580 22.343 1.00 35.24 H new ATOM 0 HH11 ARG A 93 -5.515 3.727 23.930 1.00 41.33 H new ATOM 0 HH12 ARG A 93 -6.478 5.176 23.627 1.00 41.33 H new ATOM 0 HH21 ARG A 93 -9.056 3.446 21.956 1.00 2.45 H new ATOM 0 HH22 ARG A 93 -8.475 5.019 22.514 1.00 2.45 H new ATOM 1503 N ILE A 94 -1.487 -1.200 24.338 1.00 5.32 N ATOM 1504 CA ILE A 94 -1.011 -2.523 24.722 1.00 42.00 C ATOM 1505 C ILE A 94 -0.487 -2.525 26.154 1.00 34.02 C ATOM 1506 O ILE A 94 -0.493 -3.555 26.826 1.00 35.34 O ATOM 1507 CB ILE A 94 0.103 -3.016 23.780 1.00 41.14 C ATOM 1508 CG1 ILE A 94 1.366 -2.171 23.961 1.00 53.11 C ATOM 1509 CG2 ILE A 94 -0.368 -2.971 22.334 1.00 41.24 C ATOM 1510 CD1 ILE A 94 2.508 -2.590 23.062 1.00 32.32 C ATOM 0 H ILE A 94 -0.809 -0.642 23.819 1.00 5.32 H new ATOM 0 HA ILE A 94 -1.864 -3.198 24.648 1.00 42.00 H new ATOM 0 HB ILE A 94 0.341 -4.049 24.033 1.00 41.14 H new ATOM 0 HG12 ILE A 94 1.125 -1.126 23.766 1.00 53.11 H new ATOM 0 HG13 ILE A 94 1.690 -2.235 25.000 1.00 53.11 H new ATOM 0 HG21 ILE A 94 0.430 -3.322 21.680 1.00 41.24 H new ATOM 0 HG22 ILE A 94 -1.242 -3.611 22.216 1.00 41.24 H new ATOM 0 HG23 ILE A 94 -0.630 -1.947 22.068 1.00 41.24 H new ATOM 0 HD11 ILE A 94 3.369 -1.948 23.245 1.00 32.32 H new ATOM 0 HD12 ILE A 94 2.776 -3.625 23.273 1.00 32.32 H new ATOM 0 HD13 ILE A 94 2.203 -2.499 22.020 1.00 32.32 H new ATOM 1522 N ASN A 95 -0.037 -1.363 26.615 1.00 5.13 N ATOM 1523 CA ASN A 95 0.489 -1.230 27.969 1.00 4.01 C ATOM 1524 C ASN A 95 -0.583 -1.555 29.004 1.00 74.51 C ATOM 1525 O ASN A 95 -0.283 -2.063 30.084 1.00 11.21 O ATOM 1526 CB ASN A 95 1.019 0.187 28.196 1.00 43.42 C ATOM 1527 CG ASN A 95 1.197 0.510 29.667 1.00 62.40 C ATOM 1528 OD1 ASN A 95 2.151 0.059 30.302 1.00 72.23 O ATOM 1529 ND2 ASN A 95 0.277 1.294 30.216 1.00 33.53 N ATOM 0 H ASN A 95 -0.026 -0.500 26.071 1.00 5.13 H new ATOM 0 HA ASN A 95 1.308 -1.940 28.085 1.00 4.01 H new ATOM 0 HB2 ASN A 95 1.974 0.301 27.684 1.00 43.42 H new ATOM 0 HB3 ASN A 95 0.331 0.905 27.750 1.00 43.42 H new ATOM 0 HD21 ASN A 95 0.344 1.545 31.202 1.00 33.53 H new ATOM 0 HD22 ASN A 95 -0.497 1.645 29.652 1.00 33.53 H new ATOM 1536 N GLN A 96 -1.834 -1.260 28.665 1.00 70.25 N ATOM 1537 CA GLN A 96 -2.951 -1.522 29.564 1.00 12.45 C ATOM 1538 C GLN A 96 -3.430 -2.964 29.434 1.00 42.35 C ATOM 1539 O GLN A 96 -3.823 -3.588 30.418 1.00 25.42 O ATOM 1540 CB GLN A 96 -4.105 -0.560 29.272 1.00 24.41 C ATOM 1541 CG GLN A 96 -4.564 -0.584 27.823 1.00 20.12 C ATOM 1542 CD GLN A 96 -5.779 0.290 27.582 1.00 42.13 C ATOM 1543 OE1 GLN A 96 -6.809 -0.179 27.098 1.00 34.21 O ATOM 1544 NE2 GLN A 96 -5.664 1.569 27.918 1.00 12.53 N ATOM 0 H GLN A 96 -2.099 -0.839 27.774 1.00 70.25 H new ATOM 0 HA GLN A 96 -2.606 -1.365 30.586 1.00 12.45 H new ATOM 0 HB2 GLN A 96 -4.948 -0.811 29.916 1.00 24.41 H new ATOM 0 HB3 GLN A 96 -3.797 0.453 29.530 1.00 24.41 H new ATOM 0 HG2 GLN A 96 -3.748 -0.251 27.182 1.00 20.12 H new ATOM 0 HG3 GLN A 96 -4.796 -1.610 27.536 1.00 20.12 H new ATOM 0 HE21 GLN A 96 -4.791 1.915 28.316 1.00 12.53 H new ATOM 0 HE22 GLN A 96 -6.448 2.206 27.778 1.00 12.53 H new ATOM 1553 N GLU A 97 -3.394 -3.485 28.211 1.00 32.33 N ATOM 1554 CA GLU A 97 -3.826 -4.854 27.953 1.00 41.14 C ATOM 1555 C GLU A 97 -2.773 -5.854 28.421 1.00 31.21 C ATOM 1556 O GLU A 97 -3.075 -7.024 28.660 1.00 3.31 O ATOM 1557 CB GLU A 97 -4.105 -5.051 26.461 1.00 24.11 C ATOM 1558 CG GLU A 97 -5.299 -4.260 25.955 1.00 11.13 C ATOM 1559 CD GLU A 97 -6.615 -4.975 26.193 1.00 52.33 C ATOM 1560 OE1 GLU A 97 -6.780 -5.567 27.280 1.00 60.44 O ATOM 1561 OE2 GLU A 97 -7.480 -4.942 25.292 1.00 3.13 O ATOM 0 H GLU A 97 -3.071 -2.981 27.385 1.00 32.33 H new ATOM 0 HA GLU A 97 -4.744 -5.030 28.514 1.00 41.14 H new ATOM 0 HB2 GLU A 97 -3.221 -4.761 25.893 1.00 24.11 H new ATOM 0 HB3 GLU A 97 -4.274 -6.110 26.268 1.00 24.11 H new ATOM 0 HG2 GLU A 97 -5.323 -3.289 26.449 1.00 11.13 H new ATOM 0 HG3 GLU A 97 -5.180 -4.072 24.888 1.00 11.13 H new ATOM 1568 N PHE A 98 -1.536 -5.386 28.550 1.00 51.24 N ATOM 1569 CA PHE A 98 -0.437 -6.239 28.988 1.00 53.53 C ATOM 1570 C PHE A 98 -0.522 -6.507 30.487 1.00 20.14 C ATOM 1571 O PHE A 98 -0.878 -5.636 31.281 1.00 55.43 O ATOM 1572 CB PHE A 98 0.906 -5.589 28.649 1.00 23.35 C ATOM 1573 CG PHE A 98 1.410 -5.935 27.277 1.00 5.25 C ATOM 1574 CD1 PHE A 98 0.524 -6.185 26.242 1.00 23.01 C ATOM 1575 CD2 PHE A 98 2.770 -6.009 27.023 1.00 4.10 C ATOM 1576 CE1 PHE A 98 0.986 -6.504 24.979 1.00 53.10 C ATOM 1577 CE2 PHE A 98 3.238 -6.327 25.762 1.00 52.13 C ATOM 1578 CZ PHE A 98 2.344 -6.574 24.738 1.00 0.21 C ATOM 0 H PHE A 98 -1.269 -4.420 28.357 1.00 51.24 H new ATOM 0 HA PHE A 98 -0.515 -7.190 28.462 1.00 53.53 H new ATOM 0 HB2 PHE A 98 0.807 -4.506 28.729 1.00 23.35 H new ATOM 0 HB3 PHE A 98 1.646 -5.897 29.388 1.00 23.35 H new ATOM 0 HD1 PHE A 98 -0.539 -6.130 26.424 1.00 23.01 H new ATOM 0 HD2 PHE A 98 3.473 -5.816 27.820 1.00 4.10 H new ATOM 0 HE1 PHE A 98 0.285 -6.698 24.181 1.00 53.10 H new ATOM 0 HE2 PHE A 98 4.301 -6.382 25.577 1.00 52.13 H new ATOM 0 HZ PHE A 98 2.706 -6.821 23.751 1.00 0.21 H new ATOM 1588 N PRO A 99 -0.187 -7.743 30.886 1.00 30.14 N ATOM 1589 CA PRO A 99 -0.217 -8.156 32.293 1.00 61.34 C ATOM 1590 C PRO A 99 0.878 -7.488 33.117 1.00 40.43 C ATOM 1591 O PRO A 99 1.804 -6.891 32.568 1.00 41.54 O ATOM 1592 CB PRO A 99 0.014 -9.668 32.223 1.00 11.11 C ATOM 1593 CG PRO A 99 0.754 -9.880 30.948 1.00 43.22 C ATOM 1594 CD PRO A 99 0.247 -8.832 29.996 1.00 63.24 C ATOM 0 HA PRO A 99 -1.151 -7.875 32.781 1.00 61.34 H new ATOM 0 HB2 PRO A 99 0.590 -10.020 33.078 1.00 11.11 H new ATOM 0 HB3 PRO A 99 -0.930 -10.213 32.228 1.00 11.11 H new ATOM 0 HG2 PRO A 99 1.829 -9.782 31.100 1.00 43.22 H new ATOM 0 HG3 PRO A 99 0.577 -10.882 30.556 1.00 43.22 H new ATOM 0 HD2 PRO A 99 1.026 -8.503 29.309 1.00 63.24 H new ATOM 0 HD3 PRO A 99 -0.577 -9.206 29.388 1.00 63.24 H new ATOM 1602 N ARG A 100 0.766 -7.592 34.437 1.00 71.02 N ATOM 1603 CA ARG A 100 1.746 -6.996 35.336 1.00 25.44 C ATOM 1604 C ARG A 100 3.146 -7.532 35.047 1.00 34.31 C ATOM 1605 O ARG A 100 4.146 -6.887 35.362 1.00 33.24 O ATOM 1606 CB ARG A 100 1.372 -7.278 36.793 1.00 73.45 C ATOM 1607 CG ARG A 100 0.284 -6.363 37.330 1.00 52.13 C ATOM 1608 CD ARG A 100 0.260 -6.358 38.850 1.00 21.42 C ATOM 1609 NE ARG A 100 -0.144 -7.652 39.395 1.00 13.41 N ATOM 1610 CZ ARG A 100 -1.406 -8.062 39.454 1.00 73.23 C ATOM 1611 NH1 ARG A 100 -2.381 -7.285 39.003 1.00 73.12 N ATOM 1612 NH2 ARG A 100 -1.695 -9.253 39.964 1.00 41.33 N ATOM 0 H ARG A 100 0.006 -8.084 34.907 1.00 71.02 H new ATOM 0 HA ARG A 100 1.746 -5.919 35.170 1.00 25.44 H new ATOM 0 HB2 ARG A 100 1.041 -8.313 36.881 1.00 73.45 H new ATOM 0 HB3 ARG A 100 2.262 -7.174 37.414 1.00 73.45 H new ATOM 0 HG2 ARG A 100 0.447 -5.349 36.964 1.00 52.13 H new ATOM 0 HG3 ARG A 100 -0.685 -6.687 36.951 1.00 52.13 H new ATOM 0 HD2 ARG A 100 1.249 -6.098 39.227 1.00 21.42 H new ATOM 0 HD3 ARG A 100 -0.427 -5.587 39.199 1.00 21.42 H new ATOM 0 HE ARG A 100 0.582 -8.274 39.749 1.00 13.41 H new ATOM 0 HH11 ARG A 100 -2.163 -6.370 38.609 1.00 73.12 H new ATOM 0 HH12 ARG A 100 -3.349 -7.603 39.050 1.00 73.12 H new ATOM 0 HH21 ARG A 100 -0.948 -9.854 40.311 1.00 41.33 H new ATOM 0 HH22 ARG A 100 -2.664 -9.567 40.009 1.00 41.33 H new ATOM 1626 N ASP A 101 3.208 -8.715 34.446 1.00 33.43 N ATOM 1627 CA ASP A 101 4.484 -9.338 34.114 1.00 72.11 C ATOM 1628 C ASP A 101 5.114 -8.669 32.896 1.00 22.04 C ATOM 1629 O ASP A 101 6.291 -8.304 32.915 1.00 75.13 O ATOM 1630 CB ASP A 101 4.293 -10.832 33.848 1.00 33.24 C ATOM 1631 CG ASP A 101 4.246 -11.646 35.127 1.00 54.04 C ATOM 1632 OD1 ASP A 101 5.308 -11.816 35.761 1.00 53.51 O ATOM 1633 OD2 ASP A 101 3.147 -12.114 35.492 1.00 31.03 O ATOM 0 H ASP A 101 2.390 -9.262 34.179 1.00 33.43 H new ATOM 0 HA ASP A 101 5.154 -9.211 34.964 1.00 72.11 H new ATOM 0 HB2 ASP A 101 3.369 -10.984 33.290 1.00 33.24 H new ATOM 0 HB3 ASP A 101 5.107 -11.193 33.220 1.00 33.24 H new ATOM 1638 N LEU A 102 4.325 -8.512 31.839 1.00 0.14 N ATOM 1639 CA LEU A 102 4.806 -7.887 30.612 1.00 72.42 C ATOM 1640 C LEU A 102 5.024 -6.391 30.811 1.00 13.02 C ATOM 1641 O LEU A 102 5.847 -5.776 30.132 1.00 33.35 O ATOM 1642 CB LEU A 102 3.811 -8.122 29.473 1.00 23.45 C ATOM 1643 CG LEU A 102 3.672 -9.567 28.991 1.00 3.31 C ATOM 1644 CD1 LEU A 102 2.749 -9.640 27.785 1.00 33.11 C ATOM 1645 CD2 LEU A 102 5.037 -10.151 28.656 1.00 0.23 C ATOM 0 H LEU A 102 3.350 -8.809 31.807 1.00 0.14 H new ATOM 0 HA LEU A 102 5.762 -8.343 30.352 1.00 72.42 H new ATOM 0 HB2 LEU A 102 2.831 -7.772 29.796 1.00 23.45 H new ATOM 0 HB3 LEU A 102 4.107 -7.504 28.625 1.00 23.45 H new ATOM 0 HG LEU A 102 3.234 -10.158 29.795 1.00 3.31 H new ATOM 0 HD11 LEU A 102 2.662 -10.675 27.456 1.00 33.11 H new ATOM 0 HD12 LEU A 102 1.764 -9.262 28.057 1.00 33.11 H new ATOM 0 HD13 LEU A 102 3.159 -9.035 26.976 1.00 33.11 H new ATOM 0 HD21 LEU A 102 4.919 -11.179 28.315 1.00 0.23 H new ATOM 0 HD22 LEU A 102 5.503 -9.559 27.868 1.00 0.23 H new ATOM 0 HD23 LEU A 102 5.668 -10.134 29.544 1.00 0.23 H new ATOM 1657 N LYS A 103 4.282 -5.810 31.748 1.00 22.13 N ATOM 1658 CA LYS A 103 4.396 -4.386 32.041 1.00 34.31 C ATOM 1659 C LYS A 103 5.852 -3.990 32.261 1.00 21.43 C ATOM 1660 O LYS A 103 6.305 -2.954 31.775 1.00 62.12 O ATOM 1661 CB LYS A 103 3.567 -4.031 33.278 1.00 60.23 C ATOM 1662 CG LYS A 103 2.087 -3.849 32.987 1.00 64.22 C ATOM 1663 CD LYS A 103 1.522 -2.638 33.709 1.00 40.31 C ATOM 1664 CE LYS A 103 1.686 -1.370 32.884 1.00 23.30 C ATOM 1665 NZ LYS A 103 2.984 -0.694 33.159 1.00 11.33 N ATOM 0 H LYS A 103 3.595 -6.304 32.318 1.00 22.13 H new ATOM 0 HA LYS A 103 4.013 -3.833 31.183 1.00 34.31 H new ATOM 0 HB2 LYS A 103 3.688 -4.817 34.024 1.00 60.23 H new ATOM 0 HB3 LYS A 103 3.958 -3.113 33.716 1.00 60.23 H new ATOM 0 HG2 LYS A 103 1.938 -3.736 31.913 1.00 64.22 H new ATOM 0 HG3 LYS A 103 1.543 -4.743 33.292 1.00 64.22 H new ATOM 0 HD2 LYS A 103 0.465 -2.800 33.922 1.00 40.31 H new ATOM 0 HD3 LYS A 103 2.026 -2.517 34.668 1.00 40.31 H new ATOM 0 HE2 LYS A 103 1.622 -1.615 31.824 1.00 23.30 H new ATOM 0 HE3 LYS A 103 0.866 -0.686 33.103 1.00 23.30 H new ATOM 0 HZ1 LYS A 103 2.950 0.282 32.800 1.00 11.33 H new ATOM 0 HZ2 LYS A 103 3.158 -0.680 34.184 1.00 11.33 H new ATOM 0 HZ3 LYS A 103 3.752 -1.211 32.685 1.00 11.33 H new ATOM 1679 N LYS A 104 6.582 -4.823 32.996 1.00 0.42 N ATOM 1680 CA LYS A 104 7.988 -4.562 33.279 1.00 44.21 C ATOM 1681 C LYS A 104 8.833 -4.709 32.017 1.00 3.45 C ATOM 1682 O LYS A 104 9.822 -3.999 31.834 1.00 45.20 O ATOM 1683 CB LYS A 104 8.498 -5.517 34.361 1.00 40.41 C ATOM 1684 CG LYS A 104 7.589 -5.602 35.574 1.00 14.24 C ATOM 1685 CD LYS A 104 7.554 -4.289 36.338 1.00 15.32 C ATOM 1686 CE LYS A 104 8.838 -4.065 37.121 1.00 2.11 C ATOM 1687 NZ LYS A 104 8.672 -3.025 38.174 1.00 41.11 N ATOM 0 H LYS A 104 6.222 -5.685 33.406 1.00 0.42 H new ATOM 0 HA LYS A 104 8.076 -3.536 33.637 1.00 44.21 H new ATOM 0 HB2 LYS A 104 8.611 -6.512 33.931 1.00 40.41 H new ATOM 0 HB3 LYS A 104 9.488 -5.194 34.682 1.00 40.41 H new ATOM 0 HG2 LYS A 104 6.580 -5.866 35.256 1.00 14.24 H new ATOM 0 HG3 LYS A 104 7.934 -6.398 36.233 1.00 14.24 H new ATOM 0 HD2 LYS A 104 7.404 -3.465 35.641 1.00 15.32 H new ATOM 0 HD3 LYS A 104 6.705 -4.287 37.021 1.00 15.32 H new ATOM 0 HE2 LYS A 104 9.150 -5.002 37.582 1.00 2.11 H new ATOM 0 HE3 LYS A 104 9.633 -3.766 36.437 1.00 2.11 H new ATOM 0 HZ1 LYS A 104 9.569 -2.902 38.685 1.00 41.11 H new ATOM 0 HZ2 LYS A 104 8.399 -2.124 37.732 1.00 41.11 H new ATOM 0 HZ3 LYS A 104 7.932 -3.322 38.841 1.00 41.11 H new ATOM 1701 N LYS A 105 8.437 -5.633 31.149 1.00 34.15 N ATOM 1702 CA LYS A 105 9.155 -5.872 29.903 1.00 1.34 C ATOM 1703 C LYS A 105 8.941 -4.722 28.923 1.00 25.45 C ATOM 1704 O LYS A 105 9.860 -4.329 28.203 1.00 75.04 O ATOM 1705 CB LYS A 105 8.697 -7.188 29.270 1.00 13.54 C ATOM 1706 CG LYS A 105 8.684 -8.357 30.240 1.00 41.23 C ATOM 1707 CD LYS A 105 10.090 -8.743 30.666 1.00 65.11 C ATOM 1708 CE LYS A 105 10.085 -9.984 31.545 1.00 3.05 C ATOM 1709 NZ LYS A 105 10.232 -11.231 30.746 1.00 72.54 N ATOM 0 H LYS A 105 7.621 -6.230 31.286 1.00 34.15 H new ATOM 0 HA LYS A 105 10.219 -5.938 30.132 1.00 1.34 H new ATOM 0 HB2 LYS A 105 7.696 -7.055 28.860 1.00 13.54 H new ATOM 0 HB3 LYS A 105 9.354 -7.428 28.434 1.00 13.54 H new ATOM 0 HG2 LYS A 105 8.095 -8.095 31.119 1.00 41.23 H new ATOM 0 HG3 LYS A 105 8.196 -9.213 29.773 1.00 41.23 H new ATOM 0 HD2 LYS A 105 10.702 -8.924 29.783 1.00 65.11 H new ATOM 0 HD3 LYS A 105 10.548 -7.915 31.207 1.00 65.11 H new ATOM 0 HE2 LYS A 105 10.897 -9.919 32.269 1.00 3.05 H new ATOM 0 HE3 LYS A 105 9.155 -10.024 32.112 1.00 3.05 H new ATOM 0 HZ1 LYS A 105 10.224 -12.054 31.382 1.00 72.54 H new ATOM 0 HZ2 LYS A 105 9.443 -11.306 30.072 1.00 72.54 H new ATOM 0 HZ3 LYS A 105 11.132 -11.205 30.225 1.00 72.54 H new ATOM 1723 N LEU A 106 7.726 -4.187 28.903 1.00 40.11 N ATOM 1724 CA LEU A 106 7.392 -3.081 28.012 1.00 3.32 C ATOM 1725 C LEU A 106 7.893 -1.756 28.578 1.00 3.21 C ATOM 1726 O LEU A 106 8.393 -0.905 27.843 1.00 44.23 O ATOM 1727 CB LEU A 106 5.880 -3.015 27.793 1.00 71.33 C ATOM 1728 CG LEU A 106 5.380 -1.880 26.899 1.00 12.42 C ATOM 1729 CD1 LEU A 106 4.117 -2.297 26.162 1.00 13.12 C ATOM 1730 CD2 LEU A 106 5.129 -0.624 27.722 1.00 23.42 C ATOM 0 H LEU A 106 6.955 -4.501 29.493 1.00 40.11 H new ATOM 0 HA LEU A 106 7.884 -3.256 27.055 1.00 3.32 H new ATOM 0 HB2 LEU A 106 5.554 -3.961 27.361 1.00 71.33 H new ATOM 0 HB3 LEU A 106 5.396 -2.925 28.765 1.00 71.33 H new ATOM 0 HG LEU A 106 6.151 -1.659 26.160 1.00 12.42 H new ATOM 0 HD11 LEU A 106 3.776 -1.476 25.531 1.00 13.12 H new ATOM 0 HD12 LEU A 106 4.328 -3.168 25.542 1.00 13.12 H new ATOM 0 HD13 LEU A 106 3.340 -2.546 26.884 1.00 13.12 H new ATOM 0 HD21 LEU A 106 4.774 0.174 27.070 1.00 23.42 H new ATOM 0 HD22 LEU A 106 4.377 -0.832 28.483 1.00 23.42 H new ATOM 0 HD23 LEU A 106 6.056 -0.313 28.203 1.00 23.42 H new ATOM 1742 N SER A 107 7.757 -1.589 29.890 1.00 64.22 N ATOM 1743 CA SER A 107 8.195 -0.367 30.554 1.00 32.35 C ATOM 1744 C SER A 107 9.647 -0.051 30.210 1.00 70.24 C ATOM 1745 O SER A 107 9.984 1.085 29.877 1.00 2.20 O ATOM 1746 CB SER A 107 8.036 -0.501 32.070 1.00 23.32 C ATOM 1747 OG SER A 107 8.816 0.466 32.752 1.00 31.11 O ATOM 0 H SER A 107 7.347 -2.284 30.514 1.00 64.22 H new ATOM 0 HA SER A 107 7.570 0.453 30.200 1.00 32.35 H new ATOM 0 HB2 SER A 107 6.987 -0.383 32.341 1.00 23.32 H new ATOM 0 HB3 SER A 107 8.336 -1.501 32.383 1.00 23.32 H new ATOM 0 HG SER A 107 8.696 0.360 33.719 1.00 31.11 H new ATOM 1753 N ARG A 108 10.502 -1.065 30.292 1.00 62.24 N ATOM 1754 CA ARG A 108 11.918 -0.896 29.990 1.00 65.43 C ATOM 1755 C ARG A 108 12.125 -0.570 28.513 1.00 34.44 C ATOM 1756 O ARG A 108 12.932 0.291 28.164 1.00 73.02 O ATOM 1757 CB ARG A 108 12.694 -2.163 30.356 1.00 3.25 C ATOM 1758 CG ARG A 108 12.156 -3.420 29.693 1.00 22.24 C ATOM 1759 CD ARG A 108 12.906 -4.659 30.158 1.00 34.20 C ATOM 1760 NE ARG A 108 12.939 -4.765 31.614 1.00 2.43 N ATOM 1761 CZ ARG A 108 13.770 -5.564 32.274 1.00 3.42 C ATOM 1762 NH1 ARG A 108 14.632 -6.323 31.611 1.00 10.54 N ATOM 1763 NH2 ARG A 108 13.741 -5.604 33.600 1.00 33.12 N ATOM 0 H ARG A 108 10.239 -2.012 30.565 1.00 62.24 H new ATOM 0 HA ARG A 108 12.293 -0.063 30.584 1.00 65.43 H new ATOM 0 HB2 ARG A 108 13.739 -2.033 30.074 1.00 3.25 H new ATOM 0 HB3 ARG A 108 12.669 -2.294 31.438 1.00 3.25 H new ATOM 0 HG2 ARG A 108 11.096 -3.528 29.921 1.00 22.24 H new ATOM 0 HG3 ARG A 108 12.241 -3.327 28.610 1.00 22.24 H new ATOM 0 HD2 ARG A 108 12.432 -5.547 29.741 1.00 34.20 H new ATOM 0 HD3 ARG A 108 13.926 -4.631 29.773 1.00 34.20 H new ATOM 0 HE ARG A 108 12.288 -4.194 32.154 1.00 2.43 H new ATOM 0 HH11 ARG A 108 14.658 -6.294 30.592 1.00 10.54 H new ATOM 0 HH12 ARG A 108 15.269 -6.936 32.120 1.00 10.54 H new ATOM 0 HH21 ARG A 108 13.080 -5.021 34.113 1.00 33.12 H new ATOM 0 HH22 ARG A 108 14.380 -6.218 34.106 1.00 33.12 H new ATOM 1777 N VAL A 109 11.390 -1.265 27.651 1.00 74.31 N ATOM 1778 CA VAL A 109 11.491 -1.050 26.212 1.00 0.45 C ATOM 1779 C VAL A 109 11.275 0.418 25.860 1.00 30.22 C ATOM 1780 O VAL A 109 12.055 1.010 25.114 1.00 72.32 O ATOM 1781 CB VAL A 109 10.469 -1.907 25.443 1.00 14.10 C ATOM 1782 CG1 VAL A 109 10.467 -1.540 23.967 1.00 63.02 C ATOM 1783 CG2 VAL A 109 10.765 -3.387 25.633 1.00 53.12 C ATOM 0 H VAL A 109 10.718 -1.982 27.924 1.00 74.31 H new ATOM 0 HA VAL A 109 12.497 -1.347 25.917 1.00 0.45 H new ATOM 0 HB VAL A 109 9.476 -1.704 25.844 1.00 14.10 H new ATOM 0 HG11 VAL A 109 9.739 -2.156 23.440 1.00 63.02 H new ATOM 0 HG12 VAL A 109 10.203 -0.489 23.854 1.00 63.02 H new ATOM 0 HG13 VAL A 109 11.458 -1.712 23.548 1.00 63.02 H new ATOM 0 HG21 VAL A 109 10.033 -3.978 25.083 1.00 53.12 H new ATOM 0 HG22 VAL A 109 11.765 -3.609 25.260 1.00 53.12 H new ATOM 0 HG23 VAL A 109 10.710 -3.636 26.693 1.00 53.12 H new ATOM 1793 N VAL A 110 10.211 1.001 26.403 1.00 74.40 N ATOM 1794 CA VAL A 110 9.892 2.400 26.148 1.00 51.24 C ATOM 1795 C VAL A 110 11.009 3.316 26.635 1.00 21.10 C ATOM 1796 O VAL A 110 11.287 4.350 26.029 1.00 72.21 O ATOM 1797 CB VAL A 110 8.573 2.809 26.830 1.00 2.23 C ATOM 1798 CG1 VAL A 110 8.163 4.211 26.404 1.00 23.40 C ATOM 1799 CG2 VAL A 110 7.476 1.804 26.514 1.00 51.33 C ATOM 0 H VAL A 110 9.555 0.525 27.023 1.00 74.40 H new ATOM 0 HA VAL A 110 9.782 2.508 25.069 1.00 51.24 H new ATOM 0 HB VAL A 110 8.729 2.815 27.909 1.00 2.23 H new ATOM 0 HG11 VAL A 110 7.229 4.482 26.896 1.00 23.40 H new ATOM 0 HG12 VAL A 110 8.941 4.920 26.687 1.00 23.40 H new ATOM 0 HG13 VAL A 110 8.024 4.237 25.323 1.00 23.40 H new ATOM 0 HG21 VAL A 110 6.551 2.109 27.004 1.00 51.33 H new ATOM 0 HG22 VAL A 110 7.319 1.763 25.436 1.00 51.33 H new ATOM 0 HG23 VAL A 110 7.770 0.819 26.875 1.00 51.33 H new ATOM 1809 N ASN A 111 11.647 2.928 27.734 1.00 4.14 N ATOM 1810 CA ASN A 111 12.735 3.715 28.304 1.00 24.42 C ATOM 1811 C ASN A 111 13.936 3.745 27.363 1.00 55.24 C ATOM 1812 O ASN A 111 14.833 4.575 27.512 1.00 62.32 O ATOM 1813 CB ASN A 111 13.151 3.141 29.660 1.00 25.12 C ATOM 1814 CG ASN A 111 12.274 3.639 30.792 1.00 3.24 C ATOM 1815 OD1 ASN A 111 10.965 3.634 30.572 1.00 34.33 O flip ATOM 1816 ND2 ASN A 111 12.769 4.024 31.852 1.00 13.23 N flip ATOM 0 H ASN A 111 11.430 2.074 28.248 1.00 4.14 H new ATOM 0 HA ASN A 111 12.378 4.736 28.442 1.00 24.42 H new ATOM 0 HB2 ASN A 111 13.105 2.053 29.620 1.00 25.12 H new ATOM 0 HB3 ASN A 111 14.188 3.409 29.862 1.00 25.12 H new ATOM 0 HD21 ASN A 111 13.781 4.010 31.977 1.00 13.23 H new ATOM 0 HD22 ASN A 111 12.167 4.357 32.605 1.00 13.23 H new ATOM 1823 N ILE A 112 13.943 2.836 26.393 1.00 4.24 N ATOM 1824 CA ILE A 112 15.032 2.760 25.427 1.00 52.42 C ATOM 1825 C ILE A 112 14.879 3.822 24.343 1.00 44.20 C ATOM 1826 O ILE A 112 15.868 4.328 23.810 1.00 22.40 O ATOM 1827 CB ILE A 112 15.100 1.372 24.764 1.00 50.14 C ATOM 1828 CG1 ILE A 112 15.304 0.286 25.822 1.00 14.53 C ATOM 1829 CG2 ILE A 112 16.219 1.332 23.734 1.00 71.45 C ATOM 1830 CD1 ILE A 112 15.010 -1.110 25.320 1.00 14.13 C ATOM 0 H ILE A 112 13.207 2.143 26.256 1.00 4.24 H new ATOM 0 HA ILE A 112 15.956 2.936 25.978 1.00 52.42 H new ATOM 0 HB ILE A 112 14.155 1.183 24.254 1.00 50.14 H new ATOM 0 HG12 ILE A 112 16.333 0.326 26.178 1.00 14.53 H new ATOM 0 HG13 ILE A 112 14.662 0.498 26.677 1.00 14.53 H new ATOM 0 HG21 ILE A 112 16.255 0.345 23.274 1.00 71.45 H new ATOM 0 HG22 ILE A 112 16.034 2.084 22.967 1.00 71.45 H new ATOM 0 HG23 ILE A 112 17.171 1.539 24.223 1.00 71.45 H new ATOM 0 HD11 ILE A 112 15.176 -1.828 26.123 1.00 14.13 H new ATOM 0 HD12 ILE A 112 13.973 -1.167 24.991 1.00 14.13 H new ATOM 0 HD13 ILE A 112 15.669 -1.342 24.484 1.00 14.13 H new ATOM 1842 N LEU A 113 13.635 4.158 24.022 1.00 33.23 N ATOM 1843 CA LEU A 113 13.352 5.162 23.003 1.00 54.03 C ATOM 1844 C LEU A 113 14.053 6.478 23.324 1.00 24.44 C ATOM 1845 O LEU A 113 14.531 7.175 22.429 1.00 73.42 O ATOM 1846 CB LEU A 113 11.843 5.390 22.888 1.00 3.14 C ATOM 1847 CG LEU A 113 11.023 4.208 22.372 1.00 70.41 C ATOM 1848 CD1 LEU A 113 9.538 4.533 22.406 1.00 33.22 C ATOM 1849 CD2 LEU A 113 11.456 3.833 20.962 1.00 4.01 C ATOM 0 H LEU A 113 12.806 3.750 24.453 1.00 33.23 H new ATOM 0 HA LEU A 113 13.732 4.793 22.050 1.00 54.03 H new ATOM 0 HB2 LEU A 113 11.462 5.669 23.870 1.00 3.14 H new ATOM 0 HB3 LEU A 113 11.674 6.240 22.227 1.00 3.14 H new ATOM 0 HG LEU A 113 11.202 3.354 23.025 1.00 70.41 H new ATOM 0 HD11 LEU A 113 8.970 3.680 22.035 1.00 33.22 H new ATOM 0 HD12 LEU A 113 9.237 4.752 23.430 1.00 33.22 H new ATOM 0 HD13 LEU A 113 9.341 5.401 21.777 1.00 33.22 H new ATOM 0 HD21 LEU A 113 10.861 2.990 20.611 1.00 4.01 H new ATOM 0 HD22 LEU A 113 11.307 4.684 20.297 1.00 4.01 H new ATOM 0 HD23 LEU A 113 12.510 3.557 20.967 1.00 4.01 H new ATOM 1861 N LYS A 114 14.115 6.811 24.609 1.00 35.32 N ATOM 1862 CA LYS A 114 14.761 8.041 25.051 1.00 20.43 C ATOM 1863 C LYS A 114 16.276 7.942 24.903 1.00 0.44 C ATOM 1864 O LYS A 114 16.952 8.945 24.678 1.00 4.31 O ATOM 1865 CB LYS A 114 14.398 8.336 26.508 1.00 3.43 C ATOM 1866 CG LYS A 114 15.301 7.641 27.513 1.00 75.10 C ATOM 1867 CD LYS A 114 14.599 7.438 28.846 1.00 41.24 C ATOM 1868 CE LYS A 114 14.737 8.661 29.740 1.00 62.12 C ATOM 1869 NZ LYS A 114 16.093 8.752 30.350 1.00 74.41 N ATOM 0 H LYS A 114 13.725 6.245 25.363 1.00 35.32 H new ATOM 0 HA LYS A 114 14.404 8.857 24.422 1.00 20.43 H new ATOM 0 HB2 LYS A 114 14.444 9.412 26.674 1.00 3.43 H new ATOM 0 HB3 LYS A 114 13.367 8.030 26.686 1.00 3.43 H new ATOM 0 HG2 LYS A 114 15.615 6.676 27.115 1.00 75.10 H new ATOM 0 HG3 LYS A 114 16.204 8.233 27.663 1.00 75.10 H new ATOM 0 HD2 LYS A 114 13.543 7.229 28.674 1.00 41.24 H new ATOM 0 HD3 LYS A 114 15.019 6.568 29.351 1.00 41.24 H new ATOM 0 HE2 LYS A 114 14.540 9.561 29.157 1.00 62.12 H new ATOM 0 HE3 LYS A 114 13.986 8.621 30.529 1.00 62.12 H new ATOM 0 HZ1 LYS A 114 16.097 9.495 31.078 1.00 74.41 H new ATOM 0 HZ2 LYS A 114 16.340 7.840 30.784 1.00 74.41 H new ATOM 0 HZ3 LYS A 114 16.790 8.985 29.614 1.00 74.41 H new ATOM 1883 N GLU A 115 16.801 6.728 25.030 1.00 21.34 N ATOM 1884 CA GLU A 115 18.236 6.500 24.910 1.00 44.32 C ATOM 1885 C GLU A 115 18.682 6.593 23.453 1.00 15.22 C ATOM 1886 O GLU A 115 19.670 7.256 23.136 1.00 34.31 O ATOM 1887 CB GLU A 115 18.608 5.131 25.482 1.00 70.53 C ATOM 1888 CG GLU A 115 18.568 5.073 27.000 1.00 41.55 C ATOM 1889 CD GLU A 115 19.780 5.723 27.640 1.00 55.02 C ATOM 1890 OE1 GLU A 115 20.830 5.808 26.969 1.00 11.25 O ATOM 1891 OE2 GLU A 115 19.678 6.146 28.810 1.00 33.43 O ATOM 0 H GLU A 115 16.254 5.887 25.216 1.00 21.34 H new ATOM 0 HA GLU A 115 18.749 7.275 25.480 1.00 44.32 H new ATOM 0 HB2 GLU A 115 17.926 4.382 25.080 1.00 70.53 H new ATOM 0 HB3 GLU A 115 19.609 4.865 25.143 1.00 70.53 H new ATOM 0 HG2 GLU A 115 17.664 5.568 27.355 1.00 41.55 H new ATOM 0 HG3 GLU A 115 18.507 4.032 27.319 1.00 41.55 H new ATOM 1898 N ARG A 116 17.945 5.924 22.572 1.00 45.12 N ATOM 1899 CA ARG A 116 18.265 5.929 21.149 1.00 13.33 C ATOM 1900 C ARG A 116 17.804 7.228 20.493 1.00 31.34 C ATOM 1901 O ARG A 116 18.241 7.569 19.396 1.00 44.15 O ATOM 1902 CB ARG A 116 17.611 4.734 20.454 1.00 74.02 C ATOM 1903 CG ARG A 116 17.815 3.417 21.185 1.00 44.13 C ATOM 1904 CD ARG A 116 19.292 3.110 21.376 1.00 5.00 C ATOM 1905 NE ARG A 116 19.528 1.691 21.629 1.00 42.10 N ATOM 1906 CZ ARG A 116 20.724 1.119 21.548 1.00 63.02 C ATOM 1907 NH1 ARG A 116 21.788 1.841 21.223 1.00 54.23 N ATOM 1908 NH2 ARG A 116 20.859 -0.178 21.793 1.00 75.24 N ATOM 0 H ARG A 116 17.123 5.372 22.818 1.00 45.12 H new ATOM 0 HA ARG A 116 19.347 5.854 21.045 1.00 13.33 H new ATOM 0 HB2 ARG A 116 16.542 4.923 20.355 1.00 74.02 H new ATOM 0 HB3 ARG A 116 18.014 4.646 19.445 1.00 74.02 H new ATOM 0 HG2 ARG A 116 17.322 3.458 22.156 1.00 44.13 H new ATOM 0 HG3 ARG A 116 17.344 2.611 20.623 1.00 44.13 H new ATOM 0 HD2 ARG A 116 19.844 3.416 20.487 1.00 5.00 H new ATOM 0 HD3 ARG A 116 19.679 3.696 22.209 1.00 5.00 H new ATOM 0 HE ARG A 116 18.731 1.107 21.882 1.00 42.10 H new ATOM 0 HH11 ARG A 116 21.689 2.839 21.034 1.00 54.23 H new ATOM 0 HH12 ARG A 116 22.705 1.399 21.162 1.00 54.23 H new ATOM 0 HH21 ARG A 116 20.044 -0.737 22.044 1.00 75.24 H new ATOM 0 HH22 ARG A 116 21.778 -0.616 21.730 1.00 75.24 H new ATOM 1922 N ASN A 117 16.918 7.947 21.175 1.00 74.44 N ATOM 1923 CA ASN A 117 16.397 9.207 20.658 1.00 75.13 C ATOM 1924 C ASN A 117 15.758 9.010 19.286 1.00 31.21 C ATOM 1925 O ASN A 117 16.010 9.778 18.357 1.00 70.50 O ATOM 1926 CB ASN A 117 17.515 10.247 20.567 1.00 24.51 C ATOM 1927 CG ASN A 117 18.004 10.690 21.932 1.00 25.03 C ATOM 1928 OD1 ASN A 117 18.890 10.068 22.519 1.00 62.11 O ATOM 1929 ND2 ASN A 117 17.428 11.771 22.445 1.00 74.31 N ATOM 0 H ASN A 117 16.546 7.679 22.086 1.00 74.44 H new ATOM 0 HA ASN A 117 15.632 9.565 21.348 1.00 75.13 H new ATOM 0 HB2 ASN A 117 18.349 9.831 20.002 1.00 24.51 H new ATOM 0 HB3 ASN A 117 17.156 11.115 20.013 1.00 24.51 H new ATOM 0 HD21 ASN A 117 17.716 12.117 23.360 1.00 74.31 H new ATOM 0 HD22 ASN A 117 16.697 12.256 21.924 1.00 74.31 H new ATOM 1936 N ILE A 118 14.930 7.977 19.168 1.00 64.02 N ATOM 1937 CA ILE A 118 14.255 7.680 17.911 1.00 54.31 C ATOM 1938 C ILE A 118 13.227 8.755 17.572 1.00 31.24 C ATOM 1939 O ILE A 118 13.402 9.520 16.624 1.00 61.23 O ATOM 1940 CB ILE A 118 13.552 6.311 17.959 1.00 32.22 C ATOM 1941 CG1 ILE A 118 14.508 5.241 18.490 1.00 63.23 C ATOM 1942 CG2 ILE A 118 13.037 5.931 16.579 1.00 35.00 C ATOM 1943 CD1 ILE A 118 15.744 5.059 17.637 1.00 63.31 C ATOM 0 H ILE A 118 14.711 7.332 19.927 1.00 64.02 H new ATOM 0 HA ILE A 118 15.023 7.658 17.138 1.00 54.31 H new ATOM 0 HB ILE A 118 12.701 6.380 18.636 1.00 32.22 H new ATOM 0 HG12 ILE A 118 14.811 5.506 19.503 1.00 63.23 H new ATOM 0 HG13 ILE A 118 13.978 4.291 18.555 1.00 63.23 H new ATOM 0 HG21 ILE A 118 12.543 4.961 16.630 1.00 35.00 H new ATOM 0 HG22 ILE A 118 12.326 6.683 16.236 1.00 35.00 H new ATOM 0 HG23 ILE A 118 13.873 5.876 15.881 1.00 35.00 H new ATOM 0 HD11 ILE A 118 16.376 4.285 18.073 1.00 63.31 H new ATOM 0 HD12 ILE A 118 15.451 4.763 16.630 1.00 63.31 H new ATOM 0 HD13 ILE A 118 16.297 5.997 17.593 1.00 63.31 H new ATOM 1955 N PHE A 119 12.155 8.808 18.356 1.00 73.04 N ATOM 1956 CA PHE A 119 11.098 9.790 18.140 1.00 62.32 C ATOM 1957 C PHE A 119 11.464 11.130 18.770 1.00 3.24 C ATOM 1958 O PHE A 119 12.374 11.212 19.596 1.00 15.21 O ATOM 1959 CB PHE A 119 9.776 9.284 18.721 1.00 23.12 C ATOM 1960 CG PHE A 119 9.489 7.846 18.395 1.00 40.32 C ATOM 1961 CD1 PHE A 119 9.406 7.424 17.078 1.00 40.22 C ATOM 1962 CD2 PHE A 119 9.301 6.917 19.405 1.00 24.13 C ATOM 1963 CE1 PHE A 119 9.142 6.102 16.774 1.00 62.11 C ATOM 1964 CE2 PHE A 119 9.038 5.593 19.108 1.00 52.34 C ATOM 1965 CZ PHE A 119 8.957 5.185 17.790 1.00 12.54 C ATOM 0 H PHE A 119 11.995 8.183 19.146 1.00 73.04 H new ATOM 0 HA PHE A 119 10.983 9.933 17.066 1.00 62.32 H new ATOM 0 HB2 PHE A 119 9.794 9.406 19.804 1.00 23.12 H new ATOM 0 HB3 PHE A 119 8.962 9.903 18.344 1.00 23.12 H new ATOM 0 HD1 PHE A 119 9.549 8.137 16.279 1.00 40.22 H new ATOM 0 HD2 PHE A 119 9.361 7.231 20.437 1.00 24.13 H new ATOM 0 HE1 PHE A 119 9.080 5.786 15.743 1.00 62.11 H new ATOM 0 HE2 PHE A 119 8.896 4.878 19.905 1.00 52.34 H new ATOM 0 HZ PHE A 119 8.750 4.151 17.555 1.00 12.54 H new ATOM 1975 N SER A 120 10.750 12.179 18.374 1.00 34.43 N ATOM 1976 CA SER A 120 11.001 13.517 18.897 1.00 63.44 C ATOM 1977 C SER A 120 10.415 13.672 20.296 1.00 2.45 C ATOM 1978 O SER A 120 9.651 12.826 20.761 1.00 62.24 O ATOM 1979 CB SER A 120 10.407 14.572 17.962 1.00 32.10 C ATOM 1980 OG SER A 120 9.034 14.786 18.242 1.00 3.23 O ATOM 0 H SER A 120 9.993 12.128 17.692 1.00 34.43 H new ATOM 0 HA SER A 120 12.080 13.661 18.957 1.00 63.44 H new ATOM 0 HB2 SER A 120 10.954 15.509 18.071 1.00 32.10 H new ATOM 0 HB3 SER A 120 10.525 14.253 16.927 1.00 32.10 H new ATOM 0 HG SER A 120 8.678 15.466 17.632 1.00 3.23 H new ATOM 1986 N LYS A 121 10.779 14.761 20.965 1.00 13.53 N ATOM 1987 CA LYS A 121 10.290 15.032 22.312 1.00 34.20 C ATOM 1988 C LYS A 121 8.765 15.019 22.350 1.00 72.31 C ATOM 1989 O LYS A 121 8.163 14.474 23.275 1.00 63.52 O ATOM 1990 CB LYS A 121 10.811 16.384 22.804 1.00 20.34 C ATOM 1991 CG LYS A 121 11.008 16.448 24.309 1.00 12.31 C ATOM 1992 CD LYS A 121 12.136 17.395 24.684 1.00 70.22 C ATOM 1993 CE LYS A 121 11.704 18.849 24.572 1.00 31.21 C ATOM 1994 NZ LYS A 121 11.733 19.329 23.163 1.00 55.31 N ATOM 0 H LYS A 121 11.412 15.471 20.596 1.00 13.53 H new ATOM 0 HA LYS A 121 10.659 14.246 22.970 1.00 34.20 H new ATOM 0 HB2 LYS A 121 11.760 16.599 22.312 1.00 20.34 H new ATOM 0 HB3 LYS A 121 10.112 17.165 22.504 1.00 20.34 H new ATOM 0 HG2 LYS A 121 10.083 16.776 24.784 1.00 12.31 H new ATOM 0 HG3 LYS A 121 11.227 15.451 24.691 1.00 12.31 H new ATOM 0 HD2 LYS A 121 12.462 17.189 25.704 1.00 70.22 H new ATOM 0 HD3 LYS A 121 12.993 17.218 24.034 1.00 70.22 H new ATOM 0 HE2 LYS A 121 10.697 18.960 24.973 1.00 31.21 H new ATOM 0 HE3 LYS A 121 12.360 19.471 25.181 1.00 31.21 H new ATOM 0 HZ1 LYS A 121 11.989 20.337 23.145 1.00 55.31 H new ATOM 0 HZ2 LYS A 121 12.436 18.784 22.625 1.00 55.31 H new ATOM 0 HZ3 LYS A 121 10.794 19.202 22.734 1.00 55.31 H new ATOM 2008 N GLN A 122 8.147 15.621 21.339 1.00 60.11 N ATOM 2009 CA GLN A 122 6.692 15.677 21.258 1.00 63.04 C ATOM 2010 C GLN A 122 6.092 14.275 21.262 1.00 64.23 C ATOM 2011 O GLN A 122 5.055 14.034 21.879 1.00 52.10 O ATOM 2012 CB GLN A 122 6.259 16.426 19.996 1.00 4.11 C ATOM 2013 CG GLN A 122 4.934 17.155 20.146 1.00 11.12 C ATOM 2014 CD GLN A 122 4.548 17.928 18.900 1.00 24.41 C ATOM 2015 OE1 GLN A 122 4.610 17.404 17.787 1.00 0.22 O ATOM 2016 NE2 GLN A 122 4.147 19.181 19.080 1.00 25.34 N ATOM 0 H GLN A 122 8.631 16.077 20.565 1.00 60.11 H new ATOM 0 HA GLN A 122 6.325 16.212 22.134 1.00 63.04 H new ATOM 0 HB2 GLN A 122 7.032 17.146 19.728 1.00 4.11 H new ATOM 0 HB3 GLN A 122 6.183 15.718 19.171 1.00 4.11 H new ATOM 0 HG2 GLN A 122 4.151 16.433 20.378 1.00 11.12 H new ATOM 0 HG3 GLN A 122 4.995 17.842 20.990 1.00 11.12 H new ATOM 0 HE21 GLN A 122 4.111 19.575 20.020 1.00 25.34 H new ATOM 0 HE22 GLN A 122 3.875 19.750 18.278 1.00 25.34 H new ATOM 2025 N VAL A 123 6.752 13.352 20.568 1.00 10.24 N ATOM 2026 CA VAL A 123 6.284 11.973 20.493 1.00 43.33 C ATOM 2027 C VAL A 123 6.540 11.234 21.801 1.00 63.52 C ATOM 2028 O VAL A 123 5.629 10.646 22.383 1.00 34.02 O ATOM 2029 CB VAL A 123 6.968 11.211 19.342 1.00 3.12 C ATOM 2030 CG1 VAL A 123 6.341 9.837 19.165 1.00 24.51 C ATOM 2031 CG2 VAL A 123 6.889 12.012 18.052 1.00 44.44 C ATOM 0 H VAL A 123 7.612 13.535 20.050 1.00 10.24 H new ATOM 0 HA VAL A 123 5.211 12.012 20.306 1.00 43.33 H new ATOM 0 HB VAL A 123 8.020 11.075 19.594 1.00 3.12 H new ATOM 0 HG11 VAL A 123 6.837 9.313 18.348 1.00 24.51 H new ATOM 0 HG12 VAL A 123 6.455 9.264 20.085 1.00 24.51 H new ATOM 0 HG13 VAL A 123 5.281 9.948 18.935 1.00 24.51 H new ATOM 0 HG21 VAL A 123 7.377 11.459 17.250 1.00 44.44 H new ATOM 0 HG22 VAL A 123 5.844 12.181 17.792 1.00 44.44 H new ATOM 0 HG23 VAL A 123 7.389 12.971 18.188 1.00 44.44 H new ATOM 2041 N VAL A 124 7.788 11.267 22.259 1.00 72.43 N ATOM 2042 CA VAL A 124 8.165 10.601 23.500 1.00 74.42 C ATOM 2043 C VAL A 124 7.306 11.082 24.664 1.00 23.22 C ATOM 2044 O VAL A 124 6.797 10.280 25.446 1.00 3.02 O ATOM 2045 CB VAL A 124 9.648 10.840 23.837 1.00 64.40 C ATOM 2046 CG1 VAL A 124 10.027 10.120 25.123 1.00 55.32 C ATOM 2047 CG2 VAL A 124 10.535 10.391 22.685 1.00 50.20 C ATOM 0 H VAL A 124 8.555 11.748 21.789 1.00 72.43 H new ATOM 0 HA VAL A 124 8.002 9.534 23.349 1.00 74.42 H new ATOM 0 HB VAL A 124 9.800 11.909 23.988 1.00 64.40 H new ATOM 0 HG11 VAL A 124 11.079 10.301 25.345 1.00 55.32 H new ATOM 0 HG12 VAL A 124 9.414 10.493 25.943 1.00 55.32 H new ATOM 0 HG13 VAL A 124 9.860 9.050 25.003 1.00 55.32 H new ATOM 0 HG21 VAL A 124 11.580 10.567 22.940 1.00 50.20 H new ATOM 0 HG22 VAL A 124 10.381 9.328 22.500 1.00 50.20 H new ATOM 0 HG23 VAL A 124 10.280 10.956 21.788 1.00 50.20 H new ATOM 2057 N ASN A 125 7.150 12.397 24.773 1.00 54.23 N ATOM 2058 CA ASN A 125 6.352 12.986 25.842 1.00 3.34 C ATOM 2059 C ASN A 125 4.935 12.422 25.839 1.00 71.44 C ATOM 2060 O ASN A 125 4.261 12.402 26.868 1.00 14.44 O ATOM 2061 CB ASN A 125 6.307 14.508 25.694 1.00 3.42 C ATOM 2062 CG ASN A 125 7.472 15.191 26.384 1.00 4.21 C ATOM 2063 OD1 ASN A 125 7.973 14.712 27.402 1.00 61.04 O ATOM 2064 ND2 ASN A 125 7.910 16.317 25.832 1.00 74.02 N ATOM 0 H ASN A 125 7.566 13.075 24.134 1.00 54.23 H new ATOM 0 HA ASN A 125 6.822 12.733 26.792 1.00 3.34 H new ATOM 0 HB2 ASN A 125 6.312 14.768 24.635 1.00 3.42 H new ATOM 0 HB3 ASN A 125 5.372 14.883 26.109 1.00 3.42 H new ATOM 0 HD21 ASN A 125 8.691 16.821 26.252 1.00 74.02 H new ATOM 0 HD22 ASN A 125 7.465 16.678 24.988 1.00 74.02 H new ATOM 2071 N ASP A 126 4.490 11.963 24.674 1.00 22.51 N ATOM 2072 CA ASP A 126 3.154 11.395 24.536 1.00 52.52 C ATOM 2073 C ASP A 126 3.091 9.997 25.142 1.00 44.00 C ATOM 2074 O ASP A 126 2.183 9.684 25.912 1.00 23.14 O ATOM 2075 CB ASP A 126 2.748 11.345 23.062 1.00 62.51 C ATOM 2076 CG ASP A 126 1.248 11.223 22.878 1.00 23.31 C ATOM 2077 OD1 ASP A 126 0.581 10.684 23.786 1.00 13.31 O ATOM 2078 OD2 ASP A 126 0.742 11.666 21.827 1.00 51.44 O ATOM 0 H ASP A 126 5.035 11.973 23.812 1.00 22.51 H new ATOM 0 HA ASP A 126 2.457 12.036 25.076 1.00 52.52 H new ATOM 0 HB2 ASP A 126 3.100 12.246 22.560 1.00 62.51 H new ATOM 0 HB3 ASP A 126 3.240 10.500 22.581 1.00 62.51 H new ATOM 2083 N ILE A 127 4.061 9.161 24.788 1.00 24.42 N ATOM 2084 CA ILE A 127 4.116 7.796 25.298 1.00 42.05 C ATOM 2085 C ILE A 127 4.071 7.776 26.822 1.00 73.24 C ATOM 2086 O ILE A 127 3.301 7.024 27.419 1.00 50.40 O ATOM 2087 CB ILE A 127 5.388 7.069 24.823 1.00 23.24 C ATOM 2088 CG1 ILE A 127 5.433 7.017 23.295 1.00 74.21 C ATOM 2089 CG2 ILE A 127 5.446 5.666 25.408 1.00 35.45 C ATOM 2090 CD1 ILE A 127 6.835 7.045 22.730 1.00 44.43 C ATOM 0 H ILE A 127 4.819 9.404 24.151 1.00 24.42 H new ATOM 0 HA ILE A 127 3.242 7.277 24.905 1.00 42.05 H new ATOM 0 HB ILE A 127 6.258 7.624 25.174 1.00 23.24 H new ATOM 0 HG12 ILE A 127 4.931 6.111 22.956 1.00 74.21 H new ATOM 0 HG13 ILE A 127 4.872 7.861 22.894 1.00 74.21 H new ATOM 0 HG21 ILE A 127 6.351 5.165 25.063 1.00 35.45 H new ATOM 0 HG22 ILE A 127 5.457 5.726 26.496 1.00 35.45 H new ATOM 0 HG23 ILE A 127 4.572 5.100 25.084 1.00 35.45 H new ATOM 0 HD11 ILE A 127 6.790 7.005 21.642 1.00 44.43 H new ATOM 0 HD12 ILE A 127 7.334 7.964 23.039 1.00 44.43 H new ATOM 0 HD13 ILE A 127 7.394 6.186 23.101 1.00 44.43 H new ATOM 2102 N GLU A 128 4.900 8.608 27.444 1.00 12.01 N ATOM 2103 CA GLU A 128 4.953 8.686 28.899 1.00 31.12 C ATOM 2104 C GLU A 128 3.569 8.963 29.480 1.00 22.31 C ATOM 2105 O GLU A 128 3.146 8.315 30.438 1.00 53.51 O ATOM 2106 CB GLU A 128 5.930 9.778 29.338 1.00 2.24 C ATOM 2107 CG GLU A 128 7.359 9.536 28.881 1.00 11.31 C ATOM 2108 CD GLU A 128 7.969 8.295 29.504 1.00 55.42 C ATOM 2109 OE1 GLU A 128 7.881 8.149 30.741 1.00 10.11 O ATOM 2110 OE2 GLU A 128 8.533 7.471 28.755 1.00 40.22 O ATOM 0 H GLU A 128 5.544 9.237 26.964 1.00 12.01 H new ATOM 0 HA GLU A 128 5.301 7.724 29.276 1.00 31.12 H new ATOM 0 HB2 GLU A 128 5.590 10.737 28.947 1.00 2.24 H new ATOM 0 HB3 GLU A 128 5.913 9.853 30.425 1.00 2.24 H new ATOM 0 HG2 GLU A 128 7.378 9.440 27.795 1.00 11.31 H new ATOM 0 HG3 GLU A 128 7.969 10.403 29.135 1.00 11.31 H new ATOM 2117 N ARG A 129 2.870 9.929 28.894 1.00 62.03 N ATOM 2118 CA ARG A 129 1.535 10.293 29.353 1.00 5.34 C ATOM 2119 C ARG A 129 0.556 9.141 29.147 1.00 2.33 C ATOM 2120 O ARG A 129 -0.286 8.869 30.002 1.00 13.14 O ATOM 2121 CB ARG A 129 1.040 11.537 28.613 1.00 33.21 C ATOM 2122 CG ARG A 129 1.917 12.760 28.822 1.00 43.13 C ATOM 2123 CD ARG A 129 1.476 13.562 30.036 1.00 23.44 C ATOM 2124 NE ARG A 129 2.019 13.017 31.278 1.00 21.00 N ATOM 2125 CZ ARG A 129 3.280 13.181 31.663 1.00 32.12 C ATOM 2126 NH1 ARG A 129 4.123 13.871 30.907 1.00 20.44 N ATOM 2127 NH2 ARG A 129 3.699 12.655 32.807 1.00 62.32 N ATOM 0 H ARG A 129 3.206 10.474 28.100 1.00 62.03 H new ATOM 0 HA ARG A 129 1.592 10.512 30.419 1.00 5.34 H new ATOM 0 HB2 ARG A 129 0.986 11.317 27.547 1.00 33.21 H new ATOM 0 HB3 ARG A 129 0.027 11.766 28.943 1.00 33.21 H new ATOM 0 HG2 ARG A 129 2.954 12.448 28.948 1.00 43.13 H new ATOM 0 HG3 ARG A 129 1.880 13.392 27.934 1.00 43.13 H new ATOM 0 HD2 ARG A 129 1.798 14.597 29.923 1.00 23.44 H new ATOM 0 HD3 ARG A 129 0.387 13.570 30.089 1.00 23.44 H new ATOM 0 HE ARG A 129 1.396 12.481 31.883 1.00 21.00 H new ATOM 0 HH11 ARG A 129 3.804 14.277 30.028 1.00 20.44 H new ATOM 0 HH12 ARG A 129 5.091 13.995 31.205 1.00 20.44 H new ATOM 0 HH21 ARG A 129 3.053 12.124 33.391 1.00 62.32 H new ATOM 0 HH22 ARG A 129 4.667 12.781 33.102 1.00 62.32 H new ATOM 2141 N SER A 130 0.673 8.469 28.007 1.00 63.22 N ATOM 2142 CA SER A 130 -0.204 7.349 27.686 1.00 11.11 C ATOM 2143 C SER A 130 -0.128 6.273 28.765 1.00 60.01 C ATOM 2144 O SER A 130 -1.151 5.826 29.286 1.00 3.44 O ATOM 2145 CB SER A 130 0.170 6.753 26.328 1.00 63.02 C ATOM 2146 OG SER A 130 -0.962 6.189 25.689 1.00 62.12 O ATOM 0 H SER A 130 1.367 8.680 27.290 1.00 63.22 H new ATOM 0 HA SER A 130 -1.227 7.722 27.641 1.00 11.11 H new ATOM 0 HB2 SER A 130 0.601 7.528 25.694 1.00 63.02 H new ATOM 0 HB3 SER A 130 0.935 5.988 26.461 1.00 63.02 H new ATOM 0 HG SER A 130 -0.856 6.255 24.717 1.00 62.12 H new ATOM 2152 N LEU A 131 1.091 5.861 29.095 1.00 71.40 N ATOM 2153 CA LEU A 131 1.303 4.836 30.112 1.00 12.40 C ATOM 2154 C LEU A 131 0.790 5.303 31.470 1.00 15.43 C ATOM 2155 O LEU A 131 0.267 4.511 32.253 1.00 33.13 O ATOM 2156 CB LEU A 131 2.789 4.485 30.209 1.00 54.43 C ATOM 2157 CG LEU A 131 3.470 4.083 28.900 1.00 34.12 C ATOM 2158 CD1 LEU A 131 4.972 3.955 29.098 1.00 41.23 C ATOM 2159 CD2 LEU A 131 2.886 2.779 28.374 1.00 3.43 C ATOM 0 H LEU A 131 1.948 6.221 28.674 1.00 71.40 H new ATOM 0 HA LEU A 131 0.744 3.947 29.819 1.00 12.40 H new ATOM 0 HB2 LEU A 131 3.318 5.344 30.622 1.00 54.43 H new ATOM 0 HB3 LEU A 131 2.903 3.667 30.921 1.00 54.43 H new ATOM 0 HG LEU A 131 3.287 4.864 28.162 1.00 34.12 H new ATOM 0 HD11 LEU A 131 5.440 3.668 28.156 1.00 41.23 H new ATOM 0 HD12 LEU A 131 5.378 4.911 29.429 1.00 41.23 H new ATOM 0 HD13 LEU A 131 5.176 3.194 29.851 1.00 41.23 H new ATOM 0 HD21 LEU A 131 3.382 2.508 27.442 1.00 3.43 H new ATOM 0 HD22 LEU A 131 3.039 1.989 29.109 1.00 3.43 H new ATOM 0 HD23 LEU A 131 1.819 2.905 28.193 1.00 3.43 H new