USER MOD reduce.3.24.130724 H: found=0, std=0, add=1400, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1398 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 5 TYR OH : rot -167:sc= 1.11 USER MOD Set 1.2: B 200 GLN : amide:sc= 0.733 K(o=1.8,f=-1.5) USER MOD Set 2.1: B 150 ASN : amide:sc= 1.09 K(o=0.74,f=-0.39) USER MOD Set 2.2: B 151 HIS : no HD1:sc= -0.35 K(o=0.74,f=-0.39) USER MOD Set 3.1: B 121 ASN : amide:sc= 0.917 K(o=3.1,f=-4.3!) USER MOD Set 3.2: B 124 LYS NZ :NH3+ 163:sc= 0.838! (180deg=-0.406!) USER MOD Set 3.3: B 182 TYR OH : rot -35:sc= 1.37 USER MOD Set 4.1: A 97 GLN : amide:sc= 0.742 K(o=2,f=1.5) USER MOD Set 4.2: B 108 TYR OH : rot 173:sc= 1.29 USER MOD Set 5.1: A 65 ASN : amide:sc= 1.14 K(o=2,f=-0.0031) USER MOD Set 5.2: A 69 ASN : amide:sc= 0.895 K(o=2,f=0.67) USER MOD Set 6.1: A 47 ASN : amide:sc= 0.45 K(o=0.51,f=-0.82) USER MOD Set 6.2: A 48 HIS : no HD1:sc= 0.0601 K(o=0.51,f=-1.3) USER MOD Set 7.1: A 18 ASN : amide:sc= 1.03 K(o=3.2,f=0.047) USER MOD Set 7.2: A 21 LYS NZ :NH3+ 152:sc= 2.13 (180deg=0.676) USER MOD Set 7.3: A 79 TYR OH : rot 165:sc= 0 USER MOD Single : A 6 THR OG1 : rot -143:sc= 1.25 USER MOD Single : A 10 LYS NZ :NH3+ 161:sc= 0.567 (180deg=-0.929!) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 174:sc= -0.0284 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -165:sc= 3.14 (180deg=2.63) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 41 MET CE :methyl 161:sc= -0.142 (180deg=-0.913) USER MOD Single : A 43 GLN : amide:sc= 0.124 K(o=0.12,f=-6.1!) USER MOD Single : A 44 LYS NZ :NH3+ -147:sc= 0.571 (180deg=0.311) USER MOD Single : A 49 MET CE :methyl -121:sc= -0.989 (180deg=-3.5) USER MOD Single : A 51 SER OG : rot 48:sc= 1.1 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= 0.67 K(o=0.67,f=-2.6!) USER MOD Single : A 57 LYS NZ :NH3+ -168:sc= 1.25 (180deg=1.18) USER MOD Single : A 61 LYS NZ :NH3+ -127:sc= -0.0907 (180deg=-0.732) USER MOD Single : A 64 GLN : amide:sc= -0.481 X(o=-0.48,f=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 171:sc= 0.474 (180deg=0.308) USER MOD Single : A 95 HIS : no HD1:sc= -0.192 X(o=-0.19,f=-0.5) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 109 THR OG1 : rot -130:sc= 1.27 USER MOD Single : B 113 LYS NZ :NH3+ 170:sc= 1.21 (180deg=0.746) USER MOD Single : B 123 TYR OH : rot 180:sc= 0 USER MOD Single : B 125 TYR OH : rot 150:sc= -0.0106 USER MOD Single : B 137 SER OG : rot 180:sc= 0 USER MOD Single : B 138 LYS NZ :NH3+ -150:sc= 2.54 (180deg=0.796) USER MOD Single : B 139 SER OG : rot 180:sc= 0.0486 USER MOD Single : B 140 SER OG : rot 180:sc= 0 USER MOD Single : B 144 MET CE :methyl 162:sc= -0.757 (180deg=-1.36) USER MOD Single : B 146 GLN : amide:sc= 0.453 K(o=0.45,f=-3.6!) USER MOD Single : B 147 LYS NZ :NH3+ -168:sc= 1.21 (180deg=1.07) USER MOD Single : B 152 MET CE :methyl 178:sc= -0.762 (180deg=-0.774) USER MOD Single : B 154 SER OG : rot 54:sc= 1.13 USER MOD Single : B 156 THR OG1 : rot 180:sc= 0 USER MOD Single : B 158 ASN : amide:sc= 0.778 K(o=0.78,f=-3.2!) USER MOD Single : B 160 LYS NZ :NH3+ 170:sc= 1.23 (180deg=1.15) USER MOD Single : B 164 LYS NZ :NH3+ -138:sc= -0.394 (180deg=-0.771) USER MOD Single : B 167 GLN : amide:sc= -0.0105 X(o=-0.01,f=0) USER MOD Single : B 168 ASN : amide:sc= -0.608 K(o=-0.61,f=-0.062) USER MOD Single : B 172 ASN : amide:sc= 0.48 K(o=0.48,f=-0.39) USER MOD Single : B 173 HIS : no HD1:sc= -0.553 X(o=-0.55,f=-0.56) USER MOD Single : B 178 SER OG : rot 55:sc= 0.0558 USER MOD Single : B 184 THR OG1 : rot 180:sc= 0 USER MOD Single : B 190 THR OG1 : rot 180:sc= 0 USER MOD Single : B 195 LYS NZ :NH3+ 175:sc= 1.24 (180deg=1.03) USER MOD Single : B 198 HIS : no HD1:sc= -0.0379 X(o=-0.038,f=0) USER MOD Single : B 202 GLN : amide:sc= 0.435 X(o=0.43,f=0) USER MOD Single : B 203 GLN : amide:sc= 0.705 K(o=0.7,f=0) USER MOD ----------------------------------------------------------------- ATOM 37 N TYR A 5 -14.616 10.328 4.806 1.00 1.77 N ATOM 38 CA TYR A 5 -13.442 9.449 4.672 1.00 1.47 C ATOM 39 C TYR A 5 -12.115 10.222 4.423 1.00 1.36 C ATOM 40 O TYR A 5 -12.056 11.082 3.535 1.00 1.61 O ATOM 41 CB TYR A 5 -13.757 8.433 3.556 1.00 1.66 C ATOM 42 CG TYR A 5 -14.830 7.365 3.816 1.00 1.58 C ATOM 43 CD1 TYR A 5 -15.787 7.465 4.855 1.00 2.21 C ATOM 44 CD2 TYR A 5 -14.874 6.235 2.971 1.00 2.43 C ATOM 45 CE1 TYR A 5 -16.763 6.468 5.024 1.00 2.27 C ATOM 46 CE2 TYR A 5 -15.826 5.212 3.157 1.00 2.43 C ATOM 47 CZ TYR A 5 -16.787 5.337 4.184 1.00 1.67 C ATOM 48 OH TYR A 5 -17.757 4.406 4.396 1.00 1.84 O ATOM 0 HA TYR A 5 -13.265 8.932 5.615 1.00 1.47 H new ATOM 0 HB2 TYR A 5 -14.057 8.995 2.672 1.00 1.66 H new ATOM 0 HB3 TYR A 5 -12.830 7.917 3.307 1.00 1.66 H new ATOM 0 HD1 TYR A 5 -15.767 8.314 5.523 1.00 2.21 H new ATOM 0 HD2 TYR A 5 -14.162 6.152 2.163 1.00 2.43 H new ATOM 0 HE1 TYR A 5 -17.502 6.570 5.805 1.00 2.27 H new ATOM 0 HE2 TYR A 5 -15.820 4.340 2.520 1.00 2.43 H new ATOM 0 HH TYR A 5 -17.543 3.591 3.896 1.00 1.84 H new ATOM 58 N THR A 6 -11.048 9.924 5.189 1.00 1.16 N ATOM 59 CA THR A 6 -9.742 10.640 5.161 1.00 1.00 C ATOM 60 C THR A 6 -8.961 10.356 3.873 1.00 0.84 C ATOM 61 O THR A 6 -9.213 9.336 3.243 1.00 0.91 O ATOM 62 CB THR A 6 -8.875 10.287 6.385 1.00 0.95 C ATOM 63 OG1 THR A 6 -8.331 9.000 6.208 1.00 1.14 O ATOM 64 CG2 THR A 6 -9.632 10.331 7.714 1.00 1.20 C ATOM 0 H THR A 6 -11.063 9.160 5.865 1.00 1.16 H new ATOM 0 HA THR A 6 -9.974 11.704 5.193 1.00 1.00 H new ATOM 0 HB THR A 6 -8.097 11.048 6.445 1.00 0.95 H new ATOM 0 HG1 THR A 6 -8.309 8.533 7.069 1.00 1.14 H new ATOM 0 HG21 THR A 6 -8.955 10.071 8.527 1.00 1.20 H new ATOM 0 HG22 THR A 6 -10.025 11.335 7.876 1.00 1.20 H new ATOM 0 HG23 THR A 6 -10.457 9.619 7.687 1.00 1.20 H new ATOM 72 N GLU A 7 -7.991 11.192 3.466 1.00 0.79 N ATOM 73 CA GLU A 7 -7.262 10.950 2.221 1.00 0.73 C ATOM 74 C GLU A 7 -6.492 9.637 2.231 1.00 0.67 C ATOM 75 O GLU A 7 -6.515 8.933 1.234 1.00 0.83 O ATOM 76 CB GLU A 7 -6.288 12.094 1.907 1.00 0.76 C ATOM 77 CG GLU A 7 -5.829 12.046 0.440 1.00 0.82 C ATOM 78 CD GLU A 7 -7.032 12.179 -0.492 1.00 1.31 C ATOM 79 OE1 GLU A 7 -7.822 13.135 -0.318 1.00 2.06 O ATOM 80 OE2 GLU A 7 -7.350 11.205 -1.206 1.00 2.37 O ATOM 0 H GLU A 7 -7.701 12.027 3.975 1.00 0.79 H new ATOM 0 HA GLU A 7 -8.025 10.893 1.445 1.00 0.73 H new ATOM 0 HB2 GLU A 7 -6.769 13.051 2.109 1.00 0.76 H new ATOM 0 HB3 GLU A 7 -5.421 12.028 2.564 1.00 0.76 H new ATOM 0 HG2 GLU A 7 -5.119 12.850 0.247 1.00 0.82 H new ATOM 0 HG3 GLU A 7 -5.309 11.108 0.244 1.00 0.82 H new ATOM 87 N LEU A 8 -5.868 9.267 3.354 1.00 0.58 N ATOM 88 CA LEU A 8 -5.190 7.978 3.501 1.00 0.54 C ATOM 89 C LEU A 8 -6.170 6.820 3.232 1.00 0.51 C ATOM 90 O LEU A 8 -5.888 5.899 2.463 1.00 0.48 O ATOM 91 CB LEU A 8 -4.604 7.922 4.926 1.00 0.59 C ATOM 92 CG LEU A 8 -3.302 7.115 5.060 1.00 0.55 C ATOM 93 CD1 LEU A 8 -2.974 6.946 6.547 1.00 0.77 C ATOM 94 CD2 LEU A 8 -3.340 5.733 4.402 1.00 0.57 C ATOM 0 H LEU A 8 -5.820 9.854 4.187 1.00 0.58 H new ATOM 0 HA LEU A 8 -4.385 7.874 2.774 1.00 0.54 H new ATOM 0 HB2 LEU A 8 -4.420 8.941 5.267 1.00 0.59 H new ATOM 0 HB3 LEU A 8 -5.351 7.492 5.594 1.00 0.59 H new ATOM 0 HG LEU A 8 -2.536 7.683 4.532 1.00 0.55 H new ATOM 0 HD11 LEU A 8 -2.052 6.375 6.654 1.00 0.77 H new ATOM 0 HD12 LEU A 8 -2.848 7.927 7.006 1.00 0.77 H new ATOM 0 HD13 LEU A 8 -3.788 6.416 7.041 1.00 0.77 H new ATOM 0 HD21 LEU A 8 -2.381 5.235 4.546 1.00 0.57 H new ATOM 0 HD22 LEU A 8 -4.131 5.136 4.856 1.00 0.57 H new ATOM 0 HD23 LEU A 8 -3.535 5.843 3.335 1.00 0.57 H new ATOM 106 N GLU A 9 -7.352 6.889 3.835 1.00 0.58 N ATOM 107 CA GLU A 9 -8.368 5.857 3.742 1.00 0.63 C ATOM 108 C GLU A 9 -8.966 5.772 2.326 1.00 0.62 C ATOM 109 O GLU A 9 -8.837 4.732 1.677 1.00 0.64 O ATOM 110 CB GLU A 9 -9.360 6.143 4.867 1.00 0.73 C ATOM 111 CG GLU A 9 -10.384 5.033 5.032 1.00 0.71 C ATOM 112 CD GLU A 9 -11.689 5.494 4.422 1.00 1.53 C ATOM 113 OE1 GLU A 9 -12.412 6.187 5.165 1.00 2.07 O ATOM 114 OE2 GLU A 9 -11.914 5.204 3.233 1.00 2.90 O ATOM 0 H GLU A 9 -7.632 7.682 4.413 1.00 0.58 H new ATOM 0 HA GLU A 9 -7.966 4.854 3.884 1.00 0.63 H new ATOM 0 HB2 GLU A 9 -8.816 6.274 5.803 1.00 0.73 H new ATOM 0 HB3 GLU A 9 -9.875 7.082 4.664 1.00 0.73 H new ATOM 0 HG2 GLU A 9 -10.038 4.122 4.544 1.00 0.71 H new ATOM 0 HG3 GLU A 9 -10.521 4.797 6.087 1.00 0.71 H new ATOM 121 N LYS A 10 -9.447 6.874 1.732 1.00 0.63 N ATOM 122 CA LYS A 10 -9.825 6.914 0.323 1.00 0.70 C ATOM 123 C LYS A 10 -8.697 6.516 -0.629 1.00 0.57 C ATOM 124 O LYS A 10 -8.944 5.944 -1.686 1.00 0.57 O ATOM 125 CB LYS A 10 -10.214 8.342 0.004 1.00 0.84 C ATOM 126 CG LYS A 10 -11.409 8.773 0.852 1.00 2.16 C ATOM 127 CD LYS A 10 -11.830 10.155 0.409 1.00 2.91 C ATOM 128 CE LYS A 10 -10.793 11.270 0.609 1.00 4.43 C ATOM 129 NZ LYS A 10 -9.978 11.518 -0.610 1.00 5.03 N ATOM 0 H LYS A 10 -9.583 7.759 2.220 1.00 0.63 H new ATOM 0 HA LYS A 10 -10.634 6.198 0.179 1.00 0.70 H new ATOM 0 HB2 LYS A 10 -9.370 9.006 0.191 1.00 0.84 H new ATOM 0 HB3 LYS A 10 -10.461 8.430 -1.054 1.00 0.84 H new ATOM 0 HG2 LYS A 10 -12.233 8.069 0.734 1.00 2.16 H new ATOM 0 HG3 LYS A 10 -11.143 8.777 1.909 1.00 2.16 H new ATOM 0 HD2 LYS A 10 -12.090 10.113 -0.649 1.00 2.91 H new ATOM 0 HD3 LYS A 10 -12.737 10.428 0.949 1.00 2.91 H new ATOM 0 HE2 LYS A 10 -11.304 12.190 0.893 1.00 4.43 H new ATOM 0 HE3 LYS A 10 -10.133 11.004 1.435 1.00 4.43 H new ATOM 0 HZ1 LYS A 10 -9.535 12.457 -0.546 1.00 5.03 H new ATOM 0 HZ2 LYS A 10 -9.239 10.790 -0.687 1.00 5.03 H new ATOM 0 HZ3 LYS A 10 -10.590 11.481 -1.450 1.00 5.03 H new ATOM 143 N ALA A 11 -7.448 6.798 -0.287 1.00 0.48 N ATOM 144 CA ALA A 11 -6.313 6.317 -1.058 1.00 0.46 C ATOM 145 C ALA A 11 -6.197 4.791 -1.000 1.00 0.43 C ATOM 146 O ALA A 11 -5.983 4.177 -2.037 1.00 0.44 O ATOM 147 CB ALA A 11 -5.055 7.034 -0.602 1.00 0.50 C ATOM 0 H ALA A 11 -7.195 7.361 0.525 1.00 0.48 H new ATOM 0 HA ALA A 11 -6.463 6.552 -2.112 1.00 0.46 H new ATOM 0 HB1 ALA A 11 -4.202 6.675 -1.179 1.00 0.50 H new ATOM 0 HB2 ALA A 11 -5.172 8.107 -0.756 1.00 0.50 H new ATOM 0 HB3 ALA A 11 -4.887 6.836 0.456 1.00 0.50 H new ATOM 153 N VAL A 12 -6.436 4.159 0.151 1.00 0.44 N ATOM 154 CA VAL A 12 -6.638 2.699 0.207 1.00 0.46 C ATOM 155 C VAL A 12 -7.834 2.270 -0.670 1.00 0.44 C ATOM 156 O VAL A 12 -7.730 1.234 -1.326 1.00 0.49 O ATOM 157 CB VAL A 12 -6.745 2.171 1.657 1.00 0.54 C ATOM 158 CG1 VAL A 12 -7.054 0.670 1.713 1.00 0.57 C ATOM 159 CG2 VAL A 12 -5.427 2.394 2.412 1.00 0.64 C ATOM 0 H VAL A 12 -6.495 4.627 1.055 1.00 0.44 H new ATOM 0 HA VAL A 12 -5.746 2.232 -0.211 1.00 0.46 H new ATOM 0 HB VAL A 12 -7.563 2.725 2.118 1.00 0.54 H new ATOM 0 HG11 VAL A 12 -7.119 0.350 2.753 1.00 0.57 H new ATOM 0 HG12 VAL A 12 -8.003 0.475 1.214 1.00 0.57 H new ATOM 0 HG13 VAL A 12 -6.260 0.116 1.212 1.00 0.57 H new ATOM 0 HG21 VAL A 12 -5.522 2.016 3.430 1.00 0.64 H new ATOM 0 HG22 VAL A 12 -4.622 1.865 1.902 1.00 0.64 H new ATOM 0 HG23 VAL A 12 -5.200 3.460 2.440 1.00 0.64 H new ATOM 169 N ILE A 13 -8.904 3.075 -0.806 1.00 0.43 N ATOM 170 CA ILE A 13 -9.898 2.865 -1.892 1.00 0.51 C ATOM 171 C ILE A 13 -9.242 2.931 -3.277 1.00 0.50 C ATOM 172 O ILE A 13 -9.261 1.934 -3.992 1.00 0.57 O ATOM 173 CB ILE A 13 -11.186 3.731 -1.783 1.00 0.59 C ATOM 174 CG1 ILE A 13 -11.893 3.495 -0.434 1.00 0.68 C ATOM 175 CG2 ILE A 13 -12.128 3.409 -2.958 1.00 0.68 C ATOM 176 CD1 ILE A 13 -13.111 4.387 -0.167 1.00 0.94 C ATOM 0 H ILE A 13 -9.107 3.865 -0.193 1.00 0.43 H new ATOM 0 HA ILE A 13 -10.266 1.849 -1.751 1.00 0.51 H new ATOM 0 HB ILE A 13 -10.908 4.784 -1.831 1.00 0.59 H new ATOM 0 HG12 ILE A 13 -12.209 2.453 -0.386 1.00 0.68 H new ATOM 0 HG13 ILE A 13 -11.170 3.646 0.368 1.00 0.68 H new ATOM 0 HG21 ILE A 13 -13.029 4.017 -2.879 1.00 0.68 H new ATOM 0 HG22 ILE A 13 -11.624 3.628 -3.899 1.00 0.68 H new ATOM 0 HG23 ILE A 13 -12.399 2.354 -2.929 1.00 0.68 H new ATOM 0 HD11 ILE A 13 -13.535 4.142 0.807 1.00 0.94 H new ATOM 0 HD12 ILE A 13 -12.805 5.433 -0.176 1.00 0.94 H new ATOM 0 HD13 ILE A 13 -13.860 4.221 -0.941 1.00 0.94 H new ATOM 188 N VAL A 14 -8.602 4.036 -3.652 1.00 0.48 N ATOM 189 CA VAL A 14 -7.986 4.253 -4.974 1.00 0.52 C ATOM 190 C VAL A 14 -6.974 3.153 -5.353 1.00 0.52 C ATOM 191 O VAL A 14 -6.942 2.700 -6.494 1.00 0.59 O ATOM 192 CB VAL A 14 -7.335 5.656 -5.001 1.00 0.52 C ATOM 193 CG1 VAL A 14 -6.329 5.863 -6.137 1.00 0.64 C ATOM 194 CG2 VAL A 14 -8.412 6.751 -5.087 1.00 0.63 C ATOM 0 H VAL A 14 -8.490 4.836 -3.029 1.00 0.48 H new ATOM 0 HA VAL A 14 -8.771 4.198 -5.728 1.00 0.52 H new ATOM 0 HB VAL A 14 -6.779 5.728 -4.066 1.00 0.52 H new ATOM 0 HG11 VAL A 14 -5.921 6.872 -6.082 1.00 0.64 H new ATOM 0 HG12 VAL A 14 -5.520 5.139 -6.043 1.00 0.64 H new ATOM 0 HG13 VAL A 14 -6.829 5.726 -7.096 1.00 0.64 H new ATOM 0 HG21 VAL A 14 -7.934 7.731 -5.105 1.00 0.63 H new ATOM 0 HG22 VAL A 14 -8.997 6.616 -5.997 1.00 0.63 H new ATOM 0 HG23 VAL A 14 -9.069 6.684 -4.220 1.00 0.63 H new ATOM 204 N LEU A 15 -6.175 2.655 -4.403 1.00 0.45 N ATOM 205 CA LEU A 15 -5.262 1.526 -4.625 1.00 0.47 C ATOM 206 C LEU A 15 -6.009 0.210 -4.917 1.00 0.54 C ATOM 207 O LEU A 15 -5.480 -0.652 -5.617 1.00 0.53 O ATOM 208 CB LEU A 15 -4.322 1.402 -3.405 1.00 0.45 C ATOM 209 CG LEU A 15 -3.014 2.210 -3.548 1.00 0.58 C ATOM 210 CD1 LEU A 15 -3.192 3.733 -3.449 1.00 0.92 C ATOM 211 CD2 LEU A 15 -2.008 1.776 -2.476 1.00 0.55 C ATOM 0 H LEU A 15 -6.143 3.025 -3.453 1.00 0.45 H new ATOM 0 HA LEU A 15 -4.670 1.723 -5.519 1.00 0.47 H new ATOM 0 HB2 LEU A 15 -4.851 1.738 -2.513 1.00 0.45 H new ATOM 0 HB3 LEU A 15 -4.075 0.351 -3.252 1.00 0.45 H new ATOM 0 HG LEU A 15 -2.654 1.993 -4.554 1.00 0.58 H new ATOM 0 HD11 LEU A 15 -2.223 4.221 -3.560 1.00 0.92 H new ATOM 0 HD12 LEU A 15 -3.862 4.073 -4.238 1.00 0.92 H new ATOM 0 HD13 LEU A 15 -3.617 3.987 -2.478 1.00 0.92 H new ATOM 0 HD21 LEU A 15 -1.089 2.352 -2.585 1.00 0.55 H new ATOM 0 HD22 LEU A 15 -2.431 1.952 -1.487 1.00 0.55 H new ATOM 0 HD23 LEU A 15 -1.788 0.715 -2.592 1.00 0.55 H new ATOM 223 N VAL A 16 -7.234 0.062 -4.413 1.00 0.74 N ATOM 224 CA VAL A 16 -8.080 -1.125 -4.584 1.00 0.82 C ATOM 225 C VAL A 16 -9.050 -0.957 -5.773 1.00 0.84 C ATOM 226 O VAL A 16 -9.442 -1.964 -6.346 1.00 1.00 O ATOM 227 CB VAL A 16 -8.731 -1.491 -3.227 1.00 0.71 C ATOM 228 CG1 VAL A 16 -9.671 -2.705 -3.247 1.00 0.71 C ATOM 229 CG2 VAL A 16 -7.607 -1.876 -2.244 1.00 1.03 C ATOM 0 H VAL A 16 -7.682 0.789 -3.855 1.00 0.74 H new ATOM 0 HA VAL A 16 -7.480 -1.990 -4.866 1.00 0.82 H new ATOM 0 HB VAL A 16 -9.317 -0.614 -2.952 1.00 0.71 H new ATOM 0 HG11 VAL A 16 -10.071 -2.872 -2.247 1.00 0.71 H new ATOM 0 HG12 VAL A 16 -10.492 -2.518 -3.939 1.00 0.71 H new ATOM 0 HG13 VAL A 16 -9.118 -3.588 -3.569 1.00 0.71 H new ATOM 0 HG21 VAL A 16 -8.041 -2.138 -1.279 1.00 1.03 H new ATOM 0 HG22 VAL A 16 -7.056 -2.730 -2.638 1.00 1.03 H new ATOM 0 HG23 VAL A 16 -6.928 -1.032 -2.119 1.00 1.03 H new ATOM 239 N GLU A 17 -9.336 0.267 -6.248 1.00 0.88 N ATOM 240 CA GLU A 17 -9.754 0.520 -7.643 1.00 1.08 C ATOM 241 C GLU A 17 -8.660 0.051 -8.615 1.00 0.94 C ATOM 242 O GLU A 17 -8.947 -0.792 -9.468 1.00 0.98 O ATOM 243 CB GLU A 17 -10.085 2.015 -7.843 1.00 1.31 C ATOM 244 CG GLU A 17 -10.276 2.468 -9.308 1.00 2.16 C ATOM 245 CD GLU A 17 -8.974 2.830 -10.043 1.00 3.08 C ATOM 246 OE1 GLU A 17 -8.222 3.686 -9.532 1.00 4.01 O ATOM 247 OE2 GLU A 17 -8.717 2.261 -11.129 1.00 3.67 O ATOM 0 H GLU A 17 -9.285 1.111 -5.678 1.00 0.88 H new ATOM 0 HA GLU A 17 -10.659 -0.050 -7.854 1.00 1.08 H new ATOM 0 HB2 GLU A 17 -10.996 2.244 -7.289 1.00 1.31 H new ATOM 0 HB3 GLU A 17 -9.285 2.608 -7.400 1.00 1.31 H new ATOM 0 HG2 GLU A 17 -10.778 1.672 -9.858 1.00 2.16 H new ATOM 0 HG3 GLU A 17 -10.939 3.333 -9.323 1.00 2.16 H new ATOM 254 N ASN A 18 -7.407 0.516 -8.458 1.00 0.84 N ATOM 255 CA ASN A 18 -6.313 0.148 -9.361 1.00 0.83 C ATOM 256 C ASN A 18 -6.136 -1.379 -9.501 1.00 0.68 C ATOM 257 O ASN A 18 -5.804 -1.882 -10.574 1.00 0.77 O ATOM 258 CB ASN A 18 -5.008 0.827 -8.946 1.00 0.93 C ATOM 259 CG ASN A 18 -3.912 0.437 -9.932 1.00 1.43 C ATOM 260 OD1 ASN A 18 -3.854 0.909 -11.058 1.00 2.24 O ATOM 261 ND2 ASN A 18 -3.062 -0.502 -9.560 1.00 1.86 N ATOM 0 H ASN A 18 -7.131 1.150 -7.708 1.00 0.84 H new ATOM 0 HA ASN A 18 -6.589 0.513 -10.350 1.00 0.83 H new ATOM 0 HB2 ASN A 18 -5.134 1.910 -8.932 1.00 0.93 H new ATOM 0 HB3 ASN A 18 -4.731 0.525 -7.936 1.00 0.93 H new ATOM 0 HD21 ASN A 18 -2.353 -0.836 -10.213 1.00 1.86 H new ATOM 0 HD22 ASN A 18 -3.114 -0.893 -8.619 1.00 1.86 H new ATOM 268 N PHE A 19 -6.385 -2.132 -8.428 1.00 0.59 N ATOM 269 CA PHE A 19 -6.372 -3.591 -8.479 1.00 0.56 C ATOM 270 C PHE A 19 -7.676 -4.193 -9.050 1.00 0.59 C ATOM 271 O PHE A 19 -7.625 -5.045 -9.942 1.00 0.63 O ATOM 272 CB PHE A 19 -6.052 -4.092 -7.070 1.00 0.58 C ATOM 273 CG PHE A 19 -6.003 -5.598 -6.981 1.00 0.61 C ATOM 274 CD1 PHE A 19 -5.009 -6.324 -7.662 1.00 1.83 C ATOM 275 CD2 PHE A 19 -6.980 -6.277 -6.241 1.00 2.15 C ATOM 276 CE1 PHE A 19 -4.979 -7.727 -7.577 1.00 1.86 C ATOM 277 CE2 PHE A 19 -6.965 -7.675 -6.174 1.00 2.19 C ATOM 278 CZ PHE A 19 -5.958 -8.405 -6.832 1.00 0.81 C ATOM 0 H PHE A 19 -6.599 -1.749 -7.507 1.00 0.59 H new ATOM 0 HA PHE A 19 -5.606 -3.927 -9.178 1.00 0.56 H new ATOM 0 HB2 PHE A 19 -5.093 -3.683 -6.753 1.00 0.58 H new ATOM 0 HB3 PHE A 19 -6.804 -3.716 -6.376 1.00 0.58 H new ATOM 0 HD1 PHE A 19 -4.268 -5.803 -8.251 1.00 1.83 H new ATOM 0 HD2 PHE A 19 -7.746 -5.721 -5.721 1.00 2.15 H new ATOM 0 HE1 PHE A 19 -4.204 -8.283 -8.084 1.00 1.86 H new ATOM 0 HE2 PHE A 19 -7.729 -8.195 -5.615 1.00 2.19 H new ATOM 0 HZ PHE A 19 -5.938 -9.483 -6.764 1.00 0.81 H new ATOM 288 N TYR A 20 -8.853 -3.760 -8.572 1.00 0.80 N ATOM 289 CA TYR A 20 -10.128 -4.385 -8.952 1.00 0.93 C ATOM 290 C TYR A 20 -10.588 -4.061 -10.384 1.00 0.92 C ATOM 291 O TYR A 20 -11.313 -4.879 -10.957 1.00 1.04 O ATOM 292 CB TYR A 20 -11.260 -4.118 -7.939 1.00 1.06 C ATOM 293 CG TYR A 20 -11.317 -5.087 -6.762 1.00 1.08 C ATOM 294 CD1 TYR A 20 -10.353 -5.037 -5.739 1.00 1.93 C ATOM 295 CD2 TYR A 20 -12.339 -6.057 -6.694 1.00 2.42 C ATOM 296 CE1 TYR A 20 -10.403 -5.926 -4.646 1.00 1.82 C ATOM 297 CE2 TYR A 20 -12.382 -6.974 -5.625 1.00 2.62 C ATOM 298 CZ TYR A 20 -11.412 -6.911 -4.598 1.00 1.29 C ATOM 299 OH TYR A 20 -11.432 -7.818 -3.586 1.00 1.50 O ATOM 0 H TYR A 20 -8.947 -2.980 -7.922 1.00 0.80 H new ATOM 0 HA TYR A 20 -9.910 -5.453 -8.932 1.00 0.93 H new ATOM 0 HB2 TYR A 20 -11.148 -3.106 -7.551 1.00 1.06 H new ATOM 0 HB3 TYR A 20 -12.214 -4.154 -8.466 1.00 1.06 H new ATOM 0 HD1 TYR A 20 -9.561 -4.305 -5.792 1.00 1.93 H new ATOM 0 HD2 TYR A 20 -13.093 -6.097 -7.466 1.00 2.42 H new ATOM 0 HE1 TYR A 20 -9.675 -5.854 -3.852 1.00 1.82 H new ATOM 0 HE2 TYR A 20 -13.157 -7.726 -5.590 1.00 2.62 H new ATOM 0 HH TYR A 20 -12.193 -8.424 -3.704 1.00 1.50 H new ATOM 309 N LYS A 21 -10.139 -2.968 -11.021 1.00 0.87 N ATOM 310 CA LYS A 21 -10.486 -2.658 -12.425 1.00 0.89 C ATOM 311 C LYS A 21 -10.284 -3.857 -13.377 1.00 0.84 C ATOM 312 O LYS A 21 -11.103 -4.093 -14.258 1.00 1.00 O ATOM 313 CB LYS A 21 -9.749 -1.382 -12.896 1.00 1.11 C ATOM 314 CG LYS A 21 -8.236 -1.561 -13.150 1.00 1.73 C ATOM 315 CD LYS A 21 -7.404 -0.336 -12.749 1.00 1.92 C ATOM 316 CE LYS A 21 -7.432 0.914 -13.634 1.00 1.92 C ATOM 317 NZ LYS A 21 -6.698 2.020 -12.964 1.00 2.77 N ATOM 0 H LYS A 21 -9.529 -2.276 -10.585 1.00 0.87 H new ATOM 0 HA LYS A 21 -11.556 -2.453 -12.461 1.00 0.89 H new ATOM 0 HB2 LYS A 21 -10.217 -1.028 -13.814 1.00 1.11 H new ATOM 0 HB3 LYS A 21 -9.887 -0.603 -12.146 1.00 1.11 H new ATOM 0 HG2 LYS A 21 -7.882 -2.430 -12.595 1.00 1.73 H new ATOM 0 HG3 LYS A 21 -8.075 -1.771 -14.207 1.00 1.73 H new ATOM 0 HD2 LYS A 21 -7.722 -0.037 -11.750 1.00 1.92 H new ATOM 0 HD3 LYS A 21 -6.366 -0.658 -12.670 1.00 1.92 H new ATOM 0 HE2 LYS A 21 -6.978 0.697 -14.601 1.00 1.92 H new ATOM 0 HE3 LYS A 21 -8.463 1.212 -13.826 1.00 1.92 H new ATOM 0 HZ1 LYS A 21 -6.307 2.662 -13.682 1.00 2.77 H new ATOM 0 HZ2 LYS A 21 -7.350 2.546 -12.348 1.00 2.77 H new ATOM 0 HZ3 LYS A 21 -5.923 1.626 -12.393 1.00 2.77 H new ATOM 331 N TYR A 22 -9.263 -4.684 -13.130 1.00 0.90 N ATOM 332 CA TYR A 22 -8.970 -5.876 -13.928 1.00 1.22 C ATOM 333 C TYR A 22 -9.933 -7.046 -13.681 1.00 1.63 C ATOM 334 O TYR A 22 -10.349 -7.695 -14.636 1.00 2.28 O ATOM 335 CB TYR A 22 -7.524 -6.292 -13.662 1.00 1.51 C ATOM 336 CG TYR A 22 -6.530 -5.202 -14.002 1.00 1.39 C ATOM 337 CD1 TYR A 22 -6.370 -4.811 -15.347 1.00 2.28 C ATOM 338 CD2 TYR A 22 -5.834 -4.520 -12.986 1.00 2.28 C ATOM 339 CE1 TYR A 22 -5.549 -3.717 -15.674 1.00 2.21 C ATOM 340 CE2 TYR A 22 -5.007 -3.428 -13.308 1.00 2.52 C ATOM 341 CZ TYR A 22 -4.885 -3.006 -14.649 1.00 1.65 C ATOM 342 OH TYR A 22 -4.158 -1.901 -14.959 1.00 1.94 O ATOM 0 H TYR A 22 -8.609 -4.541 -12.360 1.00 0.90 H new ATOM 0 HA TYR A 22 -9.112 -5.614 -14.976 1.00 1.22 H new ATOM 0 HB2 TYR A 22 -7.415 -6.562 -12.612 1.00 1.51 H new ATOM 0 HB3 TYR A 22 -7.293 -7.183 -14.246 1.00 1.51 H new ATOM 0 HD1 TYR A 22 -6.880 -5.354 -16.129 1.00 2.28 H new ATOM 0 HD2 TYR A 22 -5.935 -4.835 -11.958 1.00 2.28 H new ATOM 0 HE1 TYR A 22 -5.426 -3.421 -16.705 1.00 2.21 H new ATOM 0 HE2 TYR A 22 -4.465 -2.913 -12.529 1.00 2.52 H new ATOM 0 HH TYR A 22 -3.843 -1.475 -14.135 1.00 1.94 H new ATOM 352 N VAL A 23 -10.332 -7.303 -12.429 1.00 1.47 N ATOM 353 CA VAL A 23 -11.306 -8.371 -12.132 1.00 1.89 C ATOM 354 C VAL A 23 -12.757 -7.929 -12.403 1.00 2.10 C ATOM 355 O VAL A 23 -13.651 -8.773 -12.450 1.00 2.65 O ATOM 356 CB VAL A 23 -11.189 -8.951 -10.702 1.00 2.11 C ATOM 357 CG1 VAL A 23 -9.760 -9.439 -10.423 1.00 1.80 C ATOM 358 CG2 VAL A 23 -11.635 -7.990 -9.594 1.00 3.03 C ATOM 0 H VAL A 23 -10.001 -6.794 -11.609 1.00 1.47 H new ATOM 0 HA VAL A 23 -11.046 -9.174 -12.822 1.00 1.89 H new ATOM 0 HB VAL A 23 -11.882 -9.792 -10.678 1.00 2.11 H new ATOM 0 HG11 VAL A 23 -9.704 -9.842 -9.412 1.00 1.80 H new ATOM 0 HG12 VAL A 23 -9.495 -10.217 -11.139 1.00 1.80 H new ATOM 0 HG13 VAL A 23 -9.065 -8.605 -10.520 1.00 1.80 H new ATOM 0 HG21 VAL A 23 -11.521 -8.475 -8.624 1.00 3.03 H new ATOM 0 HG22 VAL A 23 -11.021 -7.090 -9.624 1.00 3.03 H new ATOM 0 HG23 VAL A 23 -12.681 -7.721 -9.745 1.00 3.03 H new ATOM 526 N ILE A 33 -5.428 -11.994 -14.674 1.00 1.53 N ATOM 527 CA ILE A 33 -4.638 -11.166 -15.626 1.00 1.39 C ATOM 528 C ILE A 33 -3.422 -11.880 -16.266 1.00 1.56 C ATOM 529 O ILE A 33 -3.217 -13.077 -16.064 1.00 2.11 O ATOM 530 CB ILE A 33 -4.221 -9.840 -14.925 1.00 1.51 C ATOM 531 CG1 ILE A 33 -3.296 -10.070 -13.704 1.00 1.73 C ATOM 532 CG2 ILE A 33 -5.482 -9.053 -14.528 1.00 2.13 C ATOM 533 CD1 ILE A 33 -2.624 -8.797 -13.170 1.00 1.83 C ATOM 0 HA ILE A 33 -5.292 -10.959 -16.473 1.00 1.39 H new ATOM 0 HB ILE A 33 -3.636 -9.257 -15.636 1.00 1.51 H new ATOM 0 HG12 ILE A 33 -3.879 -10.523 -12.902 1.00 1.73 H new ATOM 0 HG13 ILE A 33 -2.522 -10.787 -13.979 1.00 1.73 H new ATOM 0 HG21 ILE A 33 -5.192 -8.124 -14.037 1.00 2.13 H new ATOM 0 HG22 ILE A 33 -6.065 -8.825 -15.421 1.00 2.13 H new ATOM 0 HG23 ILE A 33 -6.084 -9.652 -13.845 1.00 2.13 H new ATOM 0 HD11 ILE A 33 -1.995 -9.048 -12.316 1.00 1.83 H new ATOM 0 HD12 ILE A 33 -2.011 -8.353 -13.954 1.00 1.83 H new ATOM 0 HD13 ILE A 33 -3.389 -8.085 -12.860 1.00 1.83 H new ATOM 545 N SER A 34 -2.586 -11.163 -17.023 1.00 1.42 N ATOM 546 CA SER A 34 -1.171 -11.516 -17.196 1.00 1.58 C ATOM 547 C SER A 34 -0.330 -10.608 -16.284 1.00 1.27 C ATOM 548 O SER A 34 -0.638 -9.424 -16.144 1.00 1.15 O ATOM 549 CB SER A 34 -0.740 -11.377 -18.669 1.00 1.97 C ATOM 550 OG SER A 34 -0.797 -10.039 -19.140 1.00 3.53 O ATOM 0 H SER A 34 -2.868 -10.325 -17.532 1.00 1.42 H new ATOM 0 HA SER A 34 -1.016 -12.559 -16.919 1.00 1.58 H new ATOM 0 HB2 SER A 34 0.277 -11.753 -18.781 1.00 1.97 H new ATOM 0 HB3 SER A 34 -1.381 -12.003 -19.290 1.00 1.97 H new ATOM 0 HG SER A 34 -0.512 -10.010 -20.077 1.00 3.53 H new ATOM 556 N LYS A 35 0.722 -11.130 -15.645 1.00 1.23 N ATOM 557 CA LYS A 35 1.468 -10.374 -14.622 1.00 1.07 C ATOM 558 C LYS A 35 2.312 -9.232 -15.227 1.00 0.98 C ATOM 559 O LYS A 35 2.579 -8.238 -14.561 1.00 1.05 O ATOM 560 CB LYS A 35 2.249 -11.356 -13.738 1.00 1.17 C ATOM 561 CG LYS A 35 1.302 -12.429 -13.160 1.00 1.78 C ATOM 562 CD LYS A 35 1.965 -13.235 -12.052 1.00 1.52 C ATOM 563 CE LYS A 35 1.088 -14.448 -11.712 1.00 2.75 C ATOM 564 NZ LYS A 35 1.854 -15.711 -11.808 1.00 2.35 N ATOM 0 H LYS A 35 1.079 -12.070 -15.814 1.00 1.23 H new ATOM 0 HA LYS A 35 0.768 -9.848 -13.973 1.00 1.07 H new ATOM 0 HB2 LYS A 35 3.037 -11.833 -14.321 1.00 1.17 H new ATOM 0 HB3 LYS A 35 2.736 -10.816 -12.926 1.00 1.17 H new ATOM 0 HG2 LYS A 35 0.404 -11.949 -12.772 1.00 1.78 H new ATOM 0 HG3 LYS A 35 0.985 -13.101 -13.958 1.00 1.78 H new ATOM 0 HD2 LYS A 35 2.954 -13.565 -12.369 1.00 1.52 H new ATOM 0 HD3 LYS A 35 2.104 -12.613 -11.168 1.00 1.52 H new ATOM 0 HE2 LYS A 35 0.688 -14.339 -10.704 1.00 2.75 H new ATOM 0 HE3 LYS A 35 0.236 -14.485 -12.391 1.00 2.75 H new ATOM 0 HZ1 LYS A 35 1.196 -16.516 -11.826 1.00 2.35 H new ATOM 0 HZ2 LYS A 35 2.421 -15.708 -12.680 1.00 2.35 H new ATOM 0 HZ3 LYS A 35 2.485 -15.798 -10.986 1.00 2.35 H new ATOM 578 N SER A 36 2.592 -9.287 -16.533 1.00 1.07 N ATOM 579 CA SER A 36 2.984 -8.126 -17.345 1.00 1.19 C ATOM 580 C SER A 36 2.068 -6.905 -17.157 1.00 1.07 C ATOM 581 O SER A 36 2.531 -5.773 -17.267 1.00 1.25 O ATOM 582 CB SER A 36 2.946 -8.494 -18.837 1.00 1.50 C ATOM 583 OG SER A 36 3.846 -9.543 -19.131 1.00 2.29 O ATOM 0 H SER A 36 2.552 -10.155 -17.067 1.00 1.07 H new ATOM 0 HA SER A 36 3.987 -7.860 -17.010 1.00 1.19 H new ATOM 0 HB2 SER A 36 1.935 -8.791 -19.115 1.00 1.50 H new ATOM 0 HB3 SER A 36 3.197 -7.619 -19.436 1.00 1.50 H new ATOM 0 HG SER A 36 3.799 -9.757 -20.086 1.00 2.29 H new ATOM 589 N SER A 37 0.779 -7.090 -16.855 1.00 0.89 N ATOM 590 CA SER A 37 -0.110 -5.961 -16.592 1.00 0.84 C ATOM 591 C SER A 37 0.297 -5.201 -15.328 1.00 0.75 C ATOM 592 O SER A 37 0.243 -3.978 -15.362 1.00 0.88 O ATOM 593 CB SER A 37 -1.582 -6.399 -16.550 1.00 0.85 C ATOM 594 OG SER A 37 -2.434 -5.336 -16.946 1.00 2.60 O ATOM 0 H SER A 37 0.333 -8.005 -16.788 1.00 0.89 H new ATOM 0 HA SER A 37 -0.007 -5.266 -17.426 1.00 0.84 H new ATOM 0 HB2 SER A 37 -1.731 -7.255 -17.208 1.00 0.85 H new ATOM 0 HB3 SER A 37 -1.841 -6.723 -15.542 1.00 0.85 H new ATOM 0 HG SER A 37 -3.367 -5.635 -16.914 1.00 2.60 H new ATOM 600 N PHE A 38 0.806 -5.849 -14.266 1.00 0.65 N ATOM 601 CA PHE A 38 1.311 -5.150 -13.076 1.00 0.64 C ATOM 602 C PHE A 38 2.454 -4.190 -13.421 1.00 0.61 C ATOM 603 O PHE A 38 2.381 -3.020 -13.050 1.00 0.71 O ATOM 604 CB PHE A 38 1.739 -6.152 -11.993 1.00 0.65 C ATOM 605 CG PHE A 38 2.367 -5.511 -10.765 1.00 0.59 C ATOM 606 CD1 PHE A 38 3.729 -5.153 -10.775 1.00 1.80 C ATOM 607 CD2 PHE A 38 1.615 -5.286 -9.597 1.00 1.68 C ATOM 608 CE1 PHE A 38 4.351 -4.656 -9.629 1.00 1.79 C ATOM 609 CE2 PHE A 38 2.214 -4.690 -8.470 1.00 1.71 C ATOM 610 CZ PHE A 38 3.586 -4.378 -8.485 1.00 0.63 C ATOM 0 H PHE A 38 0.878 -6.865 -14.210 1.00 0.65 H new ATOM 0 HA PHE A 38 0.493 -4.548 -12.680 1.00 0.64 H new ATOM 0 HB2 PHE A 38 0.868 -6.729 -11.683 1.00 0.65 H new ATOM 0 HB3 PHE A 38 2.450 -6.856 -12.425 1.00 0.65 H new ATOM 0 HD1 PHE A 38 4.301 -5.265 -11.684 1.00 1.80 H new ATOM 0 HD2 PHE A 38 0.574 -5.572 -9.565 1.00 1.68 H new ATOM 0 HE1 PHE A 38 5.417 -4.486 -9.622 1.00 1.79 H new ATOM 0 HE2 PHE A 38 1.620 -4.473 -7.594 1.00 1.71 H new ATOM 0 HZ PHE A 38 4.049 -3.926 -7.620 1.00 0.63 H new ATOM 620 N ARG A 39 3.476 -4.627 -14.179 1.00 0.62 N ATOM 621 CA ARG A 39 4.551 -3.701 -14.587 1.00 0.69 C ATOM 622 C ARG A 39 4.011 -2.569 -15.476 1.00 0.69 C ATOM 623 O ARG A 39 4.548 -1.460 -15.447 1.00 0.85 O ATOM 624 CB ARG A 39 5.770 -4.398 -15.230 1.00 0.91 C ATOM 625 CG ARG A 39 5.462 -5.073 -16.572 1.00 1.10 C ATOM 626 CD ARG A 39 6.666 -5.215 -17.511 1.00 1.59 C ATOM 627 NE ARG A 39 6.240 -5.755 -18.821 1.00 1.64 N ATOM 628 CZ ARG A 39 5.509 -5.123 -19.739 1.00 2.75 C ATOM 629 NH1 ARG A 39 5.266 -3.842 -19.708 1.00 4.39 N ATOM 630 NH2 ARG A 39 4.940 -5.752 -20.741 1.00 3.01 N ATOM 0 H ARG A 39 3.581 -5.585 -14.514 1.00 0.62 H new ATOM 0 HA ARG A 39 4.924 -3.261 -13.663 1.00 0.69 H new ATOM 0 HB2 ARG A 39 6.561 -3.663 -15.377 1.00 0.91 H new ATOM 0 HB3 ARG A 39 6.155 -5.147 -14.538 1.00 0.91 H new ATOM 0 HG2 ARG A 39 5.051 -6.064 -16.379 1.00 1.10 H new ATOM 0 HG3 ARG A 39 4.687 -4.500 -17.082 1.00 1.10 H new ATOM 0 HD2 ARG A 39 7.144 -4.245 -17.649 1.00 1.59 H new ATOM 0 HD3 ARG A 39 7.408 -5.875 -17.063 1.00 1.59 H new ATOM 0 HE ARG A 39 6.535 -6.706 -19.044 1.00 1.64 H new ATOM 0 HH11 ARG A 39 5.643 -3.270 -18.953 1.00 4.39 H new ATOM 0 HH12 ARG A 39 4.699 -3.413 -20.439 1.00 4.39 H new ATOM 0 HH21 ARG A 39 5.050 -6.761 -20.838 1.00 3.01 H new ATOM 0 HH22 ARG A 39 4.388 -5.231 -21.423 1.00 3.01 H new ATOM 644 N GLU A 40 2.948 -2.824 -16.244 1.00 0.68 N ATOM 645 CA GLU A 40 2.426 -1.838 -17.181 1.00 0.80 C ATOM 646 C GLU A 40 1.475 -0.826 -16.551 1.00 0.77 C ATOM 647 O GLU A 40 1.563 0.356 -16.845 1.00 0.80 O ATOM 648 CB GLU A 40 1.808 -2.519 -18.401 1.00 1.01 C ATOM 649 CG GLU A 40 2.519 -1.974 -19.634 1.00 1.25 C ATOM 650 CD GLU A 40 2.148 -2.785 -20.853 1.00 1.83 C ATOM 651 OE1 GLU A 40 1.018 -2.524 -21.319 1.00 2.00 O ATOM 652 OE2 GLU A 40 2.971 -3.642 -21.252 1.00 3.11 O ATOM 0 H GLU A 40 2.436 -3.706 -16.232 1.00 0.68 H new ATOM 0 HA GLU A 40 3.283 -1.251 -17.511 1.00 0.80 H new ATOM 0 HB2 GLU A 40 1.925 -3.601 -18.337 1.00 1.01 H new ATOM 0 HB3 GLU A 40 0.738 -2.316 -18.453 1.00 1.01 H new ATOM 0 HG2 GLU A 40 2.247 -0.930 -19.787 1.00 1.25 H new ATOM 0 HG3 GLU A 40 3.598 -2.004 -19.483 1.00 1.25 H new ATOM 659 N MET A 41 0.614 -1.271 -15.649 1.00 0.79 N ATOM 660 CA MET A 41 -0.120 -0.460 -14.677 1.00 0.89 C ATOM 661 C MET A 41 0.837 0.447 -13.897 1.00 0.85 C ATOM 662 O MET A 41 0.621 1.654 -13.853 1.00 0.93 O ATOM 663 CB MET A 41 -0.879 -1.446 -13.784 1.00 0.98 C ATOM 664 CG MET A 41 -1.414 -0.891 -12.463 1.00 1.35 C ATOM 665 SD MET A 41 -0.526 -1.618 -11.061 1.00 1.70 S ATOM 666 CE MET A 41 -1.367 -3.224 -11.058 1.00 1.09 C ATOM 0 H MET A 41 0.393 -2.263 -15.567 1.00 0.79 H new ATOM 0 HA MET A 41 -0.826 0.218 -15.156 1.00 0.89 H new ATOM 0 HB2 MET A 41 -1.719 -1.845 -14.352 1.00 0.98 H new ATOM 0 HB3 MET A 41 -0.218 -2.284 -13.561 1.00 0.98 H new ATOM 0 HG2 MET A 41 -1.305 0.193 -12.447 1.00 1.35 H new ATOM 0 HG3 MET A 41 -2.479 -1.106 -12.377 1.00 1.35 H new ATOM 0 HE1 MET A 41 -0.766 -3.949 -10.509 1.00 1.09 H new ATOM 0 HE2 MET A 41 -2.341 -3.124 -10.579 1.00 1.09 H new ATOM 0 HE3 MET A 41 -1.500 -3.567 -12.084 1.00 1.09 H new ATOM 676 N LEU A 42 1.947 -0.090 -13.383 1.00 0.77 N ATOM 677 CA LEU A 42 3.032 0.718 -12.825 1.00 0.76 C ATOM 678 C LEU A 42 3.564 1.757 -13.827 1.00 0.71 C ATOM 679 O LEU A 42 3.670 2.928 -13.477 1.00 1.00 O ATOM 680 CB LEU A 42 4.154 -0.216 -12.331 1.00 0.81 C ATOM 681 CG LEU A 42 3.940 -0.853 -10.950 1.00 0.93 C ATOM 682 CD1 LEU A 42 5.202 -1.656 -10.626 1.00 1.05 C ATOM 683 CD2 LEU A 42 3.717 0.188 -9.850 1.00 1.03 C ATOM 0 H LEU A 42 2.117 -1.095 -13.343 1.00 0.77 H new ATOM 0 HA LEU A 42 2.639 1.289 -11.983 1.00 0.76 H new ATOM 0 HB2 LEU A 42 4.283 -1.015 -13.062 1.00 0.81 H new ATOM 0 HB3 LEU A 42 5.086 0.349 -12.308 1.00 0.81 H new ATOM 0 HG LEU A 42 3.046 -1.476 -10.984 1.00 0.93 H new ATOM 0 HD11 LEU A 42 5.093 -2.127 -9.649 1.00 1.05 H new ATOM 0 HD12 LEU A 42 5.349 -2.424 -11.385 1.00 1.05 H new ATOM 0 HD13 LEU A 42 6.064 -0.989 -10.612 1.00 1.05 H new ATOM 0 HD21 LEU A 42 3.571 -0.317 -8.895 1.00 1.03 H new ATOM 0 HD22 LEU A 42 4.587 0.841 -9.786 1.00 1.03 H new ATOM 0 HD23 LEU A 42 2.834 0.782 -10.085 1.00 1.03 H new ATOM 695 N GLN A 43 3.910 1.374 -15.058 1.00 0.82 N ATOM 696 CA GLN A 43 4.507 2.314 -16.015 1.00 0.89 C ATOM 697 C GLN A 43 3.526 3.259 -16.722 1.00 0.93 C ATOM 698 O GLN A 43 3.994 4.189 -17.372 1.00 1.08 O ATOM 699 CB GLN A 43 5.471 1.584 -16.964 1.00 1.01 C ATOM 700 CG GLN A 43 4.853 0.955 -18.216 1.00 1.34 C ATOM 701 CD GLN A 43 5.747 -0.175 -18.741 1.00 1.61 C ATOM 702 OE1 GLN A 43 5.623 -1.344 -18.407 1.00 3.03 O ATOM 703 NE2 GLN A 43 6.734 0.129 -19.550 1.00 1.47 N ATOM 0 H GLN A 43 3.789 0.427 -15.416 1.00 0.82 H new ATOM 0 HA GLN A 43 5.093 3.013 -15.418 1.00 0.89 H new ATOM 0 HB2 GLN A 43 6.238 2.291 -17.281 1.00 1.01 H new ATOM 0 HB3 GLN A 43 5.974 0.798 -16.401 1.00 1.01 H new ATOM 0 HG2 GLN A 43 3.862 0.566 -17.984 1.00 1.34 H new ATOM 0 HG3 GLN A 43 4.725 1.714 -18.987 1.00 1.34 H new ATOM 0 HE21 GLN A 43 6.868 1.095 -19.850 1.00 1.47 H new ATOM 0 HE22 GLN A 43 7.367 -0.600 -19.879 1.00 1.47 H new ATOM 712 N LYS A 44 2.210 3.062 -16.583 1.00 0.89 N ATOM 713 CA LYS A 44 1.164 4.014 -16.978 1.00 0.96 C ATOM 714 C LYS A 44 0.622 4.874 -15.814 1.00 0.98 C ATOM 715 O LYS A 44 0.595 6.095 -15.936 1.00 1.13 O ATOM 716 CB LYS A 44 0.026 3.240 -17.682 1.00 0.96 C ATOM 717 CG LYS A 44 0.275 3.033 -19.193 1.00 1.03 C ATOM 718 CD LYS A 44 0.727 1.636 -19.653 1.00 0.93 C ATOM 719 CE LYS A 44 -0.321 0.550 -19.352 1.00 1.03 C ATOM 720 NZ LYS A 44 -0.460 -0.455 -20.440 1.00 1.44 N ATOM 0 H LYS A 44 1.830 2.206 -16.179 1.00 0.89 H new ATOM 0 HA LYS A 44 1.617 4.730 -17.663 1.00 0.96 H new ATOM 0 HB2 LYS A 44 -0.094 2.268 -17.204 1.00 0.96 H new ATOM 0 HB3 LYS A 44 -0.911 3.780 -17.545 1.00 0.96 H new ATOM 0 HG2 LYS A 44 -0.645 3.280 -19.723 1.00 1.03 H new ATOM 0 HG3 LYS A 44 1.029 3.753 -19.511 1.00 1.03 H new ATOM 0 HD2 LYS A 44 0.927 1.657 -20.724 1.00 0.93 H new ATOM 0 HD3 LYS A 44 1.664 1.379 -19.159 1.00 0.93 H new ATOM 0 HE2 LYS A 44 -0.049 0.039 -18.428 1.00 1.03 H new ATOM 0 HE3 LYS A 44 -1.287 1.025 -19.181 1.00 1.03 H new ATOM 0 HZ1 LYS A 44 -1.446 -0.781 -20.488 1.00 1.44 H new ATOM 0 HZ2 LYS A 44 -0.194 -0.023 -21.348 1.00 1.44 H new ATOM 0 HZ3 LYS A 44 0.163 -1.265 -20.246 1.00 1.44 H new ATOM 734 N GLU A 45 0.205 4.272 -14.698 1.00 0.89 N ATOM 735 CA GLU A 45 -0.542 4.950 -13.623 1.00 0.85 C ATOM 736 C GLU A 45 0.397 5.560 -12.565 1.00 0.86 C ATOM 737 O GLU A 45 0.199 6.687 -12.116 1.00 1.13 O ATOM 738 CB GLU A 45 -1.497 3.955 -12.924 1.00 0.87 C ATOM 739 CG GLU A 45 -2.419 3.099 -13.820 1.00 1.13 C ATOM 740 CD GLU A 45 -3.606 3.836 -14.440 1.00 1.60 C ATOM 741 OE1 GLU A 45 -3.363 4.792 -15.210 1.00 2.90 O ATOM 742 OE2 GLU A 45 -4.752 3.379 -14.202 1.00 2.12 O ATOM 0 H GLU A 45 0.377 3.285 -14.508 1.00 0.89 H new ATOM 0 HA GLU A 45 -1.110 5.755 -14.089 1.00 0.85 H new ATOM 0 HB2 GLU A 45 -0.893 3.278 -12.320 1.00 0.87 H new ATOM 0 HB3 GLU A 45 -2.127 4.520 -12.237 1.00 0.87 H new ATOM 0 HG2 GLU A 45 -1.820 2.671 -14.624 1.00 1.13 H new ATOM 0 HG3 GLU A 45 -2.800 2.266 -13.229 1.00 1.13 H new ATOM 749 N LEU A 46 1.438 4.828 -12.153 1.00 0.80 N ATOM 750 CA LEU A 46 2.287 5.144 -10.994 1.00 1.02 C ATOM 751 C LEU A 46 3.676 5.636 -11.452 1.00 1.39 C ATOM 752 O LEU A 46 4.707 5.200 -10.943 1.00 1.71 O ATOM 753 CB LEU A 46 2.310 3.874 -10.111 1.00 1.05 C ATOM 754 CG LEU A 46 2.285 4.145 -8.597 1.00 1.15 C ATOM 755 CD1 LEU A 46 2.089 2.801 -7.882 1.00 1.06 C ATOM 756 CD2 LEU A 46 3.549 4.830 -8.064 1.00 1.90 C ATOM 0 H LEU A 46 1.723 3.973 -12.630 1.00 0.80 H new ATOM 0 HA LEU A 46 1.897 5.971 -10.401 1.00 1.02 H new ATOM 0 HB2 LEU A 46 1.453 3.252 -10.370 1.00 1.05 H new ATOM 0 HB3 LEU A 46 3.205 3.298 -10.349 1.00 1.05 H new ATOM 0 HG LEU A 46 1.467 4.839 -8.401 1.00 1.15 H new ATOM 0 HD11 LEU A 46 2.067 2.962 -6.804 1.00 1.06 H new ATOM 0 HD12 LEU A 46 1.148 2.353 -8.201 1.00 1.06 H new ATOM 0 HD13 LEU A 46 2.912 2.132 -8.132 1.00 1.06 H new ATOM 0 HD21 LEU A 46 3.453 4.986 -6.990 1.00 1.90 H new ATOM 0 HD22 LEU A 46 4.416 4.200 -8.263 1.00 1.90 H new ATOM 0 HD23 LEU A 46 3.678 5.792 -8.560 1.00 1.90 H new ATOM 768 N ASN A 47 3.717 6.427 -12.529 1.00 1.49 N ATOM 769 CA ASN A 47 4.872 6.420 -13.432 1.00 1.79 C ATOM 770 C ASN A 47 5.932 7.520 -13.189 1.00 1.85 C ATOM 771 O ASN A 47 7.051 7.376 -13.697 1.00 2.33 O ATOM 772 CB ASN A 47 4.357 6.449 -14.886 1.00 1.93 C ATOM 773 CG ASN A 47 3.870 7.833 -15.298 1.00 1.94 C ATOM 774 OD1 ASN A 47 4.668 8.704 -15.617 1.00 2.36 O ATOM 775 ND2 ASN A 47 2.576 8.091 -15.247 1.00 1.69 N ATOM 0 H ASN A 47 2.973 7.073 -12.795 1.00 1.49 H new ATOM 0 HA ASN A 47 5.418 5.501 -13.220 1.00 1.79 H new ATOM 0 HB2 ASN A 47 5.154 6.132 -15.558 1.00 1.93 H new ATOM 0 HB3 ASN A 47 3.543 5.732 -14.996 1.00 1.93 H new ATOM 0 HD21 ASN A 47 2.233 9.024 -15.475 1.00 1.69 H new ATOM 0 HD22 ASN A 47 1.920 7.357 -14.980 1.00 1.69 H new ATOM 782 N HIS A 48 5.611 8.599 -12.462 1.00 1.55 N ATOM 783 CA HIS A 48 6.360 9.864 -12.437 1.00 1.43 C ATOM 784 C HIS A 48 7.424 9.918 -11.317 1.00 1.39 C ATOM 785 O HIS A 48 8.536 10.385 -11.559 1.00 1.55 O ATOM 786 CB HIS A 48 5.396 11.062 -12.300 1.00 1.38 C ATOM 787 CG HIS A 48 4.193 11.082 -13.222 1.00 1.51 C ATOM 788 ND1 HIS A 48 4.099 11.703 -14.448 1.00 1.93 N ATOM 789 CD2 HIS A 48 2.954 10.557 -12.961 1.00 1.65 C ATOM 790 CE1 HIS A 48 2.849 11.538 -14.907 1.00 1.94 C ATOM 791 NE2 HIS A 48 2.099 10.868 -14.023 1.00 1.80 N ATOM 0 H HIS A 48 4.793 8.616 -11.853 1.00 1.55 H new ATOM 0 HA HIS A 48 6.891 9.923 -13.387 1.00 1.43 H new ATOM 0 HB2 HIS A 48 5.036 11.092 -11.272 1.00 1.38 H new ATOM 0 HB3 HIS A 48 5.966 11.977 -12.465 1.00 1.38 H new ATOM 0 HD2 HIS A 48 2.683 9.995 -12.080 1.00 1.65 H new ATOM 0 HE1 HIS A 48 2.495 11.898 -15.862 1.00 1.94 H new ATOM 0 HE2 HIS A 48 1.110 10.633 -14.107 1.00 1.80 H new ATOM 799 N MET A 49 7.143 9.389 -10.118 1.00 1.45 N ATOM 800 CA MET A 49 8.138 9.201 -9.045 1.00 1.65 C ATOM 801 C MET A 49 9.056 8.000 -9.273 1.00 1.85 C ATOM 802 O MET A 49 10.085 7.866 -8.603 1.00 2.08 O ATOM 803 CB MET A 49 7.443 8.905 -7.715 1.00 2.00 C ATOM 804 CG MET A 49 6.651 10.073 -7.153 1.00 2.75 C ATOM 805 SD MET A 49 6.238 9.819 -5.414 1.00 2.67 S ATOM 806 CE MET A 49 5.252 8.299 -5.497 1.00 1.17 C ATOM 0 H MET A 49 6.208 9.075 -9.860 1.00 1.45 H new ATOM 0 HA MET A 49 8.713 10.127 -9.038 1.00 1.65 H new ATOM 0 HB2 MET A 49 6.772 8.057 -7.849 1.00 2.00 H new ATOM 0 HB3 MET A 49 8.194 8.605 -6.984 1.00 2.00 H new ATOM 0 HG2 MET A 49 7.229 10.991 -7.260 1.00 2.75 H new ATOM 0 HG3 MET A 49 5.735 10.204 -7.730 1.00 2.75 H new ATOM 0 HE1 MET A 49 4.258 8.488 -5.092 1.00 1.17 H new ATOM 0 HE2 MET A 49 5.166 7.977 -6.535 1.00 1.17 H new ATOM 0 HE3 MET A 49 5.739 7.517 -4.914 1.00 1.17 H new ATOM 816 N LEU A 50 8.630 7.075 -10.140 1.00 2.09 N ATOM 817 CA LEU A 50 9.055 5.677 -10.122 1.00 2.92 C ATOM 818 C LEU A 50 10.573 5.521 -10.218 1.00 3.89 C ATOM 819 O LEU A 50 11.112 4.608 -9.601 1.00 5.80 O ATOM 820 CB LEU A 50 8.270 4.941 -11.224 1.00 2.85 C ATOM 821 CG LEU A 50 8.441 3.411 -11.168 1.00 3.04 C ATOM 822 CD1 LEU A 50 7.183 2.689 -11.673 1.00 2.46 C ATOM 823 CD2 LEU A 50 9.622 2.955 -12.032 1.00 3.80 C ATOM 0 H LEU A 50 7.968 7.284 -10.887 1.00 2.09 H new ATOM 0 HA LEU A 50 8.821 5.219 -9.161 1.00 2.92 H new ATOM 0 HB2 LEU A 50 7.212 5.186 -11.133 1.00 2.85 H new ATOM 0 HB3 LEU A 50 8.598 5.302 -12.199 1.00 2.85 H new ATOM 0 HG LEU A 50 8.620 3.157 -10.123 1.00 3.04 H new ATOM 0 HD11 LEU A 50 7.336 1.611 -11.621 1.00 2.46 H new ATOM 0 HD12 LEU A 50 6.331 2.965 -11.052 1.00 2.46 H new ATOM 0 HD13 LEU A 50 6.988 2.978 -12.706 1.00 2.46 H new ATOM 0 HD21 LEU A 50 9.719 1.871 -11.973 1.00 3.80 H new ATOM 0 HD22 LEU A 50 9.450 3.248 -13.068 1.00 3.80 H new ATOM 0 HD23 LEU A 50 10.539 3.421 -11.671 1.00 3.80 H new ATOM 835 N SER A 51 11.229 6.452 -10.912 1.00 3.02 N ATOM 836 CA SER A 51 12.680 6.655 -10.978 1.00 3.84 C ATOM 837 C SER A 51 13.332 5.727 -12.016 1.00 3.60 C ATOM 838 O SER A 51 13.421 4.510 -11.838 1.00 4.88 O ATOM 839 CB SER A 51 13.365 6.593 -9.602 1.00 4.73 C ATOM 840 OG SER A 51 12.858 7.604 -8.734 1.00 5.15 O ATOM 0 H SER A 51 10.727 7.132 -11.483 1.00 3.02 H new ATOM 0 HA SER A 51 12.837 7.677 -11.323 1.00 3.84 H new ATOM 0 HB2 SER A 51 13.205 5.611 -9.156 1.00 4.73 H new ATOM 0 HB3 SER A 51 14.441 6.717 -9.721 1.00 4.73 H new ATOM 0 HG SER A 51 11.878 7.595 -8.758 1.00 5.15 H new ATOM 846 N ASP A 52 13.791 6.339 -13.117 1.00 2.46 N ATOM 847 CA ASP A 52 14.662 5.738 -14.138 1.00 2.47 C ATOM 848 C ASP A 52 13.984 4.593 -14.941 1.00 1.83 C ATOM 849 O ASP A 52 12.756 4.442 -14.962 1.00 1.98 O ATOM 850 CB ASP A 52 16.001 5.342 -13.466 1.00 3.18 C ATOM 851 CG ASP A 52 17.133 5.173 -14.481 1.00 3.61 C ATOM 852 OD1 ASP A 52 17.575 6.203 -15.024 1.00 3.94 O ATOM 853 OD2 ASP A 52 17.433 3.999 -14.805 1.00 4.44 O ATOM 0 H ASP A 52 13.555 7.308 -13.330 1.00 2.46 H new ATOM 0 HA ASP A 52 14.870 6.477 -14.912 1.00 2.47 H new ATOM 0 HB2 ASP A 52 16.279 6.105 -12.739 1.00 3.18 H new ATOM 0 HB3 ASP A 52 15.867 4.411 -12.916 1.00 3.18 H new ATOM 858 N THR A 53 14.792 3.777 -15.628 1.00 1.92 N ATOM 859 CA THR A 53 14.461 2.409 -16.043 1.00 1.60 C ATOM 860 C THR A 53 14.817 1.427 -14.929 1.00 1.47 C ATOM 861 O THR A 53 14.109 0.433 -14.772 1.00 1.32 O ATOM 862 CB THR A 53 15.202 2.077 -17.341 1.00 1.78 C ATOM 863 OG1 THR A 53 14.624 2.879 -18.339 1.00 1.87 O ATOM 864 CG2 THR A 53 15.044 0.623 -17.794 1.00 2.24 C ATOM 0 H THR A 53 15.727 4.061 -15.920 1.00 1.92 H new ATOM 0 HA THR A 53 13.390 2.327 -16.230 1.00 1.60 H new ATOM 0 HB THR A 53 16.265 2.249 -17.172 1.00 1.78 H new ATOM 0 HG1 THR A 53 15.067 2.705 -19.196 1.00 1.87 H new ATOM 0 HG21 THR A 53 15.598 0.468 -18.720 1.00 2.24 H new ATOM 0 HG22 THR A 53 15.432 -0.043 -17.023 1.00 2.24 H new ATOM 0 HG23 THR A 53 13.989 0.407 -17.962 1.00 2.24 H new ATOM 872 N GLY A 54 15.854 1.704 -14.129 1.00 1.74 N ATOM 873 CA GLY A 54 16.376 0.805 -13.093 1.00 1.91 C ATOM 874 C GLY A 54 15.324 0.329 -12.089 1.00 1.89 C ATOM 875 O GLY A 54 15.270 -0.866 -11.792 1.00 1.98 O ATOM 0 H GLY A 54 16.367 2.584 -14.186 1.00 1.74 H new ATOM 0 HA2 GLY A 54 16.823 -0.065 -13.574 1.00 1.91 H new ATOM 0 HA3 GLY A 54 17.173 1.315 -12.553 1.00 1.91 H new ATOM 879 N ASN A 55 14.431 1.209 -11.622 1.00 1.91 N ATOM 880 CA ASN A 55 13.377 0.789 -10.692 1.00 2.05 C ATOM 881 C ASN A 55 12.227 0.024 -11.389 1.00 1.57 C ATOM 882 O ASN A 55 11.569 -0.804 -10.760 1.00 1.48 O ATOM 883 CB ASN A 55 12.894 1.987 -9.858 1.00 2.53 C ATOM 884 CG ASN A 55 12.449 1.610 -8.441 1.00 3.53 C ATOM 885 OD1 ASN A 55 12.726 0.531 -7.937 1.00 4.73 O ATOM 886 ND2 ASN A 55 11.756 2.492 -7.748 1.00 3.61 N ATOM 0 H ASN A 55 14.416 2.199 -11.867 1.00 1.91 H new ATOM 0 HA ASN A 55 13.808 0.063 -10.003 1.00 2.05 H new ATOM 0 HB2 ASN A 55 13.697 2.721 -9.794 1.00 2.53 H new ATOM 0 HB3 ASN A 55 12.063 2.467 -10.375 1.00 2.53 H new ATOM 0 HD21 ASN A 55 11.455 2.272 -6.799 1.00 3.61 H new ATOM 0 HD22 ASN A 55 11.521 3.394 -8.161 1.00 3.61 H new ATOM 893 N ARG A 56 12.044 0.162 -12.716 1.00 1.44 N ATOM 894 CA ARG A 56 11.206 -0.779 -13.492 1.00 1.24 C ATOM 895 C ARG A 56 11.840 -2.155 -13.614 1.00 1.16 C ATOM 896 O ARG A 56 11.140 -3.149 -13.463 1.00 1.11 O ATOM 897 CB ARG A 56 10.812 -0.266 -14.872 1.00 1.24 C ATOM 898 CG ARG A 56 9.897 0.936 -14.669 1.00 1.85 C ATOM 899 CD ARG A 56 9.044 1.228 -15.892 1.00 1.73 C ATOM 900 NE ARG A 56 8.315 2.498 -15.706 1.00 3.57 N ATOM 901 CZ ARG A 56 8.832 3.733 -15.737 1.00 5.18 C ATOM 902 NH1 ARG A 56 10.114 3.929 -15.968 1.00 5.37 N ATOM 903 NH2 ARG A 56 8.081 4.795 -15.509 1.00 7.06 N ATOM 0 H ARG A 56 12.460 0.909 -13.272 1.00 1.44 H new ATOM 0 HA ARG A 56 10.289 -0.864 -12.909 1.00 1.24 H new ATOM 0 HB2 ARG A 56 11.696 0.017 -15.443 1.00 1.24 H new ATOM 0 HB3 ARG A 56 10.302 -1.045 -15.439 1.00 1.24 H new ATOM 0 HG2 ARG A 56 9.248 0.755 -13.812 1.00 1.85 H new ATOM 0 HG3 ARG A 56 10.500 1.813 -14.432 1.00 1.85 H new ATOM 0 HD2 ARG A 56 9.674 1.287 -16.780 1.00 1.73 H new ATOM 0 HD3 ARG A 56 8.338 0.414 -16.056 1.00 1.73 H new ATOM 0 HE ARG A 56 7.312 2.428 -15.536 1.00 3.57 H new ATOM 0 HH11 ARG A 56 10.731 3.133 -16.127 1.00 5.37 H new ATOM 0 HH12 ARG A 56 10.490 4.877 -15.988 1.00 5.37 H new ATOM 0 HH21 ARG A 56 7.088 4.683 -15.305 1.00 7.06 H new ATOM 0 HH22 ARG A 56 8.494 5.727 -15.537 1.00 7.06 H new ATOM 917 N LYS A 57 13.160 -2.256 -13.778 1.00 1.20 N ATOM 918 CA LYS A 57 13.814 -3.567 -13.687 1.00 1.22 C ATOM 919 C LYS A 57 13.577 -4.212 -12.329 1.00 1.23 C ATOM 920 O LYS A 57 13.335 -5.411 -12.250 1.00 1.19 O ATOM 921 CB LYS A 57 15.318 -3.457 -13.925 1.00 1.41 C ATOM 922 CG LYS A 57 15.692 -2.711 -15.200 1.00 1.37 C ATOM 923 CD LYS A 57 14.961 -3.177 -16.476 1.00 1.50 C ATOM 924 CE LYS A 57 14.995 -4.700 -16.703 1.00 3.04 C ATOM 925 NZ LYS A 57 13.848 -5.148 -17.532 1.00 4.27 N ATOM 0 H LYS A 57 13.784 -1.472 -13.969 1.00 1.20 H new ATOM 0 HA LYS A 57 13.372 -4.191 -14.464 1.00 1.22 H new ATOM 0 HB2 LYS A 57 15.774 -2.951 -13.074 1.00 1.41 H new ATOM 0 HB3 LYS A 57 15.743 -4.460 -13.965 1.00 1.41 H new ATOM 0 HG2 LYS A 57 15.490 -1.650 -15.053 1.00 1.37 H new ATOM 0 HG3 LYS A 57 16.766 -2.812 -15.359 1.00 1.37 H new ATOM 0 HD2 LYS A 57 13.922 -2.852 -16.425 1.00 1.50 H new ATOM 0 HD3 LYS A 57 15.408 -2.682 -17.338 1.00 1.50 H new ATOM 0 HE2 LYS A 57 15.929 -4.976 -17.192 1.00 3.04 H new ATOM 0 HE3 LYS A 57 14.974 -5.214 -15.742 1.00 3.04 H new ATOM 0 HZ1 LYS A 57 13.781 -6.185 -17.500 1.00 4.27 H new ATOM 0 HZ2 LYS A 57 12.969 -4.732 -17.162 1.00 4.27 H new ATOM 0 HZ3 LYS A 57 13.989 -4.841 -18.515 1.00 4.27 H new ATOM 939 N ALA A 58 13.633 -3.406 -11.269 1.00 1.36 N ATOM 940 CA ALA A 58 13.282 -3.854 -9.916 1.00 1.41 C ATOM 941 C ALA A 58 11.834 -4.376 -9.790 1.00 1.32 C ATOM 942 O ALA A 58 11.653 -5.425 -9.172 1.00 1.67 O ATOM 943 CB ALA A 58 13.606 -2.765 -8.888 1.00 1.56 C ATOM 0 H ALA A 58 13.921 -2.429 -11.320 1.00 1.36 H new ATOM 0 HA ALA A 58 13.905 -4.722 -9.699 1.00 1.41 H new ATOM 0 HB1 ALA A 58 13.339 -3.115 -7.891 1.00 1.56 H new ATOM 0 HB2 ALA A 58 14.672 -2.540 -8.920 1.00 1.56 H new ATOM 0 HB3 ALA A 58 13.038 -1.864 -9.121 1.00 1.56 H new ATOM 949 N ALA A 59 10.854 -3.727 -10.434 1.00 1.01 N ATOM 950 CA ALA A 59 9.492 -4.247 -10.626 1.00 0.84 C ATOM 951 C ALA A 59 9.479 -5.596 -11.369 1.00 0.70 C ATOM 952 O ALA A 59 8.822 -6.544 -10.936 1.00 0.61 O ATOM 953 CB ALA A 59 8.650 -3.198 -11.385 1.00 0.91 C ATOM 0 H ALA A 59 10.989 -2.804 -10.846 1.00 1.01 H new ATOM 0 HA ALA A 59 9.058 -4.430 -9.643 1.00 0.84 H new ATOM 0 HB1 ALA A 59 7.639 -3.579 -11.530 1.00 0.91 H new ATOM 0 HB2 ALA A 59 8.611 -2.275 -10.806 1.00 0.91 H new ATOM 0 HB3 ALA A 59 9.105 -2.999 -12.355 1.00 0.91 H new ATOM 959 N ASP A 60 10.232 -5.696 -12.469 1.00 0.76 N ATOM 960 CA ASP A 60 10.261 -6.878 -13.341 1.00 0.73 C ATOM 961 C ASP A 60 10.783 -8.143 -12.622 1.00 0.85 C ATOM 962 O ASP A 60 10.270 -9.234 -12.879 1.00 0.93 O ATOM 963 CB ASP A 60 11.112 -6.623 -14.601 1.00 0.87 C ATOM 964 CG ASP A 60 10.639 -5.489 -15.521 1.00 1.19 C ATOM 965 OD1 ASP A 60 9.415 -5.363 -15.756 1.00 1.75 O ATOM 966 OD2 ASP A 60 11.549 -4.837 -16.100 1.00 2.43 O ATOM 0 H ASP A 60 10.849 -4.947 -12.785 1.00 0.76 H new ATOM 0 HA ASP A 60 9.225 -7.059 -13.628 1.00 0.73 H new ATOM 0 HB2 ASP A 60 12.133 -6.406 -14.287 1.00 0.87 H new ATOM 0 HB3 ASP A 60 11.147 -7.544 -15.183 1.00 0.87 H new ATOM 971 N LYS A 61 11.739 -8.015 -11.679 1.00 1.01 N ATOM 972 CA LYS A 61 12.166 -9.098 -10.766 1.00 1.21 C ATOM 973 C LYS A 61 10.995 -9.824 -10.109 1.00 1.23 C ATOM 974 O LYS A 61 10.987 -11.036 -9.909 1.00 1.52 O ATOM 975 CB LYS A 61 12.948 -8.512 -9.588 1.00 1.42 C ATOM 976 CG LYS A 61 14.232 -7.843 -10.022 1.00 2.14 C ATOM 977 CD LYS A 61 15.143 -7.516 -8.836 1.00 2.34 C ATOM 978 CE LYS A 61 14.426 -6.618 -7.813 1.00 1.73 C ATOM 979 NZ LYS A 61 13.698 -7.368 -6.758 1.00 2.99 N ATOM 0 H LYS A 61 12.245 -7.142 -11.527 1.00 1.01 H new ATOM 0 HA LYS A 61 12.747 -9.780 -11.387 1.00 1.21 H new ATOM 0 HB2 LYS A 61 12.323 -7.788 -9.065 1.00 1.42 H new ATOM 0 HB3 LYS A 61 13.178 -9.306 -8.877 1.00 1.42 H new ATOM 0 HG2 LYS A 61 14.762 -8.494 -10.717 1.00 2.14 H new ATOM 0 HG3 LYS A 61 13.997 -6.925 -10.562 1.00 2.14 H new ATOM 0 HD2 LYS A 61 15.461 -8.440 -8.353 1.00 2.34 H new ATOM 0 HD3 LYS A 61 16.044 -7.017 -9.193 1.00 2.34 H new ATOM 0 HE2 LYS A 61 15.160 -5.966 -7.340 1.00 1.73 H new ATOM 0 HE3 LYS A 61 13.721 -5.975 -8.340 1.00 1.73 H new ATOM 0 HZ1 LYS A 61 12.712 -7.039 -6.715 1.00 2.99 H new ATOM 0 HZ2 LYS A 61 13.714 -8.384 -6.980 1.00 2.99 H new ATOM 0 HZ3 LYS A 61 14.157 -7.208 -5.839 1.00 2.99 H new ATOM 993 N LEU A 62 10.047 -9.010 -9.665 1.00 0.95 N ATOM 994 CA LEU A 62 8.893 -9.474 -8.906 1.00 0.87 C ATOM 995 C LEU A 62 7.959 -10.289 -9.798 1.00 0.89 C ATOM 996 O LEU A 62 7.514 -11.346 -9.374 1.00 1.01 O ATOM 997 CB LEU A 62 8.119 -8.315 -8.283 1.00 0.69 C ATOM 998 CG LEU A 62 8.890 -7.111 -7.721 1.00 0.71 C ATOM 999 CD1 LEU A 62 7.829 -6.134 -7.214 1.00 0.62 C ATOM 1000 CD2 LEU A 62 9.876 -7.497 -6.609 1.00 0.88 C ATOM 0 H LEU A 62 10.057 -8.002 -9.822 1.00 0.95 H new ATOM 0 HA LEU A 62 9.271 -10.103 -8.100 1.00 0.87 H new ATOM 0 HB2 LEU A 62 7.429 -7.938 -9.038 1.00 0.69 H new ATOM 0 HB3 LEU A 62 7.514 -8.723 -7.474 1.00 0.69 H new ATOM 0 HG LEU A 62 9.513 -6.666 -8.497 1.00 0.71 H new ATOM 0 HD11 LEU A 62 8.316 -5.251 -6.800 1.00 0.62 H new ATOM 0 HD12 LEU A 62 7.183 -5.838 -8.040 1.00 0.62 H new ATOM 0 HD13 LEU A 62 7.231 -6.616 -6.440 1.00 0.62 H new ATOM 0 HD21 LEU A 62 10.390 -6.604 -6.253 1.00 0.88 H new ATOM 0 HD22 LEU A 62 9.332 -7.956 -5.784 1.00 0.88 H new ATOM 0 HD23 LEU A 62 10.607 -8.205 -7.000 1.00 0.88 H new ATOM 1012 N ILE A 63 7.721 -9.813 -11.026 1.00 0.83 N ATOM 1013 CA ILE A 63 6.873 -10.456 -12.049 1.00 0.93 C ATOM 1014 C ILE A 63 7.319 -11.896 -12.287 1.00 1.15 C ATOM 1015 O ILE A 63 6.535 -12.828 -12.145 1.00 1.27 O ATOM 1016 CB ILE A 63 6.936 -9.665 -13.383 1.00 0.83 C ATOM 1017 CG1 ILE A 63 6.676 -8.151 -13.248 1.00 0.70 C ATOM 1018 CG2 ILE A 63 5.981 -10.284 -14.422 1.00 1.06 C ATOM 1019 CD1 ILE A 63 5.353 -7.782 -12.609 1.00 0.87 C ATOM 0 H ILE A 63 8.127 -8.936 -11.351 1.00 0.83 H new ATOM 0 HA ILE A 63 5.846 -10.458 -11.684 1.00 0.93 H new ATOM 0 HB ILE A 63 7.968 -9.753 -13.723 1.00 0.83 H new ATOM 0 HG12 ILE A 63 7.481 -7.711 -12.660 1.00 0.70 H new ATOM 0 HG13 ILE A 63 6.722 -7.700 -14.239 1.00 0.70 H new ATOM 0 HG21 ILE A 63 6.038 -9.717 -15.351 1.00 1.06 H new ATOM 0 HG22 ILE A 63 6.269 -11.318 -14.610 1.00 1.06 H new ATOM 0 HG23 ILE A 63 4.960 -10.255 -14.041 1.00 1.06 H new ATOM 0 HD11 ILE A 63 5.263 -6.697 -12.559 1.00 0.87 H new ATOM 0 HD12 ILE A 63 4.535 -8.186 -13.206 1.00 0.87 H new ATOM 0 HD13 ILE A 63 5.307 -8.197 -11.602 1.00 0.87 H new ATOM 1031 N GLN A 64 8.602 -12.061 -12.602 1.00 1.24 N ATOM 1032 CA GLN A 64 9.203 -13.361 -12.907 1.00 1.50 C ATOM 1033 C GLN A 64 9.178 -14.308 -11.710 1.00 1.62 C ATOM 1034 O GLN A 64 8.858 -15.475 -11.876 1.00 1.90 O ATOM 1035 CB GLN A 64 10.593 -13.140 -13.511 1.00 1.60 C ATOM 1036 CG GLN A 64 11.631 -12.482 -12.596 1.00 1.53 C ATOM 1037 CD GLN A 64 12.951 -12.085 -13.265 1.00 1.70 C ATOM 1038 OE1 GLN A 64 13.999 -12.038 -12.643 1.00 1.65 O ATOM 1039 NE2 GLN A 64 12.962 -11.722 -14.530 1.00 2.83 N ATOM 0 H GLN A 64 9.264 -11.286 -12.654 1.00 1.24 H new ATOM 0 HA GLN A 64 8.601 -13.876 -13.656 1.00 1.50 H new ATOM 0 HB2 GLN A 64 10.984 -14.105 -13.834 1.00 1.60 H new ATOM 0 HB3 GLN A 64 10.485 -12.525 -14.404 1.00 1.60 H new ATOM 0 HG2 GLN A 64 11.186 -11.590 -12.155 1.00 1.53 H new ATOM 0 HG3 GLN A 64 11.852 -13.166 -11.777 1.00 1.53 H new ATOM 0 HE21 GLN A 64 12.101 -11.751 -15.076 1.00 2.83 H new ATOM 0 HE22 GLN A 64 13.831 -11.412 -14.964 1.00 2.83 H new ATOM 1048 N ASN A 65 9.392 -13.786 -10.505 1.00 1.51 N ATOM 1049 CA ASN A 65 9.149 -14.536 -9.252 1.00 1.73 C ATOM 1050 C ASN A 65 7.695 -15.044 -9.148 1.00 1.82 C ATOM 1051 O ASN A 65 7.439 -16.188 -8.778 1.00 2.21 O ATOM 1052 CB ASN A 65 9.563 -13.664 -8.044 1.00 1.71 C ATOM 1053 CG ASN A 65 8.579 -13.681 -6.873 1.00 2.90 C ATOM 1054 OD1 ASN A 65 8.631 -14.524 -5.994 1.00 3.65 O ATOM 1055 ND2 ASN A 65 7.640 -12.755 -6.828 1.00 3.77 N ATOM 0 H ASN A 65 9.737 -12.837 -10.358 1.00 1.51 H new ATOM 0 HA ASN A 65 9.767 -15.434 -9.255 1.00 1.73 H new ATOM 0 HB2 ASN A 65 10.536 -14.001 -7.687 1.00 1.71 H new ATOM 0 HB3 ASN A 65 9.686 -12.635 -8.382 1.00 1.71 H new ATOM 0 HD21 ASN A 65 6.966 -12.749 -6.062 1.00 3.77 H new ATOM 0 HD22 ASN A 65 7.588 -12.045 -7.559 1.00 3.77 H new ATOM 1062 N LEU A 66 6.729 -14.188 -9.481 1.00 1.52 N ATOM 1063 CA LEU A 66 5.302 -14.466 -9.329 1.00 1.55 C ATOM 1064 C LEU A 66 4.829 -15.493 -10.370 1.00 1.70 C ATOM 1065 O LEU A 66 3.961 -16.309 -10.077 1.00 1.83 O ATOM 1066 CB LEU A 66 4.553 -13.113 -9.394 1.00 1.42 C ATOM 1067 CG LEU A 66 3.512 -12.816 -8.296 1.00 1.55 C ATOM 1068 CD1 LEU A 66 2.291 -13.730 -8.371 1.00 2.39 C ATOM 1069 CD2 LEU A 66 4.125 -12.860 -6.888 1.00 1.89 C ATOM 0 H LEU A 66 6.920 -13.265 -9.871 1.00 1.52 H new ATOM 0 HA LEU A 66 5.086 -14.929 -8.366 1.00 1.55 H new ATOM 0 HB2 LEU A 66 5.297 -12.317 -9.375 1.00 1.42 H new ATOM 0 HB3 LEU A 66 4.049 -13.055 -10.359 1.00 1.42 H new ATOM 0 HG LEU A 66 3.171 -11.799 -8.489 1.00 1.55 H new ATOM 0 HD11 LEU A 66 1.594 -13.473 -7.573 1.00 2.39 H new ATOM 0 HD12 LEU A 66 1.800 -13.603 -9.336 1.00 2.39 H new ATOM 0 HD13 LEU A 66 2.606 -14.767 -8.258 1.00 2.39 H new ATOM 0 HD21 LEU A 66 3.354 -12.645 -6.148 1.00 1.89 H new ATOM 0 HD22 LEU A 66 4.539 -13.851 -6.702 1.00 1.89 H new ATOM 0 HD23 LEU A 66 4.918 -12.116 -6.813 1.00 1.89 H new ATOM 1081 N ASP A 67 5.394 -15.481 -11.576 1.00 1.76 N ATOM 1082 CA ASP A 67 5.168 -16.520 -12.596 1.00 1.94 C ATOM 1083 C ASP A 67 5.960 -17.823 -12.346 1.00 2.00 C ATOM 1084 O ASP A 67 5.458 -18.900 -12.660 1.00 2.08 O ATOM 1085 CB ASP A 67 5.406 -15.937 -14.004 1.00 2.40 C ATOM 1086 CG ASP A 67 4.256 -15.032 -14.492 1.00 2.75 C ATOM 1087 OD1 ASP A 67 3.077 -15.379 -14.240 1.00 3.57 O ATOM 1088 OD2 ASP A 67 4.534 -13.988 -15.123 1.00 3.18 O ATOM 0 H ASP A 67 6.030 -14.744 -11.882 1.00 1.76 H new ATOM 0 HA ASP A 67 4.124 -16.825 -12.521 1.00 1.94 H new ATOM 0 HB2 ASP A 67 6.333 -15.364 -14.001 1.00 2.40 H new ATOM 0 HB3 ASP A 67 5.540 -16.756 -14.711 1.00 2.40 H new ATOM 1093 N ALA A 68 7.146 -17.765 -11.734 1.00 2.11 N ATOM 1094 CA ALA A 68 7.938 -18.954 -11.394 1.00 2.43 C ATOM 1095 C ALA A 68 7.413 -19.722 -10.166 1.00 2.22 C ATOM 1096 O ALA A 68 7.559 -20.942 -10.094 1.00 2.70 O ATOM 1097 CB ALA A 68 9.386 -18.503 -11.175 1.00 2.85 C ATOM 0 H ALA A 68 7.588 -16.888 -11.458 1.00 2.11 H new ATOM 0 HA ALA A 68 7.862 -19.660 -12.221 1.00 2.43 H new ATOM 0 HB1 ALA A 68 10.001 -19.366 -10.920 1.00 2.85 H new ATOM 0 HB2 ALA A 68 9.766 -18.043 -12.087 1.00 2.85 H new ATOM 0 HB3 ALA A 68 9.422 -17.779 -10.361 1.00 2.85 H new ATOM 1103 N ASN A 69 6.815 -19.021 -9.200 1.00 1.73 N ATOM 1104 CA ASN A 69 6.387 -19.577 -7.918 1.00 1.95 C ATOM 1105 C ASN A 69 5.102 -18.914 -7.368 1.00 1.79 C ATOM 1106 O ASN A 69 5.072 -18.397 -6.250 1.00 2.76 O ATOM 1107 CB ASN A 69 7.581 -19.635 -6.941 1.00 2.93 C ATOM 1108 CG ASN A 69 8.346 -18.325 -6.749 1.00 2.62 C ATOM 1109 OD1 ASN A 69 9.464 -18.162 -7.215 1.00 4.31 O ATOM 1110 ND2 ASN A 69 7.774 -17.373 -6.041 1.00 1.72 N ATOM 0 H ASN A 69 6.611 -18.026 -9.292 1.00 1.73 H new ATOM 0 HA ASN A 69 6.072 -20.610 -8.067 1.00 1.95 H new ATOM 0 HB2 ASN A 69 7.215 -19.967 -5.969 1.00 2.93 H new ATOM 0 HB3 ASN A 69 8.279 -20.394 -7.295 1.00 2.93 H new ATOM 0 HD21 ASN A 69 8.264 -16.493 -5.879 1.00 1.72 H new ATOM 0 HD22 ASN A 69 6.841 -17.515 -5.655 1.00 1.72 H new ATOM 1117 N HIS A 70 4.017 -18.968 -8.154 1.00 1.40 N ATOM 1118 CA HIS A 70 2.645 -18.639 -7.706 1.00 1.67 C ATOM 1119 C HIS A 70 1.479 -19.164 -8.591 1.00 1.95 C ATOM 1120 O HIS A 70 0.324 -18.843 -8.310 1.00 3.41 O ATOM 1121 CB HIS A 70 2.511 -17.125 -7.449 1.00 1.74 C ATOM 1122 CG HIS A 70 2.190 -16.793 -6.019 1.00 2.67 C ATOM 1123 ND1 HIS A 70 3.071 -16.300 -5.086 1.00 3.52 N ATOM 1124 CD2 HIS A 70 0.989 -16.976 -5.391 1.00 3.49 C ATOM 1125 CE1 HIS A 70 2.414 -16.182 -3.920 1.00 4.36 C ATOM 1126 NE2 HIS A 70 1.141 -16.584 -4.055 1.00 4.41 N ATOM 0 H HIS A 70 4.063 -19.245 -9.135 1.00 1.40 H new ATOM 0 HA HIS A 70 2.526 -19.196 -6.777 1.00 1.67 H new ATOM 0 HB2 HIS A 70 3.442 -16.632 -7.730 1.00 1.74 H new ATOM 0 HB3 HIS A 70 1.730 -16.722 -8.093 1.00 1.74 H new ATOM 0 HD2 HIS A 70 0.085 -17.355 -5.844 1.00 3.49 H new ATOM 0 HE1 HIS A 70 2.850 -15.815 -3.002 1.00 4.36 H new ATOM 0 HE2 HIS A 70 0.425 -16.601 -3.328 1.00 4.41 H new ATOM 1134 N ASP A 71 1.739 -19.962 -9.642 1.00 1.91 N ATOM 1135 CA ASP A 71 0.722 -20.451 -10.602 1.00 2.08 C ATOM 1136 C ASP A 71 0.024 -19.248 -11.301 1.00 2.22 C ATOM 1137 O ASP A 71 0.606 -18.171 -11.459 1.00 3.79 O ATOM 1138 CB ASP A 71 -0.218 -21.450 -9.867 1.00 2.74 C ATOM 1139 CG ASP A 71 -1.199 -22.250 -10.742 1.00 3.17 C ATOM 1140 OD1 ASP A 71 -0.840 -23.344 -11.214 1.00 3.76 O ATOM 1141 OD2 ASP A 71 -2.350 -21.776 -10.911 1.00 4.00 O ATOM 0 H ASP A 71 2.679 -20.294 -9.856 1.00 1.91 H new ATOM 0 HA ASP A 71 1.169 -21.014 -11.422 1.00 2.08 H new ATOM 0 HB2 ASP A 71 0.402 -22.158 -9.317 1.00 2.74 H new ATOM 0 HB3 ASP A 71 -0.796 -20.893 -9.130 1.00 2.74 H new ATOM 1146 N GLY A 72 -1.240 -19.388 -11.705 1.00 1.96 N ATOM 1147 CA GLY A 72 -2.159 -18.276 -11.946 1.00 2.28 C ATOM 1148 C GLY A 72 -3.022 -17.949 -10.722 1.00 2.18 C ATOM 1149 O GLY A 72 -3.989 -17.205 -10.871 1.00 2.48 O ATOM 0 H GLY A 72 -1.662 -20.300 -11.878 1.00 1.96 H new ATOM 0 HA2 GLY A 72 -1.588 -17.392 -12.230 1.00 2.28 H new ATOM 0 HA3 GLY A 72 -2.807 -18.521 -12.788 1.00 2.28 H new ATOM 1153 N ARG A 73 -2.720 -18.497 -9.534 1.00 1.98 N ATOM 1154 CA ARG A 73 -3.511 -18.309 -8.307 1.00 2.05 C ATOM 1155 C ARG A 73 -3.193 -16.962 -7.633 1.00 2.09 C ATOM 1156 O ARG A 73 -2.587 -16.898 -6.567 1.00 3.11 O ATOM 1157 CB ARG A 73 -3.325 -19.494 -7.336 1.00 2.20 C ATOM 1158 CG ARG A 73 -3.766 -20.878 -7.849 1.00 2.45 C ATOM 1159 CD ARG A 73 -5.161 -20.873 -8.490 1.00 2.61 C ATOM 1160 NE ARG A 73 -5.764 -22.223 -8.563 1.00 3.19 N ATOM 1161 CZ ARG A 73 -5.559 -23.168 -9.481 1.00 3.90 C ATOM 1162 NH1 ARG A 73 -4.662 -23.069 -10.434 1.00 4.62 N ATOM 1163 NH2 ARG A 73 -6.275 -24.271 -9.449 1.00 4.50 N ATOM 0 H ARG A 73 -1.904 -19.094 -9.397 1.00 1.98 H new ATOM 0 HA ARG A 73 -4.563 -18.284 -8.591 1.00 2.05 H new ATOM 0 HB2 ARG A 73 -2.271 -19.551 -7.065 1.00 2.20 H new ATOM 0 HB3 ARG A 73 -3.878 -19.277 -6.422 1.00 2.20 H new ATOM 0 HG2 ARG A 73 -3.040 -21.235 -8.579 1.00 2.45 H new ATOM 0 HG3 ARG A 73 -3.758 -21.585 -7.019 1.00 2.45 H new ATOM 0 HD2 ARG A 73 -5.817 -20.218 -7.917 1.00 2.61 H new ATOM 0 HD3 ARG A 73 -5.093 -20.456 -9.495 1.00 2.61 H new ATOM 0 HE ARG A 73 -6.418 -22.460 -7.817 1.00 3.19 H new ATOM 0 HH11 ARG A 73 -4.077 -22.236 -10.499 1.00 4.62 H new ATOM 0 HH12 ARG A 73 -4.550 -23.825 -11.109 1.00 4.62 H new ATOM 0 HH21 ARG A 73 -6.982 -24.399 -8.725 1.00 4.50 H new ATOM 0 HH22 ARG A 73 -6.123 -24.998 -10.148 1.00 4.50 H new ATOM 1177 N ILE A 74 -3.636 -15.883 -8.278 1.00 1.47 N ATOM 1178 CA ILE A 74 -3.548 -14.503 -7.767 1.00 1.28 C ATOM 1179 C ILE A 74 -4.381 -14.369 -6.483 1.00 1.14 C ATOM 1180 O ILE A 74 -5.490 -14.895 -6.406 1.00 1.35 O ATOM 1181 CB ILE A 74 -3.990 -13.488 -8.855 1.00 1.50 C ATOM 1182 CG1 ILE A 74 -3.091 -13.650 -10.109 1.00 1.68 C ATOM 1183 CG2 ILE A 74 -4.006 -12.043 -8.310 1.00 1.77 C ATOM 1184 CD1 ILE A 74 -3.228 -12.557 -11.172 1.00 2.17 C ATOM 0 H ILE A 74 -4.079 -15.939 -9.195 1.00 1.47 H new ATOM 0 HA ILE A 74 -2.511 -14.275 -7.519 1.00 1.28 H new ATOM 0 HB ILE A 74 -5.017 -13.701 -9.150 1.00 1.50 H new ATOM 0 HG12 ILE A 74 -2.051 -13.687 -9.785 1.00 1.68 H new ATOM 0 HG13 ILE A 74 -3.315 -14.611 -10.572 1.00 1.68 H new ATOM 0 HG21 ILE A 74 -4.320 -11.360 -9.099 1.00 1.77 H new ATOM 0 HG22 ILE A 74 -4.703 -11.977 -7.474 1.00 1.77 H new ATOM 0 HG23 ILE A 74 -3.006 -11.771 -7.971 1.00 1.77 H new ATOM 0 HD11 ILE A 74 -2.555 -12.771 -12.002 1.00 2.17 H new ATOM 0 HD12 ILE A 74 -4.255 -12.530 -11.535 1.00 2.17 H new ATOM 0 HD13 ILE A 74 -2.971 -11.591 -10.736 1.00 2.17 H new ATOM 1196 N SER A 75 -3.862 -13.643 -5.495 1.00 0.96 N ATOM 1197 CA SER A 75 -4.608 -13.207 -4.308 1.00 0.93 C ATOM 1198 C SER A 75 -4.674 -11.675 -4.269 1.00 0.79 C ATOM 1199 O SER A 75 -3.820 -11.014 -4.860 1.00 1.08 O ATOM 1200 CB SER A 75 -3.925 -13.708 -3.026 1.00 1.15 C ATOM 1201 OG SER A 75 -3.837 -15.121 -3.013 1.00 1.64 O ATOM 0 H SER A 75 -2.890 -13.333 -5.494 1.00 0.96 H new ATOM 0 HA SER A 75 -5.614 -13.623 -4.365 1.00 0.93 H new ATOM 0 HB2 SER A 75 -2.926 -13.278 -2.951 1.00 1.15 H new ATOM 0 HB3 SER A 75 -4.485 -13.368 -2.155 1.00 1.15 H new ATOM 0 HG SER A 75 -3.397 -15.414 -2.188 1.00 1.64 H new ATOM 1207 N PHE A 76 -5.643 -11.106 -3.542 1.00 0.81 N ATOM 1208 CA PHE A 76 -5.738 -9.660 -3.286 1.00 0.73 C ATOM 1209 C PHE A 76 -4.384 -9.051 -2.865 1.00 0.68 C ATOM 1210 O PHE A 76 -3.912 -8.038 -3.381 1.00 0.72 O ATOM 1211 CB PHE A 76 -6.784 -9.458 -2.177 1.00 0.73 C ATOM 1212 CG PHE A 76 -6.853 -8.003 -1.795 1.00 0.68 C ATOM 1213 CD1 PHE A 76 -7.377 -7.100 -2.729 1.00 1.79 C ATOM 1214 CD2 PHE A 76 -6.213 -7.530 -0.636 1.00 1.75 C ATOM 1215 CE1 PHE A 76 -7.216 -5.724 -2.552 1.00 1.76 C ATOM 1216 CE2 PHE A 76 -6.091 -6.147 -0.437 1.00 1.84 C ATOM 1217 CZ PHE A 76 -6.577 -5.243 -1.394 1.00 0.82 C ATOM 0 H PHE A 76 -6.394 -11.642 -3.108 1.00 0.81 H new ATOM 0 HA PHE A 76 -6.031 -9.149 -4.203 1.00 0.73 H new ATOM 0 HB2 PHE A 76 -7.761 -9.799 -2.520 1.00 0.73 H new ATOM 0 HB3 PHE A 76 -6.524 -10.060 -1.306 1.00 0.73 H new ATOM 0 HD1 PHE A 76 -7.909 -7.471 -3.592 1.00 1.79 H new ATOM 0 HD2 PHE A 76 -5.820 -8.224 0.093 1.00 1.75 H new ATOM 0 HE1 PHE A 76 -7.579 -5.034 -3.299 1.00 1.76 H new ATOM 0 HE2 PHE A 76 -5.619 -5.775 0.460 1.00 1.84 H new ATOM 0 HZ PHE A 76 -6.461 -4.180 -1.242 1.00 0.82 H new ATOM 1227 N ASP A 77 -3.769 -9.748 -1.921 1.00 0.69 N ATOM 1228 CA ASP A 77 -2.536 -9.450 -1.208 1.00 0.73 C ATOM 1229 C ASP A 77 -1.300 -9.426 -2.136 1.00 0.72 C ATOM 1230 O ASP A 77 -0.278 -8.848 -1.761 1.00 0.72 O ATOM 1231 CB ASP A 77 -2.410 -10.504 -0.083 1.00 0.87 C ATOM 1232 CG ASP A 77 -3.756 -10.842 0.598 1.00 2.14 C ATOM 1233 OD1 ASP A 77 -4.551 -11.574 -0.044 1.00 3.08 O ATOM 1234 OD2 ASP A 77 -4.018 -10.331 1.705 1.00 3.15 O ATOM 0 H ASP A 77 -4.165 -10.632 -1.602 1.00 0.69 H new ATOM 0 HA ASP A 77 -2.575 -8.445 -0.789 1.00 0.73 H new ATOM 0 HB2 ASP A 77 -1.982 -11.417 -0.497 1.00 0.87 H new ATOM 0 HB3 ASP A 77 -1.712 -10.138 0.670 1.00 0.87 H new ATOM 1239 N GLU A 78 -1.402 -9.998 -3.349 1.00 0.81 N ATOM 1240 CA GLU A 78 -0.350 -9.968 -4.373 1.00 0.87 C ATOM 1241 C GLU A 78 0.011 -8.524 -4.741 1.00 0.68 C ATOM 1242 O GLU A 78 1.154 -8.098 -4.579 1.00 0.60 O ATOM 1243 CB GLU A 78 -0.778 -10.728 -5.638 1.00 1.21 C ATOM 1244 CG GLU A 78 0.340 -10.763 -6.692 1.00 2.23 C ATOM 1245 CD GLU A 78 -0.208 -11.025 -8.091 1.00 2.99 C ATOM 1246 OE1 GLU A 78 -0.571 -12.191 -8.352 1.00 2.98 O ATOM 1247 OE2 GLU A 78 -0.243 -10.075 -8.899 1.00 4.28 O ATOM 0 H GLU A 78 -2.236 -10.503 -3.648 1.00 0.81 H new ATOM 0 HA GLU A 78 0.526 -10.460 -3.951 1.00 0.87 H new ATOM 0 HB2 GLU A 78 -1.058 -11.747 -5.372 1.00 1.21 H new ATOM 0 HB3 GLU A 78 -1.663 -10.255 -6.063 1.00 1.21 H new ATOM 0 HG2 GLU A 78 0.877 -9.814 -6.684 1.00 2.23 H new ATOM 0 HG3 GLU A 78 1.060 -11.539 -6.432 1.00 2.23 H new ATOM 1254 N TYR A 79 -0.962 -7.748 -5.222 1.00 0.71 N ATOM 1255 CA TYR A 79 -0.731 -6.367 -5.637 1.00 0.67 C ATOM 1256 C TYR A 79 -0.102 -5.545 -4.502 1.00 0.54 C ATOM 1257 O TYR A 79 0.909 -4.867 -4.707 1.00 0.51 O ATOM 1258 CB TYR A 79 -2.067 -5.781 -6.107 1.00 0.78 C ATOM 1259 CG TYR A 79 -2.064 -4.273 -6.229 1.00 0.84 C ATOM 1260 CD1 TYR A 79 -1.394 -3.656 -7.300 1.00 1.61 C ATOM 1261 CD2 TYR A 79 -2.696 -3.489 -5.246 1.00 1.79 C ATOM 1262 CE1 TYR A 79 -1.337 -2.254 -7.388 1.00 1.70 C ATOM 1263 CE2 TYR A 79 -2.657 -2.086 -5.333 1.00 1.92 C ATOM 1264 CZ TYR A 79 -1.975 -1.465 -6.401 1.00 1.19 C ATOM 1265 OH TYR A 79 -1.941 -0.107 -6.485 1.00 1.43 O ATOM 0 H TYR A 79 -1.927 -8.059 -5.334 1.00 0.71 H new ATOM 0 HA TYR A 79 -0.018 -6.335 -6.461 1.00 0.67 H new ATOM 0 HB2 TYR A 79 -2.323 -6.214 -7.074 1.00 0.78 H new ATOM 0 HB3 TYR A 79 -2.849 -6.078 -5.408 1.00 0.78 H new ATOM 0 HD1 TYR A 79 -0.921 -4.262 -8.059 1.00 1.61 H new ATOM 0 HD2 TYR A 79 -3.211 -3.965 -4.425 1.00 1.79 H new ATOM 0 HE1 TYR A 79 -0.810 -1.782 -8.204 1.00 1.70 H new ATOM 0 HE2 TYR A 79 -3.149 -1.484 -4.583 1.00 1.92 H new ATOM 0 HH TYR A 79 -2.613 0.275 -5.883 1.00 1.43 H new ATOM 1275 N TRP A 80 -0.665 -5.646 -3.292 1.00 0.51 N ATOM 1276 CA TRP A 80 -0.182 -4.890 -2.144 1.00 0.48 C ATOM 1277 C TRP A 80 1.259 -5.252 -1.768 1.00 0.47 C ATOM 1278 O TRP A 80 2.074 -4.344 -1.581 1.00 0.53 O ATOM 1279 CB TRP A 80 -1.131 -5.060 -0.952 1.00 0.51 C ATOM 1280 CG TRP A 80 -0.899 -3.997 0.065 1.00 0.50 C ATOM 1281 CD1 TRP A 80 0.089 -3.994 0.984 1.00 0.50 C ATOM 1282 CD2 TRP A 80 -1.562 -2.701 0.174 1.00 0.51 C ATOM 1283 NE1 TRP A 80 0.110 -2.775 1.624 1.00 0.50 N ATOM 1284 CE2 TRP A 80 -0.850 -1.915 1.127 1.00 0.50 C ATOM 1285 CE3 TRP A 80 -2.662 -2.095 -0.476 1.00 0.53 C ATOM 1286 CZ2 TRP A 80 -1.179 -0.573 1.374 1.00 0.51 C ATOM 1287 CZ3 TRP A 80 -3.029 -0.765 -0.197 1.00 0.55 C ATOM 1288 CH2 TRP A 80 -2.279 -0.003 0.714 1.00 0.53 C ATOM 0 H TRP A 80 -1.461 -6.250 -3.088 1.00 0.51 H new ATOM 0 HA TRP A 80 -0.169 -3.838 -2.429 1.00 0.48 H new ATOM 0 HB2 TRP A 80 -2.165 -5.021 -1.296 1.00 0.51 H new ATOM 0 HB3 TRP A 80 -0.982 -6.041 -0.500 1.00 0.51 H new ATOM 0 HD1 TRP A 80 0.758 -4.818 1.186 1.00 0.50 H new ATOM 0 HE1 TRP A 80 0.757 -2.536 2.375 1.00 0.50 H new ATOM 0 HE3 TRP A 80 -3.230 -2.662 -1.199 1.00 0.53 H new ATOM 0 HZ2 TRP A 80 -0.592 0.015 2.064 1.00 0.51 H new ATOM 0 HZ3 TRP A 80 -3.889 -0.330 -0.684 1.00 0.55 H new ATOM 0 HH2 TRP A 80 -2.549 1.025 0.907 1.00 0.53 H new ATOM 1299 N THR A 81 1.583 -6.552 -1.689 1.00 0.50 N ATOM 1300 CA THR A 81 2.926 -7.034 -1.329 1.00 0.61 C ATOM 1301 C THR A 81 3.943 -6.748 -2.429 1.00 0.60 C ATOM 1302 O THR A 81 5.042 -6.298 -2.117 1.00 0.72 O ATOM 1303 CB THR A 81 2.880 -8.504 -0.880 1.00 0.79 C ATOM 1304 OG1 THR A 81 3.968 -8.707 -0.018 1.00 1.49 O ATOM 1305 CG2 THR A 81 2.980 -9.562 -1.977 1.00 1.56 C ATOM 0 H THR A 81 0.917 -7.302 -1.874 1.00 0.50 H new ATOM 0 HA THR A 81 3.279 -6.469 -0.466 1.00 0.61 H new ATOM 0 HB THR A 81 1.895 -8.638 -0.432 1.00 0.79 H new ATOM 0 HG1 THR A 81 3.971 -9.637 0.292 1.00 1.49 H new ATOM 0 HG21 THR A 81 2.935 -10.555 -1.530 1.00 1.56 H new ATOM 0 HG22 THR A 81 2.152 -9.441 -2.676 1.00 1.56 H new ATOM 0 HG23 THR A 81 3.924 -9.446 -2.510 1.00 1.56 H new ATOM 1313 N LEU A 82 3.563 -6.905 -3.706 1.00 0.54 N ATOM 1314 CA LEU A 82 4.418 -6.569 -4.845 1.00 0.58 C ATOM 1315 C LEU A 82 4.845 -5.104 -4.822 1.00 0.67 C ATOM 1316 O LEU A 82 6.020 -4.845 -5.040 1.00 0.83 O ATOM 1317 CB LEU A 82 3.707 -6.834 -6.183 1.00 0.46 C ATOM 1318 CG LEU A 82 3.556 -8.283 -6.674 1.00 0.52 C ATOM 1319 CD1 LEU A 82 2.779 -8.253 -7.997 1.00 0.57 C ATOM 1320 CD2 LEU A 82 4.912 -8.923 -6.965 1.00 0.60 C ATOM 0 H LEU A 82 2.649 -7.270 -3.974 1.00 0.54 H new ATOM 0 HA LEU A 82 5.296 -7.208 -4.757 1.00 0.58 H new ATOM 0 HB2 LEU A 82 2.708 -6.404 -6.115 1.00 0.46 H new ATOM 0 HB3 LEU A 82 4.241 -6.279 -6.955 1.00 0.46 H new ATOM 0 HG LEU A 82 3.049 -8.857 -5.899 1.00 0.52 H new ATOM 0 HD11 LEU A 82 2.656 -9.270 -8.370 1.00 0.57 H new ATOM 0 HD12 LEU A 82 1.799 -7.806 -7.833 1.00 0.57 H new ATOM 0 HD13 LEU A 82 3.329 -7.662 -8.729 1.00 0.57 H new ATOM 0 HD21 LEU A 82 4.765 -9.947 -7.310 1.00 0.60 H new ATOM 0 HD22 LEU A 82 5.426 -8.351 -7.737 1.00 0.60 H new ATOM 0 HD23 LEU A 82 5.514 -8.929 -6.056 1.00 0.60 H new ATOM 1332 N ILE A 83 3.931 -4.152 -4.579 1.00 0.61 N ATOM 1333 CA ILE A 83 4.260 -2.708 -4.583 1.00 0.70 C ATOM 1334 C ILE A 83 5.483 -2.373 -3.710 1.00 0.78 C ATOM 1335 O ILE A 83 6.325 -1.602 -4.169 1.00 0.87 O ATOM 1336 CB ILE A 83 3.010 -1.848 -4.255 1.00 0.68 C ATOM 1337 CG1 ILE A 83 1.967 -1.846 -5.401 1.00 0.78 C ATOM 1338 CG2 ILE A 83 3.372 -0.389 -3.923 1.00 0.80 C ATOM 1339 CD1 ILE A 83 2.369 -1.122 -6.690 1.00 0.95 C ATOM 0 H ILE A 83 2.952 -4.352 -4.376 1.00 0.61 H new ATOM 0 HA ILE A 83 4.562 -2.444 -5.596 1.00 0.70 H new ATOM 0 HB ILE A 83 2.571 -2.320 -3.376 1.00 0.68 H new ATOM 0 HG12 ILE A 83 1.732 -2.881 -5.650 1.00 0.78 H new ATOM 0 HG13 ILE A 83 1.050 -1.392 -5.027 1.00 0.78 H new ATOM 0 HG21 ILE A 83 2.463 0.170 -3.701 1.00 0.80 H new ATOM 0 HG22 ILE A 83 4.033 -0.366 -3.056 1.00 0.80 H new ATOM 0 HG23 ILE A 83 3.877 0.064 -4.776 1.00 0.80 H new ATOM 0 HD11 ILE A 83 1.557 -1.191 -7.414 1.00 0.95 H new ATOM 0 HD12 ILE A 83 2.572 -0.074 -6.470 1.00 0.95 H new ATOM 0 HD13 ILE A 83 3.264 -1.586 -7.104 1.00 0.95 H new ATOM 1351 N GLY A 84 5.673 -3.026 -2.555 1.00 0.79 N ATOM 1352 CA GLY A 84 6.857 -2.825 -1.699 1.00 0.88 C ATOM 1353 C GLY A 84 8.194 -3.130 -2.392 1.00 0.83 C ATOM 1354 O GLY A 84 9.239 -2.626 -1.993 1.00 0.94 O ATOM 0 H GLY A 84 5.012 -3.709 -2.185 1.00 0.79 H new ATOM 0 HA2 GLY A 84 6.868 -1.792 -1.351 1.00 0.88 H new ATOM 0 HA3 GLY A 84 6.765 -3.458 -0.817 1.00 0.88 H new ATOM 1358 N GLY A 85 8.181 -3.904 -3.483 1.00 0.73 N ATOM 1359 CA GLY A 85 9.358 -4.201 -4.305 1.00 0.71 C ATOM 1360 C GLY A 85 9.739 -3.093 -5.292 1.00 0.65 C ATOM 1361 O GLY A 85 10.702 -3.269 -6.039 1.00 0.97 O ATOM 0 H GLY A 85 7.331 -4.352 -3.826 1.00 0.73 H new ATOM 0 HA2 GLY A 85 10.206 -4.392 -3.647 1.00 0.71 H new ATOM 0 HA3 GLY A 85 9.174 -5.119 -4.862 1.00 0.71 H new ATOM 1365 N ILE A 86 9.006 -1.971 -5.318 1.00 0.66 N ATOM 1366 CA ILE A 86 9.289 -0.760 -6.122 1.00 0.63 C ATOM 1367 C ILE A 86 9.121 0.507 -5.271 1.00 0.50 C ATOM 1368 O ILE A 86 10.001 1.374 -5.280 1.00 0.55 O ATOM 1369 CB ILE A 86 8.394 -0.654 -7.389 1.00 0.74 C ATOM 1370 CG1 ILE A 86 8.011 -1.987 -8.063 1.00 0.86 C ATOM 1371 CG2 ILE A 86 9.131 0.206 -8.432 1.00 1.00 C ATOM 1372 CD1 ILE A 86 6.781 -2.649 -7.437 1.00 0.83 C ATOM 0 H ILE A 86 8.160 -1.872 -4.756 1.00 0.66 H new ATOM 0 HA ILE A 86 10.323 -0.849 -6.455 1.00 0.63 H new ATOM 0 HB ILE A 86 7.457 -0.219 -7.041 1.00 0.74 H new ATOM 0 HG12 ILE A 86 7.821 -1.810 -9.122 1.00 0.86 H new ATOM 0 HG13 ILE A 86 8.856 -2.673 -8.002 1.00 0.86 H new ATOM 0 HG21 ILE A 86 8.519 0.293 -9.330 1.00 1.00 H new ATOM 0 HG22 ILE A 86 9.315 1.199 -8.021 1.00 1.00 H new ATOM 0 HG23 ILE A 86 10.082 -0.264 -8.685 1.00 1.00 H new ATOM 0 HD11 ILE A 86 6.566 -3.582 -7.958 1.00 0.83 H new ATOM 0 HD12 ILE A 86 6.976 -2.857 -6.385 1.00 0.83 H new ATOM 0 HD13 ILE A 86 5.925 -1.980 -7.522 1.00 0.83 H new ATOM 1384 N THR A 87 8.029 0.580 -4.497 1.00 0.46 N ATOM 1385 CA THR A 87 7.816 1.490 -3.364 1.00 0.53 C ATOM 1386 C THR A 87 8.623 0.945 -2.193 1.00 0.77 C ATOM 1387 O THR A 87 8.074 0.399 -1.247 1.00 1.45 O ATOM 1388 CB THR A 87 6.313 1.589 -3.053 1.00 0.60 C ATOM 1389 OG1 THR A 87 5.679 2.091 -4.207 1.00 0.64 O ATOM 1390 CG2 THR A 87 5.944 2.523 -1.894 1.00 0.90 C ATOM 0 H THR A 87 7.226 -0.029 -4.654 1.00 0.46 H new ATOM 0 HA THR A 87 8.151 2.503 -3.586 1.00 0.53 H new ATOM 0 HB THR A 87 5.995 0.589 -2.758 1.00 0.60 H new ATOM 0 HG1 THR A 87 4.715 2.166 -4.045 1.00 0.64 H new ATOM 0 HG21 THR A 87 4.863 2.522 -1.756 1.00 0.90 H new ATOM 0 HG22 THR A 87 6.427 2.177 -0.980 1.00 0.90 H new ATOM 0 HG23 THR A 87 6.280 3.535 -2.121 1.00 0.90 H new ATOM 1398 N GLY A 88 9.943 1.072 -2.311 1.00 0.72 N ATOM 1399 CA GLY A 88 10.927 0.621 -1.323 1.00 0.87 C ATOM 1400 C GLY A 88 12.175 1.503 -1.348 1.00 0.90 C ATOM 1401 O GLY A 88 12.284 2.408 -0.522 1.00 0.96 O ATOM 0 H GLY A 88 10.375 1.507 -3.126 1.00 0.72 H new ATOM 0 HA2 GLY A 88 10.483 0.641 -0.328 1.00 0.87 H new ATOM 0 HA3 GLY A 88 11.204 -0.413 -1.527 1.00 0.87 H new ATOM 1405 N PRO A 89 13.092 1.332 -2.322 1.00 0.95 N ATOM 1406 CA PRO A 89 14.350 2.083 -2.382 1.00 1.19 C ATOM 1407 C PRO A 89 14.155 3.599 -2.539 1.00 1.25 C ATOM 1408 O PRO A 89 14.922 4.377 -1.977 1.00 1.46 O ATOM 1409 CB PRO A 89 15.122 1.487 -3.565 1.00 1.26 C ATOM 1410 CG PRO A 89 14.035 0.876 -4.452 1.00 1.02 C ATOM 1411 CD PRO A 89 13.006 0.394 -3.433 1.00 0.88 C ATOM 0 HA PRO A 89 14.893 1.986 -1.442 1.00 1.19 H new ATOM 0 HB2 PRO A 89 15.688 2.252 -4.097 1.00 1.26 H new ATOM 0 HB3 PRO A 89 15.837 0.733 -3.235 1.00 1.26 H new ATOM 0 HG2 PRO A 89 13.613 1.609 -5.139 1.00 1.02 H new ATOM 0 HG3 PRO A 89 14.420 0.056 -5.058 1.00 1.02 H new ATOM 0 HD2 PRO A 89 12.004 0.384 -3.862 1.00 0.88 H new ATOM 0 HD3 PRO A 89 13.223 -0.623 -3.106 1.00 0.88 H new ATOM 1419 N ILE A 90 13.117 4.037 -3.261 1.00 1.17 N ATOM 1420 CA ILE A 90 12.811 5.463 -3.489 1.00 1.28 C ATOM 1421 C ILE A 90 12.024 6.140 -2.348 1.00 1.29 C ATOM 1422 O ILE A 90 11.697 7.313 -2.448 1.00 1.16 O ATOM 1423 CB ILE A 90 12.082 5.641 -4.837 1.00 1.29 C ATOM 1424 CG1 ILE A 90 10.756 4.853 -4.866 1.00 1.23 C ATOM 1425 CG2 ILE A 90 12.983 5.240 -6.015 1.00 1.37 C ATOM 1426 CD1 ILE A 90 9.673 5.596 -5.644 1.00 1.27 C ATOM 0 H ILE A 90 12.454 3.406 -3.711 1.00 1.17 H new ATOM 0 HA ILE A 90 13.773 5.974 -3.514 1.00 1.28 H new ATOM 0 HB ILE A 90 11.844 6.699 -4.942 1.00 1.29 H new ATOM 0 HG12 ILE A 90 10.924 3.876 -5.319 1.00 1.23 H new ATOM 0 HG13 ILE A 90 10.415 4.677 -3.846 1.00 1.23 H new ATOM 0 HG21 ILE A 90 12.441 5.377 -6.951 1.00 1.37 H new ATOM 0 HG22 ILE A 90 13.876 5.864 -6.019 1.00 1.37 H new ATOM 0 HG23 ILE A 90 13.272 4.194 -5.912 1.00 1.37 H new ATOM 0 HD11 ILE A 90 8.755 5.008 -5.641 1.00 1.27 H new ATOM 0 HD12 ILE A 90 9.487 6.562 -5.176 1.00 1.27 H new ATOM 0 HD13 ILE A 90 10.003 5.749 -6.672 1.00 1.27 H new ATOM 1438 N ALA A 91 11.690 5.423 -1.281 1.00 1.45 N ATOM 1439 CA ALA A 91 10.881 5.835 -0.119 1.00 1.57 C ATOM 1440 C ALA A 91 11.060 7.294 0.337 1.00 0.99 C ATOM 1441 O ALA A 91 10.108 8.075 0.289 1.00 0.68 O ATOM 1442 CB ALA A 91 11.185 4.871 1.027 1.00 2.34 C ATOM 0 H ALA A 91 12.000 4.455 -1.190 1.00 1.45 H new ATOM 0 HA ALA A 91 9.838 5.789 -0.431 1.00 1.57 H new ATOM 0 HB1 ALA A 91 10.600 5.151 1.903 1.00 2.34 H new ATOM 0 HB2 ALA A 91 10.926 3.856 0.727 1.00 2.34 H new ATOM 0 HB3 ALA A 91 12.247 4.918 1.270 1.00 2.34 H new ATOM 1448 N LYS A 92 12.268 7.703 0.743 1.00 1.21 N ATOM 1449 CA LYS A 92 12.512 9.106 1.112 1.00 1.27 C ATOM 1450 C LYS A 92 12.082 10.069 -0.002 1.00 1.13 C ATOM 1451 O LYS A 92 11.505 11.108 0.305 1.00 1.41 O ATOM 1452 CB LYS A 92 13.968 9.452 1.487 1.00 2.04 C ATOM 1453 CG LYS A 92 15.064 8.382 1.532 1.00 1.92 C ATOM 1454 CD LYS A 92 16.454 8.975 1.207 1.00 2.51 C ATOM 1455 CE LYS A 92 16.715 10.419 1.699 1.00 3.47 C ATOM 1456 NZ LYS A 92 16.584 11.440 0.621 1.00 4.43 N ATOM 0 H LYS A 92 13.082 7.094 0.824 1.00 1.21 H new ATOM 0 HA LYS A 92 11.904 9.230 2.008 1.00 1.27 H new ATOM 0 HB2 LYS A 92 14.302 10.216 0.785 1.00 2.04 H new ATOM 0 HB3 LYS A 92 13.938 9.916 2.473 1.00 2.04 H new ATOM 0 HG2 LYS A 92 15.086 7.924 2.521 1.00 1.92 H new ATOM 0 HG3 LYS A 92 14.830 7.591 0.820 1.00 1.92 H new ATOM 0 HD2 LYS A 92 17.214 8.324 1.639 1.00 2.51 H new ATOM 0 HD3 LYS A 92 16.592 8.952 0.126 1.00 2.51 H new ATOM 0 HE2 LYS A 92 16.015 10.655 2.501 1.00 3.47 H new ATOM 0 HE3 LYS A 92 17.717 10.475 2.124 1.00 3.47 H new ATOM 0 HZ1 LYS A 92 16.619 12.392 1.038 1.00 4.43 H new ATOM 0 HZ2 LYS A 92 17.365 11.331 -0.057 1.00 4.43 H new ATOM 0 HZ3 LYS A 92 15.677 11.311 0.129 1.00 4.43 H new ATOM 1470 N LEU A 93 12.346 9.719 -1.266 1.00 0.94 N ATOM 1471 CA LEU A 93 12.055 10.571 -2.413 1.00 1.20 C ATOM 1472 C LEU A 93 10.544 10.728 -2.574 1.00 1.46 C ATOM 1473 O LEU A 93 10.083 11.852 -2.716 1.00 2.02 O ATOM 1474 CB LEU A 93 12.769 9.993 -3.653 1.00 1.02 C ATOM 1475 CG LEU A 93 12.978 11.004 -4.794 1.00 1.58 C ATOM 1476 CD1 LEU A 93 14.162 10.555 -5.661 1.00 1.35 C ATOM 1477 CD2 LEU A 93 11.742 11.154 -5.696 1.00 2.14 C ATOM 0 H LEU A 93 12.772 8.827 -1.518 1.00 0.94 H new ATOM 0 HA LEU A 93 12.440 11.580 -2.269 1.00 1.20 H new ATOM 0 HB2 LEU A 93 13.740 9.601 -3.349 1.00 1.02 H new ATOM 0 HB3 LEU A 93 12.190 9.151 -4.031 1.00 1.02 H new ATOM 0 HG LEU A 93 13.169 11.971 -4.329 1.00 1.58 H new ATOM 0 HD11 LEU A 93 14.312 11.270 -6.470 1.00 1.35 H new ATOM 0 HD12 LEU A 93 15.063 10.505 -5.049 1.00 1.35 H new ATOM 0 HD13 LEU A 93 13.953 9.571 -6.080 1.00 1.35 H new ATOM 0 HD21 LEU A 93 11.951 11.880 -6.482 1.00 2.14 H new ATOM 0 HD22 LEU A 93 11.501 10.191 -6.147 1.00 2.14 H new ATOM 0 HD23 LEU A 93 10.896 11.497 -5.100 1.00 2.14 H new ATOM 1489 N ILE A 94 9.782 9.640 -2.413 1.00 1.35 N ATOM 1490 CA ILE A 94 8.308 9.670 -2.322 1.00 1.94 C ATOM 1491 C ILE A 94 7.865 10.687 -1.272 1.00 2.16 C ATOM 1492 O ILE A 94 7.089 11.582 -1.559 1.00 2.82 O ATOM 1493 CB ILE A 94 7.730 8.284 -1.978 1.00 2.05 C ATOM 1494 CG1 ILE A 94 8.179 7.204 -2.969 1.00 2.30 C ATOM 1495 CG2 ILE A 94 6.199 8.347 -1.868 1.00 2.70 C ATOM 1496 CD1 ILE A 94 7.737 5.825 -2.497 1.00 2.59 C ATOM 0 H ILE A 94 10.171 8.700 -2.341 1.00 1.35 H new ATOM 0 HA ILE A 94 7.925 9.963 -3.300 1.00 1.94 H new ATOM 0 HB ILE A 94 8.130 7.996 -1.006 1.00 2.05 H new ATOM 0 HG12 ILE A 94 7.759 7.409 -3.954 1.00 2.30 H new ATOM 0 HG13 ILE A 94 9.264 7.228 -3.074 1.00 2.30 H new ATOM 0 HG21 ILE A 94 5.811 7.358 -1.625 1.00 2.70 H new ATOM 0 HG22 ILE A 94 5.919 9.050 -1.083 1.00 2.70 H new ATOM 0 HG23 ILE A 94 5.779 8.678 -2.818 1.00 2.70 H new ATOM 0 HD11 ILE A 94 8.065 5.073 -3.214 1.00 2.59 H new ATOM 0 HD12 ILE A 94 8.179 5.615 -1.523 1.00 2.59 H new ATOM 0 HD13 ILE A 94 6.650 5.799 -2.416 1.00 2.59 H new ATOM 1508 N HIS A 95 8.369 10.567 -0.046 1.00 1.70 N ATOM 1509 CA HIS A 95 8.012 11.481 1.054 1.00 1.92 C ATOM 1510 C HIS A 95 8.398 12.943 0.762 1.00 2.46 C ATOM 1511 O HIS A 95 7.679 13.874 1.122 1.00 2.99 O ATOM 1512 CB HIS A 95 8.670 10.976 2.364 1.00 1.35 C ATOM 1513 CG HIS A 95 9.387 12.023 3.191 1.00 1.09 C ATOM 1514 ND1 HIS A 95 8.794 13.084 3.828 1.00 1.18 N ATOM 1515 CD2 HIS A 95 10.737 12.136 3.402 1.00 1.82 C ATOM 1516 CE1 HIS A 95 9.753 13.805 4.424 1.00 1.95 C ATOM 1517 NE2 HIS A 95 10.972 13.280 4.180 1.00 2.51 N ATOM 0 H HIS A 95 9.033 9.840 0.220 1.00 1.70 H new ATOM 0 HA HIS A 95 6.927 11.477 1.162 1.00 1.92 H new ATOM 0 HB2 HIS A 95 7.898 10.519 2.983 1.00 1.35 H new ATOM 0 HB3 HIS A 95 9.382 10.191 2.111 1.00 1.35 H new ATOM 0 HD2 HIS A 95 11.492 11.459 3.032 1.00 1.82 H new ATOM 0 HE1 HIS A 95 9.574 14.688 5.020 1.00 1.95 H new ATOM 0 HE2 HIS A 95 11.874 13.639 4.495 1.00 2.51 H new ATOM 1525 N GLU A 96 9.580 13.148 0.177 1.00 2.37 N ATOM 1526 CA GLU A 96 10.204 14.461 0.037 1.00 2.80 C ATOM 1527 C GLU A 96 9.880 15.130 -1.307 1.00 2.95 C ATOM 1528 O GLU A 96 10.275 16.268 -1.559 1.00 3.20 O ATOM 1529 CB GLU A 96 11.676 14.354 0.447 1.00 2.72 C ATOM 1530 CG GLU A 96 12.690 13.977 -0.619 1.00 2.81 C ATOM 1531 CD GLU A 96 13.869 13.189 -0.013 1.00 2.71 C ATOM 1532 OE1 GLU A 96 14.266 13.434 1.154 1.00 3.18 O ATOM 1533 OE2 GLU A 96 14.391 12.262 -0.670 1.00 3.17 O ATOM 0 H GLU A 96 10.138 12.392 -0.219 1.00 2.37 H new ATOM 0 HA GLU A 96 9.768 15.182 0.728 1.00 2.80 H new ATOM 0 HB2 GLU A 96 11.976 15.314 0.867 1.00 2.72 H new ATOM 0 HB3 GLU A 96 11.746 13.619 1.249 1.00 2.72 H new ATOM 0 HG2 GLU A 96 12.206 13.377 -1.389 1.00 2.81 H new ATOM 0 HG3 GLU A 96 13.063 14.879 -1.105 1.00 2.81 H new ATOM 1540 N GLN A 97 9.084 14.450 -2.138 1.00 2.92 N ATOM 1541 CA GLN A 97 8.385 15.001 -3.289 1.00 3.29 C ATOM 1542 C GLN A 97 7.386 16.092 -2.900 1.00 3.20 C ATOM 1543 O GLN A 97 7.263 17.046 -3.659 1.00 3.64 O ATOM 1544 CB GLN A 97 7.702 13.857 -4.058 1.00 3.51 C ATOM 1545 CG GLN A 97 8.491 13.502 -5.316 1.00 3.74 C ATOM 1546 CD GLN A 97 8.283 14.462 -6.487 1.00 4.72 C ATOM 1547 OE1 GLN A 97 8.528 14.088 -7.624 1.00 5.72 O ATOM 1548 NE2 GLN A 97 7.818 15.691 -6.328 1.00 4.70 N ATOM 0 H GLN A 97 8.905 13.453 -2.015 1.00 2.92 H new ATOM 0 HA GLN A 97 9.116 15.486 -3.936 1.00 3.29 H new ATOM 0 HB2 GLN A 97 7.619 12.980 -3.416 1.00 3.51 H new ATOM 0 HB3 GLN A 97 6.688 14.150 -4.330 1.00 3.51 H new ATOM 0 HG2 GLN A 97 9.552 13.476 -5.069 1.00 3.74 H new ATOM 0 HG3 GLN A 97 8.212 12.497 -5.633 1.00 3.74 H new ATOM 0 HE21 GLN A 97 7.602 16.038 -5.393 1.00 4.70 H new ATOM 0 HE22 GLN A 97 7.675 16.291 -7.140 1.00 4.70 H new ATOM 1557 N GLU A 98 6.796 16.041 -1.699 1.00 2.64 N ATOM 1558 CA GLU A 98 5.956 17.119 -1.134 1.00 2.50 C ATOM 1559 C GLU A 98 6.799 18.321 -0.666 1.00 2.57 C ATOM 1560 O GLU A 98 6.336 19.210 0.046 1.00 2.52 O ATOM 1561 CB GLU A 98 5.108 16.605 0.044 1.00 2.21 C ATOM 1562 CG GLU A 98 4.458 15.244 -0.195 1.00 2.31 C ATOM 1563 CD GLU A 98 3.406 15.247 -1.314 1.00 2.68 C ATOM 1564 OE1 GLU A 98 3.807 15.368 -2.495 1.00 2.53 O ATOM 1565 OE2 GLU A 98 2.207 15.081 -0.994 1.00 3.84 O ATOM 0 H GLU A 98 6.887 15.238 -1.077 1.00 2.64 H new ATOM 0 HA GLU A 98 5.296 17.449 -1.936 1.00 2.50 H new ATOM 0 HB2 GLU A 98 5.739 16.542 0.930 1.00 2.21 H new ATOM 0 HB3 GLU A 98 4.327 17.334 0.260 1.00 2.21 H new ATOM 0 HG2 GLU A 98 5.234 14.519 -0.441 1.00 2.31 H new ATOM 0 HG3 GLU A 98 3.990 14.908 0.730 1.00 2.31 H new ATOM 1572 N GLN A 99 8.093 18.298 -0.979 1.00 2.87 N ATOM 1573 CA GLN A 99 9.038 19.389 -0.724 1.00 3.27 C ATOM 1574 C GLN A 99 9.666 19.843 -2.041 1.00 3.81 C ATOM 1575 O GLN A 99 9.550 21.007 -2.400 1.00 4.21 O ATOM 1576 CB GLN A 99 10.131 18.967 0.269 1.00 3.19 C ATOM 1577 CG GLN A 99 9.574 18.250 1.506 1.00 2.85 C ATOM 1578 CD GLN A 99 10.037 18.913 2.788 1.00 2.87 C ATOM 1579 OE1 GLN A 99 10.967 18.464 3.436 1.00 3.12 O ATOM 1580 NE2 GLN A 99 9.444 20.032 3.150 1.00 3.01 N ATOM 0 H GLN A 99 8.529 17.495 -1.432 1.00 2.87 H new ATOM 0 HA GLN A 99 8.489 20.218 -0.277 1.00 3.27 H new ATOM 0 HB2 GLN A 99 10.839 18.310 -0.236 1.00 3.19 H new ATOM 0 HB3 GLN A 99 10.686 19.850 0.587 1.00 3.19 H new ATOM 0 HG2 GLN A 99 8.485 18.250 1.468 1.00 2.85 H new ATOM 0 HG3 GLN A 99 9.893 17.208 1.498 1.00 2.85 H new ATOM 0 HE21 GLN A 99 8.667 20.398 2.600 1.00 3.01 H new ATOM 0 HE22 GLN A 99 9.762 20.532 3.980 1.00 3.01 H new ATOM 1677 N TYR B 108 1.098 13.718 -12.143 1.00 2.03 N ATOM 1678 CA TYR B 108 1.080 13.012 -10.843 1.00 1.65 C ATOM 1679 C TYR B 108 -0.346 12.519 -10.522 1.00 1.51 C ATOM 1680 O TYR B 108 -1.200 13.280 -10.051 1.00 1.80 O ATOM 1681 CB TYR B 108 1.678 13.821 -9.674 1.00 1.61 C ATOM 1682 CG TYR B 108 3.179 14.029 -9.724 1.00 1.59 C ATOM 1683 CD1 TYR B 108 3.726 14.953 -10.639 1.00 2.29 C ATOM 1684 CD2 TYR B 108 4.029 13.325 -8.845 1.00 2.37 C ATOM 1685 CE1 TYR B 108 5.114 15.166 -10.684 1.00 2.42 C ATOM 1686 CE2 TYR B 108 5.422 13.540 -8.880 1.00 2.39 C ATOM 1687 CZ TYR B 108 5.966 14.468 -9.801 1.00 1.78 C ATOM 1688 OH TYR B 108 7.300 14.731 -9.850 1.00 2.01 O ATOM 0 HA TYR B 108 1.741 12.152 -10.953 1.00 1.65 H new ATOM 0 HB2 TYR B 108 1.194 14.797 -9.646 1.00 1.61 H new ATOM 0 HB3 TYR B 108 1.430 13.315 -8.741 1.00 1.61 H new ATOM 0 HD1 TYR B 108 3.076 15.498 -11.307 1.00 2.29 H new ATOM 0 HD2 TYR B 108 3.611 12.619 -8.143 1.00 2.37 H new ATOM 0 HE1 TYR B 108 5.530 15.865 -11.395 1.00 2.42 H new ATOM 0 HE2 TYR B 108 6.071 12.999 -8.207 1.00 2.39 H new ATOM 0 HH TYR B 108 7.752 14.268 -9.114 1.00 2.01 H new ATOM 1698 N THR B 109 -0.620 11.239 -10.806 1.00 1.24 N ATOM 1699 CA THR B 109 -1.952 10.601 -10.698 1.00 1.07 C ATOM 1700 C THR B 109 -2.369 10.419 -9.236 1.00 0.96 C ATOM 1701 O THR B 109 -1.513 10.469 -8.354 1.00 1.05 O ATOM 1702 CB THR B 109 -1.954 9.246 -11.425 1.00 0.97 C ATOM 1703 OG1 THR B 109 -1.215 8.330 -10.651 1.00 1.19 O ATOM 1704 CG2 THR B 109 -1.380 9.312 -12.847 1.00 1.06 C ATOM 0 H THR B 109 0.099 10.592 -11.129 1.00 1.24 H new ATOM 0 HA THR B 109 -2.678 11.261 -11.173 1.00 1.07 H new ATOM 0 HB THR B 109 -2.991 8.930 -11.535 1.00 0.97 H new ATOM 0 HG1 THR B 109 -0.554 7.881 -11.218 1.00 1.19 H new ATOM 0 HG21 THR B 109 -1.413 8.321 -13.299 1.00 1.06 H new ATOM 0 HG22 THR B 109 -1.972 10.004 -13.446 1.00 1.06 H new ATOM 0 HG23 THR B 109 -0.347 9.658 -12.807 1.00 1.06 H new ATOM 1712 N GLU B 110 -3.655 10.176 -8.942 1.00 0.88 N ATOM 1713 CA GLU B 110 -4.071 9.975 -7.563 1.00 0.85 C ATOM 1714 C GLU B 110 -3.479 8.714 -6.951 1.00 0.75 C ATOM 1715 O GLU B 110 -3.113 8.762 -5.790 1.00 0.88 O ATOM 1716 CB GLU B 110 -5.596 9.955 -7.426 1.00 0.88 C ATOM 1717 CG GLU B 110 -6.008 10.267 -5.979 1.00 1.09 C ATOM 1718 CD GLU B 110 -5.494 11.652 -5.598 1.00 1.69 C ATOM 1719 OE1 GLU B 110 -5.899 12.631 -6.263 1.00 1.78 O ATOM 1720 OE2 GLU B 110 -4.523 11.769 -4.819 1.00 2.98 O ATOM 0 H GLU B 110 -4.405 10.116 -9.631 1.00 0.88 H new ATOM 0 HA GLU B 110 -3.682 10.829 -7.009 1.00 0.85 H new ATOM 0 HB2 GLU B 110 -6.038 10.687 -8.102 1.00 0.88 H new ATOM 0 HB3 GLU B 110 -5.981 8.978 -7.718 1.00 0.88 H new ATOM 0 HG2 GLU B 110 -7.093 10.229 -5.881 1.00 1.09 H new ATOM 0 HG3 GLU B 110 -5.600 9.516 -5.302 1.00 1.09 H new ATOM 1727 N LEU B 111 -3.292 7.629 -7.708 1.00 0.64 N ATOM 1728 CA LEU B 111 -2.583 6.451 -7.207 1.00 0.59 C ATOM 1729 C LEU B 111 -1.211 6.886 -6.649 1.00 0.59 C ATOM 1730 O LEU B 111 -0.850 6.592 -5.507 1.00 0.57 O ATOM 1731 CB LEU B 111 -2.466 5.428 -8.360 1.00 0.67 C ATOM 1732 CG LEU B 111 -2.327 3.958 -7.916 1.00 0.71 C ATOM 1733 CD1 LEU B 111 -1.869 3.109 -9.109 1.00 0.90 C ATOM 1734 CD2 LEU B 111 -1.370 3.759 -6.735 1.00 0.76 C ATOM 0 H LEU B 111 -3.622 7.543 -8.669 1.00 0.64 H new ATOM 0 HA LEU B 111 -3.123 5.973 -6.390 1.00 0.59 H new ATOM 0 HB2 LEU B 111 -3.347 5.518 -8.996 1.00 0.67 H new ATOM 0 HB3 LEU B 111 -1.603 5.690 -8.972 1.00 0.67 H new ATOM 0 HG LEU B 111 -3.309 3.639 -7.568 1.00 0.71 H new ATOM 0 HD11 LEU B 111 -1.770 2.069 -8.799 1.00 0.90 H new ATOM 0 HD12 LEU B 111 -2.605 3.180 -9.910 1.00 0.90 H new ATOM 0 HD13 LEU B 111 -0.907 3.474 -9.467 1.00 0.90 H new ATOM 0 HD21 LEU B 111 -1.323 2.701 -6.479 1.00 0.76 H new ATOM 0 HD22 LEU B 111 -0.375 4.110 -7.010 1.00 0.76 H new ATOM 0 HD23 LEU B 111 -1.730 4.325 -5.876 1.00 0.76 H new ATOM 1746 N GLU B 112 -0.467 7.652 -7.443 1.00 0.67 N ATOM 1747 CA GLU B 112 0.879 8.083 -7.108 1.00 0.71 C ATOM 1748 C GLU B 112 0.923 9.062 -5.925 1.00 0.71 C ATOM 1749 O GLU B 112 1.584 8.773 -4.931 1.00 0.73 O ATOM 1750 CB GLU B 112 1.501 8.677 -8.361 1.00 0.80 C ATOM 1751 CG GLU B 112 2.996 8.828 -8.135 1.00 1.02 C ATOM 1752 CD GLU B 112 3.623 9.327 -9.409 1.00 1.38 C ATOM 1753 OE1 GLU B 112 3.204 10.416 -9.844 1.00 2.08 O ATOM 1754 OE2 GLU B 112 4.499 8.614 -9.944 1.00 2.54 O ATOM 0 H GLU B 112 -0.790 7.993 -8.348 1.00 0.67 H new ATOM 0 HA GLU B 112 1.455 7.221 -6.772 1.00 0.71 H new ATOM 0 HB2 GLU B 112 1.311 8.033 -9.219 1.00 0.80 H new ATOM 0 HB3 GLU B 112 1.052 9.645 -8.584 1.00 0.80 H new ATOM 0 HG2 GLU B 112 3.187 9.526 -7.320 1.00 1.02 H new ATOM 0 HG3 GLU B 112 3.434 7.873 -7.846 1.00 1.02 H new ATOM 1761 N LYS B 113 0.181 10.173 -5.953 1.00 0.74 N ATOM 1762 CA LYS B 113 0.040 11.067 -4.812 1.00 0.81 C ATOM 1763 C LYS B 113 -0.504 10.371 -3.565 1.00 0.67 C ATOM 1764 O LYS B 113 -0.101 10.695 -2.454 1.00 0.70 O ATOM 1765 CB LYS B 113 -0.904 12.172 -5.243 1.00 0.98 C ATOM 1766 CG LYS B 113 -0.308 12.925 -6.438 1.00 2.20 C ATOM 1767 CD LYS B 113 -1.184 14.115 -6.739 1.00 2.87 C ATOM 1768 CE LYS B 113 -2.611 13.783 -7.191 1.00 3.99 C ATOM 1769 NZ LYS B 113 -3.584 13.936 -6.083 1.00 4.44 N ATOM 0 H LYS B 113 -0.340 10.475 -6.776 1.00 0.74 H new ATOM 0 HA LYS B 113 1.023 11.446 -4.531 1.00 0.81 H new ATOM 0 HB2 LYS B 113 -1.873 11.751 -5.513 1.00 0.98 H new ATOM 0 HB3 LYS B 113 -1.075 12.861 -4.416 1.00 0.98 H new ATOM 0 HG2 LYS B 113 0.708 13.250 -6.213 1.00 2.20 H new ATOM 0 HG3 LYS B 113 -0.248 12.270 -7.307 1.00 2.20 H new ATOM 0 HD2 LYS B 113 -1.239 14.739 -5.847 1.00 2.87 H new ATOM 0 HD3 LYS B 113 -0.704 14.711 -7.516 1.00 2.87 H new ATOM 0 HE2 LYS B 113 -2.893 14.437 -8.017 1.00 3.99 H new ATOM 0 HE3 LYS B 113 -2.645 12.761 -7.568 1.00 3.99 H new ATOM 0 HZ1 LYS B 113 -4.551 13.870 -6.459 1.00 4.44 H new ATOM 0 HZ2 LYS B 113 -3.433 13.183 -5.382 1.00 4.44 H new ATOM 0 HZ3 LYS B 113 -3.451 14.862 -5.630 1.00 4.44 H new ATOM 1783 N ALA B 114 -1.330 9.345 -3.729 1.00 0.57 N ATOM 1784 CA ALA B 114 -1.707 8.486 -2.618 1.00 0.54 C ATOM 1785 C ALA B 114 -0.532 7.641 -2.110 1.00 0.53 C ATOM 1786 O ALA B 114 -0.320 7.610 -0.905 1.00 0.54 O ATOM 1787 CB ALA B 114 -2.909 7.649 -2.998 1.00 0.54 C ATOM 0 H ALA B 114 -1.751 9.089 -4.622 1.00 0.57 H new ATOM 0 HA ALA B 114 -1.991 9.118 -1.776 1.00 0.54 H new ATOM 0 HB1 ALA B 114 -3.185 7.008 -2.161 1.00 0.54 H new ATOM 0 HB2 ALA B 114 -3.745 8.304 -3.245 1.00 0.54 H new ATOM 0 HB3 ALA B 114 -2.664 7.031 -3.862 1.00 0.54 H new ATOM 1793 N VAL B 115 0.294 7.045 -2.974 1.00 0.53 N ATOM 1794 CA VAL B 115 1.583 6.460 -2.540 1.00 0.54 C ATOM 1795 C VAL B 115 2.429 7.511 -1.804 1.00 0.54 C ATOM 1796 O VAL B 115 3.044 7.175 -0.790 1.00 0.56 O ATOM 1797 CB VAL B 115 2.375 5.794 -3.694 1.00 0.58 C ATOM 1798 CG1 VAL B 115 3.793 5.354 -3.284 1.00 0.60 C ATOM 1799 CG2 VAL B 115 1.644 4.533 -4.172 1.00 0.69 C ATOM 0 H VAL B 115 0.103 6.951 -3.972 1.00 0.53 H new ATOM 0 HA VAL B 115 1.346 5.654 -1.846 1.00 0.54 H new ATOM 0 HB VAL B 115 2.450 6.551 -4.475 1.00 0.58 H new ATOM 0 HG11 VAL B 115 4.293 4.896 -4.137 1.00 0.60 H new ATOM 0 HG12 VAL B 115 4.362 6.223 -2.954 1.00 0.60 H new ATOM 0 HG13 VAL B 115 3.729 4.632 -2.470 1.00 0.60 H new ATOM 0 HG21 VAL B 115 2.207 4.071 -4.983 1.00 0.69 H new ATOM 0 HG22 VAL B 115 1.555 3.829 -3.345 1.00 0.69 H new ATOM 0 HG23 VAL B 115 0.650 4.802 -4.528 1.00 0.69 H new ATOM 1809 N ILE B 116 2.389 8.788 -2.220 1.00 0.56 N ATOM 1810 CA ILE B 116 2.942 9.873 -1.397 1.00 0.61 C ATOM 1811 C ILE B 116 2.238 9.985 -0.041 1.00 0.58 C ATOM 1812 O ILE B 116 2.911 9.766 0.955 1.00 0.62 O ATOM 1813 CB ILE B 116 3.109 11.238 -2.108 1.00 0.73 C ATOM 1814 CG1 ILE B 116 3.828 11.143 -3.472 1.00 0.74 C ATOM 1815 CG2 ILE B 116 3.935 12.094 -1.133 1.00 0.99 C ATOM 1816 CD1 ILE B 116 3.862 12.446 -4.283 1.00 0.90 C ATOM 0 H ILE B 116 1.986 9.090 -3.107 1.00 0.56 H new ATOM 0 HA ILE B 116 3.971 9.567 -1.208 1.00 0.61 H new ATOM 0 HB ILE B 116 2.131 11.661 -2.338 1.00 0.73 H new ATOM 0 HG12 ILE B 116 4.853 10.812 -3.303 1.00 0.74 H new ATOM 0 HG13 ILE B 116 3.339 10.374 -4.070 1.00 0.74 H new ATOM 0 HG21 ILE B 116 4.098 13.082 -1.564 1.00 0.99 H new ATOM 0 HG22 ILE B 116 3.396 12.194 -0.191 1.00 0.99 H new ATOM 0 HG23 ILE B 116 4.897 11.614 -0.952 1.00 0.99 H new ATOM 0 HD11 ILE B 116 4.388 12.276 -5.223 1.00 0.90 H new ATOM 0 HD12 ILE B 116 2.843 12.772 -4.491 1.00 0.90 H new ATOM 0 HD13 ILE B 116 4.380 13.217 -3.712 1.00 0.90 H new ATOM 1828 N VAL B 117 0.934 10.232 0.038 1.00 0.57 N ATOM 1829 CA VAL B 117 0.164 10.365 1.290 1.00 0.56 C ATOM 1830 C VAL B 117 0.380 9.177 2.246 1.00 0.54 C ATOM 1831 O VAL B 117 0.516 9.370 3.452 1.00 0.58 O ATOM 1832 CB VAL B 117 -1.334 10.549 0.952 1.00 0.52 C ATOM 1833 CG1 VAL B 117 -2.278 10.292 2.132 1.00 0.56 C ATOM 1834 CG2 VAL B 117 -1.598 11.965 0.412 1.00 0.57 C ATOM 0 H VAL B 117 0.355 10.351 -0.793 1.00 0.57 H new ATOM 0 HA VAL B 117 0.528 11.246 1.819 1.00 0.56 H new ATOM 0 HB VAL B 117 -1.549 9.795 0.194 1.00 0.52 H new ATOM 0 HG11 VAL B 117 -3.309 10.442 1.812 1.00 0.56 H new ATOM 0 HG12 VAL B 117 -2.152 9.268 2.482 1.00 0.56 H new ATOM 0 HG13 VAL B 117 -2.045 10.984 2.942 1.00 0.56 H new ATOM 0 HG21 VAL B 117 -2.657 12.074 0.180 1.00 0.57 H new ATOM 0 HG22 VAL B 117 -1.313 12.700 1.165 1.00 0.57 H new ATOM 0 HG23 VAL B 117 -1.010 12.125 -0.492 1.00 0.57 H new ATOM 1844 N LEU B 118 0.479 7.949 1.728 1.00 0.52 N ATOM 1845 CA LEU B 118 0.821 6.759 2.507 1.00 0.52 C ATOM 1846 C LEU B 118 2.239 6.848 3.098 1.00 0.55 C ATOM 1847 O LEU B 118 2.436 6.404 4.226 1.00 0.56 O ATOM 1848 CB LEU B 118 0.649 5.496 1.630 1.00 0.53 C ATOM 1849 CG LEU B 118 -0.761 4.864 1.666 1.00 0.63 C ATOM 1850 CD1 LEU B 118 -1.875 5.722 1.050 1.00 0.94 C ATOM 1851 CD2 LEU B 118 -0.742 3.512 0.942 1.00 0.67 C ATOM 0 H LEU B 118 0.321 7.753 0.740 1.00 0.52 H new ATOM 0 HA LEU B 118 0.138 6.694 3.354 1.00 0.52 H new ATOM 0 HB2 LEU B 118 0.890 5.753 0.598 1.00 0.53 H new ATOM 0 HB3 LEU B 118 1.374 4.748 1.950 1.00 0.53 H new ATOM 0 HG LEU B 118 -0.996 4.762 2.725 1.00 0.63 H new ATOM 0 HD11 LEU B 118 -2.825 5.192 1.123 1.00 0.94 H new ATOM 0 HD12 LEU B 118 -1.945 6.668 1.587 1.00 0.94 H new ATOM 0 HD13 LEU B 118 -1.648 5.915 0.002 1.00 0.94 H new ATOM 0 HD21 LEU B 118 -1.738 3.070 0.970 1.00 0.67 H new ATOM 0 HD22 LEU B 118 -0.439 3.659 -0.095 1.00 0.67 H new ATOM 0 HD23 LEU B 118 -0.035 2.845 1.436 1.00 0.67 H new ATOM 1863 N VAL B 119 3.201 7.427 2.375 1.00 0.64 N ATOM 1864 CA VAL B 119 4.607 7.542 2.785 1.00 0.66 C ATOM 1865 C VAL B 119 4.887 8.836 3.565 1.00 0.61 C ATOM 1866 O VAL B 119 5.699 8.779 4.475 1.00 0.71 O ATOM 1867 CB VAL B 119 5.537 7.341 1.566 1.00 0.68 C ATOM 1868 CG1 VAL B 119 7.025 7.603 1.847 1.00 0.72 C ATOM 1869 CG2 VAL B 119 5.444 5.875 1.113 1.00 1.00 C ATOM 0 H VAL B 119 3.020 7.842 1.461 1.00 0.64 H new ATOM 0 HA VAL B 119 4.826 6.742 3.492 1.00 0.66 H new ATOM 0 HB VAL B 119 5.199 8.061 0.820 1.00 0.68 H new ATOM 0 HG11 VAL B 119 7.602 7.438 0.937 1.00 0.72 H new ATOM 0 HG12 VAL B 119 7.157 8.633 2.178 1.00 0.72 H new ATOM 0 HG13 VAL B 119 7.373 6.924 2.625 1.00 0.72 H new ATOM 0 HG21 VAL B 119 6.095 5.718 0.253 1.00 1.00 H new ATOM 0 HG22 VAL B 119 5.755 5.222 1.928 1.00 1.00 H new ATOM 0 HG23 VAL B 119 4.415 5.644 0.836 1.00 1.00 H new ATOM 1879 N GLU B 120 4.178 9.950 3.344 1.00 0.58 N ATOM 1880 CA GLU B 120 4.060 11.030 4.335 1.00 0.64 C ATOM 1881 C GLU B 120 3.585 10.430 5.662 1.00 0.59 C ATOM 1882 O GLU B 120 4.240 10.629 6.687 1.00 0.66 O ATOM 1883 CB GLU B 120 3.073 12.108 3.842 1.00 0.74 C ATOM 1884 CG GLU B 120 2.877 13.292 4.812 1.00 1.39 C ATOM 1885 CD GLU B 120 2.043 12.969 6.062 1.00 2.29 C ATOM 1886 OE1 GLU B 120 1.006 12.278 5.969 1.00 3.29 O ATOM 1887 OE2 GLU B 120 2.401 13.392 7.181 1.00 2.99 O ATOM 0 H GLU B 120 3.671 10.129 2.477 1.00 0.58 H new ATOM 0 HA GLU B 120 5.030 11.507 4.477 1.00 0.64 H new ATOM 0 HB2 GLU B 120 3.425 12.494 2.885 1.00 0.74 H new ATOM 0 HB3 GLU B 120 2.105 11.640 3.661 1.00 0.74 H new ATOM 0 HG2 GLU B 120 3.857 13.650 5.128 1.00 1.39 H new ATOM 0 HG3 GLU B 120 2.397 14.109 4.273 1.00 1.39 H new ATOM 1894 N ASN B 121 2.505 9.631 5.645 1.00 0.53 N ATOM 1895 CA ASN B 121 1.921 9.146 6.884 1.00 0.59 C ATOM 1896 C ASN B 121 2.845 8.200 7.681 1.00 0.64 C ATOM 1897 O ASN B 121 2.766 8.138 8.906 1.00 0.82 O ATOM 1898 CB ASN B 121 0.528 8.574 6.637 1.00 0.65 C ATOM 1899 CG ASN B 121 -0.110 8.309 7.989 1.00 1.08 C ATOM 1900 OD1 ASN B 121 -0.495 9.240 8.686 1.00 2.16 O ATOM 1901 ND2 ASN B 121 -0.156 7.060 8.416 1.00 1.07 N ATOM 0 H ASN B 121 2.033 9.317 4.797 1.00 0.53 H new ATOM 0 HA ASN B 121 1.806 10.008 7.541 1.00 0.59 H new ATOM 0 HB2 ASN B 121 -0.076 9.274 6.060 1.00 0.65 H new ATOM 0 HB3 ASN B 121 0.590 7.653 6.057 1.00 0.65 H new ATOM 0 HD21 ASN B 121 -0.519 6.852 9.346 1.00 1.07 H new ATOM 0 HD22 ASN B 121 0.171 6.303 7.815 1.00 1.07 H new ATOM 1908 N PHE B 122 3.782 7.519 7.018 1.00 0.56 N ATOM 1909 CA PHE B 122 4.892 6.851 7.695 1.00 0.58 C ATOM 1910 C PHE B 122 5.991 7.840 8.128 1.00 0.58 C ATOM 1911 O PHE B 122 6.424 7.830 9.284 1.00 0.66 O ATOM 1912 CB PHE B 122 5.445 5.778 6.757 1.00 0.62 C ATOM 1913 CG PHE B 122 6.726 5.160 7.263 1.00 0.75 C ATOM 1914 CD1 PHE B 122 6.749 4.403 8.448 1.00 1.66 C ATOM 1915 CD2 PHE B 122 7.918 5.411 6.573 1.00 2.26 C ATOM 1916 CE1 PHE B 122 7.969 3.898 8.931 1.00 1.70 C ATOM 1917 CE2 PHE B 122 9.136 4.932 7.067 1.00 2.45 C ATOM 1918 CZ PHE B 122 9.166 4.164 8.243 1.00 1.25 C ATOM 0 H PHE B 122 3.792 7.416 6.003 1.00 0.56 H new ATOM 0 HA PHE B 122 4.527 6.392 8.614 1.00 0.58 H new ATOM 0 HB2 PHE B 122 4.697 4.996 6.626 1.00 0.62 H new ATOM 0 HB3 PHE B 122 5.622 6.217 5.775 1.00 0.62 H new ATOM 0 HD1 PHE B 122 5.832 4.210 8.985 1.00 1.66 H new ATOM 0 HD2 PHE B 122 7.897 5.978 5.654 1.00 2.26 H new ATOM 0 HE1 PHE B 122 7.987 3.304 9.833 1.00 1.70 H new ATOM 0 HE2 PHE B 122 10.055 5.153 6.544 1.00 2.45 H new ATOM 0 HZ PHE B 122 10.104 3.780 8.617 1.00 1.25 H new ATOM 1928 N TYR B 123 6.456 8.701 7.217 1.00 0.64 N ATOM 1929 CA TYR B 123 7.635 9.532 7.459 1.00 0.73 C ATOM 1930 C TYR B 123 7.450 10.555 8.587 1.00 0.65 C ATOM 1931 O TYR B 123 8.440 10.828 9.265 1.00 0.75 O ATOM 1932 CB TYR B 123 8.199 10.177 6.178 1.00 0.89 C ATOM 1933 CG TYR B 123 9.259 9.324 5.490 1.00 0.96 C ATOM 1934 CD1 TYR B 123 8.879 8.193 4.750 1.00 1.78 C ATOM 1935 CD2 TYR B 123 10.631 9.615 5.633 1.00 2.42 C ATOM 1936 CE1 TYR B 123 9.828 7.347 4.149 1.00 1.67 C ATOM 1937 CE2 TYR B 123 11.600 8.768 5.056 1.00 2.62 C ATOM 1938 CZ TYR B 123 11.199 7.629 4.317 1.00 1.20 C ATOM 1939 OH TYR B 123 12.124 6.788 3.787 1.00 1.42 O ATOM 0 H TYR B 123 6.029 8.839 6.301 1.00 0.64 H new ATOM 0 HA TYR B 123 8.393 8.833 7.812 1.00 0.73 H new ATOM 0 HB2 TYR B 123 7.381 10.360 5.481 1.00 0.89 H new ATOM 0 HB3 TYR B 123 8.629 11.147 6.427 1.00 0.89 H new ATOM 0 HD1 TYR B 123 7.829 7.966 4.639 1.00 1.78 H new ATOM 0 HD2 TYR B 123 10.941 10.489 6.186 1.00 2.42 H new ATOM 0 HE1 TYR B 123 9.511 6.494 3.567 1.00 1.67 H new ATOM 0 HE2 TYR B 123 12.650 8.989 5.178 1.00 2.62 H new ATOM 0 HH TYR B 123 13.023 7.122 3.989 1.00 1.42 H new ATOM 1949 N LYS B 124 6.241 11.044 8.909 1.00 0.66 N ATOM 1950 CA LYS B 124 6.056 11.940 10.067 1.00 0.78 C ATOM 1951 C LYS B 124 6.641 11.360 11.377 1.00 0.96 C ATOM 1952 O LYS B 124 7.234 12.092 12.168 1.00 1.31 O ATOM 1953 CB LYS B 124 4.575 12.353 10.182 1.00 1.09 C ATOM 1954 CG LYS B 124 3.636 11.250 10.707 1.00 1.66 C ATOM 1955 CD LYS B 124 2.406 11.095 9.821 1.00 1.68 C ATOM 1956 CE LYS B 124 1.406 12.251 9.812 1.00 1.41 C ATOM 1957 NZ LYS B 124 0.433 12.080 8.704 1.00 2.01 N ATOM 0 H LYS B 124 5.386 10.839 8.392 1.00 0.66 H new ATOM 0 HA LYS B 124 6.636 12.846 9.894 1.00 0.78 H new ATOM 0 HB2 LYS B 124 4.503 13.217 10.843 1.00 1.09 H new ATOM 0 HB3 LYS B 124 4.224 12.673 9.201 1.00 1.09 H new ATOM 0 HG2 LYS B 124 4.175 10.303 10.752 1.00 1.66 H new ATOM 0 HG3 LYS B 124 3.325 11.489 11.724 1.00 1.66 H new ATOM 0 HD2 LYS B 124 2.744 10.932 8.798 1.00 1.68 H new ATOM 0 HD3 LYS B 124 1.878 10.193 10.130 1.00 1.68 H new ATOM 0 HE2 LYS B 124 0.879 12.293 10.765 1.00 1.41 H new ATOM 0 HE3 LYS B 124 1.935 13.198 9.698 1.00 1.41 H new ATOM 0 HZ1 LYS B 124 -0.394 12.688 8.872 1.00 2.01 H new ATOM 0 HZ2 LYS B 124 0.881 12.346 7.804 1.00 2.01 H new ATOM 0 HZ3 LYS B 124 0.129 11.086 8.659 1.00 2.01 H new ATOM 1971 N TYR B 125 6.609 10.031 11.543 1.00 0.96 N ATOM 1972 CA TYR B 125 7.133 9.324 12.713 1.00 1.29 C ATOM 1973 C TYR B 125 8.666 9.264 12.785 1.00 1.45 C ATOM 1974 O TYR B 125 9.197 9.145 13.885 1.00 1.69 O ATOM 1975 CB TYR B 125 6.519 7.921 12.739 1.00 1.58 C ATOM 1976 CG TYR B 125 5.022 7.951 12.973 1.00 1.58 C ATOM 1977 CD1 TYR B 125 4.526 8.342 14.233 1.00 2.35 C ATOM 1978 CD2 TYR B 125 4.126 7.684 11.922 1.00 2.35 C ATOM 1979 CE1 TYR B 125 3.142 8.484 14.438 1.00 2.42 C ATOM 1980 CE2 TYR B 125 2.741 7.843 12.115 1.00 2.40 C ATOM 1981 CZ TYR B 125 2.247 8.255 13.368 1.00 1.74 C ATOM 1982 OH TYR B 125 0.913 8.456 13.535 1.00 1.89 O ATOM 0 H TYR B 125 6.206 9.404 10.847 1.00 0.96 H new ATOM 0 HA TYR B 125 6.845 9.892 13.598 1.00 1.29 H new ATOM 0 HB2 TYR B 125 6.727 7.419 11.794 1.00 1.58 H new ATOM 0 HB3 TYR B 125 6.995 7.333 13.524 1.00 1.58 H new ATOM 0 HD1 TYR B 125 5.212 8.533 15.045 1.00 2.35 H new ATOM 0 HD2 TYR B 125 4.502 7.356 10.964 1.00 2.35 H new ATOM 0 HE1 TYR B 125 2.764 8.767 15.409 1.00 2.42 H new ATOM 0 HE2 TYR B 125 2.057 7.649 11.302 1.00 2.40 H new ATOM 0 HH TYR B 125 0.513 8.725 12.682 1.00 1.89 H new ATOM 1992 N VAL B 126 9.375 9.381 11.656 1.00 1.46 N ATOM 1993 CA VAL B 126 10.849 9.542 11.630 1.00 1.78 C ATOM 1994 C VAL B 126 11.290 10.997 11.406 1.00 1.87 C ATOM 1995 O VAL B 126 12.466 11.318 11.572 1.00 2.74 O ATOM 1996 CB VAL B 126 11.531 8.620 10.592 1.00 2.01 C ATOM 1997 CG1 VAL B 126 11.219 7.149 10.902 1.00 1.81 C ATOM 1998 CG2 VAL B 126 11.155 8.926 9.138 1.00 2.73 C ATOM 0 H VAL B 126 8.950 9.368 10.729 1.00 1.46 H new ATOM 0 HA VAL B 126 11.180 9.241 12.624 1.00 1.78 H new ATOM 0 HB VAL B 126 12.600 8.815 10.683 1.00 2.01 H new ATOM 0 HG11 VAL B 126 11.705 6.511 10.164 1.00 1.81 H new ATOM 0 HG12 VAL B 126 11.589 6.900 11.897 1.00 1.81 H new ATOM 0 HG13 VAL B 126 10.141 6.990 10.866 1.00 1.81 H new ATOM 0 HG21 VAL B 126 11.675 8.235 8.475 1.00 2.73 H new ATOM 0 HG22 VAL B 126 10.079 8.812 9.009 1.00 2.73 H new ATOM 0 HG23 VAL B 126 11.443 9.949 8.895 1.00 2.73 H new ATOM 2166 N ILE B 136 9.820 4.589 16.953 1.00 1.71 N ATOM 2167 CA ILE B 136 8.567 4.785 17.734 1.00 1.72 C ATOM 2168 C ILE B 136 8.239 3.612 18.691 1.00 1.77 C ATOM 2169 O ILE B 136 9.132 2.888 19.124 1.00 2.42 O ATOM 2170 CB ILE B 136 7.400 5.172 16.776 1.00 1.88 C ATOM 2171 CG1 ILE B 136 7.107 4.105 15.688 1.00 1.72 C ATOM 2172 CG2 ILE B 136 7.694 6.552 16.168 1.00 2.65 C ATOM 2173 CD1 ILE B 136 5.921 4.437 14.765 1.00 1.77 C ATOM 0 HA ILE B 136 8.723 5.622 18.415 1.00 1.72 H new ATOM 0 HB ILE B 136 6.484 5.218 17.364 1.00 1.88 H new ATOM 0 HG12 ILE B 136 8.000 3.974 15.077 1.00 1.72 H new ATOM 0 HG13 ILE B 136 6.913 3.151 16.177 1.00 1.72 H new ATOM 0 HG21 ILE B 136 6.884 6.833 15.495 1.00 2.65 H new ATOM 0 HG22 ILE B 136 7.777 7.291 16.965 1.00 2.65 H new ATOM 0 HG23 ILE B 136 8.630 6.512 15.611 1.00 2.65 H new ATOM 0 HD11 ILE B 136 5.791 3.636 14.037 1.00 1.77 H new ATOM 0 HD12 ILE B 136 5.013 4.537 15.360 1.00 1.77 H new ATOM 0 HD13 ILE B 136 6.117 5.373 14.243 1.00 1.77 H new ATOM 2185 N SER B 137 6.981 3.396 19.068 1.00 1.41 N ATOM 2186 CA SER B 137 6.500 2.066 19.459 1.00 1.34 C ATOM 2187 C SER B 137 5.580 1.558 18.348 1.00 0.94 C ATOM 2188 O SER B 137 4.826 2.340 17.761 1.00 0.92 O ATOM 2189 CB SER B 137 5.767 2.107 20.810 1.00 1.70 C ATOM 2190 OG SER B 137 4.601 2.917 20.777 1.00 3.11 O ATOM 0 H SER B 137 6.270 4.126 19.112 1.00 1.41 H new ATOM 0 HA SER B 137 7.345 1.390 19.588 1.00 1.34 H new ATOM 0 HB2 SER B 137 5.492 1.093 21.100 1.00 1.70 H new ATOM 0 HB3 SER B 137 6.445 2.485 21.575 1.00 1.70 H new ATOM 0 HG SER B 137 4.172 2.908 21.658 1.00 3.11 H new ATOM 2196 N LYS B 138 5.610 0.262 18.031 1.00 0.84 N ATOM 2197 CA LYS B 138 4.741 -0.270 16.971 1.00 0.97 C ATOM 2198 C LYS B 138 3.261 -0.209 17.389 1.00 0.87 C ATOM 2199 O LYS B 138 2.384 -0.055 16.550 1.00 1.15 O ATOM 2200 CB LYS B 138 5.203 -1.658 16.537 1.00 1.40 C ATOM 2201 CG LYS B 138 6.713 -1.678 16.240 1.00 1.91 C ATOM 2202 CD LYS B 138 7.104 -3.042 15.705 1.00 1.65 C ATOM 2203 CE LYS B 138 8.625 -3.220 15.709 1.00 2.79 C ATOM 2204 NZ LYS B 138 9.076 -4.020 16.872 1.00 2.30 N ATOM 0 H LYS B 138 6.212 -0.429 18.480 1.00 0.84 H new ATOM 0 HA LYS B 138 4.826 0.364 16.088 1.00 0.97 H new ATOM 0 HB2 LYS B 138 4.975 -2.381 17.320 1.00 1.40 H new ATOM 0 HB3 LYS B 138 4.651 -1.966 15.649 1.00 1.40 H new ATOM 0 HG2 LYS B 138 6.962 -0.905 15.513 1.00 1.91 H new ATOM 0 HG3 LYS B 138 7.276 -1.456 17.147 1.00 1.91 H new ATOM 0 HD2 LYS B 138 6.642 -3.820 16.312 1.00 1.65 H new ATOM 0 HD3 LYS B 138 6.723 -3.161 14.691 1.00 1.65 H new ATOM 0 HE2 LYS B 138 8.937 -3.709 14.787 1.00 2.79 H new ATOM 0 HE3 LYS B 138 9.107 -2.242 15.730 1.00 2.79 H new ATOM 0 HZ1 LYS B 138 10.034 -3.722 17.148 1.00 2.30 H new ATOM 0 HZ2 LYS B 138 8.424 -3.872 17.669 1.00 2.30 H new ATOM 0 HZ3 LYS B 138 9.087 -5.028 16.617 1.00 2.30 H new ATOM 2218 N SER B 139 2.978 -0.147 18.690 1.00 0.77 N ATOM 2219 CA SER B 139 1.695 0.283 19.266 1.00 0.81 C ATOM 2220 C SER B 139 1.147 1.625 18.731 1.00 0.73 C ATOM 2221 O SER B 139 -0.058 1.856 18.789 1.00 0.81 O ATOM 2222 CB SER B 139 1.844 0.404 20.790 1.00 0.99 C ATOM 2223 OG SER B 139 2.591 -0.674 21.330 1.00 2.18 O ATOM 0 H SER B 139 3.660 -0.404 19.403 1.00 0.77 H new ATOM 0 HA SER B 139 0.977 -0.482 18.969 1.00 0.81 H new ATOM 0 HB2 SER B 139 2.335 1.346 21.034 1.00 0.99 H new ATOM 0 HB3 SER B 139 0.857 0.430 21.251 1.00 0.99 H new ATOM 0 HG SER B 139 2.668 -0.565 22.301 1.00 2.18 H new ATOM 2229 N SER B 140 1.980 2.520 18.192 1.00 0.67 N ATOM 2230 CA SER B 140 1.514 3.712 17.474 1.00 0.68 C ATOM 2231 C SER B 140 0.872 3.376 16.115 1.00 0.64 C ATOM 2232 O SER B 140 -0.116 4.007 15.743 1.00 0.71 O ATOM 2233 CB SER B 140 2.697 4.670 17.279 1.00 0.74 C ATOM 2234 OG SER B 140 2.306 5.928 16.757 1.00 2.28 O ATOM 0 H SER B 140 2.996 2.440 18.241 1.00 0.67 H new ATOM 0 HA SER B 140 0.737 4.182 18.076 1.00 0.68 H new ATOM 0 HB2 SER B 140 3.199 4.819 18.235 1.00 0.74 H new ATOM 0 HB3 SER B 140 3.422 4.212 16.606 1.00 0.74 H new ATOM 0 HG SER B 140 3.096 6.499 16.654 1.00 2.28 H new ATOM 2240 N PHE B 141 1.359 2.349 15.400 1.00 0.59 N ATOM 2241 CA PHE B 141 0.813 1.923 14.109 1.00 0.57 C ATOM 2242 C PHE B 141 -0.620 1.399 14.228 1.00 0.55 C ATOM 2243 O PHE B 141 -1.466 1.832 13.447 1.00 0.62 O ATOM 2244 CB PHE B 141 1.750 0.906 13.441 1.00 0.65 C ATOM 2245 CG PHE B 141 1.202 0.255 12.184 1.00 0.69 C ATOM 2246 CD1 PHE B 141 0.346 -0.855 12.295 1.00 1.45 C ATOM 2247 CD2 PHE B 141 1.564 0.717 10.908 1.00 2.09 C ATOM 2248 CE1 PHE B 141 -0.105 -1.537 11.165 1.00 1.46 C ATOM 2249 CE2 PHE B 141 1.079 0.066 9.758 1.00 2.17 C ATOM 2250 CZ PHE B 141 0.247 -1.062 9.888 1.00 0.91 C ATOM 0 H PHE B 141 2.152 1.787 15.709 1.00 0.59 H new ATOM 0 HA PHE B 141 0.756 2.800 13.465 1.00 0.57 H new ATOM 0 HB2 PHE B 141 2.687 1.406 13.194 1.00 0.65 H new ATOM 0 HB3 PHE B 141 1.987 0.124 14.163 1.00 0.65 H new ATOM 0 HD1 PHE B 141 0.032 -1.186 13.274 1.00 1.45 H new ATOM 0 HD2 PHE B 141 2.215 1.573 10.809 1.00 2.09 H new ATOM 0 HE1 PHE B 141 -0.718 -2.420 11.269 1.00 1.46 H new ATOM 0 HE2 PHE B 141 1.345 0.432 8.777 1.00 2.17 H new ATOM 0 HZ PHE B 141 -0.122 -1.564 9.006 1.00 0.91 H new ATOM 2260 N ARG B 142 -0.942 0.557 15.231 1.00 0.56 N ATOM 2261 CA ARG B 142 -2.350 0.183 15.464 1.00 0.57 C ATOM 2262 C ARG B 142 -3.209 1.426 15.716 1.00 0.60 C ATOM 2263 O ARG B 142 -4.365 1.452 15.300 1.00 0.82 O ATOM 2264 CB ARG B 142 -2.567 -0.860 16.587 1.00 0.65 C ATOM 2265 CG ARG B 142 -2.069 -0.409 17.968 1.00 0.73 C ATOM 2266 CD ARG B 142 -2.901 -0.894 19.162 1.00 1.21 C ATOM 2267 NE ARG B 142 -2.503 -0.140 20.375 1.00 1.37 N ATOM 2268 CZ ARG B 142 -2.996 1.029 20.776 1.00 2.52 C ATOM 2269 NH1 ARG B 142 -4.064 1.576 20.258 1.00 4.03 N ATOM 2270 NH2 ARG B 142 -2.422 1.739 21.722 1.00 2.89 N ATOM 0 H ARG B 142 -0.271 0.135 15.873 1.00 0.56 H new ATOM 0 HA ARG B 142 -2.668 -0.308 14.545 1.00 0.57 H new ATOM 0 HB2 ARG B 142 -3.630 -1.090 16.654 1.00 0.65 H new ATOM 0 HB3 ARG B 142 -2.058 -1.784 16.313 1.00 0.65 H new ATOM 0 HG2 ARG B 142 -1.044 -0.757 18.097 1.00 0.73 H new ATOM 0 HG3 ARG B 142 -2.040 0.680 17.986 1.00 0.73 H new ATOM 0 HD2 ARG B 142 -3.963 -0.750 18.962 1.00 1.21 H new ATOM 0 HD3 ARG B 142 -2.748 -1.962 19.317 1.00 1.21 H new ATOM 0 HE ARG B 142 -1.780 -0.559 20.960 1.00 1.37 H new ATOM 0 HH11 ARG B 142 -4.565 1.104 19.506 1.00 4.03 H new ATOM 0 HH12 ARG B 142 -4.396 2.475 20.606 1.00 4.03 H new ATOM 0 HH21 ARG B 142 -1.573 1.397 22.172 1.00 2.89 H new ATOM 0 HH22 ARG B 142 -2.826 2.632 22.006 1.00 2.89 H new ATOM 2284 N GLU B 143 -2.668 2.467 16.363 1.00 0.59 N ATOM 2285 CA GLU B 143 -3.502 3.563 16.829 1.00 0.64 C ATOM 2286 C GLU B 143 -3.736 4.653 15.784 1.00 0.64 C ATOM 2287 O GLU B 143 -4.850 5.149 15.642 1.00 0.68 O ATOM 2288 CB GLU B 143 -3.017 4.146 18.154 1.00 0.81 C ATOM 2289 CG GLU B 143 -4.288 4.495 18.933 1.00 1.21 C ATOM 2290 CD GLU B 143 -3.983 5.048 20.306 1.00 1.86 C ATOM 2291 OE1 GLU B 143 -3.691 4.221 21.201 1.00 2.99 O ATOM 2292 OE2 GLU B 143 -4.087 6.292 20.405 1.00 2.20 O ATOM 0 H GLU B 143 -1.674 2.566 16.569 1.00 0.59 H new ATOM 0 HA GLU B 143 -4.478 3.112 17.009 1.00 0.64 H new ATOM 0 HB2 GLU B 143 -2.406 3.427 18.700 1.00 0.81 H new ATOM 0 HB3 GLU B 143 -2.400 5.030 17.992 1.00 0.81 H new ATOM 0 HG2 GLU B 143 -4.868 5.226 18.370 1.00 1.21 H new ATOM 0 HG3 GLU B 143 -4.908 3.604 19.032 1.00 1.21 H new ATOM 2299 N MET B 144 -2.718 4.979 14.996 1.00 0.65 N ATOM 2300 CA MET B 144 -2.883 5.776 13.774 1.00 0.73 C ATOM 2301 C MET B 144 -3.777 5.049 12.762 1.00 0.69 C ATOM 2302 O MET B 144 -4.660 5.673 12.181 1.00 0.82 O ATOM 2303 CB MET B 144 -1.505 6.224 13.266 1.00 0.91 C ATOM 2304 CG MET B 144 -1.327 6.319 11.745 1.00 0.87 C ATOM 2305 SD MET B 144 -0.948 4.743 10.937 1.00 1.19 S ATOM 2306 CE MET B 144 0.783 4.579 11.447 1.00 1.07 C ATOM 0 H MET B 144 -1.754 4.701 15.181 1.00 0.65 H new ATOM 0 HA MET B 144 -3.426 6.699 13.976 1.00 0.73 H new ATOM 0 HB2 MET B 144 -1.286 7.201 13.696 1.00 0.91 H new ATOM 0 HB3 MET B 144 -0.758 5.531 13.653 1.00 0.91 H new ATOM 0 HG2 MET B 144 -2.239 6.727 11.309 1.00 0.87 H new ATOM 0 HG3 MET B 144 -0.526 7.026 11.528 1.00 0.87 H new ATOM 0 HE1 MET B 144 1.101 3.543 11.327 1.00 1.07 H new ATOM 0 HE2 MET B 144 1.407 5.225 10.829 1.00 1.07 H new ATOM 0 HE3 MET B 144 0.883 4.870 12.493 1.00 1.07 H new ATOM 2316 N LEU B 145 -3.684 3.720 12.635 1.00 0.66 N ATOM 2317 CA LEU B 145 -4.654 2.949 11.854 1.00 0.73 C ATOM 2318 C LEU B 145 -6.071 2.976 12.428 1.00 0.89 C ATOM 2319 O LEU B 145 -7.027 3.088 11.662 1.00 1.08 O ATOM 2320 CB LEU B 145 -4.171 1.500 11.690 1.00 0.79 C ATOM 2321 CG LEU B 145 -3.116 1.299 10.591 1.00 0.77 C ATOM 2322 CD1 LEU B 145 -2.996 -0.209 10.386 1.00 1.02 C ATOM 2323 CD2 LEU B 145 -3.504 1.940 9.249 1.00 0.89 C ATOM 0 H LEU B 145 -2.948 3.158 13.063 1.00 0.66 H new ATOM 0 HA LEU B 145 -4.715 3.434 10.880 1.00 0.73 H new ATOM 0 HB2 LEU B 145 -3.758 1.159 12.639 1.00 0.79 H new ATOM 0 HB3 LEU B 145 -5.031 0.867 11.471 1.00 0.79 H new ATOM 0 HG LEU B 145 -2.187 1.774 10.906 1.00 0.77 H new ATOM 0 HD11 LEU B 145 -2.256 -0.413 9.612 1.00 1.02 H new ATOM 0 HD12 LEU B 145 -2.685 -0.679 11.319 1.00 1.02 H new ATOM 0 HD13 LEU B 145 -3.961 -0.613 10.081 1.00 1.02 H new ATOM 0 HD21 LEU B 145 -2.715 1.760 8.518 1.00 0.89 H new ATOM 0 HD22 LEU B 145 -4.436 1.501 8.892 1.00 0.89 H new ATOM 0 HD23 LEU B 145 -3.636 3.014 9.383 1.00 0.89 H new ATOM 2335 N GLN B 146 -6.251 2.867 13.744 1.00 1.13 N ATOM 2336 CA GLN B 146 -7.596 2.795 14.313 1.00 1.51 C ATOM 2337 C GLN B 146 -8.349 4.126 14.303 1.00 1.70 C ATOM 2338 O GLN B 146 -9.579 4.092 14.395 1.00 2.14 O ATOM 2339 CB GLN B 146 -7.588 2.135 15.694 1.00 1.61 C ATOM 2340 CG GLN B 146 -7.188 3.001 16.873 1.00 1.73 C ATOM 2341 CD GLN B 146 -7.009 2.104 18.094 1.00 1.85 C ATOM 2342 OE1 GLN B 146 -6.037 1.380 18.272 1.00 3.18 O ATOM 2343 NE2 GLN B 146 -8.009 2.052 18.939 1.00 1.54 N ATOM 0 H GLN B 146 -5.495 2.827 14.427 1.00 1.13 H new ATOM 0 HA GLN B 146 -8.167 2.151 13.645 1.00 1.51 H new ATOM 0 HB2 GLN B 146 -8.586 1.742 15.887 1.00 1.61 H new ATOM 0 HB3 GLN B 146 -6.911 1.281 15.657 1.00 1.61 H new ATOM 0 HG2 GLN B 146 -6.262 3.533 16.655 1.00 1.73 H new ATOM 0 HG3 GLN B 146 -7.951 3.755 17.065 1.00 1.73 H new ATOM 0 HE21 GLN B 146 -8.824 2.650 18.802 1.00 1.54 H new ATOM 0 HE22 GLN B 146 -7.972 1.414 19.734 1.00 1.54 H new ATOM 2352 N LYS B 147 -7.622 5.245 14.185 1.00 1.53 N ATOM 2353 CA LYS B 147 -8.126 6.597 13.928 1.00 1.76 C ATOM 2354 C LYS B 147 -8.188 6.943 12.421 1.00 1.81 C ATOM 2355 O LYS B 147 -9.293 7.034 11.889 1.00 2.37 O ATOM 2356 CB LYS B 147 -7.271 7.605 14.725 1.00 1.75 C ATOM 2357 CG LYS B 147 -7.729 7.788 16.187 1.00 1.90 C ATOM 2358 CD LYS B 147 -6.790 7.227 17.266 1.00 1.34 C ATOM 2359 CE LYS B 147 -5.389 7.857 17.196 1.00 1.30 C ATOM 2360 NZ LYS B 147 -4.806 8.109 18.539 1.00 1.57 N ATOM 0 H LYS B 147 -6.606 5.228 14.272 1.00 1.53 H new ATOM 0 HA LYS B 147 -9.160 6.652 14.268 1.00 1.76 H new ATOM 0 HB2 LYS B 147 -6.233 7.273 14.718 1.00 1.75 H new ATOM 0 HB3 LYS B 147 -7.300 8.571 14.221 1.00 1.75 H new ATOM 0 HG2 LYS B 147 -7.867 8.853 16.372 1.00 1.90 H new ATOM 0 HG3 LYS B 147 -8.705 7.316 16.302 1.00 1.90 H new ATOM 0 HD2 LYS B 147 -7.220 7.409 18.251 1.00 1.34 H new ATOM 0 HD3 LYS B 147 -6.708 6.146 17.149 1.00 1.34 H new ATOM 0 HE2 LYS B 147 -4.726 7.198 16.635 1.00 1.30 H new ATOM 0 HE3 LYS B 147 -5.445 8.797 16.646 1.00 1.30 H new ATOM 0 HZ1 LYS B 147 -3.964 8.712 18.444 1.00 1.57 H new ATOM 0 HZ2 LYS B 147 -5.509 8.587 19.138 1.00 1.57 H new ATOM 0 HZ3 LYS B 147 -4.537 7.204 18.976 1.00 1.57 H new ATOM 2374 N GLU B 148 -7.065 7.095 11.709 1.00 1.31 N ATOM 2375 CA GLU B 148 -7.061 7.688 10.356 1.00 1.25 C ATOM 2376 C GLU B 148 -7.796 6.837 9.302 1.00 1.17 C ATOM 2377 O GLU B 148 -8.321 7.385 8.331 1.00 1.33 O ATOM 2378 CB GLU B 148 -5.629 7.967 9.843 1.00 1.17 C ATOM 2379 CG GLU B 148 -4.627 8.671 10.775 1.00 1.38 C ATOM 2380 CD GLU B 148 -5.258 9.696 11.705 1.00 2.56 C ATOM 2381 OE1 GLU B 148 -5.717 10.733 11.188 1.00 3.42 O ATOM 2382 OE2 GLU B 148 -5.295 9.403 12.921 1.00 3.64 O ATOM 0 H GLU B 148 -6.143 6.816 12.044 1.00 1.31 H new ATOM 0 HA GLU B 148 -7.603 8.626 10.477 1.00 1.25 H new ATOM 0 HB2 GLU B 148 -5.192 7.012 9.551 1.00 1.17 H new ATOM 0 HB3 GLU B 148 -5.715 8.568 8.938 1.00 1.17 H new ATOM 0 HG2 GLU B 148 -4.115 7.919 11.375 1.00 1.38 H new ATOM 0 HG3 GLU B 148 -3.868 9.165 10.168 1.00 1.38 H new ATOM 2389 N LEU B 149 -7.866 5.509 9.484 1.00 1.08 N ATOM 2390 CA LEU B 149 -8.532 4.580 8.557 1.00 1.03 C ATOM 2391 C LEU B 149 -9.930 4.148 9.043 1.00 1.25 C ATOM 2392 O LEU B 149 -10.551 3.259 8.465 1.00 1.62 O ATOM 2393 CB LEU B 149 -7.566 3.396 8.311 1.00 0.95 C ATOM 2394 CG LEU B 149 -7.428 3.008 6.823 1.00 1.44 C ATOM 2395 CD1 LEU B 149 -6.133 2.220 6.620 1.00 1.21 C ATOM 2396 CD2 LEU B 149 -8.594 2.156 6.310 1.00 2.34 C ATOM 0 H LEU B 149 -7.455 5.043 10.293 1.00 1.08 H new ATOM 0 HA LEU B 149 -8.737 5.079 7.610 1.00 1.03 H new ATOM 0 HB2 LEU B 149 -6.582 3.654 8.703 1.00 0.95 H new ATOM 0 HB3 LEU B 149 -7.916 2.530 8.872 1.00 0.95 H new ATOM 0 HG LEU B 149 -7.424 3.940 6.259 1.00 1.44 H new ATOM 0 HD11 LEU B 149 -6.035 1.946 5.570 1.00 1.21 H new ATOM 0 HD12 LEU B 149 -5.283 2.835 6.915 1.00 1.21 H new ATOM 0 HD13 LEU B 149 -6.157 1.317 7.230 1.00 1.21 H new ATOM 0 HD21 LEU B 149 -8.435 1.918 5.258 1.00 2.34 H new ATOM 0 HD22 LEU B 149 -8.651 1.233 6.886 1.00 2.34 H new ATOM 0 HD23 LEU B 149 -9.526 2.711 6.420 1.00 2.34 H new ATOM 2408 N ASN B 150 -10.425 4.736 10.142 1.00 1.38 N ATOM 2409 CA ASN B 150 -11.517 4.172 10.945 1.00 1.73 C ATOM 2410 C ASN B 150 -12.791 3.783 10.166 1.00 1.83 C ATOM 2411 O ASN B 150 -13.406 2.781 10.534 1.00 2.46 O ATOM 2412 CB ASN B 150 -11.884 5.126 12.099 1.00 2.03 C ATOM 2413 CG ASN B 150 -12.658 6.342 11.603 1.00 2.16 C ATOM 2414 OD1 ASN B 150 -13.881 6.329 11.599 1.00 2.47 O ATOM 2415 ND2 ASN B 150 -11.984 7.348 11.086 1.00 2.07 N ATOM 0 H ASN B 150 -10.075 5.624 10.501 1.00 1.38 H new ATOM 0 HA ASN B 150 -11.117 3.232 11.325 1.00 1.73 H new ATOM 0 HB2 ASN B 150 -12.482 4.591 12.837 1.00 2.03 H new ATOM 0 HB3 ASN B 150 -10.975 5.454 12.602 1.00 2.03 H new ATOM 0 HD21 ASN B 150 -12.482 8.136 10.672 1.00 2.07 H new ATOM 0 HD22 ASN B 150 -10.964 7.339 11.100 1.00 2.07 H new ATOM 2422 N HIS B 151 -13.185 4.546 9.140 1.00 1.34 N ATOM 2423 CA HIS B 151 -14.490 4.425 8.490 1.00 1.35 C ATOM 2424 C HIS B 151 -14.654 3.096 7.729 1.00 1.35 C ATOM 2425 O HIS B 151 -15.600 2.362 8.001 1.00 1.57 O ATOM 2426 CB HIS B 151 -14.744 5.631 7.573 1.00 1.28 C ATOM 2427 CG HIS B 151 -14.335 6.980 8.121 1.00 1.39 C ATOM 2428 ND1 HIS B 151 -15.132 7.868 8.809 1.00 1.86 N ATOM 2429 CD2 HIS B 151 -13.107 7.572 7.984 1.00 1.57 C ATOM 2430 CE1 HIS B 151 -14.398 8.958 9.086 1.00 1.89 C ATOM 2431 NE2 HIS B 151 -13.147 8.814 8.626 1.00 1.77 N ATOM 0 H HIS B 151 -12.597 5.274 8.734 1.00 1.34 H new ATOM 0 HA HIS B 151 -15.244 4.419 9.277 1.00 1.35 H new ATOM 0 HB2 HIS B 151 -14.214 5.467 6.635 1.00 1.28 H new ATOM 0 HB3 HIS B 151 -15.808 5.665 7.337 1.00 1.28 H new ATOM 0 HD2 HIS B 151 -12.255 7.152 7.469 1.00 1.57 H new ATOM 0 HE1 HIS B 151 -14.765 9.830 9.607 1.00 1.89 H new ATOM 0 HE2 HIS B 151 -12.378 9.477 8.724 1.00 1.77 H new ATOM 2439 N MET B 152 -13.728 2.738 6.828 1.00 1.40 N ATOM 2440 CA MET B 152 -13.738 1.424 6.161 1.00 1.57 C ATOM 2441 C MET B 152 -13.318 0.259 7.055 1.00 1.77 C ATOM 2442 O MET B 152 -13.624 -0.890 6.727 1.00 1.99 O ATOM 2443 CB MET B 152 -12.758 1.427 4.989 1.00 1.87 C ATOM 2444 CG MET B 152 -13.310 2.122 3.754 1.00 2.95 C ATOM 2445 SD MET B 152 -12.482 1.538 2.263 1.00 2.77 S ATOM 2446 CE MET B 152 -10.762 1.968 2.649 1.00 1.36 C ATOM 0 H MET B 152 -12.958 3.342 6.542 1.00 1.40 H new ATOM 0 HA MET B 152 -14.774 1.277 5.857 1.00 1.57 H new ATOM 0 HB2 MET B 152 -11.836 1.921 5.295 1.00 1.87 H new ATOM 0 HB3 MET B 152 -12.500 0.399 4.736 1.00 1.87 H new ATOM 0 HG2 MET B 152 -14.381 1.937 3.676 1.00 2.95 H new ATOM 0 HG3 MET B 152 -13.179 3.200 3.849 1.00 2.95 H new ATOM 0 HE1 MET B 152 -10.114 1.639 1.837 1.00 1.36 H new ATOM 0 HE2 MET B 152 -10.675 3.048 2.768 1.00 1.36 H new ATOM 0 HE3 MET B 152 -10.463 1.476 3.575 1.00 1.36 H new ATOM 2456 N LEU B 153 -12.547 0.526 8.118 1.00 2.02 N ATOM 2457 CA LEU B 153 -11.751 -0.487 8.812 1.00 2.82 C ATOM 2458 C LEU B 153 -12.565 -1.726 9.188 1.00 3.79 C ATOM 2459 O LEU B 153 -12.049 -2.825 9.032 1.00 5.65 O ATOM 2460 CB LEU B 153 -11.047 0.181 10.007 1.00 2.69 C ATOM 2461 CG LEU B 153 -9.968 -0.708 10.652 1.00 2.81 C ATOM 2462 CD1 LEU B 153 -8.873 0.165 11.287 1.00 2.19 C ATOM 2463 CD2 LEU B 153 -10.548 -1.605 11.748 1.00 3.71 C ATOM 0 H LEU B 153 -12.460 1.459 8.521 1.00 2.02 H new ATOM 0 HA LEU B 153 -10.989 -0.876 8.137 1.00 2.82 H new ATOM 0 HB2 LEU B 153 -10.590 1.113 9.676 1.00 2.69 H new ATOM 0 HB3 LEU B 153 -11.791 0.441 10.760 1.00 2.69 H new ATOM 0 HG LEU B 153 -9.557 -1.333 9.859 1.00 2.81 H new ATOM 0 HD11 LEU B 153 -8.115 -0.474 11.740 1.00 2.19 H new ATOM 0 HD12 LEU B 153 -8.412 0.786 10.519 1.00 2.19 H new ATOM 0 HD13 LEU B 153 -9.315 0.803 12.053 1.00 2.19 H new ATOM 0 HD21 LEU B 153 -9.753 -2.216 12.177 1.00 3.71 H new ATOM 0 HD22 LEU B 153 -10.991 -0.986 12.528 1.00 3.71 H new ATOM 0 HD23 LEU B 153 -11.313 -2.253 11.321 1.00 3.71 H new ATOM 2475 N SER B 154 -13.821 -1.542 9.598 1.00 3.01 N ATOM 2476 CA SER B 154 -14.818 -2.597 9.851 1.00 3.87 C ATOM 2477 C SER B 154 -14.647 -3.241 11.239 1.00 3.72 C ATOM 2478 O SER B 154 -13.777 -4.084 11.462 1.00 5.06 O ATOM 2479 CB SER B 154 -14.892 -3.648 8.728 1.00 4.77 C ATOM 2480 OG SER B 154 -15.217 -3.040 7.484 1.00 5.15 O ATOM 0 H SER B 154 -14.194 -0.609 9.773 1.00 3.01 H new ATOM 0 HA SER B 154 -15.785 -2.094 9.850 1.00 3.87 H new ATOM 0 HB2 SER B 154 -13.936 -4.166 8.646 1.00 4.77 H new ATOM 0 HB3 SER B 154 -15.641 -4.400 8.977 1.00 4.77 H new ATOM 0 HG SER B 154 -14.582 -2.318 7.297 1.00 5.15 H new ATOM 2486 N ASP B 155 -15.527 -2.836 12.166 1.00 2.55 N ATOM 2487 CA ASP B 155 -15.778 -3.499 13.452 1.00 2.62 C ATOM 2488 C ASP B 155 -14.614 -3.384 14.474 1.00 1.99 C ATOM 2489 O ASP B 155 -13.617 -2.676 14.283 1.00 1.96 O ATOM 2490 CB ASP B 155 -16.228 -4.958 13.180 1.00 3.37 C ATOM 2491 CG ASP B 155 -16.934 -5.575 14.386 1.00 3.77 C ATOM 2492 OD1 ASP B 155 -18.038 -5.096 14.710 1.00 3.99 O ATOM 2493 OD2 ASP B 155 -16.278 -6.382 15.087 1.00 4.62 O ATOM 0 H ASP B 155 -16.105 -2.006 12.035 1.00 2.55 H new ATOM 0 HA ASP B 155 -16.585 -2.967 13.956 1.00 2.62 H new ATOM 0 HB2 ASP B 155 -16.897 -4.976 12.320 1.00 3.37 H new ATOM 0 HB3 ASP B 155 -15.359 -5.563 12.920 1.00 3.37 H new ATOM 2498 N THR B 156 -14.758 -4.092 15.600 1.00 2.10 N ATOM 2499 CA THR B 156 -13.689 -4.442 16.538 1.00 1.85 C ATOM 2500 C THR B 156 -12.801 -5.526 15.936 1.00 1.62 C ATOM 2501 O THR B 156 -11.583 -5.469 16.101 1.00 1.46 O ATOM 2502 CB THR B 156 -14.303 -4.947 17.849 1.00 2.28 C ATOM 2503 OG1 THR B 156 -15.169 -3.959 18.352 1.00 2.42 O ATOM 2504 CG2 THR B 156 -13.243 -5.210 18.919 1.00 2.61 C ATOM 0 H THR B 156 -15.666 -4.453 15.894 1.00 2.10 H new ATOM 0 HA THR B 156 -13.084 -3.557 16.737 1.00 1.85 H new ATOM 0 HB THR B 156 -14.822 -5.880 17.629 1.00 2.28 H new ATOM 0 HG1 THR B 156 -15.570 -4.271 19.190 1.00 2.42 H new ATOM 0 HG21 THR B 156 -13.725 -5.566 19.829 1.00 2.61 H new ATOM 0 HG22 THR B 156 -12.543 -5.965 18.560 1.00 2.61 H new ATOM 0 HG23 THR B 156 -12.704 -4.287 19.131 1.00 2.61 H new ATOM 2512 N GLY B 157 -13.386 -6.497 15.223 1.00 1.87 N ATOM 2513 CA GLY B 157 -12.692 -7.684 14.714 1.00 1.97 C ATOM 2514 C GLY B 157 -11.488 -7.361 13.830 1.00 1.87 C ATOM 2515 O GLY B 157 -10.407 -7.913 14.053 1.00 1.92 O ATOM 0 H GLY B 157 -14.376 -6.478 14.979 1.00 1.87 H new ATOM 0 HA2 GLY B 157 -12.360 -8.289 15.558 1.00 1.97 H new ATOM 0 HA3 GLY B 157 -13.397 -8.290 14.145 1.00 1.97 H new ATOM 2519 N ASN B 158 -11.616 -6.426 12.884 1.00 1.87 N ATOM 2520 CA ASN B 158 -10.478 -6.071 12.032 1.00 1.94 C ATOM 2521 C ASN B 158 -9.398 -5.252 12.786 1.00 1.47 C ATOM 2522 O ASN B 158 -8.227 -5.296 12.416 1.00 1.38 O ATOM 2523 CB ASN B 158 -10.975 -5.421 10.727 1.00 2.39 C ATOM 2524 CG ASN B 158 -10.062 -5.685 9.526 1.00 3.38 C ATOM 2525 OD1 ASN B 158 -9.191 -6.542 9.545 1.00 4.64 O ATOM 2526 ND2 ASN B 158 -10.248 -4.975 8.431 1.00 3.44 N ATOM 0 H ASN B 158 -12.475 -5.912 12.691 1.00 1.87 H new ATOM 0 HA ASN B 158 -9.957 -6.985 11.747 1.00 1.94 H new ATOM 0 HB2 ASN B 158 -11.974 -5.794 10.502 1.00 2.39 H new ATOM 0 HB3 ASN B 158 -11.063 -4.345 10.877 1.00 2.39 H new ATOM 0 HD21 ASN B 158 -9.667 -5.143 7.609 1.00 3.44 H new ATOM 0 HD22 ASN B 158 -10.972 -4.257 8.405 1.00 3.44 H new ATOM 2533 N ARG B 159 -9.722 -4.607 13.920 1.00 1.40 N ATOM 2534 CA ARG B 159 -8.706 -4.033 14.831 1.00 1.19 C ATOM 2535 C ARG B 159 -7.906 -5.101 15.575 1.00 1.12 C ATOM 2536 O ARG B 159 -6.689 -4.992 15.702 1.00 1.06 O ATOM 2537 CB ARG B 159 -9.306 -3.030 15.812 1.00 1.27 C ATOM 2538 CG ARG B 159 -9.868 -1.866 14.999 1.00 2.07 C ATOM 2539 CD ARG B 159 -9.882 -0.581 15.801 1.00 2.05 C ATOM 2540 NE ARG B 159 -10.393 0.553 15.003 1.00 3.94 N ATOM 2541 CZ ARG B 159 -11.621 0.813 14.564 1.00 5.51 C ATOM 2542 NH1 ARG B 159 -12.612 -0.048 14.611 1.00 5.66 N ATOM 2543 NH2 ARG B 159 -11.862 1.991 14.030 1.00 7.37 N ATOM 0 H ARG B 159 -10.683 -4.468 14.232 1.00 1.40 H new ATOM 0 HA ARG B 159 -8.010 -3.495 14.187 1.00 1.19 H new ATOM 0 HB2 ARG B 159 -10.092 -3.498 16.404 1.00 1.27 H new ATOM 0 HB3 ARG B 159 -8.547 -2.678 16.511 1.00 1.27 H new ATOM 0 HG2 ARG B 159 -9.269 -1.727 14.099 1.00 2.07 H new ATOM 0 HG3 ARG B 159 -10.881 -2.104 14.674 1.00 2.07 H new ATOM 0 HD2 ARG B 159 -10.503 -0.712 16.688 1.00 2.05 H new ATOM 0 HD3 ARG B 159 -8.873 -0.357 16.148 1.00 2.05 H new ATOM 0 HE ARG B 159 -9.691 1.248 14.748 1.00 3.94 H new ATOM 0 HH11 ARG B 159 -12.461 -0.978 15.001 1.00 5.66 H new ATOM 0 HH12 ARG B 159 -13.532 0.214 14.257 1.00 5.66 H new ATOM 0 HH21 ARG B 159 -11.115 2.682 13.960 1.00 7.37 H new ATOM 0 HH22 ARG B 159 -12.796 2.214 13.686 1.00 7.37 H new ATOM 2557 N LYS B 160 -8.548 -6.193 15.990 1.00 1.19 N ATOM 2558 CA LYS B 160 -7.799 -7.346 16.503 1.00 1.20 C ATOM 2559 C LYS B 160 -6.885 -7.929 15.436 1.00 1.13 C ATOM 2560 O LYS B 160 -5.769 -8.341 15.736 1.00 1.08 O ATOM 2561 CB LYS B 160 -8.759 -8.437 16.972 1.00 1.40 C ATOM 2562 CG LYS B 160 -9.813 -7.941 17.952 1.00 1.43 C ATOM 2563 CD LYS B 160 -9.273 -7.139 19.155 1.00 1.54 C ATOM 2564 CE LYS B 160 -8.109 -7.821 19.899 1.00 3.19 C ATOM 2565 NZ LYS B 160 -7.259 -6.832 20.610 1.00 4.43 N ATOM 0 H LYS B 160 -9.562 -6.306 15.983 1.00 1.19 H new ATOM 0 HA LYS B 160 -7.194 -6.995 17.339 1.00 1.20 H new ATOM 0 HB2 LYS B 160 -9.257 -8.869 16.104 1.00 1.40 H new ATOM 0 HB3 LYS B 160 -8.186 -9.236 17.442 1.00 1.40 H new ATOM 0 HG2 LYS B 160 -10.523 -7.317 17.410 1.00 1.43 H new ATOM 0 HG3 LYS B 160 -10.367 -8.801 18.329 1.00 1.43 H new ATOM 0 HD2 LYS B 160 -8.942 -6.161 18.806 1.00 1.54 H new ATOM 0 HD3 LYS B 160 -10.088 -6.968 19.858 1.00 1.54 H new ATOM 0 HE2 LYS B 160 -8.506 -8.541 20.614 1.00 3.19 H new ATOM 0 HE3 LYS B 160 -7.500 -8.380 19.188 1.00 3.19 H new ATOM 0 HZ1 LYS B 160 -6.592 -7.331 21.233 1.00 4.43 H new ATOM 0 HZ2 LYS B 160 -6.728 -6.268 19.916 1.00 4.43 H new ATOM 0 HZ3 LYS B 160 -7.860 -6.203 21.180 1.00 4.43 H new ATOM 2579 N ALA B 161 -7.350 -7.950 14.189 1.00 1.20 N ATOM 2580 CA ALA B 161 -6.491 -8.293 13.052 1.00 1.17 C ATOM 2581 C ALA B 161 -5.290 -7.338 12.874 1.00 1.03 C ATOM 2582 O ALA B 161 -4.196 -7.838 12.613 1.00 1.31 O ATOM 2583 CB ALA B 161 -7.303 -8.452 11.766 1.00 1.31 C ATOM 0 H ALA B 161 -8.315 -7.734 13.938 1.00 1.20 H new ATOM 0 HA ALA B 161 -6.051 -9.262 13.286 1.00 1.17 H new ATOM 0 HB1 ALA B 161 -6.635 -8.706 10.943 1.00 1.31 H new ATOM 0 HB2 ALA B 161 -8.038 -9.247 11.896 1.00 1.31 H new ATOM 0 HB3 ALA B 161 -7.816 -7.517 11.541 1.00 1.31 H new ATOM 2589 N ALA B 162 -5.453 -6.026 13.094 1.00 0.79 N ATOM 2590 CA ALA B 162 -4.339 -5.072 13.190 1.00 0.68 C ATOM 2591 C ALA B 162 -3.351 -5.455 14.309 1.00 0.59 C ATOM 2592 O ALA B 162 -2.149 -5.534 14.067 1.00 0.58 O ATOM 2593 CB ALA B 162 -4.897 -3.641 13.364 1.00 0.82 C ATOM 0 H ALA B 162 -6.369 -5.593 13.211 1.00 0.79 H new ATOM 0 HA ALA B 162 -3.766 -5.106 12.263 1.00 0.68 H new ATOM 0 HB1 ALA B 162 -4.070 -2.934 13.435 1.00 0.82 H new ATOM 0 HB2 ALA B 162 -5.519 -3.386 12.506 1.00 0.82 H new ATOM 0 HB3 ALA B 162 -5.495 -3.592 14.274 1.00 0.82 H new ATOM 2599 N ASP B 163 -3.846 -5.761 15.511 1.00 0.68 N ATOM 2600 CA ASP B 163 -3.023 -6.096 16.681 1.00 0.72 C ATOM 2601 C ASP B 163 -2.151 -7.356 16.497 1.00 0.85 C ATOM 2602 O ASP B 163 -1.034 -7.387 17.018 1.00 0.92 O ATOM 2603 CB ASP B 163 -3.912 -6.287 17.916 1.00 0.89 C ATOM 2604 CG ASP B 163 -4.700 -5.057 18.378 1.00 1.09 C ATOM 2605 OD1 ASP B 163 -4.230 -3.904 18.240 1.00 1.70 O ATOM 2606 OD2 ASP B 163 -5.781 -5.317 18.956 1.00 2.30 O ATOM 0 H ASP B 163 -4.847 -5.784 15.704 1.00 0.68 H new ATOM 0 HA ASP B 163 -2.344 -5.254 16.811 1.00 0.72 H new ATOM 0 HB2 ASP B 163 -4.620 -7.089 17.708 1.00 0.89 H new ATOM 0 HB3 ASP B 163 -3.284 -6.622 18.742 1.00 0.89 H new ATOM 2611 N LYS B 164 -2.597 -8.377 15.736 1.00 0.97 N ATOM 2612 CA LYS B 164 -1.773 -9.546 15.355 1.00 1.17 C ATOM 2613 C LYS B 164 -0.385 -9.164 14.849 1.00 1.20 C ATOM 2614 O LYS B 164 0.626 -9.808 15.113 1.00 1.45 O ATOM 2615 CB LYS B 164 -2.416 -10.261 14.164 1.00 1.46 C ATOM 2616 CG LYS B 164 -3.749 -10.879 14.514 1.00 1.75 C ATOM 2617 CD LYS B 164 -4.271 -11.786 13.394 1.00 1.98 C ATOM 2618 CE LYS B 164 -4.411 -11.016 12.069 1.00 1.81 C ATOM 2619 NZ LYS B 164 -3.204 -11.044 11.206 1.00 3.18 N ATOM 0 H LYS B 164 -3.546 -8.415 15.365 1.00 0.97 H new ATOM 0 HA LYS B 164 -1.702 -10.153 16.258 1.00 1.17 H new ATOM 0 HB2 LYS B 164 -2.551 -9.552 13.348 1.00 1.46 H new ATOM 0 HB3 LYS B 164 -1.742 -11.038 13.803 1.00 1.46 H new ATOM 0 HG2 LYS B 164 -3.651 -11.457 15.433 1.00 1.75 H new ATOM 0 HG3 LYS B 164 -4.475 -10.090 14.710 1.00 1.75 H new ATOM 0 HD2 LYS B 164 -3.591 -12.627 13.258 1.00 1.98 H new ATOM 0 HD3 LYS B 164 -5.238 -12.201 13.680 1.00 1.98 H new ATOM 0 HE2 LYS B 164 -5.250 -11.430 11.510 1.00 1.81 H new ATOM 0 HE3 LYS B 164 -4.658 -9.978 12.292 1.00 1.81 H new ATOM 0 HZ1 LYS B 164 -3.045 -10.099 10.801 1.00 3.18 H new ATOM 0 HZ2 LYS B 164 -2.378 -11.321 11.774 1.00 3.18 H new ATOM 0 HZ3 LYS B 164 -3.342 -11.731 10.438 1.00 3.18 H new ATOM 2633 N LEU B 165 -0.401 -8.152 13.999 1.00 0.97 N ATOM 2634 CA LEU B 165 0.767 -7.739 13.228 1.00 0.93 C ATOM 2635 C LEU B 165 1.798 -7.043 14.114 1.00 1.02 C ATOM 2636 O LEU B 165 2.991 -7.290 13.975 1.00 1.15 O ATOM 2637 CB LEU B 165 0.359 -6.799 12.104 1.00 0.73 C ATOM 2638 CG LEU B 165 -0.986 -7.015 11.404 1.00 0.65 C ATOM 2639 CD1 LEU B 165 -1.106 -5.849 10.430 1.00 0.55 C ATOM 2640 CD2 LEU B 165 -1.065 -8.374 10.695 1.00 0.73 C ATOM 0 H LEU B 165 -1.231 -7.586 13.820 1.00 0.97 H new ATOM 0 HA LEU B 165 1.215 -8.639 12.807 1.00 0.93 H new ATOM 0 HB2 LEU B 165 0.361 -5.786 12.506 1.00 0.73 H new ATOM 0 HB3 LEU B 165 1.137 -6.841 11.342 1.00 0.73 H new ATOM 0 HG LEU B 165 -1.812 -7.038 12.115 1.00 0.65 H new ATOM 0 HD11 LEU B 165 -2.046 -5.926 9.884 1.00 0.55 H new ATOM 0 HD12 LEU B 165 -1.083 -4.910 10.982 1.00 0.55 H new ATOM 0 HD13 LEU B 165 -0.274 -5.876 9.726 1.00 0.55 H new ATOM 0 HD21 LEU B 165 -2.038 -8.478 10.215 1.00 0.73 H new ATOM 0 HD22 LEU B 165 -0.280 -8.438 9.942 1.00 0.73 H new ATOM 0 HD23 LEU B 165 -0.933 -9.173 11.424 1.00 0.73 H new ATOM 2652 N ILE B 166 1.305 -6.217 15.043 1.00 0.95 N ATOM 2653 CA ILE B 166 2.086 -5.461 16.031 1.00 1.04 C ATOM 2654 C ILE B 166 2.991 -6.409 16.801 1.00 1.27 C ATOM 2655 O ILE B 166 4.203 -6.250 16.808 1.00 1.42 O ATOM 2656 CB ILE B 166 1.138 -4.711 17.002 1.00 0.88 C ATOM 2657 CG1 ILE B 166 0.030 -3.909 16.289 1.00 0.68 C ATOM 2658 CG2 ILE B 166 1.940 -3.810 17.960 1.00 1.10 C ATOM 2659 CD1 ILE B 166 0.527 -2.775 15.418 1.00 0.93 C ATOM 0 H ILE B 166 0.303 -6.049 15.132 1.00 0.95 H new ATOM 0 HA ILE B 166 2.702 -4.725 15.514 1.00 1.04 H new ATOM 0 HB ILE B 166 0.626 -5.480 17.580 1.00 0.88 H new ATOM 0 HG12 ILE B 166 -0.554 -4.592 15.673 1.00 0.68 H new ATOM 0 HG13 ILE B 166 -0.645 -3.501 17.041 1.00 0.68 H new ATOM 0 HG21 ILE B 166 1.255 -3.293 18.632 1.00 1.10 H new ATOM 0 HG22 ILE B 166 2.629 -4.421 18.543 1.00 1.10 H new ATOM 0 HG23 ILE B 166 2.504 -3.077 17.383 1.00 1.10 H new ATOM 0 HD11 ILE B 166 -0.323 -2.270 14.959 1.00 0.93 H new ATOM 0 HD12 ILE B 166 1.085 -2.065 16.028 1.00 0.93 H new ATOM 0 HD13 ILE B 166 1.177 -3.173 14.639 1.00 0.93 H new ATOM 2671 N GLN B 167 2.402 -7.438 17.401 1.00 1.33 N ATOM 2672 CA GLN B 167 3.111 -8.445 18.200 1.00 1.55 C ATOM 2673 C GLN B 167 4.059 -9.306 17.364 1.00 1.62 C ATOM 2674 O GLN B 167 5.186 -9.552 17.777 1.00 1.90 O ATOM 2675 CB GLN B 167 2.079 -9.254 18.990 1.00 1.64 C ATOM 2676 CG GLN B 167 1.086 -10.055 18.151 1.00 1.58 C ATOM 2677 CD GLN B 167 0.006 -10.723 18.986 1.00 1.76 C ATOM 2678 OE1 GLN B 167 -0.201 -11.920 18.952 1.00 2.17 O ATOM 2679 NE2 GLN B 167 -0.740 -9.978 19.772 1.00 2.76 N ATOM 0 H GLN B 167 1.397 -7.603 17.347 1.00 1.33 H new ATOM 0 HA GLN B 167 3.773 -7.946 18.908 1.00 1.55 H new ATOM 0 HB2 GLN B 167 2.610 -9.942 19.648 1.00 1.64 H new ATOM 0 HB3 GLN B 167 1.519 -8.570 19.628 1.00 1.64 H new ATOM 0 HG2 GLN B 167 0.617 -9.393 17.423 1.00 1.58 H new ATOM 0 HG3 GLN B 167 1.626 -10.817 17.588 1.00 1.58 H new ATOM 0 HE21 GLN B 167 -0.585 -8.971 19.818 1.00 2.76 H new ATOM 0 HE22 GLN B 167 -1.473 -10.407 20.336 1.00 2.76 H new ATOM 2688 N ASN B 168 3.648 -9.657 16.149 1.00 1.44 N ATOM 2689 CA ASN B 168 4.506 -10.285 15.120 1.00 1.55 C ATOM 2690 C ASN B 168 5.758 -9.448 14.748 1.00 1.58 C ATOM 2691 O ASN B 168 6.691 -9.967 14.128 1.00 1.74 O ATOM 2692 CB ASN B 168 3.605 -10.625 13.914 1.00 1.43 C ATOM 2693 CG ASN B 168 4.332 -10.867 12.595 1.00 2.54 C ATOM 2694 OD1 ASN B 168 4.712 -11.976 12.260 1.00 2.95 O ATOM 2695 ND2 ASN B 168 4.505 -9.831 11.793 1.00 3.54 N ATOM 0 H ASN B 168 2.688 -9.514 15.834 1.00 1.44 H new ATOM 0 HA ASN B 168 4.944 -11.199 15.520 1.00 1.55 H new ATOM 0 HB2 ASN B 168 3.024 -11.515 14.157 1.00 1.43 H new ATOM 0 HB3 ASN B 168 2.895 -9.810 13.773 1.00 1.43 H new ATOM 0 HD21 ASN B 168 4.959 -9.957 10.888 1.00 3.54 H new ATOM 0 HD22 ASN B 168 4.185 -8.906 12.079 1.00 3.54 H new ATOM 2702 N LEU B 169 5.801 -8.162 15.119 1.00 1.55 N ATOM 2703 CA LEU B 169 6.987 -7.307 15.027 1.00 1.63 C ATOM 2704 C LEU B 169 7.612 -6.972 16.407 1.00 1.69 C ATOM 2705 O LEU B 169 8.831 -6.884 16.517 1.00 1.84 O ATOM 2706 CB LEU B 169 6.604 -6.021 14.271 1.00 1.63 C ATOM 2707 CG LEU B 169 6.761 -5.947 12.738 1.00 1.29 C ATOM 2708 CD1 LEU B 169 8.228 -5.811 12.325 1.00 1.92 C ATOM 2709 CD2 LEU B 169 6.174 -7.149 12.002 1.00 2.08 C ATOM 0 H LEU B 169 4.989 -7.677 15.501 1.00 1.55 H new ATOM 0 HA LEU B 169 7.757 -7.856 14.485 1.00 1.63 H new ATOM 0 HB2 LEU B 169 5.559 -5.811 14.500 1.00 1.63 H new ATOM 0 HB3 LEU B 169 7.193 -5.208 14.696 1.00 1.63 H new ATOM 0 HG LEU B 169 6.199 -5.059 12.450 1.00 1.29 H new ATOM 0 HD11 LEU B 169 8.297 -5.762 11.238 1.00 1.92 H new ATOM 0 HD12 LEU B 169 8.645 -4.901 12.756 1.00 1.92 H new ATOM 0 HD13 LEU B 169 8.789 -6.673 12.686 1.00 1.92 H new ATOM 0 HD21 LEU B 169 6.322 -7.026 10.929 1.00 2.08 H new ATOM 0 HD22 LEU B 169 6.673 -8.059 12.335 1.00 2.08 H new ATOM 0 HD23 LEU B 169 5.108 -7.221 12.215 1.00 2.08 H new ATOM 2721 N ASP B 170 6.840 -6.724 17.463 1.00 1.80 N ATOM 2722 CA ASP B 170 7.354 -6.350 18.796 1.00 2.16 C ATOM 2723 C ASP B 170 7.903 -7.539 19.606 1.00 2.46 C ATOM 2724 O ASP B 170 8.792 -7.335 20.426 1.00 2.77 O ATOM 2725 CB ASP B 170 6.295 -5.554 19.594 1.00 2.73 C ATOM 2726 CG ASP B 170 6.272 -4.037 19.311 1.00 3.21 C ATOM 2727 OD1 ASP B 170 7.314 -3.478 18.889 1.00 3.93 O ATOM 2728 OD2 ASP B 170 5.217 -3.408 19.537 1.00 3.79 O ATOM 0 H ASP B 170 5.822 -6.776 17.425 1.00 1.80 H new ATOM 0 HA ASP B 170 8.212 -5.702 18.619 1.00 2.16 H new ATOM 0 HB2 ASP B 170 5.310 -5.965 19.373 1.00 2.73 H new ATOM 0 HB3 ASP B 170 6.472 -5.707 20.658 1.00 2.73 H new ATOM 2733 N ALA B 171 7.451 -8.773 19.361 1.00 2.57 N ATOM 2734 CA ALA B 171 7.983 -9.965 20.030 1.00 3.16 C ATOM 2735 C ALA B 171 9.303 -10.479 19.426 1.00 3.10 C ATOM 2736 O ALA B 171 10.010 -11.247 20.074 1.00 3.75 O ATOM 2737 CB ALA B 171 6.905 -11.054 19.987 1.00 3.57 C ATOM 0 H ALA B 171 6.706 -8.974 18.694 1.00 2.57 H new ATOM 0 HA ALA B 171 8.228 -9.694 21.057 1.00 3.16 H new ATOM 0 HB1 ALA B 171 7.276 -11.953 20.479 1.00 3.57 H new ATOM 0 HB2 ALA B 171 6.011 -10.702 20.502 1.00 3.57 H new ATOM 0 HB3 ALA B 171 6.660 -11.283 18.950 1.00 3.57 H new ATOM 2743 N ASN B 172 9.618 -10.107 18.178 1.00 2.48 N ATOM 2744 CA ASN B 172 10.606 -10.818 17.362 1.00 2.74 C ATOM 2745 C ASN B 172 11.193 -10.003 16.184 1.00 2.03 C ATOM 2746 O ASN B 172 11.712 -10.591 15.238 1.00 2.63 O ATOM 2747 CB ASN B 172 9.987 -12.158 16.915 1.00 3.84 C ATOM 2748 CG ASN B 172 8.728 -11.967 16.083 1.00 3.23 C ATOM 2749 OD1 ASN B 172 7.614 -12.102 16.562 1.00 4.94 O ATOM 2750 ND2 ASN B 172 8.867 -11.592 14.829 1.00 2.04 N ATOM 0 H ASN B 172 9.195 -9.306 17.708 1.00 2.48 H new ATOM 0 HA ASN B 172 11.483 -10.998 17.984 1.00 2.74 H new ATOM 0 HB2 ASN B 172 10.721 -12.718 16.335 1.00 3.84 H new ATOM 0 HB3 ASN B 172 9.751 -12.757 17.794 1.00 3.84 H new ATOM 0 HD21 ASN B 172 8.042 -11.414 14.256 1.00 2.04 H new ATOM 0 HD22 ASN B 172 9.799 -11.480 14.431 1.00 2.04 H new ATOM 2757 N HIS B 173 11.131 -8.666 16.204 1.00 1.45 N ATOM 2758 CA HIS B 173 11.813 -7.806 15.215 1.00 1.62 C ATOM 2759 C HIS B 173 12.606 -6.635 15.843 1.00 1.71 C ATOM 2760 O HIS B 173 12.995 -5.697 15.145 1.00 3.09 O ATOM 2761 CB HIS B 173 10.796 -7.353 14.153 1.00 1.89 C ATOM 2762 CG HIS B 173 11.064 -7.955 12.802 1.00 3.14 C ATOM 2763 ND1 HIS B 173 10.379 -8.980 12.189 1.00 4.15 N ATOM 2764 CD2 HIS B 173 12.036 -7.543 11.941 1.00 3.99 C ATOM 2765 CE1 HIS B 173 10.939 -9.182 10.984 1.00 5.20 C ATOM 2766 NE2 HIS B 173 11.958 -8.329 10.786 1.00 5.17 N ATOM 0 H HIS B 173 10.607 -8.144 16.906 1.00 1.45 H new ATOM 0 HA HIS B 173 12.586 -8.400 14.727 1.00 1.62 H new ATOM 0 HB2 HIS B 173 9.792 -7.628 14.476 1.00 1.89 H new ATOM 0 HB3 HIS B 173 10.819 -6.266 14.073 1.00 1.89 H new ATOM 0 HD2 HIS B 173 12.744 -6.747 12.119 1.00 3.99 H new ATOM 0 HE1 HIS B 173 10.615 -9.927 10.273 1.00 5.20 H new ATOM 0 HE2 HIS B 173 12.554 -8.267 9.961 1.00 5.17 H new ATOM 2774 N ASP B 174 12.859 -6.697 17.157 1.00 1.81 N ATOM 2775 CA ASP B 174 13.639 -5.714 17.930 1.00 1.90 C ATOM 2776 C ASP B 174 12.976 -4.309 17.858 1.00 2.04 C ATOM 2777 O ASP B 174 11.771 -4.172 17.626 1.00 3.65 O ATOM 2778 CB ASP B 174 15.114 -5.794 17.447 1.00 2.54 C ATOM 2779 CG ASP B 174 16.158 -5.085 18.321 1.00 3.04 C ATOM 2780 OD1 ASP B 174 16.714 -5.717 19.239 1.00 3.66 O ATOM 2781 OD2 ASP B 174 16.432 -3.895 18.031 1.00 3.90 O ATOM 0 H ASP B 174 12.514 -7.462 17.736 1.00 1.81 H new ATOM 0 HA ASP B 174 13.647 -5.938 18.997 1.00 1.90 H new ATOM 0 HB2 ASP B 174 15.391 -6.845 17.369 1.00 2.54 H new ATOM 0 HB3 ASP B 174 15.168 -5.374 16.442 1.00 2.54 H new ATOM 2786 N GLY B 175 13.751 -3.240 18.041 1.00 1.87 N ATOM 2787 CA GLY B 175 13.381 -1.864 17.721 1.00 2.14 C ATOM 2788 C GLY B 175 13.846 -1.432 16.329 1.00 2.11 C ATOM 2789 O GLY B 175 13.865 -0.232 16.063 1.00 2.39 O ATOM 0 H GLY B 175 14.690 -3.313 18.432 1.00 1.87 H new ATOM 0 HA2 GLY B 175 12.298 -1.760 17.786 1.00 2.14 H new ATOM 0 HA3 GLY B 175 13.811 -1.195 18.466 1.00 2.14 H new ATOM 2793 N ARG B 176 14.221 -2.371 15.445 1.00 1.94 N ATOM 2794 CA ARG B 176 14.735 -2.098 14.090 1.00 2.00 C ATOM 2795 C ARG B 176 13.608 -1.744 13.093 1.00 1.97 C ATOM 2796 O ARG B 176 13.497 -2.346 12.025 1.00 3.13 O ATOM 2797 CB ARG B 176 15.587 -3.287 13.598 1.00 2.17 C ATOM 2798 CG ARG B 176 16.857 -3.576 14.418 1.00 2.52 C ATOM 2799 CD ARG B 176 17.774 -2.352 14.546 1.00 2.73 C ATOM 2800 NE ARG B 176 19.160 -2.719 14.899 1.00 3.33 N ATOM 2801 CZ ARG B 176 19.626 -3.073 16.093 1.00 4.07 C ATOM 2802 NH1 ARG B 176 18.865 -3.190 17.156 1.00 4.80 N ATOM 2803 NH2 ARG B 176 20.907 -3.329 16.245 1.00 4.66 N ATOM 0 H ARG B 176 14.174 -3.368 15.657 1.00 1.94 H new ATOM 0 HA ARG B 176 15.373 -1.216 14.145 1.00 2.00 H new ATOM 0 HB2 ARG B 176 14.965 -4.182 13.597 1.00 2.17 H new ATOM 0 HB3 ARG B 176 15.878 -3.100 12.564 1.00 2.17 H new ATOM 0 HG2 ARG B 176 16.572 -3.916 15.413 1.00 2.52 H new ATOM 0 HG3 ARG B 176 17.409 -4.390 13.949 1.00 2.52 H new ATOM 0 HD2 ARG B 176 17.775 -1.803 13.604 1.00 2.73 H new ATOM 0 HD3 ARG B 176 17.374 -1.680 15.306 1.00 2.73 H new ATOM 0 HE ARG B 176 19.839 -2.699 14.138 1.00 3.33 H new ATOM 0 HH11 ARG B 176 17.864 -3.006 17.089 1.00 4.80 H new ATOM 0 HH12 ARG B 176 19.275 -3.465 18.049 1.00 4.80 H new ATOM 0 HH21 ARG B 176 21.540 -3.256 15.448 1.00 4.66 H new ATOM 0 HH22 ARG B 176 21.268 -3.601 17.160 1.00 4.66 H new ATOM 2817 N ILE B 177 12.762 -0.779 13.476 1.00 1.50 N ATOM 2818 CA ILE B 177 11.570 -0.369 12.710 1.00 1.43 C ATOM 2819 C ILE B 177 11.971 0.083 11.306 1.00 1.37 C ATOM 2820 O ILE B 177 12.869 0.909 11.158 1.00 1.56 O ATOM 2821 CB ILE B 177 10.745 0.712 13.452 1.00 1.85 C ATOM 2822 CG1 ILE B 177 10.229 0.139 14.792 1.00 2.17 C ATOM 2823 CG2 ILE B 177 9.565 1.201 12.583 1.00 1.93 C ATOM 2824 CD1 ILE B 177 9.292 1.052 15.597 1.00 2.82 C ATOM 0 H ILE B 177 12.885 -0.251 14.340 1.00 1.50 H new ATOM 0 HA ILE B 177 10.918 -1.237 12.613 1.00 1.43 H new ATOM 0 HB ILE B 177 11.389 1.569 13.651 1.00 1.85 H new ATOM 0 HG12 ILE B 177 9.707 -0.796 14.588 1.00 2.17 H new ATOM 0 HG13 ILE B 177 11.089 -0.106 15.415 1.00 2.17 H new ATOM 0 HG21 ILE B 177 9.002 1.959 13.127 1.00 1.93 H new ATOM 0 HG22 ILE B 177 9.948 1.629 11.657 1.00 1.93 H new ATOM 0 HG23 ILE B 177 8.911 0.360 12.351 1.00 1.93 H new ATOM 0 HD11 ILE B 177 8.994 0.548 16.516 1.00 2.82 H new ATOM 0 HD12 ILE B 177 9.810 1.979 15.843 1.00 2.82 H new ATOM 0 HD13 ILE B 177 8.406 1.278 15.003 1.00 2.82 H new ATOM 2836 N SER B 178 11.327 -0.487 10.293 1.00 1.26 N ATOM 2837 CA SER B 178 11.691 -0.272 8.887 1.00 1.22 C ATOM 2838 C SER B 178 10.630 0.491 8.071 1.00 1.11 C ATOM 2839 O SER B 178 9.488 0.674 8.500 1.00 1.35 O ATOM 2840 CB SER B 178 12.015 -1.631 8.246 1.00 1.22 C ATOM 2841 OG SER B 178 13.176 -2.190 8.838 1.00 2.11 O ATOM 0 H SER B 178 10.533 -1.115 10.419 1.00 1.26 H new ATOM 0 HA SER B 178 12.568 0.375 8.874 1.00 1.22 H new ATOM 0 HB2 SER B 178 11.172 -2.310 8.371 1.00 1.22 H new ATOM 0 HB3 SER B 178 12.169 -1.508 7.174 1.00 1.22 H new ATOM 0 HG SER B 178 13.057 -2.238 9.810 1.00 2.11 H new ATOM 2847 N PHE B 179 11.014 0.917 6.858 1.00 1.01 N ATOM 2848 CA PHE B 179 10.119 1.487 5.843 1.00 0.80 C ATOM 2849 C PHE B 179 9.074 0.453 5.380 1.00 0.71 C ATOM 2850 O PHE B 179 7.862 0.638 5.482 1.00 0.68 O ATOM 2851 CB PHE B 179 10.975 1.956 4.649 1.00 0.76 C ATOM 2852 CG PHE B 179 10.073 2.491 3.566 1.00 0.67 C ATOM 2853 CD1 PHE B 179 9.404 3.691 3.822 1.00 1.76 C ATOM 2854 CD2 PHE B 179 9.717 1.721 2.445 1.00 1.74 C ATOM 2855 CE1 PHE B 179 8.337 4.107 3.029 1.00 1.69 C ATOM 2856 CE2 PHE B 179 8.671 2.160 1.614 1.00 1.87 C ATOM 2857 CZ PHE B 179 7.972 3.345 1.905 1.00 0.82 C ATOM 0 H PHE B 179 11.985 0.872 6.549 1.00 1.01 H new ATOM 0 HA PHE B 179 9.576 2.330 6.271 1.00 0.80 H new ATOM 0 HB2 PHE B 179 11.674 2.728 4.970 1.00 0.76 H new ATOM 0 HB3 PHE B 179 11.570 1.127 4.266 1.00 0.76 H new ATOM 0 HD1 PHE B 179 9.720 4.308 4.650 1.00 1.76 H new ATOM 0 HD2 PHE B 179 10.241 0.803 2.225 1.00 1.74 H new ATOM 0 HE1 PHE B 179 7.794 5.008 3.276 1.00 1.69 H new ATOM 0 HE2 PHE B 179 8.402 1.581 0.743 1.00 1.87 H new ATOM 0 HZ PHE B 179 7.160 3.668 1.270 1.00 0.82 H new ATOM 2867 N ASP B 180 9.586 -0.663 4.865 1.00 0.76 N ATOM 2868 CA ASP B 180 8.861 -1.745 4.202 1.00 0.78 C ATOM 2869 C ASP B 180 7.961 -2.510 5.191 1.00 0.69 C ATOM 2870 O ASP B 180 6.955 -3.100 4.796 1.00 0.72 O ATOM 2871 CB ASP B 180 9.904 -2.673 3.538 1.00 0.95 C ATOM 2872 CG ASP B 180 11.056 -1.907 2.853 1.00 2.43 C ATOM 2873 OD1 ASP B 180 11.917 -1.391 3.609 1.00 3.42 O ATOM 2874 OD2 ASP B 180 11.057 -1.792 1.611 1.00 3.53 O ATOM 0 H ASP B 180 10.588 -0.848 4.903 1.00 0.76 H new ATOM 0 HA ASP B 180 8.193 -1.339 3.443 1.00 0.78 H new ATOM 0 HB2 ASP B 180 10.319 -3.340 4.293 1.00 0.95 H new ATOM 0 HB3 ASP B 180 9.404 -3.300 2.799 1.00 0.95 H new ATOM 2879 N GLU B 181 8.295 -2.427 6.486 1.00 0.66 N ATOM 2880 CA GLU B 181 7.476 -2.890 7.608 1.00 0.65 C ATOM 2881 C GLU B 181 6.107 -2.209 7.601 1.00 0.55 C ATOM 2882 O GLU B 181 5.083 -2.881 7.502 1.00 0.54 O ATOM 2883 CB GLU B 181 8.214 -2.619 8.918 1.00 0.78 C ATOM 2884 CG GLU B 181 7.377 -2.891 10.179 1.00 1.84 C ATOM 2885 CD GLU B 181 8.118 -2.445 11.439 1.00 2.27 C ATOM 2886 OE1 GLU B 181 9.362 -2.331 11.371 1.00 2.65 O ATOM 2887 OE2 GLU B 181 7.453 -2.219 12.476 1.00 3.27 O ATOM 0 H GLU B 181 9.179 -2.019 6.790 1.00 0.66 H new ATOM 0 HA GLU B 181 7.308 -3.962 7.509 1.00 0.65 H new ATOM 0 HB2 GLU B 181 9.112 -3.236 8.951 1.00 0.78 H new ATOM 0 HB3 GLU B 181 8.541 -1.579 8.930 1.00 0.78 H new ATOM 0 HG2 GLU B 181 6.425 -2.365 10.108 1.00 1.84 H new ATOM 0 HG3 GLU B 181 7.149 -3.955 10.245 1.00 1.84 H new ATOM 2894 N TYR B 182 6.074 -0.877 7.669 1.00 0.55 N ATOM 2895 CA TYR B 182 4.822 -0.120 7.657 1.00 0.54 C ATOM 2896 C TYR B 182 3.928 -0.561 6.487 1.00 0.51 C ATOM 2897 O TYR B 182 2.770 -0.921 6.697 1.00 0.49 O ATOM 2898 CB TYR B 182 5.165 1.375 7.612 1.00 0.60 C ATOM 2899 CG TYR B 182 4.010 2.298 7.286 1.00 0.67 C ATOM 2900 CD1 TYR B 182 3.730 2.615 5.944 1.00 1.98 C ATOM 2901 CD2 TYR B 182 3.251 2.885 8.319 1.00 2.14 C ATOM 2902 CE1 TYR B 182 2.728 3.553 5.635 1.00 2.07 C ATOM 2903 CE2 TYR B 182 2.235 3.811 8.017 1.00 2.24 C ATOM 2904 CZ TYR B 182 1.998 4.175 6.673 1.00 1.13 C ATOM 2905 OH TYR B 182 1.129 5.181 6.385 1.00 1.48 O ATOM 0 H TYR B 182 6.910 -0.296 7.734 1.00 0.55 H new ATOM 0 HA TYR B 182 4.247 -0.317 8.562 1.00 0.54 H new ATOM 0 HB2 TYR B 182 5.578 1.665 8.578 1.00 0.60 H new ATOM 0 HB3 TYR B 182 5.950 1.528 6.871 1.00 0.60 H new ATOM 0 HD1 TYR B 182 4.285 2.138 5.150 1.00 1.98 H new ATOM 0 HD2 TYR B 182 3.450 2.623 9.348 1.00 2.14 H new ATOM 0 HE1 TYR B 182 2.517 3.798 4.605 1.00 2.07 H new ATOM 0 HE2 TYR B 182 1.640 4.241 8.809 1.00 2.24 H new ATOM 0 HH TYR B 182 1.482 5.716 5.644 1.00 1.48 H new ATOM 2915 N TRP B 183 4.473 -0.609 5.266 1.00 0.53 N ATOM 2916 CA TRP B 183 3.731 -1.005 4.067 1.00 0.52 C ATOM 2917 C TRP B 183 3.227 -2.452 4.132 1.00 0.52 C ATOM 2918 O TRP B 183 2.051 -2.686 3.837 1.00 0.51 O ATOM 2919 CB TRP B 183 4.610 -0.795 2.825 1.00 0.56 C ATOM 2920 CG TRP B 183 3.856 -0.971 1.548 1.00 0.52 C ATOM 2921 CD1 TRP B 183 3.594 -2.147 0.943 1.00 0.54 C ATOM 2922 CD2 TRP B 183 3.188 0.054 0.750 1.00 0.50 C ATOM 2923 NE1 TRP B 183 2.769 -1.930 -0.140 1.00 0.53 N ATOM 2924 CE2 TRP B 183 2.453 -0.594 -0.285 1.00 0.50 C ATOM 2925 CE3 TRP B 183 3.107 1.461 0.821 1.00 0.54 C ATOM 2926 CZ2 TRP B 183 1.631 0.121 -1.172 1.00 0.52 C ATOM 2927 CZ3 TRP B 183 2.318 2.191 -0.089 1.00 0.56 C ATOM 2928 CH2 TRP B 183 1.570 1.519 -1.071 1.00 0.54 C ATOM 0 H TRP B 183 5.448 -0.372 5.083 1.00 0.53 H new ATOM 0 HA TRP B 183 2.846 -0.372 4.005 1.00 0.52 H new ATOM 0 HB2 TRP B 183 5.039 0.207 2.854 1.00 0.56 H new ATOM 0 HB3 TRP B 183 5.442 -1.499 2.851 1.00 0.56 H new ATOM 0 HD1 TRP B 183 3.971 -3.109 1.258 1.00 0.54 H new ATOM 0 HE1 TRP B 183 2.433 -2.667 -0.759 1.00 0.53 H new ATOM 0 HE3 TRP B 183 3.659 1.987 1.586 1.00 0.54 H new ATOM 0 HZ2 TRP B 183 1.053 -0.399 -1.922 1.00 0.52 H new ATOM 0 HZ3 TRP B 183 2.288 3.269 -0.032 1.00 0.56 H new ATOM 0 HH2 TRP B 183 0.946 2.081 -1.750 1.00 0.54 H new ATOM 2939 N THR B 184 4.075 -3.411 4.535 1.00 0.55 N ATOM 2940 CA THR B 184 3.704 -4.835 4.607 1.00 0.60 C ATOM 2941 C THR B 184 2.687 -5.090 5.717 1.00 0.56 C ATOM 2942 O THR B 184 1.772 -5.885 5.517 1.00 0.65 O ATOM 2943 CB THR B 184 4.954 -5.729 4.688 1.00 0.74 C ATOM 2944 OG1 THR B 184 4.632 -6.970 4.115 1.00 1.44 O ATOM 2945 CG2 THR B 184 5.491 -6.017 6.087 1.00 1.41 C ATOM 0 H THR B 184 5.036 -3.223 4.820 1.00 0.55 H new ATOM 0 HA THR B 184 3.200 -5.112 3.681 1.00 0.60 H new ATOM 0 HB THR B 184 5.735 -5.172 4.171 1.00 0.74 H new ATOM 0 HG1 THR B 184 5.414 -7.560 4.152 1.00 1.44 H new ATOM 0 HG21 THR B 184 6.371 -6.656 6.014 1.00 1.41 H new ATOM 0 HG22 THR B 184 5.762 -5.080 6.573 1.00 1.41 H new ATOM 0 HG23 THR B 184 4.724 -6.522 6.674 1.00 1.41 H new ATOM 2953 N LEU B 185 2.768 -4.347 6.830 1.00 0.50 N ATOM 2954 CA LEU B 185 1.764 -4.373 7.888 1.00 0.50 C ATOM 2955 C LEU B 185 0.388 -3.917 7.390 1.00 0.48 C ATOM 2956 O LEU B 185 -0.583 -4.562 7.751 1.00 0.54 O ATOM 2957 CB LEU B 185 2.181 -3.498 9.082 1.00 0.47 C ATOM 2958 CG LEU B 185 3.364 -3.922 9.972 1.00 0.58 C ATOM 2959 CD1 LEU B 185 3.541 -2.838 11.042 1.00 0.59 C ATOM 2960 CD2 LEU B 185 3.117 -5.235 10.701 1.00 0.69 C ATOM 0 H LEU B 185 3.541 -3.708 7.017 1.00 0.50 H new ATOM 0 HA LEU B 185 1.692 -5.412 8.210 1.00 0.50 H new ATOM 0 HB2 LEU B 185 2.408 -2.505 8.693 1.00 0.47 H new ATOM 0 HB3 LEU B 185 1.310 -3.395 9.729 1.00 0.47 H new ATOM 0 HG LEU B 185 4.236 -4.050 9.331 1.00 0.58 H new ATOM 0 HD11 LEU B 185 4.373 -3.103 11.695 1.00 0.59 H new ATOM 0 HD12 LEU B 185 3.748 -1.882 10.561 1.00 0.59 H new ATOM 0 HD13 LEU B 185 2.628 -2.757 11.632 1.00 0.59 H new ATOM 0 HD21 LEU B 185 3.986 -5.481 11.312 1.00 0.69 H new ATOM 0 HD22 LEU B 185 2.240 -5.137 11.340 1.00 0.69 H new ATOM 0 HD23 LEU B 185 2.948 -6.029 9.973 1.00 0.69 H new ATOM 2972 N ILE B 186 0.261 -2.850 6.582 1.00 0.44 N ATOM 2973 CA ILE B 186 -1.060 -2.366 6.090 1.00 0.44 C ATOM 2974 C ILE B 186 -1.923 -3.511 5.521 1.00 0.49 C ATOM 2975 O ILE B 186 -3.107 -3.610 5.860 1.00 0.57 O ATOM 2976 CB ILE B 186 -0.917 -1.223 5.045 1.00 0.43 C ATOM 2977 CG1 ILE B 186 -0.232 0.069 5.542 1.00 0.55 C ATOM 2978 CG2 ILE B 186 -2.281 -0.828 4.455 1.00 0.46 C ATOM 2979 CD1 ILE B 186 -0.920 0.815 6.691 1.00 0.71 C ATOM 0 H ILE B 186 1.053 -2.299 6.250 1.00 0.44 H new ATOM 0 HA ILE B 186 -1.573 -1.959 6.961 1.00 0.44 H new ATOM 0 HB ILE B 186 -0.259 -1.663 4.296 1.00 0.43 H new ATOM 0 HG12 ILE B 186 0.781 -0.183 5.858 1.00 0.55 H new ATOM 0 HG13 ILE B 186 -0.142 0.753 4.698 1.00 0.55 H new ATOM 0 HG21 ILE B 186 -2.145 -0.027 3.728 1.00 0.46 H new ATOM 0 HG22 ILE B 186 -2.729 -1.692 3.963 1.00 0.46 H new ATOM 0 HG23 ILE B 186 -2.938 -0.485 5.255 1.00 0.46 H new ATOM 0 HD11 ILE B 186 -0.341 1.703 6.947 1.00 0.71 H new ATOM 0 HD12 ILE B 186 -1.923 1.112 6.383 1.00 0.71 H new ATOM 0 HD13 ILE B 186 -0.986 0.162 7.561 1.00 0.71 H new ATOM 2991 N GLY B 187 -1.326 -4.416 4.733 1.00 0.48 N ATOM 2992 CA GLY B 187 -2.017 -5.561 4.118 1.00 0.53 C ATOM 2993 C GLY B 187 -2.618 -6.553 5.126 1.00 0.56 C ATOM 2994 O GLY B 187 -3.541 -7.292 4.801 1.00 0.66 O ATOM 0 H GLY B 187 -0.334 -4.374 4.501 1.00 0.48 H new ATOM 0 HA2 GLY B 187 -2.814 -5.187 3.475 1.00 0.53 H new ATOM 0 HA3 GLY B 187 -1.314 -6.093 3.477 1.00 0.53 H new ATOM 2998 N GLY B 188 -2.163 -6.539 6.383 1.00 0.54 N ATOM 2999 CA GLY B 188 -2.722 -7.351 7.468 1.00 0.60 C ATOM 3000 C GLY B 188 -4.045 -6.821 8.035 1.00 0.62 C ATOM 3001 O GLY B 188 -4.630 -7.477 8.899 1.00 0.94 O ATOM 0 H GLY B 188 -1.383 -5.953 6.680 1.00 0.54 H new ATOM 0 HA2 GLY B 188 -2.877 -8.366 7.103 1.00 0.60 H new ATOM 0 HA3 GLY B 188 -1.992 -7.410 8.275 1.00 0.60 H new ATOM 3005 N ILE B 189 -4.508 -5.651 7.579 1.00 0.49 N ATOM 3006 CA ILE B 189 -5.843 -5.080 7.858 1.00 0.53 C ATOM 3007 C ILE B 189 -6.585 -4.800 6.543 1.00 0.54 C ATOM 3008 O ILE B 189 -7.750 -5.185 6.403 1.00 0.59 O ATOM 3009 CB ILE B 189 -5.767 -3.783 8.712 1.00 0.59 C ATOM 3010 CG1 ILE B 189 -4.650 -3.741 9.775 1.00 0.62 C ATOM 3011 CG2 ILE B 189 -7.112 -3.608 9.443 1.00 0.86 C ATOM 3012 CD1 ILE B 189 -3.283 -3.314 9.230 1.00 0.61 C ATOM 0 H ILE B 189 -3.944 -5.047 6.981 1.00 0.49 H new ATOM 0 HA ILE B 189 -6.393 -5.820 8.440 1.00 0.53 H new ATOM 0 HB ILE B 189 -5.540 -2.985 8.005 1.00 0.59 H new ATOM 0 HG12 ILE B 189 -4.944 -3.053 10.568 1.00 0.62 H new ATOM 0 HG13 ILE B 189 -4.556 -4.728 10.227 1.00 0.62 H new ATOM 0 HG21 ILE B 189 -7.081 -2.703 10.049 1.00 0.86 H new ATOM 0 HG22 ILE B 189 -7.916 -3.528 8.711 1.00 0.86 H new ATOM 0 HG23 ILE B 189 -7.291 -4.470 10.086 1.00 0.86 H new ATOM 0 HD11 ILE B 189 -2.553 -3.310 10.040 1.00 0.61 H new ATOM 0 HD12 ILE B 189 -2.964 -4.014 8.458 1.00 0.61 H new ATOM 0 HD13 ILE B 189 -3.358 -2.313 8.804 1.00 0.61 H new ATOM 3024 N THR B 190 -5.892 -4.196 5.564 1.00 0.57 N ATOM 3025 CA THR B 190 -6.294 -4.102 4.151 1.00 0.56 C ATOM 3026 C THR B 190 -6.076 -5.470 3.514 1.00 0.78 C ATOM 3027 O THR B 190 -5.145 -5.665 2.747 1.00 1.52 O ATOM 3028 CB THR B 190 -5.507 -2.981 3.445 1.00 0.61 C ATOM 3029 OG1 THR B 190 -5.784 -1.768 4.109 1.00 0.72 O ATOM 3030 CG2 THR B 190 -5.881 -2.765 1.972 1.00 0.84 C ATOM 0 H THR B 190 -4.997 -3.740 5.743 1.00 0.57 H new ATOM 0 HA THR B 190 -7.347 -3.837 4.056 1.00 0.56 H new ATOM 0 HB THR B 190 -4.460 -3.282 3.479 1.00 0.61 H new ATOM 0 HG1 THR B 190 -5.292 -1.039 3.677 1.00 0.72 H new ATOM 0 HG21 THR B 190 -5.277 -1.958 1.558 1.00 0.84 H new ATOM 0 HG22 THR B 190 -5.695 -3.681 1.411 1.00 0.84 H new ATOM 0 HG23 THR B 190 -6.936 -2.503 1.899 1.00 0.84 H new ATOM 3038 N GLY B 191 -6.942 -6.413 3.891 1.00 0.72 N ATOM 3039 CA GLY B 191 -6.962 -7.794 3.404 1.00 0.84 C ATOM 3040 C GLY B 191 -8.394 -8.316 3.285 1.00 0.77 C ATOM 3041 O GLY B 191 -8.946 -8.292 2.186 1.00 0.87 O ATOM 0 H GLY B 191 -7.679 -6.228 4.572 1.00 0.72 H new ATOM 0 HA2 GLY B 191 -6.471 -7.847 2.433 1.00 0.84 H new ATOM 0 HA3 GLY B 191 -6.395 -8.431 4.083 1.00 0.84 H new ATOM 3045 N PRO B 192 -9.055 -8.719 4.392 1.00 0.74 N ATOM 3046 CA PRO B 192 -10.405 -9.294 4.361 1.00 0.87 C ATOM 3047 C PRO B 192 -11.480 -8.319 3.854 1.00 0.88 C ATOM 3048 O PRO B 192 -12.432 -8.737 3.200 1.00 1.02 O ATOM 3049 CB PRO B 192 -10.682 -9.742 5.803 1.00 0.96 C ATOM 3050 CG PRO B 192 -9.781 -8.844 6.651 1.00 0.86 C ATOM 3051 CD PRO B 192 -8.554 -8.669 5.758 1.00 0.77 C ATOM 0 HA PRO B 192 -10.450 -10.120 3.651 1.00 0.87 H new ATOM 0 HB2 PRO B 192 -11.732 -9.615 6.065 1.00 0.96 H new ATOM 0 HB3 PRO B 192 -10.443 -10.796 5.946 1.00 0.96 H new ATOM 0 HG2 PRO B 192 -10.257 -7.890 6.878 1.00 0.86 H new ATOM 0 HG3 PRO B 192 -9.527 -9.308 7.604 1.00 0.86 H new ATOM 0 HD2 PRO B 192 -8.055 -7.721 5.958 1.00 0.77 H new ATOM 0 HD3 PRO B 192 -7.823 -9.458 5.937 1.00 0.77 H new ATOM 3059 N ILE B 193 -11.330 -7.015 4.111 1.00 0.85 N ATOM 3060 CA ILE B 193 -12.272 -5.967 3.663 1.00 0.94 C ATOM 3061 C ILE B 193 -12.119 -5.567 2.180 1.00 1.03 C ATOM 3062 O ILE B 193 -12.874 -4.743 1.689 1.00 0.96 O ATOM 3063 CB ILE B 193 -12.169 -4.727 4.578 1.00 1.02 C ATOM 3064 CG1 ILE B 193 -10.718 -4.214 4.667 1.00 1.11 C ATOM 3065 CG2 ILE B 193 -12.715 -5.034 5.980 1.00 1.04 C ATOM 3066 CD1 ILE B 193 -10.645 -2.709 4.924 1.00 1.10 C ATOM 0 H ILE B 193 -10.542 -6.646 4.643 1.00 0.85 H new ATOM 0 HA ILE B 193 -13.267 -6.405 3.744 1.00 0.94 H new ATOM 0 HB ILE B 193 -12.779 -3.940 4.134 1.00 1.02 H new ATOM 0 HG12 ILE B 193 -10.198 -4.742 5.466 1.00 1.11 H new ATOM 0 HG13 ILE B 193 -10.196 -4.447 3.739 1.00 1.11 H new ATOM 0 HG21 ILE B 193 -12.632 -4.145 6.606 1.00 1.04 H new ATOM 0 HG22 ILE B 193 -13.762 -5.329 5.906 1.00 1.04 H new ATOM 0 HG23 ILE B 193 -12.140 -5.846 6.425 1.00 1.04 H new ATOM 0 HD11 ILE B 193 -9.601 -2.399 4.978 1.00 1.10 H new ATOM 0 HD12 ILE B 193 -11.140 -2.177 4.112 1.00 1.10 H new ATOM 0 HD13 ILE B 193 -11.142 -2.476 5.866 1.00 1.10 H new ATOM 3078 N ALA B 194 -11.150 -6.121 1.457 1.00 1.24 N ATOM 3079 CA ALA B 194 -10.793 -5.833 0.050 1.00 1.45 C ATOM 3080 C ALA B 194 -11.978 -5.513 -0.884 1.00 0.98 C ATOM 3081 O ALA B 194 -12.108 -4.386 -1.368 1.00 0.71 O ATOM 3082 CB ALA B 194 -9.978 -7.014 -0.482 1.00 2.22 C ATOM 0 H ALA B 194 -10.543 -6.836 1.858 1.00 1.24 H new ATOM 0 HA ALA B 194 -10.213 -4.910 0.053 1.00 1.45 H new ATOM 0 HB1 ALA B 194 -9.701 -6.827 -1.520 1.00 2.22 H new ATOM 0 HB2 ALA B 194 -9.076 -7.133 0.118 1.00 2.22 H new ATOM 0 HB3 ALA B 194 -10.575 -7.924 -0.424 1.00 2.22 H new ATOM 3088 N LYS B 195 -12.883 -6.468 -1.128 1.00 1.27 N ATOM 3089 CA LYS B 195 -14.064 -6.212 -1.954 1.00 1.40 C ATOM 3090 C LYS B 195 -14.936 -5.063 -1.424 1.00 1.28 C ATOM 3091 O LYS B 195 -15.513 -4.349 -2.242 1.00 1.51 O ATOM 3092 CB LYS B 195 -14.913 -7.481 -2.084 1.00 1.99 C ATOM 3093 CG LYS B 195 -15.734 -7.422 -3.381 1.00 4.08 C ATOM 3094 CD LYS B 195 -16.398 -8.772 -3.663 1.00 4.47 C ATOM 3095 CE LYS B 195 -17.261 -9.242 -2.489 1.00 3.72 C ATOM 3096 NZ LYS B 195 -18.433 -8.359 -2.256 1.00 4.87 N ATOM 0 H LYS B 195 -12.819 -7.420 -0.766 1.00 1.27 H new ATOM 0 HA LYS B 195 -13.691 -5.909 -2.932 1.00 1.40 H new ATOM 0 HB2 LYS B 195 -14.270 -8.361 -2.088 1.00 1.99 H new ATOM 0 HB3 LYS B 195 -15.578 -7.576 -1.225 1.00 1.99 H new ATOM 0 HG2 LYS B 195 -16.496 -6.646 -3.300 1.00 4.08 H new ATOM 0 HG3 LYS B 195 -15.087 -7.148 -4.215 1.00 4.08 H new ATOM 0 HD2 LYS B 195 -17.015 -8.693 -4.558 1.00 4.47 H new ATOM 0 HD3 LYS B 195 -15.630 -9.518 -3.870 1.00 4.47 H new ATOM 0 HE2 LYS B 195 -17.608 -10.258 -2.680 1.00 3.72 H new ATOM 0 HE3 LYS B 195 -16.652 -9.278 -1.586 1.00 3.72 H new ATOM 0 HZ1 LYS B 195 -19.030 -8.765 -1.508 1.00 4.87 H new ATOM 0 HZ2 LYS B 195 -18.105 -7.416 -1.964 1.00 4.87 H new ATOM 0 HZ3 LYS B 195 -18.985 -8.276 -3.133 1.00 4.87 H new ATOM 3110 N LEU B 196 -15.024 -4.868 -0.102 1.00 1.11 N ATOM 3111 CA LEU B 196 -15.780 -3.777 0.486 1.00 1.35 C ATOM 3112 C LEU B 196 -15.089 -2.442 0.216 1.00 1.51 C ATOM 3113 O LEU B 196 -15.775 -1.510 -0.171 1.00 2.04 O ATOM 3114 CB LEU B 196 -15.975 -4.091 1.981 1.00 1.18 C ATOM 3115 CG LEU B 196 -16.919 -3.120 2.701 1.00 2.09 C ATOM 3116 CD1 LEU B 196 -17.568 -3.862 3.874 1.00 1.85 C ATOM 3117 CD2 LEU B 196 -16.207 -1.867 3.244 1.00 2.83 C ATOM 0 H LEU B 196 -14.568 -5.469 0.584 1.00 1.11 H new ATOM 0 HA LEU B 196 -16.767 -3.682 0.033 1.00 1.35 H new ATOM 0 HB2 LEU B 196 -16.365 -5.104 2.082 1.00 1.18 H new ATOM 0 HB3 LEU B 196 -15.004 -4.073 2.476 1.00 1.18 H new ATOM 0 HG LEU B 196 -17.654 -2.779 1.972 1.00 2.09 H new ATOM 0 HD11 LEU B 196 -18.244 -3.189 4.401 1.00 1.85 H new ATOM 0 HD12 LEU B 196 -18.128 -4.718 3.498 1.00 1.85 H new ATOM 0 HD13 LEU B 196 -16.794 -4.208 4.559 1.00 1.85 H new ATOM 0 HD21 LEU B 196 -16.932 -1.223 3.741 1.00 2.83 H new ATOM 0 HD22 LEU B 196 -15.438 -2.166 3.957 1.00 2.83 H new ATOM 0 HD23 LEU B 196 -15.746 -1.324 2.419 1.00 2.83 H new ATOM 3129 N ILE B 197 -13.760 -2.365 0.319 1.00 1.32 N ATOM 3130 CA ILE B 197 -12.970 -1.178 -0.078 1.00 1.83 C ATOM 3131 C ILE B 197 -13.306 -0.759 -1.509 1.00 2.11 C ATOM 3132 O ILE B 197 -13.610 0.391 -1.776 1.00 2.79 O ATOM 3133 CB ILE B 197 -11.463 -1.457 0.047 1.00 1.87 C ATOM 3134 CG1 ILE B 197 -11.044 -1.816 1.479 1.00 2.03 C ATOM 3135 CG2 ILE B 197 -10.647 -0.270 -0.475 1.00 2.47 C ATOM 3136 CD1 ILE B 197 -9.621 -2.357 1.477 1.00 2.30 C ATOM 0 H ILE B 197 -13.189 -3.128 0.683 1.00 1.32 H new ATOM 0 HA ILE B 197 -13.230 -0.362 0.597 1.00 1.83 H new ATOM 0 HB ILE B 197 -11.252 -2.330 -0.571 1.00 1.87 H new ATOM 0 HG12 ILE B 197 -11.108 -0.935 2.118 1.00 2.03 H new ATOM 0 HG13 ILE B 197 -11.725 -2.560 1.892 1.00 2.03 H new ATOM 0 HG21 ILE B 197 -9.584 -0.488 -0.377 1.00 2.47 H new ATOM 0 HG22 ILE B 197 -10.887 -0.097 -1.524 1.00 2.47 H new ATOM 0 HG23 ILE B 197 -10.889 0.621 0.104 1.00 2.47 H new ATOM 0 HD11 ILE B 197 -9.327 -2.611 2.495 1.00 2.30 H new ATOM 0 HD12 ILE B 197 -9.572 -3.249 0.852 1.00 2.30 H new ATOM 0 HD13 ILE B 197 -8.944 -1.599 1.082 1.00 2.30 H new ATOM 3148 N HIS B 198 -13.272 -1.714 -2.434 1.00 1.66 N ATOM 3149 CA HIS B 198 -13.666 -1.515 -3.830 1.00 1.83 C ATOM 3150 C HIS B 198 -15.143 -1.097 -3.994 1.00 2.38 C ATOM 3151 O HIS B 198 -15.453 -0.191 -4.764 1.00 2.96 O ATOM 3152 CB HIS B 198 -13.355 -2.827 -4.587 1.00 1.33 C ATOM 3153 CG HIS B 198 -14.275 -3.148 -5.736 1.00 1.19 C ATOM 3154 ND1 HIS B 198 -14.295 -2.514 -6.950 1.00 1.18 N ATOM 3155 CD2 HIS B 198 -15.252 -4.106 -5.762 1.00 2.00 C ATOM 3156 CE1 HIS B 198 -15.254 -3.080 -7.697 1.00 1.71 C ATOM 3157 NE2 HIS B 198 -15.893 -4.053 -7.007 1.00 2.48 N ATOM 0 H HIS B 198 -12.965 -2.666 -2.233 1.00 1.66 H new ATOM 0 HA HIS B 198 -13.099 -0.683 -4.247 1.00 1.83 H new ATOM 0 HB2 HIS B 198 -12.334 -2.774 -4.966 1.00 1.33 H new ATOM 0 HB3 HIS B 198 -13.389 -3.653 -3.876 1.00 1.33 H new ATOM 0 HD2 HIS B 198 -15.489 -4.788 -4.959 1.00 2.00 H new ATOM 0 HE1 HIS B 198 -15.485 -2.797 -8.713 1.00 1.71 H new ATOM 0 HE2 HIS B 198 -16.675 -4.626 -7.325 1.00 2.48 H new ATOM 3165 N GLU B 199 -16.079 -1.773 -3.325 1.00 2.26 N ATOM 3166 CA GLU B 199 -17.512 -1.612 -3.587 1.00 2.69 C ATOM 3167 C GLU B 199 -18.175 -0.557 -2.696 1.00 2.70 C ATOM 3168 O GLU B 199 -19.369 -0.279 -2.827 1.00 2.92 O ATOM 3169 CB GLU B 199 -18.167 -2.987 -3.648 1.00 2.71 C ATOM 3170 CG GLU B 199 -18.729 -3.582 -2.368 1.00 2.75 C ATOM 3171 CD GLU B 199 -18.783 -5.108 -2.504 1.00 2.68 C ATOM 3172 OE1 GLU B 199 -18.995 -5.636 -3.625 1.00 3.36 O ATOM 3173 OE2 GLU B 199 -18.484 -5.809 -1.514 1.00 3.05 O ATOM 0 H GLU B 199 -15.867 -2.446 -2.588 1.00 2.26 H new ATOM 0 HA GLU B 199 -17.669 -1.170 -4.571 1.00 2.69 H new ATOM 0 HB2 GLU B 199 -18.979 -2.935 -4.373 1.00 2.71 H new ATOM 0 HB3 GLU B 199 -17.431 -3.687 -4.043 1.00 2.71 H new ATOM 0 HG2 GLU B 199 -18.106 -3.302 -1.518 1.00 2.75 H new ATOM 0 HG3 GLU B 199 -19.726 -3.186 -2.176 1.00 2.75 H new ATOM 3180 N GLN B 200 -17.374 0.098 -1.855 1.00 2.65 N ATOM 3181 CA GLN B 200 -17.679 1.359 -1.207 1.00 2.98 C ATOM 3182 C GLN B 200 -17.956 2.493 -2.192 1.00 2.85 C ATOM 3183 O GLN B 200 -18.686 3.410 -1.823 1.00 3.43 O ATOM 3184 CB GLN B 200 -16.503 1.734 -0.282 1.00 3.25 C ATOM 3185 CG GLN B 200 -16.810 1.428 1.181 1.00 3.63 C ATOM 3186 CD GLN B 200 -17.911 2.286 1.808 1.00 4.39 C ATOM 3187 OE1 GLN B 200 -18.177 2.177 2.990 1.00 5.12 O ATOM 3188 NE2 GLN B 200 -18.609 3.175 1.120 1.00 4.50 N ATOM 0 H GLN B 200 -16.453 -0.259 -1.600 1.00 2.65 H new ATOM 0 HA GLN B 200 -18.598 1.224 -0.636 1.00 2.98 H new ATOM 0 HB2 GLN B 200 -15.612 1.187 -0.588 1.00 3.25 H new ATOM 0 HB3 GLN B 200 -16.279 2.795 -0.392 1.00 3.25 H new ATOM 0 HG2 GLN B 200 -17.097 0.380 1.264 1.00 3.63 H new ATOM 0 HG3 GLN B 200 -15.897 1.556 1.762 1.00 3.63 H new ATOM 0 HE21 GLN B 200 -18.427 3.307 0.125 1.00 4.50 H new ATOM 0 HE22 GLN B 200 -19.329 3.728 1.585 1.00 4.50 H new ATOM 3197 N GLU B 201 -17.471 2.386 -3.433 1.00 2.21 N ATOM 3198 CA GLU B 201 -17.760 3.302 -4.551 1.00 2.08 C ATOM 3199 C GLU B 201 -19.028 2.868 -5.312 1.00 2.10 C ATOM 3200 O GLU B 201 -19.297 3.231 -6.457 1.00 1.95 O ATOM 3201 CB GLU B 201 -16.530 3.401 -5.466 1.00 2.01 C ATOM 3202 CG GLU B 201 -15.258 3.672 -4.657 1.00 2.15 C ATOM 3203 CD GLU B 201 -15.321 5.003 -3.897 1.00 2.25 C ATOM 3204 OE1 GLU B 201 -15.052 6.042 -4.538 1.00 3.28 O ATOM 3205 OE2 GLU B 201 -15.648 4.977 -2.690 1.00 2.20 O ATOM 0 H GLU B 201 -16.841 1.630 -3.701 1.00 2.21 H new ATOM 0 HA GLU B 201 -17.967 4.298 -4.158 1.00 2.08 H new ATOM 0 HB2 GLU B 201 -16.416 2.474 -6.028 1.00 2.01 H new ATOM 0 HB3 GLU B 201 -16.678 4.199 -6.194 1.00 2.01 H new ATOM 0 HG2 GLU B 201 -15.101 2.859 -3.948 1.00 2.15 H new ATOM 0 HG3 GLU B 201 -14.399 3.680 -5.328 1.00 2.15 H new ATOM 3212 N GLN B 202 -19.799 1.990 -4.682 1.00 2.51 N ATOM 3213 CA GLN B 202 -21.156 1.623 -5.085 1.00 2.98 C ATOM 3214 C GLN B 202 -22.115 1.918 -3.934 1.00 3.52 C ATOM 3215 O GLN B 202 -22.952 2.805 -4.045 1.00 4.05 O ATOM 3216 CB GLN B 202 -21.234 0.150 -5.483 1.00 3.03 C ATOM 3217 CG GLN B 202 -20.137 -0.282 -6.449 1.00 2.71 C ATOM 3218 CD GLN B 202 -20.466 -0.036 -7.922 1.00 3.25 C ATOM 3219 OE1 GLN B 202 -20.736 -0.958 -8.679 1.00 3.58 O ATOM 3220 NE2 GLN B 202 -20.452 1.200 -8.382 1.00 3.52 N ATOM 0 H GLN B 202 -19.488 1.495 -3.846 1.00 2.51 H new ATOM 0 HA GLN B 202 -21.438 2.213 -5.957 1.00 2.98 H new ATOM 0 HB2 GLN B 202 -21.177 -0.464 -4.584 1.00 3.03 H new ATOM 0 HB3 GLN B 202 -22.205 -0.043 -5.940 1.00 3.03 H new ATOM 0 HG2 GLN B 202 -19.219 0.250 -6.200 1.00 2.71 H new ATOM 0 HG3 GLN B 202 -19.939 -1.344 -6.305 1.00 2.71 H new ATOM 0 HE21 GLN B 202 -20.228 1.974 -7.757 1.00 3.52 H new ATOM 0 HE22 GLN B 202 -20.665 1.382 -9.363 1.00 3.52 H new ATOM 3229 N GLN B 203 -21.977 1.150 -2.845 1.00 3.51 N ATOM 3230 CA GLN B 203 -22.516 1.354 -1.479 1.00 4.28 C ATOM 3231 C GLN B 203 -24.028 1.637 -1.361 1.00 4.49 C ATOM 3232 O GLN B 203 -24.502 2.112 -0.331 1.00 5.30 O ATOM 3233 CB GLN B 203 -21.672 2.391 -0.712 1.00 4.97 C ATOM 3234 CG GLN B 203 -21.905 3.865 -1.116 1.00 5.85 C ATOM 3235 CD GLN B 203 -22.211 4.751 0.087 1.00 6.81 C ATOM 3236 OE1 GLN B 203 -21.433 5.597 0.514 1.00 8.03 O ATOM 3237 NE2 GLN B 203 -23.363 4.562 0.693 1.00 6.68 N ATOM 0 H GLN B 203 -21.435 0.287 -2.895 1.00 3.51 H new ATOM 0 HA GLN B 203 -22.422 0.376 -1.006 1.00 4.28 H new ATOM 0 HB2 GLN B 203 -21.879 2.287 0.353 1.00 4.97 H new ATOM 0 HB3 GLN B 203 -20.618 2.155 -0.856 1.00 4.97 H new ATOM 0 HG2 GLN B 203 -21.020 4.244 -1.628 1.00 5.85 H new ATOM 0 HG3 GLN B 203 -22.731 3.919 -1.825 1.00 5.85 H new ATOM 0 HE21 GLN B 203 -24.014 3.860 0.343 1.00 6.68 H new ATOM 0 HE22 GLN B 203 -23.605 5.118 1.513 1.00 6.68 H new