USER MOD reduce.3.24.130724 H: found=0, std=0, add=939, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 944 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 236 GLN : amide:sc=-0.00114 X(o=0.24,f=0.24) USER MOD Set 1.2: A 238 GLN : amide:sc= 0.237 X(o=0.24,f=-0.23) USER MOD Set 2.1: A 204 GLN : amide:sc= 0.205 K(o=0.4,f=-2!) USER MOD Set 2.2: B 117 SER OG : rot 180:sc= 0.191 USER MOD Set 3.1: A 197 GLN : amide:sc= 0.413 K(o=1,f=-2.2!) USER MOD Set 3.2: A 198 GLN : amide:sc= 0.619 K(o=1,f=-0.69) USER MOD Set 4.1: A 173 MET CE :methyl 179:sc= -0.393 (180deg=-0.375) USER MOD Set 4.2: A 223 HIS : no HD1:sc= 0.749 K(o=0.36,f=-6.7!) USER MOD Set 5.1: A 171 ASN : amide:sc= 0.132 K(o=0.36,f=-1.2!) USER MOD Set 5.2: A 174 LYS NZ :NH3+ -133:sc= 0.224 (180deg=0) USER MOD Set 6.1: A 163 THR OG1 : rot -90:sc= -0.903 USER MOD Set 6.2: A 166 GLN : amide:sc= 0.305 X(o=-0.6,f=-0.74) USER MOD Set 7.1: A 161 GLN : amide:sc= 0.577 X(o=1.1,f=0.84) USER MOD Set 7.2: A 167 GLN : amide:sc= 0.492 X(o=1.1,f=0.84) USER MOD Single : A 158 GLN : amide:sc= 0.851 K(o=0.85,f=-5.6!) USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 168 GLN : amide:sc= -0.591 K(o=-0.59,f=-4!) USER MOD Single : A 172 GLN : amide:sc= 0.759 K(o=0.76,f=0) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 184 GLN : amide:sc= -0.445 X(o=-0.45,f=-0.86) USER MOD Single : A 188 ASN : amide:sc= -0.0545 X(o=-0.055,f=-0.069) USER MOD Single : A 192 ASN : amide:sc= -0.0637 K(o=-0.064,f=-0.78) USER MOD Single : A 194 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 195 THR OG1 : rot 180:sc= 0 USER MOD Single : A 200 THR OG1 : rot 42:sc= 0.0575 USER MOD Single : A 205 GLN : amide:sc= -0.0339 X(o=-0.034,f=-0.034) USER MOD Single : A 206 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 209 THR OG1 : rot -56:sc= 1.19 USER MOD Single : A 211 GLN : amide:sc= 0.94 K(o=0.94,f=-0.42) USER MOD Single : A 213 MET CE :methyl -146:sc= 0 (180deg=-0.312) USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 2.57 (180deg=2.57) USER MOD Single : A 220 TYR OH : rot -56:sc= 1.27 USER MOD Single : A 221 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 224 GLN : amide:sc= -1.06 K(o=-1.1,f=-1.6!) USER MOD Single : A 225 GLN : amide:sc= -0.253 X(o=-0.25,f=0) USER MOD Single : A 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 233 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 234 GLN : amide:sc= -0.237 K(o=-0.24,f=-1.2!) USER MOD Single : A 235 GLN : amide:sc= -0.17 K(o=-0.17,f=-0.78) USER MOD Single : B 101 SER OG : rot 29:sc= 0.419 USER MOD Single : B 102 THR OG1 : rot 180:sc= 0 USER MOD Single : B 104 SER OG : rot 180:sc= 0 USER MOD Single : B 105 THR OG1 : rot 180:sc= 0 USER MOD Single : B 107 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 110 TYR OH : rot -150:sc= 1.42 USER MOD Single : B 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 116 ASN : amide:sc= 0.734 K(o=0.73,f=-2.5) USER MOD Single : B 118 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0214) USER MOD Single : B 121 THR OG1 : rot 80:sc= 0.111 USER MOD Single : B 122 SER OG : rot 180:sc= 0.155 USER MOD Single : B 126 ASN : amide:sc= -0.145 X(o=-0.14,f=0) USER MOD Single : B 131 THR OG1 : rot 180:sc= 0 USER MOD Single : B 132 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 158 -15.073 -4.787 -18.039 1.00 14.62 N ATOM 2 CA GLN A 158 -13.600 -4.691 -18.143 1.00 14.18 C ATOM 3 C GLN A 158 -12.955 -5.179 -16.852 1.00 13.66 C ATOM 4 O GLN A 158 -13.398 -4.820 -15.762 1.00 13.66 O ATOM 5 CB GLN A 158 -13.193 -3.244 -18.422 1.00 14.24 C ATOM 6 CG GLN A 158 -12.499 -3.044 -19.759 1.00 14.52 C ATOM 7 CD GLN A 158 -11.186 -3.790 -19.849 1.00 14.67 C ATOM 8 OE1 GLN A 158 -10.513 -4.014 -18.842 1.00 14.57 O ATOM 9 NE2 GLN A 158 -10.806 -4.171 -21.057 1.00 15.07 N ATOM 0 HA GLN A 158 -13.258 -5.319 -18.966 1.00 14.18 H new ATOM 0 HB2 GLN A 158 -14.082 -2.614 -18.388 1.00 14.24 H new ATOM 0 HB3 GLN A 158 -12.531 -2.904 -17.626 1.00 14.24 H new ATOM 0 HG2 GLN A 158 -13.158 -3.378 -20.560 1.00 14.52 H new ATOM 0 HG3 GLN A 158 -12.320 -1.980 -19.916 1.00 14.52 H new ATOM 0 HE21 GLN A 158 -11.394 -3.965 -21.865 1.00 15.07 H new ATOM 0 HE22 GLN A 158 -9.925 -4.671 -21.181 1.00 15.07 H new ATOM 20 N ARG A 159 -11.923 -6.007 -16.973 1.00 13.39 N ATOM 21 CA ARG A 159 -11.239 -6.545 -15.803 1.00 13.07 C ATOM 22 C ARG A 159 -9.976 -5.755 -15.473 1.00 12.59 C ATOM 23 O ARG A 159 -9.656 -5.547 -14.302 1.00 12.86 O ATOM 24 CB ARG A 159 -10.887 -8.017 -16.017 1.00 13.30 C ATOM 25 CG ARG A 159 -12.065 -8.960 -15.840 1.00 13.64 C ATOM 26 CD ARG A 159 -11.612 -10.412 -15.823 1.00 14.11 C ATOM 27 NE ARG A 159 -12.692 -11.326 -15.444 1.00 14.43 N ATOM 28 CZ ARG A 159 -12.909 -11.745 -14.197 1.00 14.90 C ATOM 29 NH1 ARG A 159 -12.132 -11.334 -13.204 1.00 15.09 N1+ ATOM 30 NH2 ARG A 159 -13.897 -12.594 -13.945 1.00 15.34 N ATOM 0 H ARG A 159 -11.543 -6.319 -17.866 1.00 13.39 H new ATOM 0 HA ARG A 159 -11.923 -6.456 -14.959 1.00 13.07 H new ATOM 0 HB2 ARG A 159 -10.481 -8.142 -17.021 1.00 13.30 H new ATOM 0 HB3 ARG A 159 -10.100 -8.298 -15.318 1.00 13.30 H new ATOM 0 HG2 ARG A 159 -12.583 -8.727 -14.910 1.00 13.64 H new ATOM 0 HG3 ARG A 159 -12.779 -8.809 -16.649 1.00 13.64 H new ATOM 0 HD2 ARG A 159 -11.237 -10.685 -16.809 1.00 14.11 H new ATOM 0 HD3 ARG A 159 -10.783 -10.524 -15.125 1.00 14.11 H new ATOM 0 HE ARG A 159 -13.315 -11.662 -16.178 1.00 14.43 H new ATOM 0 HH11 ARG A 159 -11.361 -10.692 -13.391 1.00 15.09 H new ATOM 0 HH12 ARG A 159 -12.305 -11.659 -12.253 1.00 15.09 H new ATOM 0 HH21 ARG A 159 -14.490 -12.926 -14.705 1.00 15.34 H new ATOM 0 HH22 ARG A 159 -14.063 -12.915 -12.991 1.00 15.34 H new ATOM 44 N ARG A 160 -9.258 -5.315 -16.499 1.00 12.05 N ATOM 45 CA ARG A 160 -8.029 -4.556 -16.292 1.00 11.74 C ATOM 46 C ARG A 160 -8.336 -3.094 -15.993 1.00 11.04 C ATOM 47 O ARG A 160 -7.686 -2.474 -15.152 1.00 10.84 O ATOM 48 CB ARG A 160 -7.104 -4.668 -17.506 1.00 11.99 C ATOM 49 CG ARG A 160 -6.196 -5.890 -17.473 1.00 12.34 C ATOM 50 CD ARG A 160 -5.252 -5.862 -16.279 1.00 12.69 C ATOM 51 NE ARG A 160 -5.902 -6.325 -15.054 1.00 12.85 N ATOM 52 CZ ARG A 160 -5.652 -5.840 -13.837 1.00 13.18 C ATOM 53 NH1 ARG A 160 -4.740 -4.887 -13.662 1.00 13.36 N1+ ATOM 54 NH2 ARG A 160 -6.310 -6.318 -12.789 1.00 13.51 N ATOM 0 H ARG A 160 -9.503 -5.469 -17.477 1.00 12.05 H new ATOM 0 HA ARG A 160 -7.517 -4.983 -15.430 1.00 11.74 H new ATOM 0 HB2 ARG A 160 -7.710 -4.701 -18.412 1.00 11.99 H new ATOM 0 HB3 ARG A 160 -6.488 -3.770 -17.567 1.00 11.99 H new ATOM 0 HG2 ARG A 160 -6.804 -6.794 -17.434 1.00 12.34 H new ATOM 0 HG3 ARG A 160 -5.615 -5.936 -18.394 1.00 12.34 H new ATOM 0 HD2 ARG A 160 -4.385 -6.489 -16.488 1.00 12.69 H new ATOM 0 HD3 ARG A 160 -4.884 -4.847 -16.132 1.00 12.69 H new ATOM 0 HE ARG A 160 -6.594 -7.070 -15.136 1.00 12.85 H new ATOM 0 HH11 ARG A 160 -4.225 -4.521 -14.463 1.00 13.36 H new ATOM 0 HH12 ARG A 160 -4.556 -4.523 -12.727 1.00 13.36 H new ATOM 0 HH21 ARG A 160 -7.005 -7.054 -12.915 1.00 13.51 H new ATOM 0 HH22 ARG A 160 -6.121 -5.949 -11.857 1.00 13.51 H new ATOM 68 N GLN A 161 -9.314 -2.538 -16.691 1.00 10.86 N ATOM 69 CA GLN A 161 -9.698 -1.155 -16.469 1.00 10.36 C ATOM 70 C GLN A 161 -11.012 -1.108 -15.711 1.00 9.86 C ATOM 71 O GLN A 161 -12.052 -1.535 -16.214 1.00 10.18 O ATOM 72 CB GLN A 161 -9.827 -0.390 -17.784 1.00 10.81 C ATOM 73 CG GLN A 161 -9.274 1.027 -17.722 1.00 11.07 C ATOM 74 CD GLN A 161 -10.049 1.930 -16.777 1.00 11.46 C ATOM 75 OE1 GLN A 161 -9.694 2.070 -15.604 1.00 11.66 O ATOM 76 NE2 GLN A 161 -11.104 2.552 -17.279 1.00 11.77 N ATOM 0 H GLN A 161 -9.852 -3.020 -17.411 1.00 10.86 H new ATOM 0 HA GLN A 161 -8.915 -0.675 -15.882 1.00 10.36 H new ATOM 0 HB2 GLN A 161 -9.306 -0.940 -18.567 1.00 10.81 H new ATOM 0 HB3 GLN A 161 -10.878 -0.349 -18.069 1.00 10.81 H new ATOM 0 HG2 GLN A 161 -8.232 0.990 -17.406 1.00 11.07 H new ATOM 0 HG3 GLN A 161 -9.289 1.460 -18.722 1.00 11.07 H new ATOM 0 HE21 GLN A 161 -11.364 2.409 -18.255 1.00 11.77 H new ATOM 0 HE22 GLN A 161 -11.657 3.175 -16.690 1.00 11.77 H new ATOM 85 N LEU A 162 -10.962 -0.579 -14.507 1.00 9.29 N ATOM 86 CA LEU A 162 -12.139 -0.491 -13.672 1.00 8.96 C ATOM 87 C LEU A 162 -12.530 0.959 -13.477 1.00 8.97 C ATOM 88 O LEU A 162 -13.559 1.408 -13.981 1.00 9.41 O ATOM 89 CB LEU A 162 -11.884 -1.158 -12.317 1.00 8.70 C ATOM 90 CG LEU A 162 -11.632 -2.664 -12.365 1.00 8.71 C ATOM 91 CD1 LEU A 162 -11.208 -3.176 -11.000 1.00 8.87 C ATOM 92 CD2 LEU A 162 -12.874 -3.399 -12.845 1.00 8.59 C ATOM 0 H LEU A 162 -10.114 -0.202 -14.084 1.00 9.29 H new ATOM 0 HA LEU A 162 -12.958 -1.014 -14.166 1.00 8.96 H new ATOM 0 HB2 LEU A 162 -11.024 -0.678 -11.851 1.00 8.70 H new ATOM 0 HB3 LEU A 162 -12.742 -0.971 -11.672 1.00 8.70 H new ATOM 0 HG LEU A 162 -10.824 -2.854 -13.072 1.00 8.71 H new ATOM 0 HD11 LEU A 162 -11.033 -4.251 -11.053 1.00 8.87 H new ATOM 0 HD12 LEU A 162 -10.291 -2.674 -10.692 1.00 8.87 H new ATOM 0 HD13 LEU A 162 -11.995 -2.972 -10.274 1.00 8.87 H new ATOM 0 HD21 LEU A 162 -12.675 -4.470 -12.873 1.00 8.59 H new ATOM 0 HD22 LEU A 162 -13.701 -3.201 -12.163 1.00 8.59 H new ATOM 0 HD23 LEU A 162 -13.138 -3.053 -13.844 1.00 8.59 H new ATOM 104 N THR A 163 -11.697 1.691 -12.762 1.00 8.60 N ATOM 105 CA THR A 163 -11.948 3.090 -12.493 1.00 8.65 C ATOM 106 C THR A 163 -10.643 3.857 -12.388 1.00 8.24 C ATOM 107 O THR A 163 -9.699 3.382 -11.761 1.00 7.76 O ATOM 108 CB THR A 163 -12.734 3.254 -11.186 1.00 8.64 C ATOM 109 OG1 THR A 163 -12.450 2.158 -10.311 1.00 8.49 O ATOM 110 CG2 THR A 163 -14.216 3.306 -11.466 1.00 8.89 C ATOM 0 H THR A 163 -10.833 1.333 -12.354 1.00 8.60 H new ATOM 0 HA THR A 163 -12.535 3.489 -13.321 1.00 8.65 H new ATOM 0 HB THR A 163 -12.432 4.188 -10.711 1.00 8.64 H new ATOM 0 HG1 THR A 163 -13.091 1.435 -10.474 1.00 8.49 H new ATOM 0 HG21 THR A 163 -14.760 3.423 -10.528 1.00 8.89 H new ATOM 0 HG22 THR A 163 -14.433 4.151 -12.119 1.00 8.89 H new ATOM 0 HG23 THR A 163 -14.527 2.382 -11.953 1.00 8.89 H new ATOM 118 N PRO A 164 -10.568 5.051 -12.996 1.00 8.51 N ATOM 119 CA PRO A 164 -9.361 5.879 -12.952 1.00 8.32 C ATOM 120 C PRO A 164 -8.927 6.195 -11.523 1.00 7.84 C ATOM 121 O PRO A 164 -7.734 6.214 -11.222 1.00 7.58 O ATOM 122 CB PRO A 164 -9.763 7.165 -13.686 1.00 8.84 C ATOM 123 CG PRO A 164 -11.248 7.133 -13.790 1.00 9.21 C ATOM 124 CD PRO A 164 -11.638 5.681 -13.787 1.00 9.12 C ATOM 0 HA PRO A 164 -8.510 5.370 -13.406 1.00 8.32 H new ATOM 0 HB2 PRO A 164 -9.429 8.047 -13.139 1.00 8.84 H new ATOM 0 HB3 PRO A 164 -9.304 7.210 -14.674 1.00 8.84 H new ATOM 0 HG2 PRO A 164 -11.708 7.661 -12.955 1.00 9.21 H new ATOM 0 HG3 PRO A 164 -11.585 7.625 -14.703 1.00 9.21 H new ATOM 0 HD2 PRO A 164 -12.618 5.527 -13.335 1.00 9.12 H new ATOM 0 HD3 PRO A 164 -11.686 5.274 -14.797 1.00 9.12 H new ATOM 132 N GLN A 165 -9.899 6.415 -10.640 1.00 7.83 N ATOM 133 CA GLN A 165 -9.606 6.738 -9.249 1.00 7.51 C ATOM 134 C GLN A 165 -9.030 5.533 -8.504 1.00 6.97 C ATOM 135 O GLN A 165 -8.039 5.662 -7.786 1.00 6.65 O ATOM 136 CB GLN A 165 -10.856 7.241 -8.527 1.00 7.82 C ATOM 137 CG GLN A 165 -10.543 7.938 -7.212 1.00 8.09 C ATOM 138 CD GLN A 165 -11.607 7.721 -6.158 1.00 8.36 C ATOM 139 OE1 GLN A 165 -11.553 6.756 -5.395 1.00 8.55 O ATOM 140 NE2 GLN A 165 -12.578 8.617 -6.103 1.00 8.64 N ATOM 0 H GLN A 165 -10.893 6.375 -10.864 1.00 7.83 H new ATOM 0 HA GLN A 165 -8.858 7.531 -9.255 1.00 7.51 H new ATOM 0 HB2 GLN A 165 -11.392 7.931 -9.179 1.00 7.82 H new ATOM 0 HB3 GLN A 165 -11.522 6.399 -8.336 1.00 7.82 H new ATOM 0 HG2 GLN A 165 -9.587 7.576 -6.834 1.00 8.09 H new ATOM 0 HG3 GLN A 165 -10.431 9.007 -7.392 1.00 8.09 H new ATOM 0 HE21 GLN A 165 -12.585 9.402 -6.754 1.00 8.64 H new ATOM 0 HE22 GLN A 165 -13.320 8.523 -5.409 1.00 8.64 H new ATOM 149 N GLN A 166 -9.638 4.364 -8.692 1.00 6.95 N ATOM 150 CA GLN A 166 -9.179 3.155 -8.017 1.00 6.50 C ATOM 151 C GLN A 166 -7.882 2.664 -8.634 1.00 6.28 C ATOM 152 O GLN A 166 -6.985 2.194 -7.931 1.00 5.88 O ATOM 153 CB GLN A 166 -10.236 2.053 -8.080 1.00 6.71 C ATOM 154 CG GLN A 166 -11.395 2.261 -7.120 1.00 6.96 C ATOM 155 CD GLN A 166 -12.264 1.027 -6.988 1.00 7.29 C ATOM 156 OE1 GLN A 166 -12.025 0.172 -6.131 1.00 7.56 O ATOM 157 NE2 GLN A 166 -13.270 0.915 -7.839 1.00 7.52 N ATOM 0 H GLN A 166 -10.444 4.230 -9.302 1.00 6.95 H new ATOM 0 HA GLN A 166 -9.004 3.403 -6.970 1.00 6.50 H new ATOM 0 HB2 GLN A 166 -10.625 1.993 -9.097 1.00 6.71 H new ATOM 0 HB3 GLN A 166 -9.763 1.095 -7.862 1.00 6.71 H new ATOM 0 HG2 GLN A 166 -11.006 2.535 -6.139 1.00 6.96 H new ATOM 0 HG3 GLN A 166 -12.004 3.096 -7.466 1.00 6.96 H new ATOM 0 HE21 GLN A 166 -13.434 1.644 -8.533 1.00 7.52 H new ATOM 0 HE22 GLN A 166 -13.882 0.100 -7.801 1.00 7.52 H new ATOM 166 N GLN A 167 -7.784 2.780 -9.952 1.00 6.66 N ATOM 167 CA GLN A 167 -6.588 2.357 -10.665 1.00 6.68 C ATOM 168 C GLN A 167 -5.367 3.125 -10.170 1.00 6.51 C ATOM 169 O GLN A 167 -4.289 2.560 -10.004 1.00 6.41 O ATOM 170 CB GLN A 167 -6.748 2.565 -12.168 1.00 7.28 C ATOM 171 CG GLN A 167 -7.098 1.296 -12.926 1.00 7.57 C ATOM 172 CD GLN A 167 -6.286 1.153 -14.197 1.00 8.01 C ATOM 173 OE1 GLN A 167 -5.171 0.638 -14.177 1.00 8.31 O ATOM 174 NE2 GLN A 167 -6.836 1.604 -15.311 1.00 8.31 N ATOM 0 H GLN A 167 -8.518 3.163 -10.548 1.00 6.66 H new ATOM 0 HA GLN A 167 -6.444 1.294 -10.470 1.00 6.68 H new ATOM 0 HB2 GLN A 167 -7.526 3.308 -12.342 1.00 7.28 H new ATOM 0 HB3 GLN A 167 -5.821 2.974 -12.570 1.00 7.28 H new ATOM 0 HG2 GLN A 167 -6.924 0.431 -12.285 1.00 7.57 H new ATOM 0 HG3 GLN A 167 -8.160 1.302 -13.173 1.00 7.57 H new ATOM 0 HE21 GLN A 167 -7.764 2.026 -15.287 1.00 8.31 H new ATOM 0 HE22 GLN A 167 -6.332 1.530 -16.195 1.00 8.31 H new ATOM 183 N GLN A 168 -5.563 4.411 -9.911 1.00 6.59 N ATOM 184 CA GLN A 168 -4.492 5.281 -9.434 1.00 6.60 C ATOM 185 C GLN A 168 -3.987 4.862 -8.056 1.00 6.15 C ATOM 186 O GLN A 168 -2.884 5.224 -7.659 1.00 6.21 O ATOM 187 CB GLN A 168 -4.967 6.728 -9.385 1.00 6.88 C ATOM 188 CG GLN A 168 -4.794 7.468 -10.699 1.00 7.43 C ATOM 189 CD GLN A 168 -3.345 7.816 -10.987 1.00 7.81 C ATOM 190 OE1 GLN A 168 -2.427 7.110 -10.571 1.00 8.12 O ATOM 191 NE2 GLN A 168 -3.136 8.904 -11.708 1.00 8.10 N ATOM 0 H GLN A 168 -6.462 4.880 -10.024 1.00 6.59 H new ATOM 0 HA GLN A 168 -3.665 5.189 -10.138 1.00 6.60 H new ATOM 0 HB2 GLN A 168 -6.020 6.747 -9.103 1.00 6.88 H new ATOM 0 HB3 GLN A 168 -4.418 7.256 -8.605 1.00 6.88 H new ATOM 0 HG2 GLN A 168 -5.185 6.855 -11.511 1.00 7.43 H new ATOM 0 HG3 GLN A 168 -5.386 8.383 -10.677 1.00 7.43 H new ATOM 0 HE21 GLN A 168 -3.927 9.460 -12.033 1.00 8.10 H new ATOM 0 HE22 GLN A 168 -2.184 9.187 -11.940 1.00 8.10 H new ATOM 200 N LEU A 169 -4.799 4.117 -7.324 1.00 5.81 N ATOM 201 CA LEU A 169 -4.423 3.676 -5.991 1.00 5.44 C ATOM 202 C LEU A 169 -3.572 2.413 -6.054 1.00 5.18 C ATOM 203 O LEU A 169 -2.470 2.363 -5.506 1.00 5.07 O ATOM 204 CB LEU A 169 -5.674 3.419 -5.148 1.00 5.36 C ATOM 205 CG LEU A 169 -6.528 4.653 -4.851 1.00 5.65 C ATOM 206 CD1 LEU A 169 -7.877 4.245 -4.283 1.00 5.76 C ATOM 207 CD2 LEU A 169 -5.807 5.587 -3.889 1.00 5.82 C ATOM 0 H LEU A 169 -5.721 3.805 -7.630 1.00 5.81 H new ATOM 0 HA LEU A 169 -3.833 4.466 -5.527 1.00 5.44 H new ATOM 0 HB2 LEU A 169 -6.294 2.684 -5.662 1.00 5.36 H new ATOM 0 HB3 LEU A 169 -5.369 2.973 -4.202 1.00 5.36 H new ATOM 0 HG LEU A 169 -6.694 5.186 -5.787 1.00 5.65 H new ATOM 0 HD11 LEU A 169 -8.470 5.136 -4.078 1.00 5.76 H new ATOM 0 HD12 LEU A 169 -8.401 3.618 -5.005 1.00 5.76 H new ATOM 0 HD13 LEU A 169 -7.729 3.687 -3.358 1.00 5.76 H new ATOM 0 HD21 LEU A 169 -6.431 6.458 -3.691 1.00 5.82 H new ATOM 0 HD22 LEU A 169 -5.608 5.063 -2.954 1.00 5.82 H new ATOM 0 HD23 LEU A 169 -4.865 5.909 -4.332 1.00 5.82 H new ATOM 219 N VAL A 170 -4.073 1.406 -6.756 1.00 5.20 N ATOM 220 CA VAL A 170 -3.374 0.130 -6.861 1.00 5.06 C ATOM 221 C VAL A 170 -2.121 0.207 -7.728 1.00 5.34 C ATOM 222 O VAL A 170 -1.120 -0.445 -7.435 1.00 5.28 O ATOM 223 CB VAL A 170 -4.294 -0.991 -7.393 1.00 5.24 C ATOM 224 CG1 VAL A 170 -5.349 -1.348 -6.358 1.00 5.25 C ATOM 225 CG2 VAL A 170 -4.947 -0.596 -8.711 1.00 5.42 C ATOM 0 H VAL A 170 -4.959 1.446 -7.261 1.00 5.20 H new ATOM 0 HA VAL A 170 -3.067 -0.112 -5.843 1.00 5.06 H new ATOM 0 HB VAL A 170 -3.677 -1.870 -7.580 1.00 5.24 H new ATOM 0 HG11 VAL A 170 -5.989 -2.139 -6.749 1.00 5.25 H new ATOM 0 HG12 VAL A 170 -4.862 -1.692 -5.446 1.00 5.25 H new ATOM 0 HG13 VAL A 170 -5.954 -0.469 -6.137 1.00 5.25 H new ATOM 0 HG21 VAL A 170 -5.588 -1.407 -9.057 1.00 5.42 H new ATOM 0 HG22 VAL A 170 -5.546 0.303 -8.565 1.00 5.42 H new ATOM 0 HG23 VAL A 170 -4.175 -0.400 -9.455 1.00 5.42 H new ATOM 235 N ASN A 171 -2.160 1.005 -8.787 1.00 5.77 N ATOM 236 CA ASN A 171 -1.013 1.125 -9.682 1.00 6.24 C ATOM 237 C ASN A 171 0.134 1.883 -9.020 1.00 6.25 C ATOM 238 O ASN A 171 1.302 1.665 -9.347 1.00 6.59 O ATOM 239 CB ASN A 171 -1.409 1.820 -10.984 1.00 6.76 C ATOM 240 CG ASN A 171 -0.480 1.472 -12.134 1.00 7.31 C ATOM 241 OD1 ASN A 171 0.049 0.360 -12.211 1.00 7.47 O ATOM 242 ND2 ASN A 171 -0.286 2.417 -13.041 1.00 7.80 N ATOM 0 H ASN A 171 -2.965 1.575 -9.047 1.00 5.77 H new ATOM 0 HA ASN A 171 -0.672 0.115 -9.908 1.00 6.24 H new ATOM 0 HB2 ASN A 171 -2.429 1.539 -11.247 1.00 6.76 H new ATOM 0 HB3 ASN A 171 -1.405 2.899 -10.832 1.00 6.76 H new ATOM 0 HD21 ASN A 171 0.320 2.239 -13.842 1.00 7.80 H new ATOM 0 HD22 ASN A 171 -0.743 3.323 -12.939 1.00 7.80 H new ATOM 249 N GLN A 172 -0.194 2.761 -8.080 1.00 6.00 N ATOM 250 CA GLN A 172 0.824 3.540 -7.390 1.00 6.13 C ATOM 251 C GLN A 172 1.412 2.746 -6.232 1.00 5.80 C ATOM 252 O GLN A 172 2.628 2.693 -6.067 1.00 6.06 O ATOM 253 CB GLN A 172 0.247 4.866 -6.886 1.00 6.13 C ATOM 254 CG GLN A 172 0.155 5.935 -7.965 1.00 6.58 C ATOM 255 CD GLN A 172 -0.133 7.314 -7.403 1.00 6.95 C ATOM 256 OE1 GLN A 172 0.784 8.071 -7.086 1.00 7.27 O ATOM 257 NE2 GLN A 172 -1.407 7.649 -7.272 1.00 7.22 N ATOM 0 H GLN A 172 -1.150 2.950 -7.780 1.00 6.00 H new ATOM 0 HA GLN A 172 1.620 3.760 -8.101 1.00 6.13 H new ATOM 0 HB2 GLN A 172 -0.747 4.688 -6.476 1.00 6.13 H new ATOM 0 HB3 GLN A 172 0.867 5.237 -6.070 1.00 6.13 H new ATOM 0 HG2 GLN A 172 1.091 5.963 -8.523 1.00 6.58 H new ATOM 0 HG3 GLN A 172 -0.629 5.665 -8.672 1.00 6.58 H new ATOM 0 HE21 GLN A 172 -2.138 6.993 -7.547 1.00 7.22 H new ATOM 0 HE22 GLN A 172 -1.658 8.564 -6.897 1.00 7.22 H new ATOM 266 N MET A 173 0.545 2.099 -5.453 1.00 5.33 N ATOM 267 CA MET A 173 0.986 1.304 -4.304 1.00 5.03 C ATOM 268 C MET A 173 1.768 0.072 -4.750 1.00 5.21 C ATOM 269 O MET A 173 2.414 -0.591 -3.940 1.00 5.01 O ATOM 270 CB MET A 173 -0.209 0.869 -3.449 1.00 4.54 C ATOM 271 CG MET A 173 -0.821 1.995 -2.628 1.00 4.49 C ATOM 272 SD MET A 173 0.397 2.901 -1.648 1.00 4.57 S ATOM 273 CE MET A 173 1.113 1.589 -0.665 1.00 4.49 C ATOM 0 H MET A 173 -0.465 2.109 -5.595 1.00 5.33 H new ATOM 0 HA MET A 173 1.642 1.937 -3.706 1.00 5.03 H new ATOM 0 HB2 MET A 173 -0.976 0.449 -4.100 1.00 4.54 H new ATOM 0 HB3 MET A 173 0.109 0.073 -2.776 1.00 4.54 H new ATOM 0 HG2 MET A 173 -1.329 2.689 -3.297 1.00 4.49 H new ATOM 0 HG3 MET A 173 -1.579 1.581 -1.963 1.00 4.49 H new ATOM 0 HE1 MET A 173 1.894 1.999 -0.024 1.00 4.49 H new ATOM 0 HE2 MET A 173 0.339 1.133 -0.047 1.00 4.49 H new ATOM 0 HE3 MET A 173 1.543 0.834 -1.323 1.00 4.49 H new ATOM 283 N LYS A 174 1.706 -0.225 -6.043 1.00 5.68 N ATOM 284 CA LYS A 174 2.405 -1.369 -6.606 1.00 6.02 C ATOM 285 C LYS A 174 3.907 -1.169 -6.475 1.00 6.49 C ATOM 286 O LYS A 174 4.643 -2.083 -6.096 1.00 6.55 O ATOM 287 CB LYS A 174 2.013 -1.547 -8.076 1.00 6.45 C ATOM 288 CG LYS A 174 2.611 -2.784 -8.727 1.00 6.44 C ATOM 289 CD LYS A 174 2.045 -3.021 -10.118 1.00 6.92 C ATOM 290 CE LYS A 174 2.526 -1.973 -11.104 1.00 7.15 C ATOM 291 NZ LYS A 174 1.915 -2.149 -12.447 1.00 7.76 N1+ ATOM 0 H LYS A 174 1.174 0.317 -6.724 1.00 5.68 H new ATOM 0 HA LYS A 174 2.123 -2.269 -6.060 1.00 6.02 H new ATOM 0 HB2 LYS A 174 0.927 -1.599 -8.148 1.00 6.45 H new ATOM 0 HB3 LYS A 174 2.328 -0.666 -8.635 1.00 6.45 H new ATOM 0 HG2 LYS A 174 3.694 -2.674 -8.789 1.00 6.44 H new ATOM 0 HG3 LYS A 174 2.414 -3.655 -8.102 1.00 6.44 H new ATOM 0 HD2 LYS A 174 2.339 -4.011 -10.467 1.00 6.92 H new ATOM 0 HD3 LYS A 174 0.956 -3.008 -10.075 1.00 6.92 H new ATOM 0 HE2 LYS A 174 2.285 -0.980 -10.724 1.00 7.15 H new ATOM 0 HE3 LYS A 174 3.611 -2.027 -11.190 1.00 7.15 H new ATOM 0 HZ1 LYS A 174 2.655 -2.088 -13.176 1.00 7.76 H new ATOM 0 HZ2 LYS A 174 1.453 -3.079 -12.499 1.00 7.76 H new ATOM 0 HZ3 LYS A 174 1.209 -1.403 -12.608 1.00 7.76 H new ATOM 305 N VAL A 175 4.346 0.041 -6.787 1.00 6.90 N ATOM 306 CA VAL A 175 5.748 0.409 -6.702 1.00 7.46 C ATOM 307 C VAL A 175 5.879 1.846 -6.233 1.00 7.44 C ATOM 308 O VAL A 175 5.993 2.775 -7.031 1.00 7.78 O ATOM 309 CB VAL A 175 6.480 0.251 -8.050 1.00 8.18 C ATOM 310 CG1 VAL A 175 6.944 -1.183 -8.239 1.00 8.62 C ATOM 311 CG2 VAL A 175 5.584 0.692 -9.197 1.00 8.33 C ATOM 0 H VAL A 175 3.738 0.795 -7.106 1.00 6.90 H new ATOM 0 HA VAL A 175 6.212 -0.269 -5.986 1.00 7.46 H new ATOM 0 HB VAL A 175 7.361 0.892 -8.045 1.00 8.18 H new ATOM 0 HG11 VAL A 175 7.458 -1.276 -9.195 1.00 8.62 H new ATOM 0 HG12 VAL A 175 7.625 -1.454 -7.433 1.00 8.62 H new ATOM 0 HG13 VAL A 175 6.082 -1.849 -8.225 1.00 8.62 H new ATOM 0 HG21 VAL A 175 6.116 0.574 -10.141 1.00 8.33 H new ATOM 0 HG22 VAL A 175 4.682 0.080 -9.210 1.00 8.33 H new ATOM 0 HG23 VAL A 175 5.310 1.739 -9.063 1.00 8.33 H new ATOM 321 N ALA A 176 5.840 2.025 -4.931 1.00 7.10 N ATOM 322 CA ALA A 176 5.967 3.348 -4.348 1.00 7.14 C ATOM 323 C ALA A 176 6.954 3.337 -3.188 1.00 7.24 C ATOM 324 O ALA A 176 7.078 2.339 -2.484 1.00 6.92 O ATOM 325 CB ALA A 176 4.603 3.846 -3.887 1.00 6.59 C ATOM 0 H ALA A 176 5.721 1.272 -4.253 1.00 7.10 H new ATOM 0 HA ALA A 176 6.351 4.028 -5.109 1.00 7.14 H new ATOM 0 HB1 ALA A 176 4.707 4.839 -3.451 1.00 6.59 H new ATOM 0 HB2 ALA A 176 3.926 3.893 -4.740 1.00 6.59 H new ATOM 0 HB3 ALA A 176 4.199 3.162 -3.140 1.00 6.59 H new ATOM 331 N PRO A 177 7.719 4.422 -3.027 1.00 7.75 N ATOM 332 CA PRO A 177 8.673 4.556 -1.933 1.00 7.96 C ATOM 333 C PRO A 177 7.994 5.044 -0.659 1.00 7.58 C ATOM 334 O PRO A 177 7.173 5.962 -0.692 1.00 7.42 O ATOM 335 CB PRO A 177 9.636 5.613 -2.455 1.00 8.76 C ATOM 336 CG PRO A 177 8.808 6.480 -3.333 1.00 8.86 C ATOM 337 CD PRO A 177 7.739 5.595 -3.921 1.00 8.23 C ATOM 0 HA PRO A 177 9.151 3.612 -1.670 1.00 7.96 H new ATOM 0 HB2 PRO A 177 10.078 6.184 -1.638 1.00 8.76 H new ATOM 0 HB3 PRO A 177 10.459 5.160 -3.008 1.00 8.76 H new ATOM 0 HG2 PRO A 177 8.365 7.298 -2.765 1.00 8.86 H new ATOM 0 HG3 PRO A 177 9.415 6.930 -4.119 1.00 8.86 H new ATOM 0 HD2 PRO A 177 6.772 6.097 -3.943 1.00 8.23 H new ATOM 0 HD3 PRO A 177 7.974 5.312 -4.947 1.00 8.23 H new ATOM 345 N ILE A 178 8.336 4.434 0.462 1.00 7.53 N ATOM 346 CA ILE A 178 7.750 4.826 1.735 1.00 7.29 C ATOM 347 C ILE A 178 8.341 6.147 2.212 1.00 7.90 C ATOM 348 O ILE A 178 9.552 6.349 2.131 1.00 8.45 O ATOM 349 CB ILE A 178 7.952 3.765 2.835 1.00 7.03 C ATOM 350 CG1 ILE A 178 8.999 2.720 2.423 1.00 6.56 C ATOM 351 CG2 ILE A 178 6.627 3.102 3.165 1.00 6.79 C ATOM 352 CD1 ILE A 178 9.249 1.667 3.479 1.00 6.69 C ATOM 0 H ILE A 178 9.011 3.671 0.519 1.00 7.53 H new ATOM 0 HA ILE A 178 6.680 4.931 1.559 1.00 7.29 H new ATOM 0 HB ILE A 178 8.328 4.266 3.727 1.00 7.03 H new ATOM 0 HG12 ILE A 178 8.672 2.232 1.505 1.00 6.56 H new ATOM 0 HG13 ILE A 178 9.937 3.227 2.197 1.00 6.56 H new ATOM 0 HG21 ILE A 178 6.778 2.354 3.943 1.00 6.79 H new ATOM 0 HG22 ILE A 178 5.922 3.854 3.518 1.00 6.79 H new ATOM 0 HG23 ILE A 178 6.228 2.621 2.272 1.00 6.79 H new ATOM 0 HD11 ILE A 178 9.999 0.963 3.120 1.00 6.69 H new ATOM 0 HD12 ILE A 178 9.607 2.144 4.391 1.00 6.69 H new ATOM 0 HD13 ILE A 178 8.321 1.134 3.688 1.00 6.69 H new ATOM 364 N PRO A 179 7.487 7.081 2.672 1.00 7.89 N ATOM 365 CA PRO A 179 7.928 8.383 3.182 1.00 8.51 C ATOM 366 C PRO A 179 8.902 8.246 4.348 1.00 8.75 C ATOM 367 O PRO A 179 8.983 7.193 4.976 1.00 8.38 O ATOM 368 CB PRO A 179 6.631 9.042 3.653 1.00 8.36 C ATOM 369 CG PRO A 179 5.557 8.369 2.883 1.00 7.74 C ATOM 370 CD PRO A 179 6.017 6.952 2.700 1.00 7.36 C ATOM 0 HA PRO A 179 8.462 8.955 2.424 1.00 8.51 H new ATOM 0 HB2 PRO A 179 6.489 8.911 4.726 1.00 8.36 H new ATOM 0 HB3 PRO A 179 6.641 10.115 3.461 1.00 8.36 H new ATOM 0 HG2 PRO A 179 4.608 8.407 3.419 1.00 7.74 H new ATOM 0 HG3 PRO A 179 5.400 8.857 1.921 1.00 7.74 H new ATOM 0 HD2 PRO A 179 5.684 6.311 3.516 1.00 7.36 H new ATOM 0 HD3 PRO A 179 5.632 6.519 1.777 1.00 7.36 H new ATOM 378 N LYS A 180 9.607 9.329 4.651 1.00 9.42 N ATOM 379 CA LYS A 180 10.601 9.340 5.728 1.00 9.77 C ATOM 380 C LYS A 180 10.027 8.843 7.056 1.00 9.52 C ATOM 381 O LYS A 180 10.656 8.042 7.750 1.00 9.52 O ATOM 382 CB LYS A 180 11.166 10.749 5.917 1.00 10.55 C ATOM 383 CG LYS A 180 12.007 11.234 4.746 1.00 10.96 C ATOM 384 CD LYS A 180 12.479 12.664 4.951 1.00 11.55 C ATOM 385 CE LYS A 180 13.476 12.770 6.092 1.00 12.03 C ATOM 386 NZ LYS A 180 13.855 14.180 6.372 1.00 12.47 N1+ ATOM 0 H LYS A 180 9.511 10.220 4.164 1.00 9.42 H new ATOM 0 HA LYS A 180 11.396 8.656 5.430 1.00 9.77 H new ATOM 0 HB2 LYS A 180 10.341 11.444 6.072 1.00 10.55 H new ATOM 0 HB3 LYS A 180 11.774 10.769 6.822 1.00 10.55 H new ATOM 0 HG2 LYS A 180 12.870 10.580 4.621 1.00 10.96 H new ATOM 0 HG3 LYS A 180 11.424 11.171 3.827 1.00 10.96 H new ATOM 0 HD2 LYS A 180 12.937 13.031 4.033 1.00 11.55 H new ATOM 0 HD3 LYS A 180 11.621 13.304 5.157 1.00 11.55 H new ATOM 0 HE2 LYS A 180 13.048 12.325 6.990 1.00 12.03 H new ATOM 0 HE3 LYS A 180 14.370 12.196 5.847 1.00 12.03 H new ATOM 0 HZ1 LYS A 180 14.537 14.207 7.157 1.00 12.47 H new ATOM 0 HZ2 LYS A 180 14.287 14.598 5.524 1.00 12.47 H new ATOM 0 HZ3 LYS A 180 13.007 14.723 6.631 1.00 12.47 H new ATOM 400 N GLN A 181 8.831 9.310 7.395 1.00 9.38 N ATOM 401 CA GLN A 181 8.180 8.924 8.644 1.00 9.25 C ATOM 402 C GLN A 181 7.863 7.429 8.677 1.00 8.64 C ATOM 403 O GLN A 181 7.972 6.786 9.722 1.00 8.66 O ATOM 404 CB GLN A 181 6.894 9.729 8.830 1.00 9.25 C ATOM 405 CG GLN A 181 7.119 11.232 8.884 1.00 9.84 C ATOM 406 CD GLN A 181 5.825 12.013 8.784 1.00 9.79 C ATOM 407 OE1 GLN A 181 4.778 11.565 9.249 1.00 9.75 O ATOM 408 NE2 GLN A 181 5.885 13.183 8.170 1.00 9.99 N ATOM 0 H GLN A 181 8.290 9.958 6.822 1.00 9.38 H new ATOM 0 HA GLN A 181 8.871 9.138 9.460 1.00 9.25 H new ATOM 0 HB2 GLN A 181 6.211 9.501 8.011 1.00 9.25 H new ATOM 0 HB3 GLN A 181 6.405 9.410 9.751 1.00 9.25 H new ATOM 0 HG2 GLN A 181 7.624 11.488 9.816 1.00 9.84 H new ATOM 0 HG3 GLN A 181 7.782 11.527 8.071 1.00 9.84 H new ATOM 0 HE21 GLN A 181 6.773 13.519 7.798 1.00 9.99 H new ATOM 0 HE22 GLN A 181 5.043 13.749 8.068 1.00 9.99 H new ATOM 417 N LEU A 182 7.491 6.874 7.532 1.00 8.14 N ATOM 418 CA LEU A 182 7.150 5.457 7.443 1.00 7.55 C ATOM 419 C LEU A 182 8.410 4.601 7.329 1.00 7.61 C ATOM 420 O LEU A 182 8.427 3.448 7.744 1.00 7.33 O ATOM 421 CB LEU A 182 6.214 5.202 6.254 1.00 6.99 C ATOM 422 CG LEU A 182 4.729 5.493 6.512 1.00 6.82 C ATOM 423 CD1 LEU A 182 4.467 6.990 6.547 1.00 6.67 C ATOM 424 CD2 LEU A 182 3.856 4.825 5.459 1.00 6.66 C ATOM 0 H LEU A 182 7.417 7.382 6.650 1.00 8.14 H new ATOM 0 HA LEU A 182 6.630 5.174 8.358 1.00 7.55 H new ATOM 0 HB2 LEU A 182 6.546 5.813 5.414 1.00 6.99 H new ATOM 0 HB3 LEU A 182 6.315 4.160 5.950 1.00 6.99 H new ATOM 0 HG LEU A 182 4.471 5.078 7.486 1.00 6.82 H new ATOM 0 HD11 LEU A 182 3.408 7.170 6.731 1.00 6.67 H new ATOM 0 HD12 LEU A 182 5.056 7.444 7.344 1.00 6.67 H new ATOM 0 HD13 LEU A 182 4.749 7.431 5.591 1.00 6.67 H new ATOM 0 HD21 LEU A 182 2.808 5.045 5.662 1.00 6.66 H new ATOM 0 HD22 LEU A 182 4.122 5.204 4.472 1.00 6.66 H new ATOM 0 HD23 LEU A 182 4.012 3.747 5.487 1.00 6.66 H new ATOM 436 N LEU A 183 9.465 5.185 6.772 1.00 8.04 N ATOM 437 CA LEU A 183 10.740 4.490 6.611 1.00 8.24 C ATOM 438 C LEU A 183 11.404 4.269 7.968 1.00 8.55 C ATOM 439 O LEU A 183 11.940 3.198 8.248 1.00 8.54 O ATOM 440 CB LEU A 183 11.671 5.298 5.702 1.00 8.80 C ATOM 441 CG LEU A 183 11.748 4.831 4.246 1.00 8.62 C ATOM 442 CD1 LEU A 183 12.529 5.828 3.408 1.00 9.31 C ATOM 443 CD2 LEU A 183 12.388 3.456 4.162 1.00 8.25 C ATOM 0 H LEU A 183 9.463 6.143 6.422 1.00 8.04 H new ATOM 0 HA LEU A 183 10.548 3.520 6.153 1.00 8.24 H new ATOM 0 HB2 LEU A 183 11.347 6.339 5.714 1.00 8.80 H new ATOM 0 HB3 LEU A 183 12.675 5.272 6.126 1.00 8.80 H new ATOM 0 HG LEU A 183 10.734 4.766 3.852 1.00 8.62 H new ATOM 0 HD11 LEU A 183 12.574 5.480 2.376 1.00 9.31 H new ATOM 0 HD12 LEU A 183 12.034 6.799 3.442 1.00 9.31 H new ATOM 0 HD13 LEU A 183 13.540 5.922 3.803 1.00 9.31 H new ATOM 0 HD21 LEU A 183 12.435 3.139 3.120 1.00 8.25 H new ATOM 0 HD22 LEU A 183 13.396 3.498 4.574 1.00 8.25 H new ATOM 0 HD23 LEU A 183 11.793 2.742 4.732 1.00 8.25 H new ATOM 455 N GLN A 184 11.340 5.289 8.815 1.00 8.87 N ATOM 456 CA GLN A 184 11.934 5.225 10.146 1.00 9.25 C ATOM 457 C GLN A 184 11.099 4.371 11.092 1.00 8.85 C ATOM 458 O GLN A 184 11.471 4.154 12.248 1.00 9.14 O ATOM 459 CB GLN A 184 12.110 6.633 10.718 1.00 9.76 C ATOM 460 CG GLN A 184 13.243 7.401 10.062 1.00 10.33 C ATOM 461 CD GLN A 184 14.560 6.651 10.118 1.00 10.90 C ATOM 462 OE1 GLN A 184 14.850 5.947 11.088 1.00 11.17 O ATOM 463 NE2 GLN A 184 15.358 6.780 9.073 1.00 11.29 N ATOM 0 H GLN A 184 10.881 6.175 8.603 1.00 8.87 H new ATOM 0 HA GLN A 184 12.913 4.755 10.050 1.00 9.25 H new ATOM 0 HB2 GLN A 184 11.181 7.189 10.593 1.00 9.76 H new ATOM 0 HB3 GLN A 184 12.298 6.563 11.789 1.00 9.76 H new ATOM 0 HG2 GLN A 184 12.987 7.602 9.022 1.00 10.33 H new ATOM 0 HG3 GLN A 184 13.357 8.366 10.555 1.00 10.33 H new ATOM 0 HE21 GLN A 184 15.081 7.372 8.290 1.00 11.29 H new ATOM 0 HE22 GLN A 184 16.251 6.287 9.049 1.00 11.29 H new ATOM 472 N ARG A 185 9.968 3.890 10.602 1.00 8.24 N ATOM 473 CA ARG A 185 9.079 3.059 11.394 1.00 7.89 C ATOM 474 C ARG A 185 9.656 1.656 11.561 1.00 7.66 C ATOM 475 O ARG A 185 9.315 0.948 12.504 1.00 7.54 O ATOM 476 CB ARG A 185 7.714 2.972 10.716 1.00 7.40 C ATOM 477 CG ARG A 185 6.540 3.040 11.675 1.00 7.66 C ATOM 478 CD ARG A 185 5.282 2.488 11.026 1.00 7.53 C ATOM 479 NE ARG A 185 4.098 2.634 11.871 1.00 7.91 N ATOM 480 CZ ARG A 185 3.485 1.611 12.471 1.00 8.28 C ATOM 481 NH1 ARG A 185 4.005 0.390 12.423 1.00 8.35 N1+ ATOM 482 NH2 ARG A 185 2.355 1.814 13.137 1.00 8.81 N ATOM 0 H ARG A 185 9.643 4.063 9.651 1.00 8.24 H new ATOM 0 HA ARG A 185 8.971 3.511 12.380 1.00 7.89 H new ATOM 0 HB2 ARG A 185 7.627 3.784 9.994 1.00 7.40 H new ATOM 0 HB3 ARG A 185 7.658 2.039 10.155 1.00 7.40 H new ATOM 0 HG2 ARG A 185 6.768 2.473 12.577 1.00 7.66 H new ATOM 0 HG3 ARG A 185 6.374 4.073 11.981 1.00 7.66 H new ATOM 0 HD2 ARG A 185 5.112 3.000 10.079 1.00 7.53 H new ATOM 0 HD3 ARG A 185 5.430 1.433 10.795 1.00 7.53 H new ATOM 0 HE ARG A 185 3.719 3.571 12.010 1.00 7.91 H new ATOM 0 HH11 ARG A 185 4.880 0.228 11.925 1.00 8.35 H new ATOM 0 HH12 ARG A 185 3.529 -0.385 12.885 1.00 8.35 H new ATOM 0 HH21 ARG A 185 1.956 2.751 13.190 1.00 8.81 H new ATOM 0 HH22 ARG A 185 1.886 1.033 13.596 1.00 8.81 H new ATOM 496 N ILE A 186 10.527 1.260 10.644 1.00 7.69 N ATOM 497 CA ILE A 186 11.133 -0.063 10.695 1.00 7.57 C ATOM 498 C ILE A 186 12.629 0.039 10.995 1.00 8.20 C ATOM 499 O ILE A 186 13.425 0.366 10.115 1.00 8.43 O ATOM 500 CB ILE A 186 10.921 -0.831 9.369 1.00 7.11 C ATOM 501 CG1 ILE A 186 9.436 -0.852 9.002 1.00 6.84 C ATOM 502 CG2 ILE A 186 11.458 -2.253 9.481 1.00 6.83 C ATOM 503 CD1 ILE A 186 9.153 -1.389 7.613 1.00 6.52 C ATOM 0 H ILE A 186 10.830 1.834 9.857 1.00 7.69 H new ATOM 0 HA ILE A 186 10.643 -0.615 11.497 1.00 7.57 H new ATOM 0 HB ILE A 186 11.471 -0.317 8.580 1.00 7.11 H new ATOM 0 HG12 ILE A 186 8.900 -1.459 9.732 1.00 6.84 H new ATOM 0 HG13 ILE A 186 9.039 0.160 9.077 1.00 6.84 H new ATOM 0 HG21 ILE A 186 11.300 -2.777 8.538 1.00 6.83 H new ATOM 0 HG22 ILE A 186 12.524 -2.223 9.705 1.00 6.83 H new ATOM 0 HG23 ILE A 186 10.935 -2.778 10.280 1.00 6.83 H new ATOM 0 HD11 ILE A 186 8.079 -1.372 7.428 1.00 6.52 H new ATOM 0 HD12 ILE A 186 9.659 -0.769 6.873 1.00 6.52 H new ATOM 0 HD13 ILE A 186 9.518 -2.413 7.538 1.00 6.52 H new ATOM 515 N PRO A 187 13.021 -0.200 12.257 1.00 8.55 N ATOM 516 CA PRO A 187 14.411 -0.151 12.687 1.00 9.18 C ATOM 517 C PRO A 187 15.089 -1.526 12.680 1.00 9.19 C ATOM 518 O PRO A 187 14.517 -2.508 12.199 1.00 8.73 O ATOM 519 CB PRO A 187 14.277 0.369 14.117 1.00 9.56 C ATOM 520 CG PRO A 187 12.959 -0.150 14.604 1.00 9.11 C ATOM 521 CD PRO A 187 12.137 -0.520 13.388 1.00 8.45 C ATOM 0 HA PRO A 187 15.031 0.459 12.030 1.00 9.18 H new ATOM 0 HB2 PRO A 187 15.095 0.014 14.743 1.00 9.56 H new ATOM 0 HB3 PRO A 187 14.305 1.458 14.144 1.00 9.56 H new ATOM 0 HG2 PRO A 187 13.103 -1.018 15.248 1.00 9.11 H new ATOM 0 HG3 PRO A 187 12.445 0.606 15.198 1.00 9.11 H new ATOM 0 HD2 PRO A 187 11.863 -1.575 13.396 1.00 8.45 H new ATOM 0 HD3 PRO A 187 11.209 0.050 13.344 1.00 8.45 H new ATOM 529 N ASN A 188 16.321 -1.561 13.204 1.00 9.77 N ATOM 530 CA ASN A 188 17.147 -2.781 13.313 1.00 9.94 C ATOM 531 C ASN A 188 17.719 -3.230 11.958 1.00 9.83 C ATOM 532 O ASN A 188 18.750 -3.904 11.898 1.00 9.99 O ATOM 533 CB ASN A 188 16.346 -3.925 13.952 1.00 9.66 C ATOM 534 CG ASN A 188 16.963 -5.295 13.716 1.00 9.91 C ATOM 535 OD1 ASN A 188 18.071 -5.583 14.172 1.00 10.35 O ATOM 536 ND2 ASN A 188 16.245 -6.151 13.007 1.00 9.83 N ATOM 0 H ASN A 188 16.784 -0.730 13.572 1.00 9.77 H new ATOM 0 HA ASN A 188 17.991 -2.530 13.955 1.00 9.94 H new ATOM 0 HB2 ASN A 188 16.267 -3.749 15.025 1.00 9.66 H new ATOM 0 HB3 ASN A 188 15.332 -3.917 13.552 1.00 9.66 H new ATOM 0 HD21 ASN A 188 16.605 -7.087 12.821 1.00 9.83 H new ATOM 0 HD22 ASN A 188 15.332 -5.875 12.647 1.00 9.83 H new ATOM 543 N ILE A 189 17.096 -2.792 10.880 1.00 9.66 N ATOM 544 CA ILE A 189 17.541 -3.150 9.545 1.00 9.64 C ATOM 545 C ILE A 189 17.394 -1.961 8.616 1.00 9.96 C ATOM 546 O ILE A 189 16.307 -1.399 8.487 1.00 9.97 O ATOM 547 CB ILE A 189 16.755 -4.358 8.978 1.00 9.24 C ATOM 548 CG1 ILE A 189 15.303 -4.336 9.479 1.00 9.23 C ATOM 549 CG2 ILE A 189 17.451 -5.656 9.365 1.00 9.06 C ATOM 550 CD1 ILE A 189 14.419 -5.421 8.889 1.00 9.09 C ATOM 0 H ILE A 189 16.277 -2.185 10.903 1.00 9.66 H new ATOM 0 HA ILE A 189 18.590 -3.439 9.613 1.00 9.64 H new ATOM 0 HB ILE A 189 16.733 -4.291 7.890 1.00 9.24 H new ATOM 0 HG12 ILE A 189 15.304 -4.436 10.564 1.00 9.23 H new ATOM 0 HG13 ILE A 189 14.867 -3.364 9.249 1.00 9.23 H new ATOM 0 HG21 ILE A 189 16.893 -6.502 8.963 1.00 9.06 H new ATOM 0 HG22 ILE A 189 18.462 -5.662 8.958 1.00 9.06 H new ATOM 0 HG23 ILE A 189 17.497 -5.735 10.451 1.00 9.06 H new ATOM 0 HD11 ILE A 189 13.412 -5.332 9.297 1.00 9.09 H new ATOM 0 HD12 ILE A 189 14.383 -5.311 7.805 1.00 9.09 H new ATOM 0 HD13 ILE A 189 14.827 -6.400 9.141 1.00 9.09 H new ATOM 562 N PRO A 190 18.492 -1.549 7.973 1.00 10.38 N ATOM 563 CA PRO A 190 18.482 -0.419 7.061 1.00 10.85 C ATOM 564 C PRO A 190 18.051 -0.823 5.656 1.00 10.73 C ATOM 565 O PRO A 190 18.769 -1.553 4.963 1.00 11.03 O ATOM 566 CB PRO A 190 19.936 0.040 7.077 1.00 11.43 C ATOM 567 CG PRO A 190 20.737 -1.188 7.348 1.00 11.22 C ATOM 568 CD PRO A 190 19.836 -2.149 8.085 1.00 10.57 C ATOM 0 HA PRO A 190 17.775 0.356 7.357 1.00 10.85 H new ATOM 0 HB2 PRO A 190 20.216 0.489 6.124 1.00 11.43 H new ATOM 0 HB3 PRO A 190 20.101 0.794 7.846 1.00 11.43 H new ATOM 0 HG2 PRO A 190 21.093 -1.630 6.417 1.00 11.22 H new ATOM 0 HG3 PRO A 190 21.618 -0.950 7.945 1.00 11.22 H new ATOM 0 HD2 PRO A 190 19.866 -3.143 7.639 1.00 10.57 H new ATOM 0 HD3 PRO A 190 20.138 -2.257 9.127 1.00 10.57 H new ATOM 576 N PRO A 191 16.862 -0.371 5.224 1.00 10.37 N ATOM 577 CA PRO A 191 16.340 -0.679 3.894 1.00 10.30 C ATOM 578 C PRO A 191 17.324 -0.244 2.815 1.00 10.68 C ATOM 579 O PRO A 191 17.603 -0.991 1.879 1.00 10.94 O ATOM 580 CB PRO A 191 15.034 0.124 3.806 1.00 9.89 C ATOM 581 CG PRO A 191 15.062 1.082 4.949 1.00 9.82 C ATOM 582 CD PRO A 191 15.938 0.472 5.999 1.00 10.13 C ATOM 0 HA PRO A 191 16.180 -1.747 3.743 1.00 10.30 H new ATOM 0 HB2 PRO A 191 14.965 0.653 2.855 1.00 9.89 H new ATOM 0 HB3 PRO A 191 14.167 -0.533 3.869 1.00 9.89 H new ATOM 0 HG2 PRO A 191 15.452 2.050 4.634 1.00 9.82 H new ATOM 0 HG3 PRO A 191 14.057 1.254 5.335 1.00 9.82 H new ATOM 0 HD2 PRO A 191 16.471 1.233 6.570 1.00 10.13 H new ATOM 0 HD3 PRO A 191 15.360 -0.116 6.713 1.00 10.13 H new ATOM 590 N ASN A 192 17.852 0.969 2.973 1.00 10.83 N ATOM 591 CA ASN A 192 18.831 1.542 2.048 1.00 11.33 C ATOM 592 C ASN A 192 18.254 1.731 0.645 1.00 11.24 C ATOM 593 O ASN A 192 18.997 1.886 -0.326 1.00 11.75 O ATOM 594 CB ASN A 192 20.086 0.665 1.981 1.00 11.90 C ATOM 595 CG ASN A 192 21.362 1.483 1.947 1.00 12.46 C ATOM 596 OD1 ASN A 192 21.360 2.652 1.559 1.00 12.68 O ATOM 597 ND2 ASN A 192 22.464 0.871 2.345 1.00 12.84 N ATOM 0 H ASN A 192 17.612 1.585 3.750 1.00 10.83 H new ATOM 0 HA ASN A 192 19.097 2.526 2.434 1.00 11.33 H new ATOM 0 HB2 ASN A 192 20.107 -0.001 2.844 1.00 11.90 H new ATOM 0 HB3 ASN A 192 20.038 0.034 1.093 1.00 11.90 H new ATOM 0 HD21 ASN A 192 23.355 1.368 2.338 1.00 12.84 H new ATOM 0 HD22 ASN A 192 22.424 -0.099 2.659 1.00 12.84 H new ATOM 604 N ILE A 193 16.933 1.732 0.539 1.00 10.63 N ATOM 605 CA ILE A 193 16.269 1.906 -0.744 1.00 10.51 C ATOM 606 C ILE A 193 15.001 2.721 -0.579 1.00 9.90 C ATOM 607 O ILE A 193 14.545 2.958 0.541 1.00 9.52 O ATOM 608 CB ILE A 193 15.913 0.559 -1.416 1.00 10.37 C ATOM 609 CG1 ILE A 193 15.598 -0.517 -0.371 1.00 10.58 C ATOM 610 CG2 ILE A 193 17.036 0.109 -2.335 1.00 10.81 C ATOM 611 CD1 ILE A 193 14.202 -0.429 0.200 1.00 10.26 C ATOM 0 H ILE A 193 16.299 1.614 1.329 1.00 10.63 H new ATOM 0 HA ILE A 193 16.975 2.430 -1.388 1.00 10.51 H new ATOM 0 HB ILE A 193 15.016 0.709 -2.017 1.00 10.37 H new ATOM 0 HG12 ILE A 193 15.733 -1.499 -0.824 1.00 10.58 H new ATOM 0 HG13 ILE A 193 16.318 -0.440 0.444 1.00 10.58 H new ATOM 0 HG21 ILE A 193 16.768 -0.840 -2.799 1.00 10.81 H new ATOM 0 HG22 ILE A 193 17.195 0.859 -3.109 1.00 10.81 H new ATOM 0 HG23 ILE A 193 17.952 -0.015 -1.757 1.00 10.81 H new ATOM 0 HD11 ILE A 193 14.057 -1.224 0.931 1.00 10.26 H new ATOM 0 HD12 ILE A 193 14.067 0.538 0.684 1.00 10.26 H new ATOM 0 HD13 ILE A 193 13.473 -0.538 -0.603 1.00 10.26 H new ATOM 623 N ASN A 194 14.427 3.140 -1.693 1.00 9.87 N ATOM 624 CA ASN A 194 13.208 3.926 -1.672 1.00 9.35 C ATOM 625 C ASN A 194 12.192 3.355 -2.653 1.00 8.86 C ATOM 626 O ASN A 194 11.813 4.011 -3.620 1.00 8.57 O ATOM 627 CB ASN A 194 13.501 5.397 -2.003 1.00 9.78 C ATOM 628 CG ASN A 194 14.243 6.117 -0.892 1.00 10.10 C ATOM 629 OD1 ASN A 194 15.466 6.035 -0.794 1.00 10.43 O ATOM 630 ND2 ASN A 194 13.517 6.844 -0.057 1.00 10.17 N ATOM 0 H ASN A 194 14.788 2.947 -2.627 1.00 9.87 H new ATOM 0 HA ASN A 194 12.789 3.879 -0.667 1.00 9.35 H new ATOM 0 HB2 ASN A 194 14.090 5.447 -2.919 1.00 9.78 H new ATOM 0 HB3 ASN A 194 12.562 5.914 -2.200 1.00 9.78 H new ATOM 0 HD21 ASN A 194 13.971 7.359 0.698 1.00 10.17 H new ATOM 0 HD22 ASN A 194 12.504 6.889 -0.168 1.00 10.17 H new ATOM 637 N THR A 195 11.786 2.111 -2.419 1.00 8.88 N ATOM 638 CA THR A 195 10.794 1.439 -3.252 1.00 8.49 C ATOM 639 C THR A 195 10.238 0.229 -2.511 1.00 7.92 C ATOM 640 O THR A 195 11.003 -0.551 -1.949 1.00 8.08 O ATOM 641 CB THR A 195 11.406 0.955 -4.586 1.00 9.05 C ATOM 642 OG1 THR A 195 12.825 0.811 -4.447 1.00 9.80 O ATOM 643 CG2 THR A 195 11.094 1.912 -5.725 1.00 8.98 C ATOM 0 H THR A 195 12.134 1.541 -1.648 1.00 8.88 H new ATOM 0 HA THR A 195 10.004 2.158 -3.468 1.00 8.49 H new ATOM 0 HB THR A 195 10.960 -0.010 -4.828 1.00 9.05 H new ATOM 0 HG1 THR A 195 13.207 0.502 -5.295 1.00 9.80 H new ATOM 0 HG21 THR A 195 11.541 1.539 -6.647 1.00 8.98 H new ATOM 0 HG22 THR A 195 10.014 1.989 -5.850 1.00 8.98 H new ATOM 0 HG23 THR A 195 11.503 2.896 -5.496 1.00 8.98 H new ATOM 651 N TRP A 196 8.918 0.049 -2.543 1.00 7.29 N ATOM 652 CA TRP A 196 8.278 -1.077 -1.853 1.00 6.73 C ATOM 653 C TRP A 196 8.776 -2.415 -2.385 1.00 7.00 C ATOM 654 O TRP A 196 8.848 -3.398 -1.647 1.00 6.84 O ATOM 655 CB TRP A 196 6.755 -0.999 -1.978 1.00 6.14 C ATOM 656 CG TRP A 196 6.097 -0.406 -0.770 1.00 5.65 C ATOM 657 CD1 TRP A 196 5.371 0.746 -0.715 1.00 5.54 C ATOM 658 CD2 TRP A 196 6.119 -0.932 0.561 1.00 5.33 C ATOM 659 NE1 TRP A 196 4.944 0.972 0.567 1.00 5.20 N ATOM 660 CE2 TRP A 196 5.385 -0.044 1.370 1.00 5.06 C ATOM 661 CE3 TRP A 196 6.684 -2.069 1.147 1.00 5.33 C ATOM 662 CZ2 TRP A 196 5.204 -0.256 2.733 1.00 4.84 C ATOM 663 CZ3 TRP A 196 6.506 -2.279 2.501 1.00 5.05 C ATOM 664 CH2 TRP A 196 5.770 -1.377 3.281 1.00 4.82 C ATOM 0 H TRP A 196 8.271 0.664 -3.036 1.00 7.29 H new ATOM 0 HA TRP A 196 8.550 -1.007 -0.800 1.00 6.73 H new ATOM 0 HB2 TRP A 196 6.498 -0.403 -2.854 1.00 6.14 H new ATOM 0 HB3 TRP A 196 6.358 -2.000 -2.146 1.00 6.14 H new ATOM 0 HD1 TRP A 196 5.163 1.387 -1.559 1.00 5.54 H new ATOM 0 HE1 TRP A 196 4.387 1.770 0.873 1.00 5.20 H new ATOM 0 HE3 TRP A 196 7.250 -2.771 0.552 1.00 5.33 H new ATOM 0 HZ2 TRP A 196 4.638 0.438 3.337 1.00 4.84 H new ATOM 0 HZ3 TRP A 196 6.941 -3.152 2.965 1.00 5.05 H new ATOM 0 HH2 TRP A 196 5.646 -1.570 4.336 1.00 4.82 H new ATOM 675 N GLN A 197 9.128 -2.432 -3.661 1.00 7.47 N ATOM 676 CA GLN A 197 9.633 -3.636 -4.314 1.00 7.85 C ATOM 677 C GLN A 197 10.924 -4.107 -3.646 1.00 8.27 C ATOM 678 O GLN A 197 11.153 -5.305 -3.476 1.00 8.37 O ATOM 679 CB GLN A 197 9.884 -3.338 -5.793 1.00 8.38 C ATOM 680 CG GLN A 197 10.380 -4.529 -6.595 1.00 8.33 C ATOM 681 CD GLN A 197 11.299 -4.109 -7.723 1.00 8.43 C ATOM 682 OE1 GLN A 197 12.058 -3.149 -7.597 1.00 8.59 O ATOM 683 NE2 GLN A 197 11.233 -4.819 -8.837 1.00 8.60 N ATOM 0 H GLN A 197 9.073 -1.618 -4.273 1.00 7.47 H new ATOM 0 HA GLN A 197 8.892 -4.430 -4.222 1.00 7.85 H new ATOM 0 HB2 GLN A 197 8.959 -2.973 -6.240 1.00 8.38 H new ATOM 0 HB3 GLN A 197 10.615 -2.533 -5.871 1.00 8.38 H new ATOM 0 HG2 GLN A 197 10.908 -5.217 -5.934 1.00 8.33 H new ATOM 0 HG3 GLN A 197 9.528 -5.071 -7.004 1.00 8.33 H new ATOM 0 HE21 GLN A 197 10.590 -5.608 -8.901 1.00 8.60 H new ATOM 0 HE22 GLN A 197 11.825 -4.577 -9.632 1.00 8.60 H new ATOM 692 N GLN A 198 11.762 -3.157 -3.263 1.00 8.57 N ATOM 693 CA GLN A 198 13.027 -3.470 -2.619 1.00 9.03 C ATOM 694 C GLN A 198 12.845 -3.622 -1.109 1.00 8.61 C ATOM 695 O GLN A 198 13.651 -4.273 -0.443 1.00 8.82 O ATOM 696 CB GLN A 198 14.056 -2.388 -2.938 1.00 9.66 C ATOM 697 CG GLN A 198 14.298 -2.211 -4.429 1.00 10.19 C ATOM 698 CD GLN A 198 14.923 -3.435 -5.067 1.00 10.85 C ATOM 699 OE1 GLN A 198 15.768 -4.103 -4.468 1.00 11.11 O ATOM 700 NE2 GLN A 198 14.504 -3.745 -6.281 1.00 11.29 N ATOM 0 H GLN A 198 11.588 -2.160 -3.388 1.00 8.57 H new ATOM 0 HA GLN A 198 13.391 -4.421 -3.007 1.00 9.03 H new ATOM 0 HB2 GLN A 198 13.720 -1.441 -2.516 1.00 9.66 H new ATOM 0 HB3 GLN A 198 14.999 -2.637 -2.451 1.00 9.66 H new ATOM 0 HG2 GLN A 198 13.352 -1.991 -4.923 1.00 10.19 H new ATOM 0 HG3 GLN A 198 14.948 -1.351 -4.588 1.00 10.19 H new ATOM 0 HE21 GLN A 198 13.803 -3.165 -6.742 1.00 11.29 H new ATOM 0 HE22 GLN A 198 14.882 -4.564 -6.757 1.00 11.29 H new ATOM 709 N VAL A 199 11.784 -3.020 -0.573 1.00 8.07 N ATOM 710 CA VAL A 199 11.492 -3.114 0.855 1.00 7.70 C ATOM 711 C VAL A 199 11.072 -4.540 1.210 1.00 7.32 C ATOM 712 O VAL A 199 11.479 -5.087 2.236 1.00 7.31 O ATOM 713 CB VAL A 199 10.372 -2.131 1.292 1.00 7.25 C ATOM 714 CG1 VAL A 199 10.082 -2.273 2.779 1.00 7.19 C ATOM 715 CG2 VAL A 199 10.738 -0.687 0.966 1.00 7.41 C ATOM 0 H VAL A 199 11.115 -2.464 -1.105 1.00 8.07 H new ATOM 0 HA VAL A 199 12.404 -2.844 1.387 1.00 7.70 H new ATOM 0 HB VAL A 199 9.474 -2.388 0.730 1.00 7.25 H new ATOM 0 HG11 VAL A 199 9.295 -1.575 3.064 1.00 7.19 H new ATOM 0 HG12 VAL A 199 9.758 -3.292 2.991 1.00 7.19 H new ATOM 0 HG13 VAL A 199 10.985 -2.053 3.348 1.00 7.19 H new ATOM 0 HG21 VAL A 199 9.932 -0.026 1.285 1.00 7.41 H new ATOM 0 HG22 VAL A 199 11.656 -0.418 1.488 1.00 7.41 H new ATOM 0 HG23 VAL A 199 10.888 -0.583 -0.109 1.00 7.41 H new ATOM 725 N THR A 200 10.278 -5.148 0.338 1.00 7.10 N ATOM 726 CA THR A 200 9.800 -6.508 0.553 1.00 6.83 C ATOM 727 C THR A 200 10.924 -7.528 0.361 1.00 7.39 C ATOM 728 O THR A 200 10.860 -8.646 0.875 1.00 7.30 O ATOM 729 CB THR A 200 8.643 -6.839 -0.405 1.00 6.60 C ATOM 730 OG1 THR A 200 8.803 -6.116 -1.632 1.00 6.76 O ATOM 731 CG2 THR A 200 7.301 -6.490 0.225 1.00 6.11 C ATOM 0 H THR A 200 9.950 -4.719 -0.528 1.00 7.10 H new ATOM 0 HA THR A 200 9.444 -6.567 1.581 1.00 6.83 H new ATOM 0 HB THR A 200 8.663 -7.910 -0.608 1.00 6.60 H new ATOM 0 HG1 THR A 200 9.745 -6.132 -1.900 1.00 6.76 H new ATOM 0 HG21 THR A 200 6.498 -6.733 -0.471 1.00 6.11 H new ATOM 0 HG22 THR A 200 7.170 -7.062 1.143 1.00 6.11 H new ATOM 0 HG23 THR A 200 7.273 -5.425 0.454 1.00 6.11 H new ATOM 739 N ALA A 201 11.964 -7.120 -0.356 1.00 8.02 N ATOM 740 CA ALA A 201 13.106 -7.987 -0.628 1.00 8.63 C ATOM 741 C ALA A 201 13.849 -8.350 0.658 1.00 8.64 C ATOM 742 O ALA A 201 14.517 -9.384 0.726 1.00 8.93 O ATOM 743 CB ALA A 201 14.051 -7.318 -1.615 1.00 9.32 C ATOM 0 H ALA A 201 12.041 -6.188 -0.762 1.00 8.02 H new ATOM 0 HA ALA A 201 12.730 -8.911 -1.067 1.00 8.63 H new ATOM 0 HB1 ALA A 201 14.899 -7.975 -1.810 1.00 9.32 H new ATOM 0 HB2 ALA A 201 13.523 -7.121 -2.548 1.00 9.32 H new ATOM 0 HB3 ALA A 201 14.409 -6.378 -1.196 1.00 9.32 H new ATOM 749 N LEU A 202 13.716 -7.504 1.674 1.00 8.38 N ATOM 750 CA LEU A 202 14.374 -7.733 2.957 1.00 8.45 C ATOM 751 C LEU A 202 13.812 -8.980 3.635 1.00 8.04 C ATOM 752 O LEU A 202 14.509 -9.661 4.391 1.00 8.27 O ATOM 753 CB LEU A 202 14.195 -6.518 3.873 1.00 8.32 C ATOM 754 CG LEU A 202 14.548 -5.164 3.247 1.00 8.50 C ATOM 755 CD1 LEU A 202 14.176 -4.030 4.191 1.00 8.35 C ATOM 756 CD2 LEU A 202 16.029 -5.099 2.901 1.00 9.03 C ATOM 0 H LEU A 202 13.157 -6.651 1.634 1.00 8.38 H new ATOM 0 HA LEU A 202 15.437 -7.884 2.772 1.00 8.45 H new ATOM 0 HB2 LEU A 202 13.158 -6.485 4.206 1.00 8.32 H new ATOM 0 HB3 LEU A 202 14.811 -6.660 4.761 1.00 8.32 H new ATOM 0 HG LEU A 202 13.976 -5.054 2.326 1.00 8.50 H new ATOM 0 HD11 LEU A 202 14.433 -3.075 3.732 1.00 8.35 H new ATOM 0 HD12 LEU A 202 13.105 -4.060 4.391 1.00 8.35 H new ATOM 0 HD13 LEU A 202 14.723 -4.141 5.127 1.00 8.35 H new ATOM 0 HD21 LEU A 202 16.257 -4.129 2.458 1.00 9.03 H new ATOM 0 HD22 LEU A 202 16.620 -5.232 3.807 1.00 9.03 H new ATOM 0 HD23 LEU A 202 16.272 -5.889 2.190 1.00 9.03 H new ATOM 768 N ALA A 203 12.554 -9.288 3.343 1.00 7.51 N ATOM 769 CA ALA A 203 11.898 -10.452 3.923 1.00 7.19 C ATOM 770 C ALA A 203 12.391 -11.736 3.262 1.00 7.64 C ATOM 771 O ALA A 203 12.465 -12.786 3.902 1.00 7.71 O ATOM 772 CB ALA A 203 10.384 -10.333 3.796 1.00 6.60 C ATOM 0 H ALA A 203 11.968 -8.747 2.707 1.00 7.51 H new ATOM 0 HA ALA A 203 12.153 -10.493 4.982 1.00 7.19 H new ATOM 0 HB1 ALA A 203 9.912 -11.212 4.235 1.00 6.60 H new ATOM 0 HB2 ALA A 203 10.044 -9.439 4.319 1.00 6.60 H new ATOM 0 HB3 ALA A 203 10.112 -10.263 2.743 1.00 6.60 H new ATOM 778 N GLN A 204 12.759 -11.637 1.987 1.00 8.03 N ATOM 779 CA GLN A 204 13.246 -12.790 1.229 1.00 8.56 C ATOM 780 C GLN A 204 14.615 -13.235 1.734 1.00 9.11 C ATOM 781 O GLN A 204 15.046 -14.360 1.485 1.00 9.51 O ATOM 782 CB GLN A 204 13.316 -12.459 -0.263 1.00 8.89 C ATOM 783 CG GLN A 204 11.966 -12.126 -0.875 1.00 8.56 C ATOM 784 CD GLN A 204 12.048 -11.902 -2.375 1.00 8.93 C ATOM 785 OE1 GLN A 204 12.262 -10.780 -2.835 1.00 9.22 O ATOM 786 NE2 GLN A 204 11.890 -12.968 -3.145 1.00 9.16 N ATOM 0 H GLN A 204 12.730 -10.768 1.454 1.00 8.03 H new ATOM 0 HA GLN A 204 12.543 -13.610 1.374 1.00 8.56 H new ATOM 0 HB2 GLN A 204 13.990 -11.615 -0.408 1.00 8.89 H new ATOM 0 HB3 GLN A 204 13.748 -13.307 -0.795 1.00 8.89 H new ATOM 0 HG2 GLN A 204 11.267 -12.937 -0.669 1.00 8.56 H new ATOM 0 HG3 GLN A 204 11.565 -11.231 -0.398 1.00 8.56 H new ATOM 0 HE21 GLN A 204 11.714 -13.880 -2.724 1.00 9.16 H new ATOM 0 HE22 GLN A 204 11.944 -12.877 -4.159 1.00 9.16 H new ATOM 795 N GLN A 205 15.292 -12.345 2.453 1.00 9.17 N ATOM 796 CA GLN A 205 16.607 -12.648 3.003 1.00 9.72 C ATOM 797 C GLN A 205 16.463 -13.364 4.345 1.00 9.52 C ATOM 798 O GLN A 205 17.455 -13.646 5.019 1.00 9.93 O ATOM 799 CB GLN A 205 17.424 -11.369 3.178 1.00 10.00 C ATOM 800 CG GLN A 205 17.608 -10.567 1.898 1.00 10.36 C ATOM 801 CD GLN A 205 18.396 -11.314 0.838 1.00 10.95 C ATOM 802 OE1 GLN A 205 17.828 -12.011 -0.003 1.00 11.13 O ATOM 803 NE2 GLN A 205 19.714 -11.180 0.873 1.00 11.44 N ATOM 0 H GLN A 205 14.951 -11.408 2.668 1.00 9.17 H new ATOM 0 HA GLN A 205 17.131 -13.302 2.305 1.00 9.72 H new ATOM 0 HB2 GLN A 205 16.937 -10.739 3.922 1.00 10.00 H new ATOM 0 HB3 GLN A 205 18.405 -11.629 3.575 1.00 10.00 H new ATOM 0 HG2 GLN A 205 16.629 -10.304 1.497 1.00 10.36 H new ATOM 0 HG3 GLN A 205 18.119 -9.633 2.131 1.00 10.36 H new ATOM 0 HE21 GLN A 205 20.148 -10.593 1.585 1.00 11.44 H new ATOM 0 HE22 GLN A 205 20.294 -11.664 0.187 1.00 11.44 H new ATOM 812 N LYS A 206 15.210 -13.641 4.721 1.00 8.93 N ATOM 813 CA LYS A 206 14.882 -14.333 5.971 1.00 8.75 C ATOM 814 C LYS A 206 15.317 -13.530 7.196 1.00 8.72 C ATOM 815 O LYS A 206 15.522 -14.089 8.275 1.00 8.89 O ATOM 816 CB LYS A 206 15.524 -15.724 6.004 1.00 9.26 C ATOM 817 CG LYS A 206 15.118 -16.614 4.842 1.00 9.36 C ATOM 818 CD LYS A 206 15.810 -17.962 4.905 1.00 9.64 C ATOM 819 CE LYS A 206 15.560 -18.780 3.650 1.00 9.95 C ATOM 820 NZ LYS A 206 16.220 -20.110 3.718 1.00 10.29 N1+ ATOM 0 H LYS A 206 14.392 -13.391 4.165 1.00 8.93 H new ATOM 0 HA LYS A 206 13.798 -14.438 6.005 1.00 8.75 H new ATOM 0 HB2 LYS A 206 16.608 -15.614 6.003 1.00 9.26 H new ATOM 0 HB3 LYS A 206 15.254 -16.216 6.938 1.00 9.26 H new ATOM 0 HG2 LYS A 206 14.038 -16.758 4.853 1.00 9.36 H new ATOM 0 HG3 LYS A 206 15.364 -16.121 3.902 1.00 9.36 H new ATOM 0 HD2 LYS A 206 16.882 -17.815 5.036 1.00 9.64 H new ATOM 0 HD3 LYS A 206 15.455 -18.513 5.776 1.00 9.64 H new ATOM 0 HE2 LYS A 206 14.487 -18.913 3.511 1.00 9.95 H new ATOM 0 HE3 LYS A 206 15.929 -18.235 2.781 1.00 9.95 H new ATOM 0 HZ1 LYS A 206 16.026 -20.639 2.844 1.00 10.29 H new ATOM 0 HZ2 LYS A 206 17.247 -19.983 3.826 1.00 10.29 H new ATOM 0 HZ3 LYS A 206 15.849 -20.640 4.532 1.00 10.29 H new ATOM 834 N LEU A 207 15.442 -12.220 7.031 1.00 8.58 N ATOM 835 CA LEU A 207 15.851 -11.342 8.127 1.00 8.66 C ATOM 836 C LEU A 207 14.641 -10.905 8.943 1.00 8.06 C ATOM 837 O LEU A 207 14.762 -10.544 10.114 1.00 8.10 O ATOM 838 CB LEU A 207 16.572 -10.109 7.584 1.00 9.02 C ATOM 839 CG LEU A 207 17.762 -10.388 6.668 1.00 9.66 C ATOM 840 CD1 LEU A 207 18.171 -9.121 5.931 1.00 9.96 C ATOM 841 CD2 LEU A 207 18.935 -10.943 7.465 1.00 10.21 C ATOM 0 H LEU A 207 15.267 -11.738 6.149 1.00 8.58 H new ATOM 0 HA LEU A 207 16.532 -11.900 8.770 1.00 8.66 H new ATOM 0 HB2 LEU A 207 15.851 -9.500 7.038 1.00 9.02 H new ATOM 0 HB3 LEU A 207 16.918 -9.512 8.428 1.00 9.02 H new ATOM 0 HG LEU A 207 17.463 -11.136 5.934 1.00 9.66 H new ATOM 0 HD11 LEU A 207 19.020 -9.336 5.282 1.00 9.96 H new ATOM 0 HD12 LEU A 207 17.335 -8.764 5.329 1.00 9.96 H new ATOM 0 HD13 LEU A 207 18.451 -8.354 6.653 1.00 9.96 H new ATOM 0 HD21 LEU A 207 19.772 -11.135 6.794 1.00 10.21 H new ATOM 0 HD22 LEU A 207 19.235 -10.219 8.222 1.00 10.21 H new ATOM 0 HD23 LEU A 207 18.638 -11.873 7.950 1.00 10.21 H new ATOM 853 N LEU A 208 13.481 -10.939 8.308 1.00 7.59 N ATOM 854 CA LEU A 208 12.237 -10.539 8.947 1.00 7.05 C ATOM 855 C LEU A 208 11.667 -11.678 9.785 1.00 6.95 C ATOM 856 O LEU A 208 11.529 -12.802 9.303 1.00 6.96 O ATOM 857 CB LEU A 208 11.223 -10.126 7.879 1.00 6.63 C ATOM 858 CG LEU A 208 10.064 -9.260 8.376 1.00 6.34 C ATOM 859 CD1 LEU A 208 10.477 -7.796 8.424 1.00 6.60 C ATOM 860 CD2 LEU A 208 8.847 -9.448 7.488 1.00 5.96 C ATOM 0 H LEU A 208 13.374 -11.243 7.340 1.00 7.59 H new ATOM 0 HA LEU A 208 12.441 -9.695 9.606 1.00 7.05 H new ATOM 0 HB2 LEU A 208 11.749 -9.584 7.093 1.00 6.63 H new ATOM 0 HB3 LEU A 208 10.812 -11.027 7.424 1.00 6.63 H new ATOM 0 HG LEU A 208 9.802 -9.573 9.387 1.00 6.34 H new ATOM 0 HD11 LEU A 208 9.641 -7.194 8.780 1.00 6.60 H new ATOM 0 HD12 LEU A 208 11.323 -7.679 9.101 1.00 6.60 H new ATOM 0 HD13 LEU A 208 10.763 -7.466 7.425 1.00 6.60 H new ATOM 0 HD21 LEU A 208 8.030 -8.826 7.854 1.00 5.96 H new ATOM 0 HD22 LEU A 208 9.094 -9.159 6.466 1.00 5.96 H new ATOM 0 HD23 LEU A 208 8.542 -10.494 7.506 1.00 5.96 H new ATOM 872 N THR A 209 11.353 -11.383 11.034 1.00 6.97 N ATOM 873 CA THR A 209 10.779 -12.371 11.930 1.00 7.00 C ATOM 874 C THR A 209 9.294 -12.051 12.149 1.00 6.57 C ATOM 875 O THR A 209 8.832 -10.974 11.755 1.00 6.24 O ATOM 876 CB THR A 209 11.535 -12.416 13.280 1.00 7.40 C ATOM 877 OG1 THR A 209 11.443 -11.158 13.957 1.00 7.39 O ATOM 878 CG2 THR A 209 13.003 -12.772 13.065 1.00 7.89 C ATOM 0 H THR A 209 11.487 -10.462 11.452 1.00 6.97 H new ATOM 0 HA THR A 209 10.875 -13.356 11.474 1.00 7.00 H new ATOM 0 HB THR A 209 11.068 -13.185 13.896 1.00 7.40 H new ATOM 0 HG1 THR A 209 11.783 -10.447 13.374 1.00 7.39 H new ATOM 0 HG21 THR A 209 13.516 -12.798 14.027 1.00 7.89 H new ATOM 0 HG22 THR A 209 13.074 -13.750 12.589 1.00 7.89 H new ATOM 0 HG23 THR A 209 13.469 -12.022 12.426 1.00 7.89 H new ATOM 886 N PRO A 210 8.517 -12.968 12.758 1.00 6.66 N ATOM 887 CA PRO A 210 7.081 -12.752 13.001 1.00 6.45 C ATOM 888 C PRO A 210 6.782 -11.484 13.804 1.00 6.38 C ATOM 889 O PRO A 210 5.684 -10.933 13.729 1.00 6.16 O ATOM 890 CB PRO A 210 6.664 -13.992 13.790 1.00 6.85 C ATOM 891 CG PRO A 210 7.668 -15.032 13.447 1.00 7.16 C ATOM 892 CD PRO A 210 8.959 -14.295 13.239 1.00 7.08 C ATOM 0 HA PRO A 210 6.539 -12.613 12.065 1.00 6.45 H new ATOM 0 HB2 PRO A 210 6.656 -13.792 14.861 1.00 6.85 H new ATOM 0 HB3 PRO A 210 5.658 -14.312 13.518 1.00 6.85 H new ATOM 0 HG2 PRO A 210 7.761 -15.766 14.247 1.00 7.16 H new ATOM 0 HG3 PRO A 210 7.378 -15.575 12.548 1.00 7.16 H new ATOM 0 HD2 PRO A 210 9.532 -14.218 14.163 1.00 7.08 H new ATOM 0 HD3 PRO A 210 9.596 -14.796 12.510 1.00 7.08 H new ATOM 900 N GLN A 211 7.762 -11.009 14.562 1.00 6.66 N ATOM 901 CA GLN A 211 7.570 -9.814 15.369 1.00 6.77 C ATOM 902 C GLN A 211 7.678 -8.543 14.518 1.00 6.45 C ATOM 903 O GLN A 211 7.045 -7.530 14.821 1.00 6.38 O ATOM 904 CB GLN A 211 8.572 -9.780 16.529 1.00 7.30 C ATOM 905 CG GLN A 211 9.986 -9.405 16.121 1.00 7.72 C ATOM 906 CD GLN A 211 10.596 -8.363 17.028 1.00 8.30 C ATOM 907 OE1 GLN A 211 10.364 -8.359 18.239 1.00 8.70 O ATOM 908 NE2 GLN A 211 11.360 -7.456 16.446 1.00 8.61 N ATOM 0 H GLN A 211 8.689 -11.429 14.634 1.00 6.66 H new ATOM 0 HA GLN A 211 6.563 -9.849 15.785 1.00 6.77 H new ATOM 0 HB2 GLN A 211 8.221 -9.069 17.276 1.00 7.30 H new ATOM 0 HB3 GLN A 211 8.592 -10.760 17.006 1.00 7.30 H new ATOM 0 HG2 GLN A 211 10.611 -10.298 16.128 1.00 7.72 H new ATOM 0 HG3 GLN A 211 9.977 -9.030 15.098 1.00 7.72 H new ATOM 0 HE21 GLN A 211 11.525 -7.498 15.440 1.00 8.61 H new ATOM 0 HE22 GLN A 211 11.785 -6.714 17.002 1.00 8.61 H new ATOM 917 N ASP A 212 8.478 -8.602 13.453 1.00 6.37 N ATOM 918 CA ASP A 212 8.658 -7.452 12.567 1.00 6.18 C ATOM 919 C ASP A 212 7.570 -7.448 11.508 1.00 5.63 C ATOM 920 O ASP A 212 7.236 -6.407 10.942 1.00 5.44 O ATOM 921 CB ASP A 212 10.031 -7.470 11.881 1.00 6.44 C ATOM 922 CG ASP A 212 11.136 -8.014 12.761 1.00 7.03 C ATOM 923 OD1 ASP A 212 11.487 -7.359 13.767 1.00 7.34 O1- ATOM 924 OD2 ASP A 212 11.655 -9.108 12.448 1.00 7.38 O ATOM 0 H ASP A 212 9.009 -9.430 13.184 1.00 6.37 H new ATOM 0 HA ASP A 212 8.596 -6.551 13.177 1.00 6.18 H new ATOM 0 HB2 ASP A 212 9.968 -8.073 10.975 1.00 6.44 H new ATOM 0 HB3 ASP A 212 10.288 -6.457 11.573 1.00 6.44 H new ATOM 929 N MET A 213 7.021 -8.629 11.255 1.00 5.47 N ATOM 930 CA MET A 213 5.968 -8.821 10.262 1.00 5.06 C ATOM 931 C MET A 213 4.790 -7.875 10.491 1.00 4.94 C ATOM 932 O MET A 213 4.354 -7.177 9.575 1.00 4.64 O ATOM 933 CB MET A 213 5.482 -10.271 10.305 1.00 5.15 C ATOM 934 CG MET A 213 5.542 -10.966 8.961 1.00 5.33 C ATOM 935 SD MET A 213 4.265 -10.394 7.825 1.00 5.56 S ATOM 936 CE MET A 213 4.565 -11.472 6.426 1.00 5.57 C ATOM 0 H MET A 213 7.294 -9.487 11.735 1.00 5.47 H new ATOM 0 HA MET A 213 6.388 -8.596 9.282 1.00 5.06 H new ATOM 0 HB2 MET A 213 6.087 -10.828 11.021 1.00 5.15 H new ATOM 0 HB3 MET A 213 4.455 -10.292 10.671 1.00 5.15 H new ATOM 0 HG2 MET A 213 6.522 -10.799 8.514 1.00 5.33 H new ATOM 0 HG3 MET A 213 5.437 -12.041 9.107 1.00 5.33 H new ATOM 0 HE1 MET A 213 4.352 -10.936 5.501 1.00 5.57 H new ATOM 0 HE2 MET A 213 5.607 -11.791 6.429 1.00 5.57 H new ATOM 0 HE3 MET A 213 3.918 -12.347 6.495 1.00 5.57 H new ATOM 946 N GLU A 214 4.296 -7.843 11.721 1.00 5.29 N ATOM 947 CA GLU A 214 3.158 -7.000 12.076 1.00 5.44 C ATOM 948 C GLU A 214 3.489 -5.516 11.936 1.00 5.41 C ATOM 949 O GLU A 214 2.601 -4.695 11.709 1.00 5.42 O ATOM 950 CB GLU A 214 2.711 -7.296 13.509 1.00 6.00 C ATOM 951 CG GLU A 214 2.434 -8.768 13.773 1.00 6.18 C ATOM 952 CD GLU A 214 1.523 -9.389 12.731 1.00 6.23 C ATOM 953 OE1 GLU A 214 0.316 -9.070 12.721 1.00 6.43 O ATOM 954 OE2 GLU A 214 2.015 -10.198 11.914 1.00 6.40 O1- ATOM 0 H GLU A 214 4.667 -8.394 12.495 1.00 5.29 H new ATOM 0 HA GLU A 214 2.348 -7.231 11.384 1.00 5.44 H new ATOM 0 HB2 GLU A 214 3.481 -6.951 14.199 1.00 6.00 H new ATOM 0 HB3 GLU A 214 1.810 -6.722 13.725 1.00 6.00 H new ATOM 0 HG2 GLU A 214 3.378 -9.313 13.795 1.00 6.18 H new ATOM 0 HG3 GLU A 214 1.980 -8.877 14.758 1.00 6.18 H new ATOM 961 N ALA A 215 4.761 -5.181 12.062 1.00 5.51 N ATOM 962 CA ALA A 215 5.202 -3.799 11.962 1.00 5.66 C ATOM 963 C ALA A 215 5.283 -3.345 10.508 1.00 5.27 C ATOM 964 O ALA A 215 4.854 -2.242 10.169 1.00 5.33 O ATOM 965 CB ALA A 215 6.549 -3.626 12.647 1.00 6.08 C ATOM 0 H ALA A 215 5.511 -5.850 12.235 1.00 5.51 H new ATOM 0 HA ALA A 215 4.465 -3.174 12.466 1.00 5.66 H new ATOM 0 HB1 ALA A 215 6.868 -2.587 12.565 1.00 6.08 H new ATOM 0 HB2 ALA A 215 6.459 -3.896 13.699 1.00 6.08 H new ATOM 0 HB3 ALA A 215 7.286 -4.271 12.168 1.00 6.08 H new ATOM 971 N ALA A 216 5.808 -4.210 9.649 1.00 4.95 N ATOM 972 CA ALA A 216 5.961 -3.888 8.240 1.00 4.66 C ATOM 973 C ALA A 216 4.611 -3.845 7.542 1.00 4.31 C ATOM 974 O ALA A 216 4.385 -3.020 6.656 1.00 4.17 O ATOM 975 CB ALA A 216 6.874 -4.900 7.566 1.00 4.61 C ATOM 0 H ALA A 216 6.135 -5.141 9.906 1.00 4.95 H new ATOM 0 HA ALA A 216 6.413 -2.899 8.163 1.00 4.66 H new ATOM 0 HB1 ALA A 216 6.981 -4.648 6.511 1.00 4.61 H new ATOM 0 HB2 ALA A 216 7.853 -4.882 8.044 1.00 4.61 H new ATOM 0 HB3 ALA A 216 6.443 -5.897 7.659 1.00 4.61 H new ATOM 981 N LYS A 217 3.711 -4.729 7.957 1.00 4.31 N ATOM 982 CA LYS A 217 2.382 -4.787 7.365 1.00 4.20 C ATOM 983 C LYS A 217 1.611 -3.495 7.625 1.00 4.42 C ATOM 984 O LYS A 217 0.858 -3.030 6.770 1.00 4.34 O ATOM 985 CB LYS A 217 1.598 -5.990 7.903 1.00 4.47 C ATOM 986 CG LYS A 217 2.034 -7.318 7.300 1.00 4.63 C ATOM 987 CD LYS A 217 1.044 -8.434 7.610 1.00 5.07 C ATOM 988 CE LYS A 217 1.046 -8.798 9.087 1.00 5.46 C ATOM 989 NZ LYS A 217 1.504 -10.194 9.319 1.00 5.88 N1+ ATOM 0 H LYS A 217 3.877 -5.411 8.697 1.00 4.31 H new ATOM 0 HA LYS A 217 2.502 -4.905 6.288 1.00 4.20 H new ATOM 0 HB2 LYS A 217 1.716 -6.036 8.986 1.00 4.47 H new ATOM 0 HB3 LYS A 217 0.537 -5.841 7.704 1.00 4.47 H new ATOM 0 HG2 LYS A 217 2.134 -7.211 6.220 1.00 4.63 H new ATOM 0 HG3 LYS A 217 3.017 -7.587 7.686 1.00 4.63 H new ATOM 0 HD2 LYS A 217 0.042 -8.123 7.314 1.00 5.07 H new ATOM 0 HD3 LYS A 217 1.293 -9.315 7.018 1.00 5.07 H new ATOM 0 HE2 LYS A 217 1.695 -8.109 9.629 1.00 5.46 H new ATOM 0 HE3 LYS A 217 0.041 -8.675 9.492 1.00 5.46 H new ATOM 0 HZ1 LYS A 217 1.490 -10.399 10.338 1.00 5.88 H new ATOM 0 HZ2 LYS A 217 0.871 -10.854 8.824 1.00 5.88 H new ATOM 0 HZ3 LYS A 217 2.472 -10.306 8.957 1.00 5.88 H new ATOM 1003 N GLU A 218 1.819 -2.903 8.800 1.00 0.00 N ATOM 1004 CA GLU A 218 1.134 -1.660 9.143 1.00 0.00 C ATOM 1005 C GLU A 218 1.597 -0.526 8.260 1.00 0.00 C ATOM 1006 O GLU A 218 0.793 0.324 7.868 1.00 0.00 O ATOM 1007 CB GLU A 218 1.382 -1.319 10.640 1.00 0.00 C ATOM 1008 CG GLU A 218 0.724 -2.289 11.674 1.00 0.00 C ATOM 1009 CD GLU A 218 0.970 -2.043 13.152 1.00 0.00 C ATOM 1010 OE1 GLU A 218 1.711 -1.117 13.532 1.00 0.00 O ATOM 1011 OE2 GLU A 218 0.382 -2.804 13.948 1.00 0.00 O1- ATOM 0 H GLU A 218 2.447 -3.258 9.521 1.00 0.00 H new ATOM 0 HA GLU A 218 0.065 -1.796 8.980 1.00 0.00 H new ATOM 0 HB2 GLU A 218 2.457 -1.304 10.817 1.00 0.00 H new ATOM 0 HB3 GLU A 218 1.014 -0.311 10.830 1.00 0.00 H new ATOM 0 HG2 GLU A 218 -0.353 -2.269 11.509 1.00 0.00 H new ATOM 0 HG3 GLU A 218 1.063 -3.299 11.444 1.00 0.00 H new ATOM 1018 N VAL A 219 2.882 -0.507 7.934 1.00 4.99 N ATOM 1019 CA VAL A 219 3.446 0.539 7.087 1.00 5.07 C ATOM 1020 C VAL A 219 2.742 0.571 5.733 1.00 4.71 C ATOM 1021 O VAL A 219 2.351 1.634 5.250 1.00 4.89 O ATOM 1022 CB VAL A 219 4.961 0.333 6.873 1.00 5.20 C ATOM 1023 CG1 VAL A 219 5.560 1.496 6.104 1.00 5.47 C ATOM 1024 CG2 VAL A 219 5.671 0.160 8.205 1.00 5.63 C ATOM 0 H VAL A 219 3.557 -1.206 8.244 1.00 4.99 H new ATOM 0 HA VAL A 219 3.293 1.490 7.598 1.00 5.07 H new ATOM 0 HB VAL A 219 5.099 -0.575 6.286 1.00 5.20 H new ATOM 0 HG11 VAL A 219 6.628 1.329 5.965 1.00 5.47 H new ATOM 0 HG12 VAL A 219 5.076 1.577 5.131 1.00 5.47 H new ATOM 0 HG13 VAL A 219 5.407 2.419 6.663 1.00 5.47 H new ATOM 0 HG21 VAL A 219 6.738 0.016 8.033 1.00 5.63 H new ATOM 0 HG22 VAL A 219 5.519 1.049 8.817 1.00 5.63 H new ATOM 0 HG23 VAL A 219 5.267 -0.710 8.723 1.00 5.63 H new ATOM 1034 N TYR A 220 2.563 -0.606 5.145 1.00 4.28 N ATOM 1035 CA TYR A 220 1.896 -0.736 3.853 1.00 4.00 C ATOM 1036 C TYR A 220 0.453 -0.235 3.944 1.00 4.14 C ATOM 1037 O TYR A 220 -0.028 0.489 3.070 1.00 4.18 O ATOM 1038 CB TYR A 220 1.914 -2.205 3.417 1.00 3.69 C ATOM 1039 CG TYR A 220 2.168 -2.434 1.939 1.00 3.55 C ATOM 1040 CD1 TYR A 220 1.442 -1.758 0.967 1.00 3.97 C ATOM 1041 CD2 TYR A 220 3.126 -3.351 1.520 1.00 3.52 C ATOM 1042 CE1 TYR A 220 1.669 -1.986 -0.382 1.00 4.12 C ATOM 1043 CE2 TYR A 220 3.356 -3.587 0.177 1.00 3.66 C ATOM 1044 CZ TYR A 220 2.626 -2.903 -0.768 1.00 3.85 C ATOM 1045 OH TYR A 220 2.843 -3.144 -2.106 1.00 4.23 O ATOM 0 H TYR A 220 2.873 -1.491 5.546 1.00 4.28 H new ATOM 0 HA TYR A 220 2.425 -0.131 3.117 1.00 4.00 H new ATOM 0 HB2 TYR A 220 2.682 -2.728 3.987 1.00 3.69 H new ATOM 0 HB3 TYR A 220 0.958 -2.658 3.680 1.00 3.69 H new ATOM 0 HD1 TYR A 220 0.689 -1.044 1.266 1.00 3.97 H new ATOM 0 HD2 TYR A 220 3.702 -3.889 2.258 1.00 3.52 H new ATOM 0 HE1 TYR A 220 1.100 -1.449 -1.127 1.00 4.12 H new ATOM 0 HE2 TYR A 220 4.104 -4.304 -0.128 1.00 3.66 H new ATOM 0 HH TYR A 220 2.002 -3.413 -2.531 1.00 4.23 H new ATOM 1055 N LYS A 221 -0.220 -0.605 5.029 1.00 4.37 N ATOM 1056 CA LYS A 221 -1.610 -0.224 5.247 1.00 4.73 C ATOM 1057 C LYS A 221 -1.766 1.280 5.495 1.00 5.09 C ATOM 1058 O LYS A 221 -2.755 1.885 5.077 1.00 5.27 O ATOM 1059 CB LYS A 221 -2.191 -1.016 6.422 1.00 5.11 C ATOM 1060 CG LYS A 221 -3.700 -0.882 6.554 1.00 5.12 C ATOM 1061 CD LYS A 221 -4.263 -1.873 7.556 1.00 5.57 C ATOM 1062 CE LYS A 221 -5.764 -1.706 7.705 1.00 5.79 C ATOM 1063 NZ LYS A 221 -6.346 -2.718 8.625 1.00 6.17 N1+ ATOM 0 H LYS A 221 0.179 -1.173 5.776 1.00 4.37 H new ATOM 0 HA LYS A 221 -2.161 -0.461 4.337 1.00 4.73 H new ATOM 0 HB2 LYS A 221 -1.936 -2.069 6.302 1.00 5.11 H new ATOM 0 HB3 LYS A 221 -1.722 -0.678 7.346 1.00 5.11 H new ATOM 0 HG2 LYS A 221 -3.950 0.132 6.865 1.00 5.12 H new ATOM 0 HG3 LYS A 221 -4.167 -1.042 5.582 1.00 5.12 H new ATOM 0 HD2 LYS A 221 -4.037 -2.889 7.233 1.00 5.57 H new ATOM 0 HD3 LYS A 221 -3.780 -1.731 8.523 1.00 5.57 H new ATOM 0 HE2 LYS A 221 -5.982 -0.706 8.080 1.00 5.79 H new ATOM 0 HE3 LYS A 221 -6.237 -1.790 6.727 1.00 5.79 H new ATOM 0 HZ1 LYS A 221 -7.373 -2.570 8.700 1.00 6.17 H new ATOM 0 HZ2 LYS A 221 -6.160 -3.672 8.254 1.00 6.17 H new ATOM 0 HZ3 LYS A 221 -5.913 -2.622 9.566 1.00 6.17 H new ATOM 1077 N ILE A 222 -0.807 1.884 6.179 1.00 5.30 N ATOM 1078 CA ILE A 222 -0.865 3.316 6.465 1.00 5.78 C ATOM 1079 C ILE A 222 -0.519 4.133 5.220 1.00 5.68 C ATOM 1080 O ILE A 222 -1.138 5.162 4.948 1.00 6.01 O ATOM 1081 CB ILE A 222 0.084 3.703 7.626 1.00 6.15 C ATOM 1082 CG1 ILE A 222 -0.323 2.975 8.909 1.00 6.30 C ATOM 1083 CG2 ILE A 222 0.075 5.209 7.848 1.00 6.74 C ATOM 1084 CD1 ILE A 222 0.699 3.084 10.020 1.00 6.53 C ATOM 0 H ILE A 222 0.019 1.411 6.547 1.00 5.30 H new ATOM 0 HA ILE A 222 -1.887 3.543 6.768 1.00 5.78 H new ATOM 0 HB ILE A 222 1.096 3.401 7.358 1.00 6.15 H new ATOM 0 HG12 ILE A 222 -1.273 3.379 9.260 1.00 6.30 H new ATOM 0 HG13 ILE A 222 -0.489 1.922 8.682 1.00 6.30 H new ATOM 0 HG21 ILE A 222 0.748 5.460 8.668 1.00 6.74 H new ATOM 0 HG22 ILE A 222 0.406 5.713 6.940 1.00 6.74 H new ATOM 0 HG23 ILE A 222 -0.935 5.534 8.096 1.00 6.74 H new ATOM 0 HD11 ILE A 222 0.342 2.544 10.897 1.00 6.53 H new ATOM 0 HD12 ILE A 222 1.644 2.654 9.689 1.00 6.53 H new ATOM 0 HD13 ILE A 222 0.848 4.133 10.276 1.00 6.53 H new ATOM 1096 N HIS A 223 0.454 3.646 4.462 1.00 5.31 N ATOM 1097 CA HIS A 223 0.904 4.312 3.241 1.00 5.36 C ATOM 1098 C HIS A 223 -0.262 4.555 2.282 1.00 5.26 C ATOM 1099 O HIS A 223 -0.492 5.682 1.836 1.00 5.59 O ATOM 1100 CB HIS A 223 1.977 3.459 2.557 1.00 5.11 C ATOM 1101 CG HIS A 223 2.800 4.186 1.536 1.00 5.45 C ATOM 1102 ND1 HIS A 223 3.890 3.592 0.951 1.00 5.42 N ATOM 1103 CD2 HIS A 223 2.652 5.433 1.024 1.00 5.95 C ATOM 1104 CE1 HIS A 223 4.382 4.482 0.107 1.00 5.92 C ATOM 1105 NE2 HIS A 223 3.668 5.615 0.117 1.00 6.23 N ATOM 0 H HIS A 223 0.954 2.782 4.672 1.00 5.31 H new ATOM 0 HA HIS A 223 1.324 5.281 3.512 1.00 5.36 H new ATOM 0 HB2 HIS A 223 2.643 3.056 3.320 1.00 5.11 H new ATOM 0 HB3 HIS A 223 1.493 2.609 2.075 1.00 5.11 H new ATOM 0 HD2 HIS A 223 1.883 6.147 1.280 1.00 5.95 H new ATOM 0 HE1 HIS A 223 5.251 4.316 -0.513 1.00 5.92 H new ATOM 0 HE2 HIS A 223 3.844 6.451 -0.440 1.00 6.23 H new ATOM 1113 N GLN A 224 -1.011 3.496 1.997 1.00 4.91 N ATOM 1114 CA GLN A 224 -2.149 3.573 1.081 1.00 4.90 C ATOM 1115 C GLN A 224 -3.247 4.504 1.605 1.00 5.38 C ATOM 1116 O GLN A 224 -4.064 5.009 0.829 1.00 5.57 O ATOM 1117 CB GLN A 224 -2.716 2.175 0.813 1.00 4.63 C ATOM 1118 CG GLN A 224 -3.156 1.435 2.064 1.00 4.79 C ATOM 1119 CD GLN A 224 -4.660 1.290 2.157 1.00 4.97 C ATOM 1120 OE1 GLN A 224 -5.348 1.180 1.143 1.00 5.09 O ATOM 1121 NE2 GLN A 224 -5.182 1.303 3.371 1.00 5.38 N ATOM 0 H GLN A 224 -0.851 2.568 2.388 1.00 4.91 H new ATOM 0 HA GLN A 224 -1.784 3.995 0.144 1.00 4.90 H new ATOM 0 HB2 GLN A 224 -3.567 2.263 0.137 1.00 4.63 H new ATOM 0 HB3 GLN A 224 -1.961 1.581 0.299 1.00 4.63 H new ATOM 0 HG2 GLN A 224 -2.698 0.446 2.076 1.00 4.79 H new ATOM 0 HG3 GLN A 224 -2.791 1.966 2.943 1.00 4.79 H new ATOM 0 HE21 GLN A 224 -4.576 1.396 4.186 1.00 5.38 H new ATOM 0 HE22 GLN A 224 -6.191 1.220 3.493 1.00 5.38 H new ATOM 1130 N GLN A 225 -3.273 4.731 2.912 1.00 5.66 N ATOM 1131 CA GLN A 225 -4.283 5.602 3.509 1.00 6.22 C ATOM 1132 C GLN A 225 -3.888 7.064 3.336 1.00 6.53 C ATOM 1133 O GLN A 225 -4.734 7.924 3.085 1.00 6.88 O ATOM 1134 CB GLN A 225 -4.478 5.283 4.993 1.00 6.56 C ATOM 1135 CG GLN A 225 -5.233 3.992 5.254 1.00 6.94 C ATOM 1136 CD GLN A 225 -5.394 3.707 6.734 1.00 7.36 C ATOM 1137 OE1 GLN A 225 -6.392 4.089 7.352 1.00 7.76 O ATOM 1138 NE2 GLN A 225 -4.412 3.034 7.313 1.00 7.56 N ATOM 0 H GLN A 225 -2.612 4.328 3.577 1.00 5.66 H new ATOM 0 HA GLN A 225 -5.228 5.424 2.995 1.00 6.22 H new ATOM 0 HB2 GLN A 225 -3.501 5.224 5.473 1.00 6.56 H new ATOM 0 HB3 GLN A 225 -5.014 6.107 5.464 1.00 6.56 H new ATOM 0 HG2 GLN A 225 -6.217 4.049 4.788 1.00 6.94 H new ATOM 0 HG3 GLN A 225 -4.705 3.163 4.782 1.00 6.94 H new ATOM 0 HE21 GLN A 225 -3.605 2.737 6.765 1.00 7.56 H new ATOM 0 HE22 GLN A 225 -4.463 2.812 8.307 1.00 7.56 H new ATOM 1147 N LEU A 226 -2.595 7.335 3.461 1.00 6.49 N ATOM 1148 CA LEU A 226 -2.077 8.692 3.321 1.00 6.92 C ATOM 1149 C LEU A 226 -2.246 9.191 1.893 1.00 6.85 C ATOM 1150 O LEU A 226 -2.581 10.353 1.668 1.00 7.28 O ATOM 1151 CB LEU A 226 -0.597 8.741 3.709 1.00 7.02 C ATOM 1152 CG LEU A 226 -0.310 8.526 5.194 1.00 7.62 C ATOM 1153 CD1 LEU A 226 1.164 8.225 5.411 1.00 7.93 C ATOM 1154 CD2 LEU A 226 -0.726 9.747 6.000 1.00 8.09 C ATOM 0 H LEU A 226 -1.883 6.632 3.660 1.00 6.49 H new ATOM 0 HA LEU A 226 -2.645 9.339 3.989 1.00 6.92 H new ATOM 0 HB2 LEU A 226 -0.062 7.982 3.138 1.00 7.02 H new ATOM 0 HB3 LEU A 226 -0.191 9.708 3.413 1.00 7.02 H new ATOM 0 HG LEU A 226 -0.893 7.671 5.537 1.00 7.62 H new ATOM 0 HD11 LEU A 226 1.352 8.074 6.474 1.00 7.93 H new ATOM 0 HD12 LEU A 226 1.436 7.323 4.863 1.00 7.93 H new ATOM 0 HD13 LEU A 226 1.763 9.062 5.052 1.00 7.93 H new ATOM 0 HD21 LEU A 226 -0.514 9.576 7.055 1.00 8.09 H new ATOM 0 HD22 LEU A 226 -0.169 10.618 5.655 1.00 8.09 H new ATOM 0 HD23 LEU A 226 -1.794 9.924 5.868 1.00 8.09 H new ATOM 1166 N LEU A 227 -2.015 8.303 0.934 1.00 6.38 N ATOM 1167 CA LEU A 227 -2.137 8.655 -0.476 1.00 6.38 C ATOM 1168 C LEU A 227 -3.564 9.073 -0.810 1.00 6.51 C ATOM 1169 O LEU A 227 -3.779 10.021 -1.561 1.00 6.81 O ATOM 1170 CB LEU A 227 -1.709 7.485 -1.367 1.00 5.94 C ATOM 1171 CG LEU A 227 -0.236 7.078 -1.260 1.00 5.92 C ATOM 1172 CD1 LEU A 227 0.146 6.171 -2.421 1.00 5.56 C ATOM 1173 CD2 LEU A 227 0.666 8.306 -1.223 1.00 6.51 C ATOM 0 H LEU A 227 -1.743 7.335 1.106 1.00 6.38 H new ATOM 0 HA LEU A 227 -1.475 9.499 -0.668 1.00 6.38 H new ATOM 0 HB2 LEU A 227 -2.325 6.620 -1.122 1.00 5.94 H new ATOM 0 HB3 LEU A 227 -1.922 7.744 -2.404 1.00 5.94 H new ATOM 0 HG LEU A 227 -0.099 6.530 -0.328 1.00 5.92 H new ATOM 0 HD11 LEU A 227 1.195 5.889 -2.333 1.00 5.56 H new ATOM 0 HD12 LEU A 227 -0.473 5.274 -2.401 1.00 5.56 H new ATOM 0 HD13 LEU A 227 -0.010 6.699 -3.362 1.00 5.56 H new ATOM 0 HD21 LEU A 227 1.707 7.991 -1.147 1.00 6.51 H new ATOM 0 HD22 LEU A 227 0.528 8.886 -2.135 1.00 6.51 H new ATOM 0 HD23 LEU A 227 0.409 8.920 -0.360 1.00 6.51 H new ATOM 1185 N PHE A 228 -4.536 8.372 -0.233 1.00 6.38 N ATOM 1186 CA PHE A 228 -5.942 8.680 -0.468 1.00 6.62 C ATOM 1187 C PHE A 228 -6.271 10.081 0.040 1.00 7.17 C ATOM 1188 O PHE A 228 -6.936 10.860 -0.640 1.00 7.44 O ATOM 1189 CB PHE A 228 -6.841 7.648 0.223 1.00 6.57 C ATOM 1190 CG PHE A 228 -8.182 7.492 -0.421 1.00 6.89 C ATOM 1191 CD1 PHE A 228 -9.173 8.440 -0.232 1.00 7.26 C ATOM 1192 CD2 PHE A 228 -8.451 6.393 -1.212 1.00 7.04 C ATOM 1193 CE1 PHE A 228 -10.408 8.294 -0.826 1.00 7.64 C ATOM 1194 CE2 PHE A 228 -9.685 6.240 -1.809 1.00 7.43 C ATOM 1195 CZ PHE A 228 -10.668 7.191 -1.617 1.00 7.67 C ATOM 0 H PHE A 228 -4.376 7.588 0.400 1.00 6.38 H new ATOM 0 HA PHE A 228 -6.126 8.642 -1.542 1.00 6.62 H new ATOM 0 HB2 PHE A 228 -6.335 6.683 0.226 1.00 6.57 H new ATOM 0 HB3 PHE A 228 -6.979 7.939 1.264 1.00 6.57 H new ATOM 0 HD1 PHE A 228 -8.976 9.303 0.387 1.00 7.26 H new ATOM 0 HD2 PHE A 228 -7.687 5.645 -1.365 1.00 7.04 H new ATOM 0 HE1 PHE A 228 -11.172 9.041 -0.673 1.00 7.64 H new ATOM 0 HE2 PHE A 228 -9.883 5.376 -2.427 1.00 7.43 H new ATOM 0 HZ PHE A 228 -11.635 7.073 -2.083 1.00 7.67 H new ATOM 1205 N LYS A 229 -5.782 10.391 1.233 1.00 7.38 N ATOM 1206 CA LYS A 229 -6.018 11.691 1.849 1.00 7.96 C ATOM 1207 C LYS A 229 -5.357 12.811 1.052 1.00 8.17 C ATOM 1208 O LYS A 229 -5.950 13.870 0.841 1.00 8.60 O ATOM 1209 CB LYS A 229 -5.484 11.695 3.281 1.00 8.19 C ATOM 1210 CG LYS A 229 -6.238 10.764 4.215 1.00 8.20 C ATOM 1211 CD LYS A 229 -5.545 10.655 5.561 1.00 8.62 C ATOM 1212 CE LYS A 229 -6.428 9.981 6.598 1.00 8.81 C ATOM 1213 NZ LYS A 229 -6.684 8.553 6.275 1.00 9.36 N1+ ATOM 0 H LYS A 229 -5.216 9.756 1.797 1.00 7.38 H new ATOM 0 HA LYS A 229 -7.094 11.867 1.858 1.00 7.96 H new ATOM 0 HB2 LYS A 229 -4.432 11.409 3.268 1.00 8.19 H new ATOM 0 HB3 LYS A 229 -5.534 12.710 3.675 1.00 8.19 H new ATOM 0 HG2 LYS A 229 -7.255 11.131 4.355 1.00 8.20 H new ATOM 0 HG3 LYS A 229 -6.316 9.776 3.762 1.00 8.20 H new ATOM 0 HD2 LYS A 229 -4.620 10.090 5.449 1.00 8.62 H new ATOM 0 HD3 LYS A 229 -5.270 11.650 5.910 1.00 8.62 H new ATOM 0 HE2 LYS A 229 -5.954 10.051 7.577 1.00 8.81 H new ATOM 0 HE3 LYS A 229 -7.377 10.512 6.665 1.00 8.81 H new ATOM 0 HZ1 LYS A 229 -7.290 8.134 7.009 1.00 9.36 H new ATOM 0 HZ2 LYS A 229 -7.160 8.486 5.353 1.00 9.36 H new ATOM 0 HZ3 LYS A 229 -5.781 8.038 6.237 1.00 9.36 H new ATOM 1227 N ALA A 230 -4.132 12.564 0.603 1.00 7.94 N ATOM 1228 CA ALA A 230 -3.378 13.547 -0.166 1.00 8.24 C ATOM 1229 C ALA A 230 -4.062 13.864 -1.492 1.00 8.26 C ATOM 1230 O ALA A 230 -3.973 14.983 -1.991 1.00 8.69 O ATOM 1231 CB ALA A 230 -1.958 13.054 -0.405 1.00 8.09 C ATOM 0 H ALA A 230 -3.637 11.686 0.760 1.00 7.94 H new ATOM 0 HA ALA A 230 -3.340 14.468 0.416 1.00 8.24 H new ATOM 0 HB1 ALA A 230 -1.407 13.798 -0.980 1.00 8.09 H new ATOM 0 HB2 ALA A 230 -1.462 12.895 0.553 1.00 8.09 H new ATOM 0 HB3 ALA A 230 -1.987 12.116 -0.959 1.00 8.09 H new ATOM 1237 N ARG A 231 -4.743 12.874 -2.057 1.00 7.86 N ATOM 1238 CA ARG A 231 -5.442 13.057 -3.325 1.00 7.92 C ATOM 1239 C ARG A 231 -6.659 13.962 -3.148 1.00 8.29 C ATOM 1240 O ARG A 231 -7.086 14.640 -4.082 1.00 8.56 O ATOM 1241 CB ARG A 231 -5.875 11.709 -3.909 1.00 7.47 C ATOM 1242 CG ARG A 231 -4.712 10.849 -4.380 1.00 7.27 C ATOM 1243 CD ARG A 231 -5.195 9.557 -5.016 1.00 7.20 C ATOM 1244 NE ARG A 231 -5.787 9.784 -6.334 1.00 7.43 N ATOM 1245 CZ ARG A 231 -6.482 8.872 -7.008 1.00 7.64 C ATOM 1246 NH1 ARG A 231 -6.705 7.674 -6.476 1.00 7.67 N1+ ATOM 1247 NH2 ARG A 231 -6.959 9.158 -8.214 1.00 8.09 N ATOM 0 H ARG A 231 -4.827 11.939 -1.659 1.00 7.86 H new ATOM 0 HA ARG A 231 -4.750 13.533 -4.020 1.00 7.92 H new ATOM 0 HB2 ARG A 231 -6.440 11.160 -3.155 1.00 7.47 H new ATOM 0 HB3 ARG A 231 -6.549 11.885 -4.747 1.00 7.47 H new ATOM 0 HG2 ARG A 231 -4.113 11.408 -5.099 1.00 7.27 H new ATOM 0 HG3 ARG A 231 -4.063 10.619 -3.535 1.00 7.27 H new ATOM 0 HD2 ARG A 231 -4.359 8.864 -5.108 1.00 7.20 H new ATOM 0 HD3 ARG A 231 -5.930 9.085 -4.365 1.00 7.20 H new ATOM 0 HE ARG A 231 -5.659 10.700 -6.764 1.00 7.43 H new ATOM 0 HH11 ARG A 231 -6.343 7.452 -5.549 1.00 7.67 H new ATOM 0 HH12 ARG A 231 -7.238 6.977 -6.995 1.00 7.67 H new ATOM 0 HH21 ARG A 231 -6.792 10.077 -8.624 1.00 8.09 H new ATOM 0 HH22 ARG A 231 -7.492 8.458 -8.731 1.00 8.09 H new ATOM 1261 N LEU A 232 -7.213 13.962 -1.945 1.00 8.38 N ATOM 1262 CA LEU A 232 -8.373 14.785 -1.634 1.00 8.81 C ATOM 1263 C LEU A 232 -7.933 16.193 -1.253 1.00 9.30 C ATOM 1264 O LEU A 232 -8.374 17.182 -1.847 1.00 9.67 O ATOM 1265 CB LEU A 232 -9.174 14.164 -0.487 1.00 8.85 C ATOM 1266 CG LEU A 232 -9.725 12.763 -0.754 1.00 8.92 C ATOM 1267 CD1 LEU A 232 -10.280 12.161 0.526 1.00 8.90 C ATOM 1268 CD2 LEU A 232 -10.800 12.807 -1.833 1.00 9.12 C ATOM 0 H LEU A 232 -6.876 13.398 -1.164 1.00 8.38 H new ATOM 0 HA LEU A 232 -9.007 14.838 -2.519 1.00 8.81 H new ATOM 0 HB2 LEU A 232 -8.538 14.123 0.397 1.00 8.85 H new ATOM 0 HB3 LEU A 232 -10.008 14.825 -0.250 1.00 8.85 H new ATOM 0 HG LEU A 232 -8.909 12.133 -1.109 1.00 8.92 H new ATOM 0 HD11 LEU A 232 -10.669 11.164 0.320 1.00 8.90 H new ATOM 0 HD12 LEU A 232 -9.487 12.095 1.271 1.00 8.90 H new ATOM 0 HD13 LEU A 232 -11.083 12.792 0.906 1.00 8.90 H new ATOM 0 HD21 LEU A 232 -11.180 11.801 -2.009 1.00 9.12 H new ATOM 0 HD22 LEU A 232 -11.616 13.451 -1.507 1.00 9.12 H new ATOM 0 HD23 LEU A 232 -10.373 13.200 -2.756 1.00 9.12 H new ATOM 1280 N GLN A 233 -7.053 16.275 -0.267 1.00 9.34 N ATOM 1281 CA GLN A 233 -6.553 17.555 0.206 1.00 9.87 C ATOM 1282 C GLN A 233 -5.036 17.523 0.326 1.00 9.87 C ATOM 1283 O GLN A 233 -4.469 16.644 0.976 1.00 9.75 O ATOM 1284 CB GLN A 233 -7.185 17.904 1.555 1.00 10.25 C ATOM 1285 CG GLN A 233 -8.597 18.454 1.437 1.00 10.67 C ATOM 1286 CD GLN A 233 -9.427 18.219 2.681 1.00 11.24 C ATOM 1287 OE1 GLN A 233 -10.134 17.216 2.787 1.00 11.55 O ATOM 1288 NE2 GLN A 233 -9.345 19.136 3.631 1.00 11.55 N ATOM 0 H GLN A 233 -6.670 15.466 0.222 1.00 9.34 H new ATOM 0 HA GLN A 233 -6.826 18.323 -0.518 1.00 9.87 H new ATOM 0 HB2 GLN A 233 -7.202 17.012 2.181 1.00 10.25 H new ATOM 0 HB3 GLN A 233 -6.559 18.638 2.062 1.00 10.25 H new ATOM 0 HG2 GLN A 233 -8.549 19.524 1.235 1.00 10.67 H new ATOM 0 HG3 GLN A 233 -9.092 17.991 0.583 1.00 10.67 H new ATOM 0 HE21 GLN A 233 -8.747 19.952 3.502 1.00 11.55 H new ATOM 0 HE22 GLN A 233 -9.880 19.027 4.493 1.00 11.55 H new ATOM 1297 N GLN A 234 -4.385 18.480 -0.316 1.00 10.20 N ATOM 1298 CA GLN A 234 -2.936 18.578 -0.285 1.00 10.43 C ATOM 1299 C GLN A 234 -2.511 19.674 0.687 1.00 10.93 C ATOM 1300 O GLN A 234 -2.290 19.412 1.870 1.00 11.18 O ATOM 1301 CB GLN A 234 -2.391 18.872 -1.685 1.00 10.71 C ATOM 1302 CG GLN A 234 -2.684 17.786 -2.707 1.00 10.40 C ATOM 1303 CD GLN A 234 -2.994 18.355 -4.077 1.00 10.40 C ATOM 1304 OE1 GLN A 234 -3.590 19.425 -4.198 1.00 10.46 O ATOM 1305 NE2 GLN A 234 -2.592 17.643 -5.117 1.00 10.55 N ATOM 0 H GLN A 234 -4.842 19.205 -0.869 1.00 10.20 H new ATOM 0 HA GLN A 234 -2.526 17.626 0.052 1.00 10.43 H new ATOM 0 HB2 GLN A 234 -2.815 19.812 -2.038 1.00 10.71 H new ATOM 0 HB3 GLN A 234 -1.312 19.014 -1.621 1.00 10.71 H new ATOM 0 HG2 GLN A 234 -1.826 17.117 -2.779 1.00 10.40 H new ATOM 0 HG3 GLN A 234 -3.528 17.187 -2.365 1.00 10.40 H new ATOM 0 HE21 GLN A 234 -2.101 16.761 -4.972 1.00 10.55 H new ATOM 0 HE22 GLN A 234 -2.773 17.976 -6.064 1.00 10.55 H new ATOM 1314 N GLN A 235 -2.416 20.901 0.187 1.00 11.20 N ATOM 1315 CA GLN A 235 -2.030 22.041 1.010 1.00 11.76 C ATOM 1316 C GLN A 235 -3.036 23.171 0.846 1.00 11.96 C ATOM 1317 O GLN A 235 -2.806 24.298 1.288 1.00 12.27 O ATOM 1318 CB GLN A 235 -0.631 22.535 0.630 1.00 12.22 C ATOM 1319 CG GLN A 235 0.483 21.571 1.011 1.00 12.26 C ATOM 1320 CD GLN A 235 0.595 21.370 2.510 1.00 12.74 C ATOM 1321 OE1 GLN A 235 0.295 22.268 3.296 1.00 13.00 O ATOM 1322 NE2 GLN A 235 1.034 20.192 2.920 1.00 13.02 N ATOM 0 H GLN A 235 -2.602 21.132 -0.789 1.00 11.20 H new ATOM 0 HA GLN A 235 -2.016 21.720 2.052 1.00 11.76 H new ATOM 0 HB2 GLN A 235 -0.597 22.709 -0.445 1.00 12.22 H new ATOM 0 HB3 GLN A 235 -0.450 23.495 1.114 1.00 12.22 H new ATOM 0 HG2 GLN A 235 0.305 20.608 0.532 1.00 12.26 H new ATOM 0 HG3 GLN A 235 1.431 21.948 0.627 1.00 12.26 H new ATOM 0 HE21 GLN A 235 1.273 19.472 2.239 1.00 13.02 H new ATOM 0 HE22 GLN A 235 1.134 20.004 3.918 1.00 13.02 H new ATOM 1331 N GLN A 236 -4.151 22.860 0.208 1.00 11.97 N ATOM 1332 CA GLN A 236 -5.199 23.840 -0.027 1.00 12.36 C ATOM 1333 C GLN A 236 -6.406 23.561 0.858 1.00 12.79 C ATOM 1334 O GLN A 236 -6.920 22.437 0.892 1.00 12.91 O ATOM 1335 CB GLN A 236 -5.599 23.824 -1.503 1.00 12.49 C ATOM 1336 CG GLN A 236 -6.911 24.531 -1.804 1.00 12.78 C ATOM 1337 CD GLN A 236 -7.362 24.313 -3.235 1.00 13.04 C ATOM 1338 OE1 GLN A 236 -7.045 25.100 -4.125 1.00 13.08 O ATOM 1339 NE2 GLN A 236 -8.095 23.235 -3.469 1.00 13.40 N ATOM 0 H GLN A 236 -4.355 21.930 -0.159 1.00 11.97 H new ATOM 0 HA GLN A 236 -4.819 24.830 0.226 1.00 12.36 H new ATOM 0 HB2 GLN A 236 -4.806 24.291 -2.087 1.00 12.49 H new ATOM 0 HB3 GLN A 236 -5.673 22.789 -1.836 1.00 12.49 H new ATOM 0 HG2 GLN A 236 -7.681 24.170 -1.123 1.00 12.78 H new ATOM 0 HG3 GLN A 236 -6.797 25.599 -1.619 1.00 12.78 H new ATOM 0 HE21 GLN A 236 -8.337 22.606 -2.703 1.00 13.40 H new ATOM 0 HE22 GLN A 236 -8.418 23.033 -4.415 1.00 13.40 H new ATOM 1348 N ALA A 237 -6.846 24.585 1.580 1.00 13.20 N ATOM 1349 CA ALA A 237 -7.998 24.466 2.463 1.00 13.80 C ATOM 1350 C ALA A 237 -9.286 24.383 1.651 1.00 14.33 C ATOM 1351 O ALA A 237 -9.381 24.956 0.559 1.00 14.81 O ATOM 1352 CB ALA A 237 -8.047 25.641 3.430 1.00 14.21 C ATOM 0 H ALA A 237 -6.419 25.511 1.570 1.00 13.20 H new ATOM 0 HA ALA A 237 -7.899 23.548 3.042 1.00 13.80 H new ATOM 0 HB1 ALA A 237 -8.913 25.538 4.084 1.00 14.21 H new ATOM 0 HB2 ALA A 237 -7.138 25.655 4.032 1.00 14.21 H new ATOM 0 HB3 ALA A 237 -8.125 26.572 2.868 1.00 14.21 H new ATOM 1358 N GLN A 238 -10.266 23.667 2.176 1.00 14.40 N ATOM 1359 CA GLN A 238 -11.541 23.501 1.499 1.00 15.05 C ATOM 1360 C GLN A 238 -12.680 24.009 2.366 1.00 15.31 C ATOM 1361 O GLN A 238 -13.401 24.926 1.925 1.00 15.61 O ATOM 1362 CB GLN A 238 -11.767 22.033 1.133 1.00 15.30 C ATOM 1363 CG GLN A 238 -10.826 21.528 0.051 1.00 15.63 C ATOM 1364 CD GLN A 238 -11.069 22.198 -1.287 1.00 15.81 C ATOM 1365 OE1 GLN A 238 -11.803 21.682 -2.128 1.00 15.98 O ATOM 1366 NE2 GLN A 238 -10.466 23.358 -1.489 1.00 15.93 N ATOM 1367 OXT GLN A 238 -12.841 23.499 3.495 1.00 15.35 O1- ATOM 0 H GLN A 238 -10.202 23.189 3.075 1.00 14.40 H new ATOM 0 HA GLN A 238 -11.518 24.089 0.581 1.00 15.05 H new ATOM 0 HB2 GLN A 238 -11.643 21.421 2.026 1.00 15.30 H new ATOM 0 HB3 GLN A 238 -12.796 21.904 0.798 1.00 15.30 H new ATOM 0 HG2 GLN A 238 -9.795 21.703 0.360 1.00 15.63 H new ATOM 0 HG3 GLN A 238 -10.948 20.450 -0.058 1.00 15.63 H new ATOM 0 HE21 GLN A 238 -9.865 23.753 -0.766 1.00 15.93 H new ATOM 0 HE22 GLN A 238 -10.603 23.858 -2.368 1.00 15.93 H new TER 1376 GLN A 238 ATOM 1377 N SER B 101 41.281 -42.244 -29.204 1.00 35.36 N ATOM 1378 CA SER B 101 41.191 -40.882 -28.638 1.00 34.91 C ATOM 1379 C SER B 101 40.099 -40.814 -27.572 1.00 34.43 C ATOM 1380 O SER B 101 38.961 -41.219 -27.814 1.00 34.37 O ATOM 1381 CB SER B 101 40.898 -39.880 -29.754 1.00 35.00 C ATOM 1382 OG SER B 101 41.619 -40.209 -30.931 1.00 35.49 O ATOM 0 HA SER B 101 42.143 -40.633 -28.170 1.00 34.91 H new ATOM 0 HB2 SER B 101 39.829 -39.870 -29.968 1.00 35.00 H new ATOM 0 HB3 SER B 101 41.167 -38.876 -29.427 1.00 35.00 H new ATOM 0 HG SER B 101 41.766 -41.177 -30.965 1.00 35.49 H new ATOM 1390 N THR B 102 40.448 -40.315 -26.396 1.00 34.15 N ATOM 1391 CA THR B 102 39.495 -40.193 -25.305 1.00 33.76 C ATOM 1392 C THR B 102 38.780 -38.842 -25.348 1.00 33.28 C ATOM 1393 O THR B 102 39.384 -37.801 -25.078 1.00 33.22 O ATOM 1394 CB THR B 102 40.190 -40.342 -23.940 1.00 33.83 C ATOM 1395 OG1 THR B 102 41.362 -41.162 -24.074 1.00 34.21 O ATOM 1396 CG2 THR B 102 39.243 -40.954 -22.916 1.00 33.72 C ATOM 0 H THR B 102 41.388 -39.987 -26.173 1.00 34.15 H new ATOM 0 HA THR B 102 38.766 -40.994 -25.428 1.00 33.76 H new ATOM 0 HB THR B 102 40.481 -39.351 -23.592 1.00 33.83 H new ATOM 0 HG1 THR B 102 41.800 -41.251 -23.202 1.00 34.21 H new ATOM 0 HG21 THR B 102 39.755 -41.050 -21.959 1.00 33.72 H new ATOM 0 HG22 THR B 102 38.370 -40.312 -22.798 1.00 33.72 H new ATOM 0 HG23 THR B 102 38.925 -41.939 -23.258 1.00 33.72 H new ATOM 1404 N ASP B 103 37.506 -38.860 -25.703 1.00 33.03 N ATOM 1405 CA ASP B 103 36.711 -37.637 -25.765 1.00 32.64 C ATOM 1406 C ASP B 103 35.954 -37.443 -24.462 1.00 32.11 C ATOM 1407 O ASP B 103 35.316 -38.373 -23.964 1.00 31.91 O ATOM 1408 CB ASP B 103 35.722 -37.675 -26.929 1.00 32.81 C ATOM 1409 CG ASP B 103 34.713 -36.543 -26.867 1.00 32.63 C ATOM 1410 OD1 ASP B 103 35.004 -35.453 -27.398 1.00 32.53 O1- ATOM 1411 OD2 ASP B 103 33.629 -36.735 -26.274 1.00 32.67 O ATOM 0 H ASP B 103 36.996 -39.707 -25.954 1.00 33.03 H new ATOM 0 HA ASP B 103 37.394 -36.802 -25.922 1.00 32.64 H new ATOM 0 HB2 ASP B 103 36.270 -37.619 -27.870 1.00 32.81 H new ATOM 0 HB3 ASP B 103 35.195 -38.629 -26.923 1.00 32.81 H new ATOM 1416 N SER B 104 36.021 -36.242 -23.912 1.00 31.97 N ATOM 1417 CA SER B 104 35.342 -35.941 -22.665 1.00 31.54 C ATOM 1418 C SER B 104 34.870 -34.492 -22.644 1.00 31.14 C ATOM 1419 O SER B 104 35.456 -33.626 -23.300 1.00 31.23 O ATOM 1420 CB SER B 104 36.278 -36.213 -21.485 1.00 31.91 C ATOM 1421 OG SER B 104 37.626 -35.944 -21.835 1.00 32.43 O ATOM 0 H SER B 104 36.540 -35.459 -24.311 1.00 31.97 H new ATOM 0 HA SER B 104 34.466 -36.585 -22.580 1.00 31.54 H new ATOM 0 HB2 SER B 104 35.988 -35.594 -20.636 1.00 31.91 H new ATOM 0 HB3 SER B 104 36.180 -37.252 -21.170 1.00 31.91 H new ATOM 0 HG SER B 104 38.206 -36.123 -21.065 1.00 32.43 H new ATOM 1427 N THR B 105 33.803 -34.242 -21.906 1.00 30.79 N ATOM 1428 CA THR B 105 33.250 -32.907 -21.775 1.00 30.46 C ATOM 1429 C THR B 105 33.431 -32.410 -20.343 1.00 29.85 C ATOM 1430 O THR B 105 32.692 -32.811 -19.446 1.00 29.61 O ATOM 1431 CB THR B 105 31.755 -32.892 -22.151 1.00 30.44 C ATOM 1432 OG1 THR B 105 31.545 -33.688 -23.324 1.00 30.93 O ATOM 1433 CG2 THR B 105 31.264 -31.475 -22.405 1.00 30.50 C ATOM 0 H THR B 105 33.297 -34.957 -21.382 1.00 30.79 H new ATOM 0 HA THR B 105 33.782 -32.245 -22.458 1.00 30.46 H new ATOM 0 HB THR B 105 31.191 -33.305 -21.315 1.00 30.44 H new ATOM 0 HG1 THR B 105 30.594 -33.678 -23.560 1.00 30.93 H new ATOM 0 HG21 THR B 105 30.206 -31.498 -22.668 1.00 30.50 H new ATOM 0 HG22 THR B 105 31.401 -30.876 -21.505 1.00 30.50 H new ATOM 0 HG23 THR B 105 31.832 -31.035 -23.224 1.00 30.50 H new ATOM 1441 N PRO B 106 34.448 -31.565 -20.103 1.00 29.68 N ATOM 1442 CA PRO B 106 34.730 -31.023 -18.769 1.00 29.20 C ATOM 1443 C PRO B 106 33.567 -30.204 -18.211 1.00 28.60 C ATOM 1444 O PRO B 106 33.014 -30.529 -17.161 1.00 28.39 O ATOM 1445 CB PRO B 106 35.957 -30.129 -18.990 1.00 29.37 C ATOM 1446 CG PRO B 106 36.555 -30.584 -20.270 1.00 29.85 C ATOM 1447 CD PRO B 106 35.414 -31.082 -21.106 1.00 30.05 C ATOM 0 HA PRO B 106 34.893 -31.817 -18.040 1.00 29.20 H new ATOM 0 HB2 PRO B 106 35.672 -29.078 -19.042 1.00 29.37 H new ATOM 0 HB3 PRO B 106 36.667 -30.227 -18.169 1.00 29.37 H new ATOM 0 HG2 PRO B 106 37.077 -29.767 -20.769 1.00 29.85 H new ATOM 0 HG3 PRO B 106 37.287 -31.373 -20.100 1.00 29.85 H new ATOM 0 HD2 PRO B 106 34.991 -30.289 -21.723 1.00 30.05 H new ATOM 0 HD3 PRO B 106 35.727 -31.879 -21.781 1.00 30.05 H new ATOM 1455 N MET B 107 33.198 -29.154 -18.928 1.00 28.40 N ATOM 1456 CA MET B 107 32.110 -28.283 -18.506 1.00 27.90 C ATOM 1457 C MET B 107 30.820 -28.646 -19.227 1.00 27.40 C ATOM 1458 O MET B 107 30.764 -28.640 -20.458 1.00 27.53 O ATOM 1459 CB MET B 107 32.456 -26.817 -18.781 1.00 28.12 C ATOM 1460 CG MET B 107 33.458 -26.225 -17.805 1.00 28.42 C ATOM 1461 SD MET B 107 32.683 -25.613 -16.296 1.00 28.81 S ATOM 1462 CE MET B 107 34.102 -24.896 -15.469 1.00 29.25 C ATOM 0 H MET B 107 33.637 -28.883 -19.808 1.00 28.40 H new ATOM 0 HA MET B 107 31.967 -28.420 -17.434 1.00 27.90 H new ATOM 0 HB2 MET B 107 32.855 -26.732 -19.792 1.00 28.12 H new ATOM 0 HB3 MET B 107 31.541 -26.226 -18.749 1.00 28.12 H new ATOM 0 HG2 MET B 107 34.198 -26.982 -17.547 1.00 28.42 H new ATOM 0 HG3 MET B 107 33.993 -25.409 -18.290 1.00 28.42 H new ATOM 0 HE1 MET B 107 33.791 -24.472 -14.514 1.00 29.25 H new ATOM 0 HE2 MET B 107 34.851 -25.669 -15.296 1.00 29.25 H new ATOM 0 HE3 MET B 107 34.528 -24.111 -16.093 1.00 29.25 H new ATOM 1472 N PHE B 108 29.798 -28.971 -18.454 1.00 26.90 N ATOM 1473 CA PHE B 108 28.499 -29.324 -19.005 1.00 26.45 C ATOM 1474 C PHE B 108 27.572 -28.113 -18.973 1.00 25.50 C ATOM 1475 O PHE B 108 28.019 -26.989 -18.731 1.00 25.24 O ATOM 1476 CB PHE B 108 27.879 -30.483 -18.212 1.00 26.78 C ATOM 1477 CG PHE B 108 28.540 -31.811 -18.451 1.00 27.55 C ATOM 1478 CD1 PHE B 108 28.271 -32.538 -19.599 1.00 28.09 C ATOM 1479 CD2 PHE B 108 29.430 -32.335 -17.525 1.00 27.83 C ATOM 1480 CE1 PHE B 108 28.874 -33.762 -19.820 1.00 28.87 C ATOM 1481 CE2 PHE B 108 30.036 -33.556 -17.740 1.00 28.61 C ATOM 1482 CZ PHE B 108 29.759 -34.270 -18.890 1.00 29.12 C ATOM 0 H PHE B 108 29.843 -28.998 -17.435 1.00 26.90 H new ATOM 0 HA PHE B 108 28.633 -29.642 -20.039 1.00 26.45 H new ATOM 0 HB2 PHE B 108 27.930 -30.250 -17.148 1.00 26.78 H new ATOM 0 HB3 PHE B 108 26.823 -30.563 -18.471 1.00 26.78 H new ATOM 0 HD1 PHE B 108 27.581 -32.143 -20.331 1.00 28.09 H new ATOM 0 HD2 PHE B 108 29.651 -31.781 -16.625 1.00 27.83 H new ATOM 0 HE1 PHE B 108 28.653 -34.320 -20.718 1.00 28.87 H new ATOM 0 HE2 PHE B 108 30.726 -33.953 -17.010 1.00 28.61 H new ATOM 0 HZ PHE B 108 30.234 -35.225 -19.061 1.00 29.12 H new ATOM 1492 N GLU B 109 26.294 -28.344 -19.218 1.00 25.08 N ATOM 1493 CA GLU B 109 25.308 -27.273 -19.211 1.00 24.24 C ATOM 1494 C GLU B 109 24.836 -26.979 -17.793 1.00 23.47 C ATOM 1495 O GLU B 109 24.647 -27.893 -16.992 1.00 23.64 O ATOM 1496 CB GLU B 109 24.117 -27.651 -20.088 1.00 24.33 C ATOM 1497 CG GLU B 109 24.390 -27.509 -21.575 1.00 24.89 C ATOM 1498 CD GLU B 109 24.452 -26.064 -22.010 1.00 25.22 C ATOM 1499 OE1 GLU B 109 23.385 -25.486 -22.306 1.00 25.44 O1- ATOM 1500 OE2 GLU B 109 25.564 -25.496 -22.054 1.00 25.35 O ATOM 0 H GLU B 109 25.912 -29.267 -19.425 1.00 25.08 H new ATOM 0 HA GLU B 109 25.777 -26.374 -19.611 1.00 24.24 H new ATOM 0 HB2 GLU B 109 23.832 -28.682 -19.876 1.00 24.33 H new ATOM 0 HB3 GLU B 109 23.266 -27.024 -19.821 1.00 24.33 H new ATOM 0 HG2 GLU B 109 25.332 -28.000 -21.818 1.00 24.89 H new ATOM 0 HG3 GLU B 109 23.609 -28.022 -22.136 1.00 24.89 H new ATOM 1507 N TYR B 110 24.664 -25.702 -17.484 1.00 22.72 N ATOM 1508 CA TYR B 110 24.209 -25.279 -16.162 1.00 22.00 C ATOM 1509 C TYR B 110 22.877 -24.544 -16.278 1.00 21.09 C ATOM 1510 O TYR B 110 22.523 -24.063 -17.353 1.00 20.78 O ATOM 1511 CB TYR B 110 25.252 -24.373 -15.496 1.00 21.98 C ATOM 1512 CG TYR B 110 26.602 -25.031 -15.295 1.00 22.41 C ATOM 1513 CD1 TYR B 110 26.860 -25.810 -14.174 1.00 22.68 C ATOM 1514 CD2 TYR B 110 27.618 -24.868 -16.227 1.00 22.67 C ATOM 1515 CE1 TYR B 110 28.095 -26.409 -13.991 1.00 23.17 C ATOM 1516 CE2 TYR B 110 28.854 -25.462 -16.051 1.00 23.17 C ATOM 1517 CZ TYR B 110 29.086 -26.230 -14.932 1.00 23.41 C ATOM 1518 OH TYR B 110 30.316 -26.828 -14.754 1.00 24.00 O ATOM 0 H TYR B 110 24.833 -24.934 -18.134 1.00 22.72 H new ATOM 0 HA TYR B 110 24.075 -26.166 -15.543 1.00 22.00 H new ATOM 0 HB2 TYR B 110 25.383 -23.478 -16.105 1.00 21.98 H new ATOM 0 HB3 TYR B 110 24.870 -24.047 -14.528 1.00 21.98 H new ATOM 0 HD1 TYR B 110 26.086 -25.951 -13.434 1.00 22.68 H new ATOM 0 HD2 TYR B 110 27.440 -24.266 -17.106 1.00 22.67 H new ATOM 0 HE1 TYR B 110 28.281 -27.013 -13.115 1.00 23.17 H new ATOM 0 HE2 TYR B 110 29.633 -25.324 -16.787 1.00 23.17 H new ATOM 0 HH TYR B 110 31.011 -26.279 -15.173 1.00 24.00 H new ATOM 1528 N GLU B 111 22.138 -24.456 -15.180 1.00 20.77 N ATOM 1529 CA GLU B 111 20.847 -23.777 -15.192 1.00 19.99 C ATOM 1530 C GLU B 111 20.897 -22.458 -14.434 1.00 19.16 C ATOM 1531 O GLU B 111 21.906 -22.122 -13.811 1.00 19.28 O ATOM 1532 CB GLU B 111 19.751 -24.680 -14.609 1.00 20.31 C ATOM 1533 CG GLU B 111 19.422 -25.878 -15.490 1.00 20.68 C ATOM 1534 CD GLU B 111 19.083 -25.485 -16.913 1.00 20.91 C ATOM 1535 OE1 GLU B 111 18.640 -24.337 -17.132 1.00 21.02 O1- ATOM 1536 OE2 GLU B 111 19.256 -26.324 -17.823 1.00 21.10 O ATOM 0 H GLU B 111 22.407 -24.843 -14.275 1.00 20.77 H new ATOM 0 HA GLU B 111 20.608 -23.557 -16.232 1.00 19.99 H new ATOM 0 HB2 GLU B 111 20.067 -25.036 -13.628 1.00 20.31 H new ATOM 0 HB3 GLU B 111 18.847 -24.090 -14.458 1.00 20.31 H new ATOM 0 HG2 GLU B 111 20.272 -26.561 -15.499 1.00 20.68 H new ATOM 0 HG3 GLU B 111 18.581 -26.421 -15.058 1.00 20.68 H new ATOM 1543 N ASN B 112 19.805 -21.711 -14.507 1.00 18.42 N ATOM 1544 CA ASN B 112 19.698 -20.421 -13.838 1.00 17.65 C ATOM 1545 C ASN B 112 18.723 -20.511 -12.670 1.00 16.89 C ATOM 1546 O ASN B 112 18.324 -21.604 -12.273 1.00 16.78 O ATOM 1547 CB ASN B 112 19.218 -19.348 -14.817 1.00 17.58 C ATOM 1548 CG ASN B 112 20.151 -19.163 -15.994 1.00 17.23 C ATOM 1549 OD1 ASN B 112 21.166 -18.476 -15.889 1.00 17.01 O ATOM 1550 ND2 ASN B 112 19.810 -19.755 -17.131 1.00 17.33 N ATOM 0 H ASN B 112 18.971 -21.980 -15.029 1.00 18.42 H new ATOM 0 HA ASN B 112 20.685 -20.148 -13.465 1.00 17.65 H new ATOM 0 HB2 ASN B 112 18.227 -19.616 -15.184 1.00 17.58 H new ATOM 0 HB3 ASN B 112 19.117 -18.400 -14.288 1.00 17.58 H new ATOM 0 HD21 ASN B 112 20.398 -19.648 -17.958 1.00 17.33 H new ATOM 0 HD22 ASN B 112 18.960 -20.317 -17.178 1.00 17.33 H new ATOM 1557 N LEU B 113 18.334 -19.363 -12.127 1.00 16.49 N ATOM 1558 CA LEU B 113 17.395 -19.324 -11.012 1.00 15.86 C ATOM 1559 C LEU B 113 16.091 -18.676 -11.455 1.00 15.11 C ATOM 1560 O LEU B 113 16.072 -17.914 -12.423 1.00 15.28 O ATOM 1561 CB LEU B 113 17.994 -18.546 -9.833 1.00 16.39 C ATOM 1562 CG LEU B 113 19.339 -19.067 -9.329 1.00 16.71 C ATOM 1563 CD1 LEU B 113 19.876 -18.172 -8.223 1.00 17.03 C ATOM 1564 CD2 LEU B 113 19.218 -20.507 -8.849 1.00 17.03 C ATOM 0 H LEU B 113 18.654 -18.447 -12.441 1.00 16.49 H new ATOM 0 HA LEU B 113 17.195 -20.345 -10.688 1.00 15.86 H new ATOM 0 HB2 LEU B 113 18.113 -17.504 -10.129 1.00 16.39 H new ATOM 0 HB3 LEU B 113 17.283 -18.564 -9.007 1.00 16.39 H new ATOM 0 HG LEU B 113 20.045 -19.048 -10.159 1.00 16.71 H new ATOM 0 HD11 LEU B 113 20.834 -18.558 -7.876 1.00 17.03 H new ATOM 0 HD12 LEU B 113 20.009 -17.160 -8.606 1.00 17.03 H new ATOM 0 HD13 LEU B 113 19.169 -18.155 -7.393 1.00 17.03 H new ATOM 0 HD21 LEU B 113 20.188 -20.855 -8.495 1.00 17.03 H new ATOM 0 HD22 LEU B 113 18.495 -20.560 -8.035 1.00 17.03 H new ATOM 0 HD23 LEU B 113 18.884 -21.138 -9.673 1.00 17.03 H new ATOM 1576 N GLU B 114 15.012 -18.968 -10.741 1.00 14.37 N ATOM 1577 CA GLU B 114 13.707 -18.411 -11.077 1.00 13.68 C ATOM 1578 C GLU B 114 13.379 -17.224 -10.176 1.00 13.12 C ATOM 1579 O GLU B 114 14.241 -16.758 -9.420 1.00 13.03 O ATOM 1580 CB GLU B 114 12.625 -19.489 -10.995 1.00 13.43 C ATOM 1581 CG GLU B 114 12.844 -20.601 -12.007 1.00 13.57 C ATOM 1582 CD GLU B 114 11.580 -21.349 -12.372 1.00 13.68 C ATOM 1583 OE1 GLU B 114 10.502 -20.724 -12.417 1.00 13.80 O1- ATOM 1584 OE2 GLU B 114 11.669 -22.567 -12.627 1.00 13.83 O ATOM 0 H GLU B 114 15.013 -19.585 -9.929 1.00 14.37 H new ATOM 0 HA GLU B 114 13.739 -18.048 -12.104 1.00 13.68 H new ATOM 0 HB2 GLU B 114 12.611 -19.912 -9.990 1.00 13.43 H new ATOM 0 HB3 GLU B 114 11.649 -19.035 -11.163 1.00 13.43 H new ATOM 0 HG2 GLU B 114 13.278 -20.176 -12.912 1.00 13.57 H new ATOM 0 HG3 GLU B 114 13.571 -21.307 -11.606 1.00 13.57 H new ATOM 1591 N ASP B 115 12.133 -16.751 -10.236 1.00 12.91 N ATOM 1592 CA ASP B 115 11.711 -15.570 -9.460 1.00 12.53 C ATOM 1593 C ASP B 115 10.304 -15.692 -8.855 1.00 11.84 C ATOM 1594 O ASP B 115 9.404 -14.922 -9.181 1.00 11.73 O ATOM 1595 CB ASP B 115 11.801 -14.287 -10.298 1.00 13.18 C ATOM 1596 CG ASP B 115 11.628 -13.036 -9.456 1.00 13.20 C ATOM 1597 OD1 ASP B 115 12.618 -12.582 -8.844 1.00 13.29 O1- ATOM 1598 OD2 ASP B 115 10.502 -12.497 -9.400 1.00 13.30 O ATOM 0 H ASP B 115 11.396 -17.162 -10.810 1.00 12.91 H new ATOM 0 HA ASP B 115 12.412 -15.515 -8.627 1.00 12.53 H new ATOM 0 HB2 ASP B 115 12.767 -14.252 -10.802 1.00 13.18 H new ATOM 0 HB3 ASP B 115 11.036 -14.308 -11.074 1.00 13.18 H new ATOM 1603 N ASN B 116 10.072 -16.704 -8.039 1.00 11.51 N ATOM 1604 CA ASN B 116 8.764 -16.852 -7.389 1.00 10.99 C ATOM 1605 C ASN B 116 8.615 -15.825 -6.246 1.00 10.00 C ATOM 1606 O ASN B 116 8.168 -16.151 -5.149 1.00 9.54 O ATOM 1607 CB ASN B 116 8.588 -18.264 -6.840 1.00 11.43 C ATOM 1608 CG ASN B 116 7.176 -18.518 -6.363 1.00 11.80 C ATOM 1609 OD1 ASN B 116 6.215 -18.044 -6.961 1.00 12.04 O ATOM 1610 ND2 ASN B 116 7.048 -19.249 -5.270 1.00 12.05 N ATOM 0 H ASN B 116 10.752 -17.428 -7.808 1.00 11.51 H new ATOM 0 HA ASN B 116 7.992 -16.670 -8.137 1.00 10.99 H new ATOM 0 HB2 ASN B 116 8.844 -18.988 -7.614 1.00 11.43 H new ATOM 0 HB3 ASN B 116 9.282 -18.421 -6.015 1.00 11.43 H new ATOM 0 HD21 ASN B 116 6.121 -19.440 -4.890 1.00 12.05 H new ATOM 0 HD22 ASN B 116 7.876 -19.622 -4.806 1.00 12.05 H new ATOM 1617 N SER B 117 8.972 -14.573 -6.513 1.00 9.85 N ATOM 1618 CA SER B 117 8.905 -13.522 -5.505 1.00 9.09 C ATOM 1619 C SER B 117 7.501 -12.933 -5.374 1.00 8.48 C ATOM 1620 O SER B 117 7.213 -12.210 -4.419 1.00 7.94 O ATOM 1621 CB SER B 117 9.885 -12.403 -5.851 1.00 9.58 C ATOM 1622 OG SER B 117 11.167 -12.920 -6.167 1.00 10.42 O ATOM 0 H SER B 117 9.312 -14.261 -7.423 1.00 9.85 H new ATOM 0 HA SER B 117 9.170 -13.977 -4.551 1.00 9.09 H new ATOM 0 HB2 SER B 117 9.503 -11.831 -6.696 1.00 9.58 H new ATOM 0 HB3 SER B 117 9.965 -11.714 -5.010 1.00 9.58 H new ATOM 0 HG SER B 117 11.773 -12.181 -6.386 1.00 10.42 H new ATOM 1628 N LYS B 118 6.630 -13.240 -6.326 1.00 8.71 N ATOM 1629 CA LYS B 118 5.266 -12.714 -6.303 1.00 8.32 C ATOM 1630 C LYS B 118 4.459 -13.245 -5.114 1.00 7.50 C ATOM 1631 O LYS B 118 3.455 -12.650 -4.721 1.00 7.07 O ATOM 1632 CB LYS B 118 4.548 -13.048 -7.607 1.00 9.09 C ATOM 1633 CG LYS B 118 3.375 -12.127 -7.891 1.00 9.49 C ATOM 1634 CD LYS B 118 2.476 -12.672 -8.982 1.00 10.17 C ATOM 1635 CE LYS B 118 1.397 -11.666 -9.366 1.00 10.68 C ATOM 1636 NZ LYS B 118 0.464 -11.370 -8.239 1.00 11.16 N1+ ATOM 0 H LYS B 118 6.838 -13.846 -7.120 1.00 8.71 H new ATOM 0 HA LYS B 118 5.341 -11.632 -6.193 1.00 8.32 H new ATOM 0 HB2 LYS B 118 5.258 -12.988 -8.432 1.00 9.09 H new ATOM 0 HB3 LYS B 118 4.193 -14.078 -7.566 1.00 9.09 H new ATOM 0 HG2 LYS B 118 2.795 -11.988 -6.979 1.00 9.49 H new ATOM 0 HG3 LYS B 118 3.748 -11.146 -8.185 1.00 9.49 H new ATOM 0 HD2 LYS B 118 3.074 -12.919 -9.859 1.00 10.17 H new ATOM 0 HD3 LYS B 118 2.009 -13.597 -8.643 1.00 10.17 H new ATOM 0 HE2 LYS B 118 1.869 -10.740 -9.696 1.00 10.68 H new ATOM 0 HE3 LYS B 118 0.829 -12.053 -10.212 1.00 10.68 H new ATOM 0 HZ1 LYS B 118 -0.299 -10.748 -8.574 1.00 11.16 H new ATOM 0 HZ2 LYS B 118 0.056 -12.258 -7.884 1.00 11.16 H new ATOM 0 HZ3 LYS B 118 0.984 -10.897 -7.472 1.00 11.16 H new ATOM 1650 N GLU B 119 4.904 -14.352 -4.534 1.00 7.48 N ATOM 1651 CA GLU B 119 4.201 -14.950 -3.403 1.00 6.99 C ATOM 1652 C GLU B 119 4.685 -14.382 -2.071 1.00 6.13 C ATOM 1653 O GLU B 119 4.663 -15.067 -1.046 1.00 5.77 O ATOM 1654 CB GLU B 119 4.368 -16.473 -3.417 1.00 7.65 C ATOM 1655 CG GLU B 119 3.835 -17.125 -4.679 1.00 8.43 C ATOM 1656 CD GLU B 119 3.480 -18.583 -4.477 1.00 9.01 C ATOM 1657 OE1 GLU B 119 4.379 -19.445 -4.595 1.00 9.34 O ATOM 1658 OE2 GLU B 119 2.300 -18.873 -4.199 1.00 9.37 O1- ATOM 0 H GLU B 119 5.744 -14.853 -4.825 1.00 7.48 H new ATOM 0 HA GLU B 119 3.144 -14.703 -3.506 1.00 6.99 H new ATOM 0 HB2 GLU B 119 5.425 -16.716 -3.310 1.00 7.65 H new ATOM 0 HB3 GLU B 119 3.854 -16.896 -2.554 1.00 7.65 H new ATOM 0 HG2 GLU B 119 2.952 -16.584 -5.018 1.00 8.43 H new ATOM 0 HG3 GLU B 119 4.582 -17.043 -5.469 1.00 8.43 H new ATOM 1665 N TRP B 120 5.116 -13.130 -2.083 1.00 6.01 N ATOM 1666 CA TRP B 120 5.581 -12.481 -0.866 1.00 5.38 C ATOM 1667 C TRP B 120 4.726 -11.262 -0.541 1.00 4.90 C ATOM 1668 O TRP B 120 4.336 -11.056 0.607 1.00 4.43 O ATOM 1669 CB TRP B 120 7.050 -12.076 -0.993 1.00 5.80 C ATOM 1670 CG TRP B 120 8.004 -13.201 -0.734 1.00 5.98 C ATOM 1671 CD1 TRP B 120 8.503 -14.080 -1.650 1.00 6.39 C ATOM 1672 CD2 TRP B 120 8.571 -13.571 0.529 1.00 6.18 C ATOM 1673 NE1 TRP B 120 9.349 -14.971 -1.037 1.00 6.78 N ATOM 1674 CE2 TRP B 120 9.409 -14.679 0.300 1.00 6.64 C ATOM 1675 CE3 TRP B 120 8.458 -13.074 1.831 1.00 6.35 C ATOM 1676 CZ2 TRP B 120 10.130 -15.292 1.320 1.00 7.17 C ATOM 1677 CZ3 TRP B 120 9.170 -13.685 2.843 1.00 6.93 C ATOM 1678 CH2 TRP B 120 9.999 -14.785 2.583 1.00 7.28 C ATOM 0 H TRP B 120 5.154 -12.545 -2.918 1.00 6.01 H new ATOM 0 HA TRP B 120 5.488 -13.197 -0.049 1.00 5.38 H new ATOM 0 HB2 TRP B 120 7.226 -11.685 -1.995 1.00 5.80 H new ATOM 0 HB3 TRP B 120 7.257 -11.266 -0.294 1.00 5.80 H new ATOM 0 HD1 TRP B 120 8.267 -14.076 -2.704 1.00 6.39 H new ATOM 0 HE1 TRP B 120 9.851 -15.727 -1.502 1.00 6.78 H new ATOM 0 HE3 TRP B 120 7.824 -12.226 2.041 1.00 6.35 H new ATOM 0 HZ2 TRP B 120 10.771 -16.138 1.121 1.00 7.17 H new ATOM 0 HZ3 TRP B 120 9.087 -13.309 3.852 1.00 6.93 H new ATOM 0 HH2 TRP B 120 10.545 -15.241 3.396 1.00 7.28 H new ATOM 1689 N THR B 121 4.411 -10.467 -1.559 1.00 5.33 N ATOM 1690 CA THR B 121 3.606 -9.266 -1.374 1.00 5.34 C ATOM 1691 C THR B 121 2.156 -9.595 -1.015 1.00 5.03 C ATOM 1692 O THR B 121 1.391 -8.710 -0.649 1.00 5.08 O ATOM 1693 CB THR B 121 3.627 -8.390 -2.637 1.00 6.28 C ATOM 1694 OG1 THR B 121 4.450 -9.018 -3.632 1.00 6.81 O ATOM 1695 CG2 THR B 121 4.157 -6.990 -2.329 1.00 6.77 C ATOM 0 H THR B 121 4.702 -10.634 -2.522 1.00 5.33 H new ATOM 0 HA THR B 121 4.051 -8.719 -0.542 1.00 5.34 H new ATOM 0 HB THR B 121 2.607 -8.287 -3.008 1.00 6.28 H new ATOM 0 HG1 THR B 121 3.941 -9.728 -4.077 1.00 6.81 H new ATOM 0 HG21 THR B 121 4.160 -6.393 -3.241 1.00 6.77 H new ATOM 0 HG22 THR B 121 3.517 -6.514 -1.586 1.00 6.77 H new ATOM 0 HG23 THR B 121 5.172 -7.063 -1.940 1.00 6.77 H new ATOM 1703 N SER B 122 1.782 -10.866 -1.110 1.00 5.01 N ATOM 1704 CA SER B 122 0.429 -11.293 -0.779 1.00 4.99 C ATOM 1705 C SER B 122 0.148 -11.087 0.710 1.00 4.55 C ATOM 1706 O SER B 122 -1.002 -11.044 1.141 1.00 4.76 O ATOM 1707 CB SER B 122 0.248 -12.762 -1.156 1.00 5.61 C ATOM 1708 OG SER B 122 1.486 -13.339 -1.548 1.00 6.23 O ATOM 0 H SER B 122 2.399 -11.619 -1.414 1.00 5.01 H new ATOM 0 HA SER B 122 -0.280 -10.689 -1.345 1.00 4.99 H new ATOM 0 HB2 SER B 122 -0.162 -13.312 -0.309 1.00 5.61 H new ATOM 0 HB3 SER B 122 -0.472 -12.847 -1.970 1.00 5.61 H new ATOM 0 HG SER B 122 1.348 -14.280 -1.784 1.00 6.23 H new ATOM 1714 N LEU B 123 1.218 -10.954 1.482 1.00 4.24 N ATOM 1715 CA LEU B 123 1.115 -10.750 2.919 1.00 4.22 C ATOM 1716 C LEU B 123 1.562 -9.339 3.286 1.00 4.10 C ATOM 1717 O LEU B 123 1.911 -9.068 4.431 1.00 4.50 O ATOM 1718 CB LEU B 123 1.984 -11.775 3.655 1.00 4.40 C ATOM 1719 CG LEU B 123 1.942 -13.193 3.083 1.00 5.14 C ATOM 1720 CD1 LEU B 123 3.114 -14.012 3.602 1.00 5.74 C ATOM 1721 CD2 LEU B 123 0.627 -13.870 3.428 1.00 5.71 C ATOM 0 H LEU B 123 2.176 -10.984 1.132 1.00 4.24 H new ATOM 0 HA LEU B 123 0.075 -10.880 3.217 1.00 4.22 H new ATOM 0 HB2 LEU B 123 3.017 -11.426 3.645 1.00 4.40 H new ATOM 0 HB3 LEU B 123 1.670 -11.812 4.698 1.00 4.40 H new ATOM 0 HG LEU B 123 2.020 -13.127 1.998 1.00 5.14 H new ATOM 0 HD11 LEU B 123 3.068 -15.018 3.185 1.00 5.74 H new ATOM 0 HD12 LEU B 123 4.049 -13.538 3.304 1.00 5.74 H new ATOM 0 HD13 LEU B 123 3.066 -14.068 4.690 1.00 5.74 H new ATOM 0 HD21 LEU B 123 0.616 -14.878 3.012 1.00 5.71 H new ATOM 0 HD22 LEU B 123 0.518 -13.923 4.511 1.00 5.71 H new ATOM 0 HD23 LEU B 123 -0.199 -13.296 3.008 1.00 5.71 H new ATOM 1733 N PHE B 124 1.550 -8.445 2.304 1.00 4.01 N ATOM 1734 CA PHE B 124 1.973 -7.064 2.518 1.00 4.44 C ATOM 1735 C PHE B 124 1.118 -6.090 1.710 1.00 4.95 C ATOM 1736 O PHE B 124 0.468 -5.207 2.268 1.00 5.55 O ATOM 1737 CB PHE B 124 3.444 -6.889 2.111 1.00 4.64 C ATOM 1738 CG PHE B 124 4.432 -7.515 3.055 1.00 4.77 C ATOM 1739 CD1 PHE B 124 4.701 -6.931 4.282 1.00 5.23 C ATOM 1740 CD2 PHE B 124 5.092 -8.684 2.713 1.00 4.93 C ATOM 1741 CE1 PHE B 124 5.612 -7.502 5.150 1.00 5.76 C ATOM 1742 CE2 PHE B 124 6.003 -9.260 3.575 1.00 5.43 C ATOM 1743 CZ PHE B 124 6.264 -8.668 4.796 1.00 5.82 C ATOM 0 H PHE B 124 1.252 -8.651 1.351 1.00 4.01 H new ATOM 0 HA PHE B 124 1.851 -6.845 3.579 1.00 4.44 H new ATOM 0 HB2 PHE B 124 3.587 -7.318 1.119 1.00 4.64 H new ATOM 0 HB3 PHE B 124 3.661 -5.824 2.032 1.00 4.64 H new ATOM 0 HD1 PHE B 124 4.193 -6.020 4.563 1.00 5.23 H new ATOM 0 HD2 PHE B 124 4.891 -9.150 1.760 1.00 4.93 H new ATOM 0 HE1 PHE B 124 5.814 -7.038 6.104 1.00 5.76 H new ATOM 0 HE2 PHE B 124 6.511 -10.171 3.296 1.00 5.43 H new ATOM 0 HZ PHE B 124 6.977 -9.116 5.473 1.00 5.82 H new ATOM 1753 N ASP B 125 1.127 -6.279 0.394 1.00 4.98 N ATOM 1754 CA ASP B 125 0.397 -5.423 -0.547 1.00 5.65 C ATOM 1755 C ASP B 125 -1.087 -5.346 -0.214 1.00 5.72 C ATOM 1756 O ASP B 125 -1.630 -4.263 0.004 1.00 6.24 O ATOM 1757 CB ASP B 125 0.587 -5.957 -1.974 1.00 5.98 C ATOM 1758 CG ASP B 125 0.011 -5.049 -3.043 1.00 6.71 C ATOM 1759 OD1 ASP B 125 0.417 -3.871 -3.116 1.00 7.12 O1- ATOM 1760 OD2 ASP B 125 -0.827 -5.528 -3.841 1.00 7.13 O ATOM 0 H ASP B 125 1.643 -7.034 -0.057 1.00 4.98 H new ATOM 0 HA ASP B 125 0.801 -4.414 -0.468 1.00 5.65 H new ATOM 0 HB2 ASP B 125 1.652 -6.096 -2.162 1.00 5.98 H new ATOM 0 HB3 ASP B 125 0.119 -6.938 -2.051 1.00 5.98 H new ATOM 1765 N ASN B 126 -1.738 -6.497 -0.170 1.00 5.46 N ATOM 1766 CA ASN B 126 -3.160 -6.557 0.125 1.00 5.77 C ATOM 1767 C ASN B 126 -3.564 -7.981 0.472 1.00 5.90 C ATOM 1768 O ASN B 126 -3.341 -8.903 -0.316 1.00 6.04 O ATOM 1769 CB ASN B 126 -3.969 -6.057 -1.079 1.00 5.95 C ATOM 1770 CG ASN B 126 -5.469 -6.128 -0.858 1.00 6.52 C ATOM 1771 OD1 ASN B 126 -6.069 -5.228 -0.268 1.00 6.97 O ATOM 1772 ND2 ASN B 126 -6.088 -7.192 -1.342 1.00 6.79 N ATOM 0 H ASN B 126 -1.303 -7.405 -0.335 1.00 5.46 H new ATOM 0 HA ASN B 126 -3.369 -5.915 0.981 1.00 5.77 H new ATOM 0 HB2 ASN B 126 -3.688 -5.026 -1.296 1.00 5.95 H new ATOM 0 HB3 ASN B 126 -3.708 -6.650 -1.956 1.00 5.95 H new ATOM 0 HD21 ASN B 126 -7.098 -7.288 -1.233 1.00 6.79 H new ATOM 0 HD22 ASN B 126 -5.556 -7.916 -1.825 1.00 6.79 H new ATOM 1779 N ASP B 127 -4.141 -8.156 1.653 1.00 6.22 N ATOM 1780 CA ASP B 127 -4.590 -9.471 2.108 1.00 6.72 C ATOM 1781 C ASP B 127 -5.740 -9.957 1.225 1.00 7.18 C ATOM 1782 O ASP B 127 -6.481 -9.143 0.672 1.00 7.47 O ATOM 1783 CB ASP B 127 -5.024 -9.393 3.576 1.00 7.18 C ATOM 1784 CG ASP B 127 -5.607 -10.693 4.103 1.00 7.84 C ATOM 1785 OD1 ASP B 127 -5.014 -11.765 3.859 1.00 8.20 O ATOM 1786 OD2 ASP B 127 -6.662 -10.639 4.778 1.00 8.25 O1- ATOM 0 H ASP B 127 -4.311 -7.402 2.318 1.00 6.22 H new ATOM 0 HA ASP B 127 -3.769 -10.184 2.030 1.00 6.72 H new ATOM 0 HB2 ASP B 127 -4.165 -9.115 4.187 1.00 7.18 H new ATOM 0 HB3 ASP B 127 -5.764 -8.600 3.687 1.00 7.18 H new ATOM 1791 N ILE B 128 -5.876 -11.276 1.094 1.00 7.53 N ATOM 1792 CA ILE B 128 -6.916 -11.881 0.257 1.00 8.22 C ATOM 1793 C ILE B 128 -8.304 -11.331 0.585 1.00 8.70 C ATOM 1794 O ILE B 128 -8.853 -11.582 1.661 1.00 8.87 O ATOM 1795 CB ILE B 128 -6.932 -13.421 0.382 1.00 8.70 C ATOM 1796 CG1 ILE B 128 -6.828 -13.854 1.848 1.00 8.64 C ATOM 1797 CG2 ILE B 128 -5.799 -14.025 -0.434 1.00 8.97 C ATOM 1798 CD1 ILE B 128 -7.287 -15.275 2.096 1.00 9.43 C ATOM 0 H ILE B 128 -5.273 -11.953 1.561 1.00 7.53 H new ATOM 0 HA ILE B 128 -6.668 -11.615 -0.771 1.00 8.22 H new ATOM 0 HB ILE B 128 -7.881 -13.787 -0.010 1.00 8.70 H new ATOM 0 HG12 ILE B 128 -5.793 -13.753 2.175 1.00 8.64 H new ATOM 0 HG13 ILE B 128 -7.423 -13.177 2.461 1.00 8.64 H new ATOM 0 HG21 ILE B 128 -5.820 -15.111 -0.338 1.00 8.97 H new ATOM 0 HG22 ILE B 128 -5.919 -13.751 -1.482 1.00 8.97 H new ATOM 0 HG23 ILE B 128 -4.845 -13.647 -0.067 1.00 8.97 H new ATOM 0 HD11 ILE B 128 -7.185 -15.511 3.155 1.00 9.43 H new ATOM 0 HD12 ILE B 128 -8.331 -15.377 1.801 1.00 9.43 H new ATOM 0 HD13 ILE B 128 -6.676 -15.962 1.511 1.00 9.43 H new ATOM 1810 N PRO B 129 -8.888 -10.568 -0.347 1.00 9.15 N ATOM 1811 CA PRO B 129 -10.204 -9.969 -0.162 1.00 9.85 C ATOM 1812 C PRO B 129 -11.340 -10.928 -0.509 1.00 10.63 C ATOM 1813 O PRO B 129 -11.659 -11.143 -1.685 1.00 11.00 O ATOM 1814 CB PRO B 129 -10.171 -8.787 -1.129 1.00 10.26 C ATOM 1815 CG PRO B 129 -9.253 -9.200 -2.231 1.00 9.98 C ATOM 1816 CD PRO B 129 -8.305 -10.227 -1.659 1.00 9.29 C ATOM 0 HA PRO B 129 -10.393 -9.690 0.875 1.00 9.85 H new ATOM 0 HB2 PRO B 129 -11.167 -8.564 -1.511 1.00 10.26 H new ATOM 0 HB3 PRO B 129 -9.810 -7.885 -0.635 1.00 10.26 H new ATOM 0 HG2 PRO B 129 -9.816 -9.618 -3.065 1.00 9.98 H new ATOM 0 HG3 PRO B 129 -8.703 -8.341 -2.617 1.00 9.98 H new ATOM 0 HD2 PRO B 129 -8.233 -11.104 -2.302 1.00 9.29 H new ATOM 0 HD3 PRO B 129 -7.298 -9.824 -1.554 1.00 9.29 H new ATOM 1824 N VAL B 130 -11.944 -11.505 0.515 1.00 11.05 N ATOM 1825 CA VAL B 130 -13.042 -12.441 0.321 1.00 11.95 C ATOM 1826 C VAL B 130 -14.385 -11.731 0.440 1.00 12.59 C ATOM 1827 O VAL B 130 -14.507 -10.728 1.144 1.00 12.77 O ATOM 1828 CB VAL B 130 -12.982 -13.609 1.329 1.00 12.34 C ATOM 1829 CG1 VAL B 130 -11.788 -14.504 1.030 1.00 12.40 C ATOM 1830 CG2 VAL B 130 -12.919 -13.091 2.759 1.00 12.18 C ATOM 0 H VAL B 130 -11.694 -11.343 1.491 1.00 11.05 H new ATOM 0 HA VAL B 130 -12.939 -12.851 -0.684 1.00 11.95 H new ATOM 0 HB VAL B 130 -13.893 -14.198 1.225 1.00 12.34 H new ATOM 0 HG11 VAL B 130 -11.758 -15.323 1.749 1.00 12.40 H new ATOM 0 HG12 VAL B 130 -11.880 -14.909 0.022 1.00 12.40 H new ATOM 0 HG13 VAL B 130 -10.869 -13.922 1.105 1.00 12.40 H new ATOM 0 HG21 VAL B 130 -12.877 -13.933 3.450 1.00 12.18 H new ATOM 0 HG22 VAL B 130 -12.028 -12.475 2.884 1.00 12.18 H new ATOM 0 HG23 VAL B 130 -13.806 -12.493 2.969 1.00 12.18 H new ATOM 1840 N THR B 131 -15.385 -12.244 -0.256 1.00 13.10 N ATOM 1841 CA THR B 131 -16.710 -11.655 -0.231 1.00 13.88 C ATOM 1842 C THR B 131 -17.777 -12.743 -0.135 1.00 14.63 C ATOM 1843 O THR B 131 -17.603 -13.842 -0.667 1.00 14.78 O ATOM 1844 CB THR B 131 -16.955 -10.777 -1.481 1.00 14.08 C ATOM 1845 OG1 THR B 131 -18.252 -10.164 -1.422 1.00 14.22 O ATOM 1846 CG2 THR B 131 -16.833 -11.592 -2.760 1.00 14.14 C ATOM 0 H THR B 131 -15.302 -13.071 -0.847 1.00 13.10 H new ATOM 0 HA THR B 131 -16.775 -11.018 0.651 1.00 13.88 H new ATOM 0 HB THR B 131 -16.191 -10.000 -1.491 1.00 14.08 H new ATOM 0 HG1 THR B 131 -18.389 -9.611 -2.219 1.00 14.22 H new ATOM 0 HG21 THR B 131 -17.010 -10.947 -3.621 1.00 14.14 H new ATOM 0 HG22 THR B 131 -15.832 -12.018 -2.826 1.00 14.14 H new ATOM 0 HG23 THR B 131 -17.569 -12.396 -2.751 1.00 14.14 H new ATOM 1854 N THR B 132 -18.858 -12.449 0.571 1.00 15.25 N ATOM 1855 CA THR B 132 -19.946 -13.399 0.733 1.00 16.11 C ATOM 1856 C THR B 132 -20.800 -13.454 -0.531 1.00 16.43 C ATOM 1857 O THR B 132 -21.345 -12.441 -0.966 1.00 16.63 O ATOM 1858 CB THR B 132 -20.829 -13.017 1.934 1.00 16.66 C ATOM 1859 OG1 THR B 132 -20.004 -12.577 3.024 1.00 16.38 O ATOM 1860 CG2 THR B 132 -21.677 -14.195 2.377 1.00 17.36 C ATOM 0 H THR B 132 -19.005 -11.556 1.042 1.00 15.25 H new ATOM 0 HA THR B 132 -19.510 -14.381 0.913 1.00 16.11 H new ATOM 0 HB THR B 132 -21.493 -12.208 1.629 1.00 16.66 H new ATOM 0 HG1 THR B 132 -20.571 -12.333 3.786 1.00 16.38 H new ATOM 0 HG21 THR B 132 -22.293 -13.901 3.227 1.00 17.36 H new ATOM 0 HG22 THR B 132 -22.320 -14.510 1.555 1.00 17.36 H new ATOM 0 HG23 THR B 132 -21.028 -15.021 2.667 1.00 17.36 H new ATOM 1868 N ASP B 133 -20.911 -14.641 -1.114 1.00 16.62 N ATOM 1869 CA ASP B 133 -21.691 -14.817 -2.332 1.00 17.09 C ATOM 1870 C ASP B 133 -23.145 -15.128 -1.997 1.00 18.05 C ATOM 1871 O ASP B 133 -24.066 -14.674 -2.678 1.00 18.48 O ATOM 1872 CB ASP B 133 -21.104 -15.941 -3.193 1.00 16.97 C ATOM 1873 CG ASP B 133 -21.818 -16.088 -4.522 1.00 16.91 C ATOM 1874 OD1 ASP B 133 -21.529 -15.301 -5.447 1.00 16.99 O1- ATOM 1875 OD2 ASP B 133 -22.677 -16.990 -4.653 1.00 16.92 O ATOM 0 H ASP B 133 -20.473 -15.493 -0.765 1.00 16.62 H new ATOM 0 HA ASP B 133 -21.650 -13.885 -2.896 1.00 17.09 H new ATOM 0 HB2 ASP B 133 -20.047 -15.743 -3.372 1.00 16.97 H new ATOM 0 HB3 ASP B 133 -21.164 -16.882 -2.646 1.00 16.97 H new ATOM 1880 N ASP B 134 -23.345 -15.896 -0.938 1.00 18.48 N ATOM 1881 CA ASP B 134 -24.681 -16.271 -0.504 1.00 19.48 C ATOM 1882 C ASP B 134 -24.880 -15.932 0.968 1.00 20.00 C ATOM 1883 O ASP B 134 -25.533 -14.907 1.260 1.00 20.13 O ATOM 1884 CB ASP B 134 -24.919 -17.763 -0.738 1.00 19.84 C ATOM 1885 CG ASP B 134 -26.305 -18.203 -0.311 1.00 20.68 C ATOM 1886 OD1 ASP B 134 -27.295 -17.592 -0.767 1.00 20.91 O ATOM 1887 OD2 ASP B 134 -26.412 -19.170 0.472 1.00 21.19 O1- ATOM 1888 OXT ASP B 134 -24.377 -16.685 1.826 1.00 20.39 O1- ATOM 0 H ASP B 134 -22.594 -16.274 -0.360 1.00 18.48 H new ATOM 0 HA ASP B 134 -25.404 -15.705 -1.092 1.00 19.48 H new ATOM 0 HB2 ASP B 134 -24.779 -17.989 -1.795 1.00 19.84 H new ATOM 0 HB3 ASP B 134 -24.173 -18.337 -0.188 1.00 19.84 H new TER 1893 ASP B 134