USER MOD reduce.3.24.130724 H: found=0, std=0, add=1162, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1161 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 10 MET CE :methyl -152:sc= -0.529 (180deg=-1.63) USER MOD Set 1.2: A 73 THR OG1 : rot 160:sc= -0.257 USER MOD Set 1.3: A 119 ASN : amide:sc= -1.08! C(o=-1.9!,f=-2.4!) USER MOD Set 2.1: A 97 ASN : amide:sc= 2.07 K(o=3.3,f=-8.3!) USER MOD Set 2.2: A 98 LYS NZ :NH3+ -173:sc= 1.22 (180deg=0) USER MOD Set 3.1: A 88 CYS SG : rot -147:sc= 0.681 USER MOD Set 3.2: A 137 TYR OH : rot -71:sc= 1.07 USER MOD Set 4.1: A 83 MET CE :methyl -177:sc= -0.162 (180deg=-0.222) USER MOD Set 4.2: A 84 THR OG1 : rot 180:sc= -0.0307 USER MOD Set 5.1: A 6 LYS NZ :NH3+ 176:sc= 0.676 (180deg=-0.45) USER MOD Set 5.2: A 50 TYR OH : rot 130:sc= 0.804 USER MOD Set 5.3: A 57 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 45 THR OG1 : rot 82:sc= 1.12 USER MOD Set 6.2: A 121 LYS NZ :NH3+ -179:sc= 1.27 (180deg=0) USER MOD Set 7.1: A 5 GLN : amide:sc= 1.99 K(o=3.2,f=-6.1!) USER MOD Set 7.2: A 35 THR OG1 : rot 103:sc= 1.23 USER MOD Set 8.1: A 16 THR OG1 : rot 97:sc= 0.501 USER MOD Set 8.2: A 20 CYS SG : rot -140:sc= 1.49 USER MOD Set 8.3: A 69 TYR OH : rot -132:sc= 0.82 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -152:sc= 1.28 (180deg=-0.191) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.757 K(o=-0.76,f=-2.2!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 174:sc= -0.932 (180deg=-0.992) USER MOD Single : A 17 CYS SG : rot -47:sc= -0.55 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 MET CE :methyl 163:sc= 0 (180deg=-0.116) USER MOD Single : A 38 ASN : amide:sc= -0.289! X(o=-0.29!,f=-0.22) USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -0.174 K(o=-0.17,f=-2.2!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0.296 USER MOD Single : A 61 GLN : amide:sc= 1.15 K(o=1.1,f=-0.12) USER MOD Single : A 63 LYS NZ :NH3+ -139:sc= 1.18 (180deg=0.431) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ -173:sc= 2.36 (180deg=2.17) USER MOD Single : A 85 CYS SG : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0.958 K(o=0.96,f=-0.29) USER MOD Single : A 108 ASN : amide:sc=-0.00434 K(o=-0.0043,f=-1.9) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 TYR OH : rot 30:sc= 0 USER MOD Single : A 124 SER OG : rot 22:sc= 0.946 USER MOD Single : A 126 SER OG : rot 180:sc= 0.0427 USER MOD Single : A 129 LYS NZ :NH3+ 163:sc= -0.16 (180deg=-0.652) USER MOD Single : A 134 LYS NZ :NH3+ -162:sc= 1.23 (180deg=1.13) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= -0.0569 (180deg=-0.0569) USER MOD Single : A 140 LYS NZ :NH3+ 142:sc= 1.08 (180deg=0.509) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.649 -19.142 10.741 1.00 9.43 N ATOM 2 CA MET A 1 6.072 -19.115 9.331 1.00 8.55 C ATOM 3 C MET A 1 5.207 -19.961 8.389 1.00 7.08 C ATOM 4 O MET A 1 5.414 -19.906 7.181 1.00 6.98 O ATOM 5 CB MET A 1 7.573 -19.403 9.172 1.00 9.54 C ATOM 6 CG MET A 1 7.985 -20.821 9.584 1.00 10.54 C ATOM 7 SD MET A 1 7.921 -21.151 11.361 1.00 11.92 S ATOM 8 CE MET A 1 8.448 -22.880 11.376 1.00 13.00 C ATOM 0 H1 MET A 1 5.927 -18.253 11.204 1.00 9.43 H new ATOM 0 H2 MET A 1 4.616 -19.250 10.791 1.00 9.43 H new ATOM 0 H3 MET A 1 6.105 -19.942 11.225 1.00 9.43 H new ATOM 0 HA MET A 1 5.902 -18.089 9.006 1.00 8.55 H new ATOM 0 HB2 MET A 1 7.855 -19.242 8.131 1.00 9.54 H new ATOM 0 HB3 MET A 1 8.135 -18.685 9.769 1.00 9.54 H new ATOM 0 HG2 MET A 1 7.337 -21.534 9.074 1.00 10.54 H new ATOM 0 HG3 MET A 1 9.000 -21.005 9.232 1.00 10.54 H new ATOM 0 HE1 MET A 1 8.465 -23.246 12.402 1.00 13.00 H new ATOM 0 HE2 MET A 1 7.751 -23.478 10.789 1.00 13.00 H new ATOM 0 HE3 MET A 1 9.446 -22.960 10.946 1.00 13.00 H new ATOM 20 N LEU A 2 4.227 -20.728 8.889 1.00 6.74 N ATOM 21 CA LEU A 2 3.241 -21.313 7.987 1.00 5.98 C ATOM 22 C LEU A 2 2.471 -20.170 7.327 1.00 4.90 C ATOM 23 O LEU A 2 1.717 -19.478 8.007 1.00 5.67 O ATOM 24 CB LEU A 2 2.264 -22.238 8.730 1.00 7.02 C ATOM 25 CG LEU A 2 2.759 -23.689 8.840 1.00 7.78 C ATOM 26 CD1 LEU A 2 3.935 -23.826 9.811 1.00 8.45 C ATOM 27 CD2 LEU A 2 1.602 -24.585 9.298 1.00 8.95 C ATOM 0 H LEU A 2 4.102 -20.949 9.877 1.00 6.74 H new ATOM 0 HA LEU A 2 3.756 -21.921 7.243 1.00 5.98 H new ATOM 0 HB2 LEU A 2 2.093 -21.844 9.732 1.00 7.02 H new ATOM 0 HB3 LEU A 2 1.303 -22.228 8.215 1.00 7.02 H new ATOM 0 HG LEU A 2 3.112 -23.998 7.856 1.00 7.78 H new ATOM 0 HD11 LEU A 2 4.250 -24.868 9.856 1.00 8.45 H new ATOM 0 HD12 LEU A 2 4.765 -23.210 9.466 1.00 8.45 H new ATOM 0 HD13 LEU A 2 3.627 -23.497 10.804 1.00 8.45 H new ATOM 0 HD21 LEU A 2 1.949 -25.615 9.377 1.00 8.95 H new ATOM 0 HD22 LEU A 2 1.243 -24.247 10.270 1.00 8.95 H new ATOM 0 HD23 LEU A 2 0.790 -24.530 8.573 1.00 8.95 H new ATOM 39 N SER A 3 2.673 -19.979 6.022 1.00 3.71 N ATOM 40 CA SER A 3 1.888 -19.067 5.208 1.00 2.86 C ATOM 41 C SER A 3 2.048 -17.619 5.677 1.00 2.10 C ATOM 42 O SER A 3 1.113 -17.046 6.235 1.00 2.82 O ATOM 43 CB SER A 3 0.419 -19.520 5.203 1.00 3.52 C ATOM 44 OG SER A 3 0.336 -20.900 4.896 1.00 4.39 O ATOM 0 H SER A 3 3.401 -20.465 5.498 1.00 3.71 H new ATOM 0 HA SER A 3 2.257 -19.095 4.183 1.00 2.86 H new ATOM 0 HB2 SER A 3 -0.032 -19.328 6.177 1.00 3.52 H new ATOM 0 HB3 SER A 3 -0.145 -18.942 4.471 1.00 3.52 H new ATOM 0 HG SER A 3 -0.603 -21.179 4.897 1.00 4.39 H new ATOM 50 N GLU A 4 3.199 -17.003 5.379 1.00 1.32 N ATOM 51 CA GLU A 4 3.455 -15.581 5.598 1.00 1.29 C ATOM 52 C GLU A 4 2.668 -14.738 4.583 1.00 1.16 C ATOM 53 O GLU A 4 3.233 -13.934 3.843 1.00 1.64 O ATOM 54 CB GLU A 4 4.969 -15.319 5.497 1.00 1.91 C ATOM 55 CG GLU A 4 5.768 -15.959 6.650 1.00 2.73 C ATOM 56 CD GLU A 4 5.648 -15.205 7.976 1.00 3.34 C ATOM 57 OE1 GLU A 4 5.140 -14.066 7.959 1.00 4.00 O ATOM 58 OE2 GLU A 4 6.083 -15.788 8.995 1.00 4.31 O ATOM 0 H GLU A 4 3.994 -17.494 4.970 1.00 1.32 H new ATOM 0 HA GLU A 4 3.119 -15.292 6.594 1.00 1.29 H new ATOM 0 HB2 GLU A 4 5.337 -15.707 4.547 1.00 1.91 H new ATOM 0 HB3 GLU A 4 5.147 -14.244 5.492 1.00 1.91 H new ATOM 0 HG2 GLU A 4 5.425 -16.984 6.793 1.00 2.73 H new ATOM 0 HG3 GLU A 4 6.819 -16.012 6.366 1.00 2.73 H new ATOM 65 N GLN A 5 1.346 -14.921 4.551 1.00 0.86 N ATOM 66 CA GLN A 5 0.452 -14.072 3.797 1.00 0.76 C ATOM 67 C GLN A 5 0.422 -12.710 4.464 1.00 0.85 C ATOM 68 O GLN A 5 0.691 -12.586 5.658 1.00 1.16 O ATOM 69 CB GLN A 5 -0.968 -14.656 3.764 1.00 0.82 C ATOM 70 CG GLN A 5 -1.005 -16.095 3.249 1.00 0.88 C ATOM 71 CD GLN A 5 -0.215 -16.223 1.955 1.00 1.02 C ATOM 72 OE1 GLN A 5 -0.619 -15.673 0.936 1.00 2.20 O ATOM 73 NE2 GLN A 5 0.935 -16.887 2.021 1.00 1.42 N ATOM 0 H GLN A 5 0.873 -15.671 5.055 1.00 0.86 H new ATOM 0 HA GLN A 5 0.808 -13.996 2.770 1.00 0.76 H new ATOM 0 HB2 GLN A 5 -1.393 -14.623 4.767 1.00 0.82 H new ATOM 0 HB3 GLN A 5 -1.598 -14.032 3.130 1.00 0.82 H new ATOM 0 HG2 GLN A 5 -0.592 -16.767 4.001 1.00 0.88 H new ATOM 0 HG3 GLN A 5 -2.038 -16.400 3.082 1.00 0.88 H new ATOM 0 HE21 GLN A 5 1.221 -17.325 2.896 1.00 1.42 H new ATOM 0 HE22 GLN A 5 1.531 -16.958 1.196 1.00 1.42 H new ATOM 82 N LYS A 6 0.054 -11.695 3.695 1.00 0.69 N ATOM 83 CA LYS A 6 -0.137 -10.363 4.221 1.00 0.74 C ATOM 84 C LYS A 6 -1.420 -9.812 3.620 1.00 0.78 C ATOM 85 O LYS A 6 -1.723 -10.081 2.453 1.00 1.03 O ATOM 86 CB LYS A 6 1.112 -9.517 3.934 1.00 0.95 C ATOM 87 CG LYS A 6 1.436 -9.400 2.438 1.00 1.28 C ATOM 88 CD LYS A 6 0.577 -8.321 1.769 1.00 1.21 C ATOM 89 CE LYS A 6 1.442 -7.133 1.369 1.00 1.35 C ATOM 90 NZ LYS A 6 0.612 -5.950 1.073 1.00 2.46 N ATOM 0 H LYS A 6 -0.119 -11.777 2.693 1.00 0.69 H new ATOM 0 HA LYS A 6 -0.253 -10.353 5.305 1.00 0.74 H new ATOM 0 HB2 LYS A 6 0.969 -8.518 4.347 1.00 0.95 H new ATOM 0 HB3 LYS A 6 1.966 -9.956 4.450 1.00 0.95 H new ATOM 0 HG2 LYS A 6 2.491 -9.160 2.309 1.00 1.28 H new ATOM 0 HG3 LYS A 6 1.265 -10.359 1.950 1.00 1.28 H new ATOM 0 HD2 LYS A 6 0.083 -8.733 0.889 1.00 1.21 H new ATOM 0 HD3 LYS A 6 -0.208 -7.995 2.452 1.00 1.21 H new ATOM 0 HE2 LYS A 6 2.140 -6.900 2.173 1.00 1.35 H new ATOM 0 HE3 LYS A 6 2.038 -7.391 0.494 1.00 1.35 H new ATOM 0 HZ1 LYS A 6 1.227 -5.137 0.869 1.00 2.46 H new ATOM 0 HZ2 LYS A 6 0.011 -6.145 0.247 1.00 2.46 H new ATOM 0 HZ3 LYS A 6 0.012 -5.733 1.894 1.00 2.46 H new ATOM 104 N GLU A 7 -2.148 -9.038 4.421 1.00 0.68 N ATOM 105 CA GLU A 7 -3.302 -8.283 3.984 1.00 0.68 C ATOM 106 C GLU A 7 -2.857 -6.942 3.401 1.00 0.74 C ATOM 107 O GLU A 7 -1.745 -6.464 3.642 1.00 1.20 O ATOM 108 CB GLU A 7 -4.282 -8.140 5.157 1.00 0.76 C ATOM 109 CG GLU A 7 -3.749 -7.326 6.343 1.00 2.41 C ATOM 110 CD GLU A 7 -4.435 -7.766 7.630 1.00 2.54 C ATOM 111 OE1 GLU A 7 -5.649 -7.493 7.750 1.00 3.85 O ATOM 112 OE2 GLU A 7 -3.742 -8.414 8.442 1.00 2.53 O ATOM 0 H GLU A 7 -1.941 -8.921 5.413 1.00 0.68 H new ATOM 0 HA GLU A 7 -3.828 -8.806 3.185 1.00 0.68 H new ATOM 0 HB2 GLU A 7 -5.196 -7.671 4.794 1.00 0.76 H new ATOM 0 HB3 GLU A 7 -4.553 -9.135 5.510 1.00 0.76 H new ATOM 0 HG2 GLU A 7 -2.671 -7.461 6.432 1.00 2.41 H new ATOM 0 HG3 GLU A 7 -3.924 -6.264 6.173 1.00 2.41 H new ATOM 119 N ILE A 8 -3.722 -6.351 2.586 1.00 0.55 N ATOM 120 CA ILE A 8 -3.644 -4.941 2.229 1.00 0.57 C ATOM 121 C ILE A 8 -5.072 -4.431 2.036 1.00 0.54 C ATOM 122 O ILE A 8 -5.741 -4.842 1.086 1.00 0.72 O ATOM 123 CB ILE A 8 -2.715 -4.759 1.009 1.00 0.61 C ATOM 124 CG1 ILE A 8 -2.611 -3.313 0.510 1.00 0.77 C ATOM 125 CG2 ILE A 8 -3.060 -5.716 -0.133 1.00 0.73 C ATOM 126 CD1 ILE A 8 -1.382 -3.076 -0.378 1.00 2.04 C ATOM 0 H ILE A 8 -4.504 -6.841 2.151 1.00 0.55 H new ATOM 0 HA ILE A 8 -3.192 -4.336 3.015 1.00 0.57 H new ATOM 0 HB ILE A 8 -1.723 -5.020 1.378 1.00 0.61 H new ATOM 0 HG12 ILE A 8 -3.512 -3.061 -0.050 1.00 0.77 H new ATOM 0 HG13 ILE A 8 -2.570 -2.640 1.367 1.00 0.77 H new ATOM 0 HG21 ILE A 8 -2.378 -5.548 -0.967 1.00 0.73 H new ATOM 0 HG22 ILE A 8 -2.964 -6.745 0.213 1.00 0.73 H new ATOM 0 HG23 ILE A 8 -4.084 -5.538 -0.460 1.00 0.73 H new ATOM 0 HD11 ILE A 8 -1.362 -2.035 -0.701 1.00 2.04 H new ATOM 0 HD12 ILE A 8 -0.477 -3.298 0.187 1.00 2.04 H new ATOM 0 HD13 ILE A 8 -1.433 -3.726 -1.252 1.00 2.04 H new ATOM 138 N ALA A 9 -5.560 -3.588 2.954 1.00 0.51 N ATOM 139 CA ALA A 9 -6.851 -2.931 2.813 1.00 0.47 C ATOM 140 C ALA A 9 -6.633 -1.576 2.155 1.00 0.45 C ATOM 141 O ALA A 9 -5.786 -0.807 2.597 1.00 0.57 O ATOM 142 CB ALA A 9 -7.556 -2.785 4.161 1.00 0.56 C ATOM 0 H ALA A 9 -5.066 -3.347 3.813 1.00 0.51 H new ATOM 0 HA ALA A 9 -7.502 -3.542 2.188 1.00 0.47 H new ATOM 0 HB1 ALA A 9 -8.517 -2.290 4.018 1.00 0.56 H new ATOM 0 HB2 ALA A 9 -7.717 -3.771 4.596 1.00 0.56 H new ATOM 0 HB3 ALA A 9 -6.938 -2.189 4.832 1.00 0.56 H new ATOM 148 N MET A 10 -7.345 -1.296 1.066 1.00 0.37 N ATOM 149 CA MET A 10 -7.253 -0.027 0.359 1.00 0.38 C ATOM 150 C MET A 10 -8.622 0.357 -0.199 1.00 0.37 C ATOM 151 O MET A 10 -9.527 -0.475 -0.275 1.00 0.39 O ATOM 152 CB MET A 10 -6.213 -0.131 -0.767 1.00 0.40 C ATOM 153 CG MET A 10 -4.781 -0.252 -0.224 1.00 0.56 C ATOM 154 SD MET A 10 -3.476 -0.267 -1.472 1.00 1.29 S ATOM 155 CE MET A 10 -3.472 1.480 -1.893 1.00 2.07 C ATOM 0 H MET A 10 -8.006 -1.951 0.648 1.00 0.37 H new ATOM 0 HA MET A 10 -6.933 0.751 1.052 1.00 0.38 H new ATOM 0 HB2 MET A 10 -6.439 -0.997 -1.389 1.00 0.40 H new ATOM 0 HB3 MET A 10 -6.284 0.748 -1.407 1.00 0.40 H new ATOM 0 HG2 MET A 10 -4.598 0.578 0.458 1.00 0.56 H new ATOM 0 HG3 MET A 10 -4.709 -1.168 0.363 1.00 0.56 H new ATOM 0 HE1 MET A 10 -3.137 1.605 -2.923 1.00 2.07 H new ATOM 0 HE2 MET A 10 -4.480 1.882 -1.788 1.00 2.07 H new ATOM 0 HE3 MET A 10 -2.797 2.014 -1.224 1.00 2.07 H new ATOM 165 N GLN A 11 -8.755 1.610 -0.637 1.00 0.41 N ATOM 166 CA GLN A 11 -9.953 2.160 -1.247 1.00 0.43 C ATOM 167 C GLN A 11 -9.734 2.297 -2.752 1.00 0.48 C ATOM 168 O GLN A 11 -8.762 2.920 -3.191 1.00 0.63 O ATOM 169 CB GLN A 11 -10.268 3.519 -0.618 1.00 0.51 C ATOM 170 CG GLN A 11 -11.752 3.885 -0.761 1.00 1.33 C ATOM 171 CD GLN A 11 -11.977 5.378 -0.971 1.00 1.93 C ATOM 172 OE1 GLN A 11 -11.807 5.878 -2.072 1.00 2.68 O ATOM 173 NE2 GLN A 11 -12.369 6.114 0.065 1.00 2.18 N ATOM 0 H GLN A 11 -7.998 2.291 -0.571 1.00 0.41 H new ATOM 0 HA GLN A 11 -10.799 1.495 -1.075 1.00 0.43 H new ATOM 0 HB2 GLN A 11 -9.998 3.502 0.438 1.00 0.51 H new ATOM 0 HB3 GLN A 11 -9.657 4.288 -1.090 1.00 0.51 H new ATOM 0 HG2 GLN A 11 -12.177 3.337 -1.602 1.00 1.33 H new ATOM 0 HG3 GLN A 11 -12.288 3.564 0.132 1.00 1.33 H new ATOM 0 HE21 GLN A 11 -12.506 5.679 0.977 1.00 2.18 H new ATOM 0 HE22 GLN A 11 -12.533 7.114 -0.053 1.00 2.18 H new ATOM 182 N VAL A 12 -10.650 1.717 -3.525 1.00 0.45 N ATOM 183 CA VAL A 12 -10.675 1.701 -4.974 1.00 0.48 C ATOM 184 C VAL A 12 -12.036 2.243 -5.409 1.00 0.34 C ATOM 185 O VAL A 12 -13.001 2.119 -4.659 1.00 0.43 O ATOM 186 CB VAL A 12 -10.407 0.260 -5.461 1.00 0.65 C ATOM 187 CG1 VAL A 12 -11.230 -0.772 -4.681 1.00 0.84 C ATOM 188 CG2 VAL A 12 -10.688 0.075 -6.954 1.00 0.57 C ATOM 0 H VAL A 12 -11.442 1.215 -3.124 1.00 0.45 H new ATOM 0 HA VAL A 12 -9.901 2.328 -5.416 1.00 0.48 H new ATOM 0 HB VAL A 12 -9.345 0.095 -5.281 1.00 0.65 H new ATOM 0 HG11 VAL A 12 -11.010 -1.771 -5.056 1.00 0.84 H new ATOM 0 HG12 VAL A 12 -10.974 -0.717 -3.623 1.00 0.84 H new ATOM 0 HG13 VAL A 12 -12.292 -0.562 -4.808 1.00 0.84 H new ATOM 0 HG21 VAL A 12 -10.482 -0.957 -7.238 1.00 0.57 H new ATOM 0 HG22 VAL A 12 -11.733 0.306 -7.159 1.00 0.57 H new ATOM 0 HG23 VAL A 12 -10.049 0.744 -7.530 1.00 0.57 H new ATOM 198 N SER A 13 -12.101 2.838 -6.602 1.00 0.31 N ATOM 199 CA SER A 13 -13.332 3.305 -7.224 1.00 0.37 C ATOM 200 C SER A 13 -13.562 2.568 -8.539 1.00 0.48 C ATOM 201 O SER A 13 -12.640 1.962 -9.089 1.00 0.77 O ATOM 202 CB SER A 13 -13.238 4.795 -7.541 1.00 0.62 C ATOM 203 OG SER A 13 -12.616 5.515 -6.499 1.00 0.89 O ATOM 0 H SER A 13 -11.274 3.011 -7.174 1.00 0.31 H new ATOM 0 HA SER A 13 -14.150 3.119 -6.528 1.00 0.37 H new ATOM 0 HB2 SER A 13 -12.677 4.935 -8.465 1.00 0.62 H new ATOM 0 HB3 SER A 13 -14.238 5.194 -7.712 1.00 0.62 H new ATOM 0 HG SER A 13 -12.572 6.464 -6.738 1.00 0.89 H new ATOM 209 N GLY A 14 -14.790 2.689 -9.054 1.00 0.65 N ATOM 210 CA GLY A 14 -15.268 2.021 -10.256 1.00 0.81 C ATOM 211 C GLY A 14 -16.318 0.967 -9.900 1.00 0.71 C ATOM 212 O GLY A 14 -16.978 0.423 -10.784 1.00 0.73 O ATOM 0 H GLY A 14 -15.502 3.280 -8.623 1.00 0.65 H new ATOM 0 HA2 GLY A 14 -15.696 2.753 -10.940 1.00 0.81 H new ATOM 0 HA3 GLY A 14 -14.433 1.550 -10.775 1.00 0.81 H new ATOM 216 N MET A 15 -16.482 0.663 -8.608 1.00 0.71 N ATOM 217 CA MET A 15 -17.457 -0.339 -8.194 1.00 0.79 C ATOM 218 C MET A 15 -18.887 0.152 -8.409 1.00 0.78 C ATOM 219 O MET A 15 -19.430 0.903 -7.606 1.00 0.93 O ATOM 220 CB MET A 15 -17.221 -0.851 -6.770 1.00 1.02 C ATOM 221 CG MET A 15 -15.856 -1.544 -6.658 1.00 0.99 C ATOM 222 SD MET A 15 -14.535 -0.479 -6.058 1.00 2.54 S ATOM 223 CE MET A 15 -14.989 -0.465 -4.308 1.00 2.77 C ATOM 0 H MET A 15 -15.959 1.092 -7.845 1.00 0.71 H new ATOM 0 HA MET A 15 -17.311 -1.204 -8.842 1.00 0.79 H new ATOM 0 HB2 MET A 15 -17.270 -0.019 -6.067 1.00 1.02 H new ATOM 0 HB3 MET A 15 -18.012 -1.549 -6.494 1.00 1.02 H new ATOM 0 HG2 MET A 15 -15.949 -2.400 -5.990 1.00 0.99 H new ATOM 0 HG3 MET A 15 -15.577 -1.933 -7.637 1.00 0.99 H new ATOM 0 HE1 MET A 15 -14.224 0.061 -3.738 1.00 2.77 H new ATOM 0 HE2 MET A 15 -15.946 0.042 -4.184 1.00 2.77 H new ATOM 0 HE3 MET A 15 -15.071 -1.490 -3.945 1.00 2.77 H new ATOM 233 N THR A 16 -19.514 -0.357 -9.472 1.00 0.84 N ATOM 234 CA THR A 16 -20.933 -0.174 -9.761 1.00 0.98 C ATOM 235 C THR A 16 -21.813 -0.701 -8.615 1.00 0.95 C ATOM 236 O THR A 16 -22.980 -0.335 -8.521 1.00 1.14 O ATOM 237 CB THR A 16 -21.254 -0.842 -11.109 1.00 1.20 C ATOM 238 OG1 THR A 16 -20.397 -0.321 -12.109 1.00 1.43 O ATOM 239 CG2 THR A 16 -22.693 -0.609 -11.577 1.00 1.48 C ATOM 0 H THR A 16 -19.034 -0.922 -10.172 1.00 0.84 H new ATOM 0 HA THR A 16 -21.158 0.890 -9.840 1.00 0.98 H new ATOM 0 HB THR A 16 -21.113 -1.912 -10.957 1.00 1.20 H new ATOM 0 HG1 THR A 16 -19.634 -0.923 -12.232 1.00 1.43 H new ATOM 0 HG21 THR A 16 -22.850 -1.108 -12.533 1.00 1.48 H new ATOM 0 HG22 THR A 16 -23.386 -1.013 -10.839 1.00 1.48 H new ATOM 0 HG23 THR A 16 -22.869 0.460 -11.692 1.00 1.48 H new ATOM 247 N CYS A 17 -21.259 -1.557 -7.746 1.00 1.00 N ATOM 248 CA CYS A 17 -21.877 -2.013 -6.497 1.00 1.46 C ATOM 249 C CYS A 17 -22.844 -3.171 -6.754 1.00 1.62 C ATOM 250 O CYS A 17 -23.780 -3.416 -5.998 1.00 2.90 O ATOM 251 CB CYS A 17 -22.490 -0.852 -5.696 1.00 2.75 C ATOM 252 SG CYS A 17 -22.817 -1.372 -3.994 1.00 3.63 S ATOM 0 H CYS A 17 -20.337 -1.964 -7.900 1.00 1.00 H new ATOM 0 HA CYS A 17 -21.092 -2.412 -5.854 1.00 1.46 H new ATOM 0 HB2 CYS A 17 -21.811 0.000 -5.699 1.00 2.75 H new ATOM 0 HB3 CYS A 17 -23.416 -0.524 -6.168 1.00 2.75 H new ATOM 0 HG CYS A 17 -23.426 -2.521 -4.001 1.00 3.63 H new ATOM 258 N ALA A 18 -22.562 -3.923 -7.818 1.00 1.70 N ATOM 259 CA ALA A 18 -23.178 -5.184 -8.175 1.00 2.21 C ATOM 260 C ALA A 18 -22.190 -5.826 -9.141 1.00 1.93 C ATOM 261 O ALA A 18 -21.781 -5.163 -10.092 1.00 3.23 O ATOM 262 CB ALA A 18 -24.531 -4.937 -8.849 1.00 3.15 C ATOM 0 H ALA A 18 -21.850 -3.642 -8.492 1.00 1.70 H new ATOM 0 HA ALA A 18 -23.376 -5.820 -7.313 1.00 2.21 H new ATOM 0 HB1 ALA A 18 -24.986 -5.892 -9.113 1.00 3.15 H new ATOM 0 HB2 ALA A 18 -25.187 -4.401 -8.163 1.00 3.15 H new ATOM 0 HB3 ALA A 18 -24.385 -4.343 -9.751 1.00 3.15 H new ATOM 268 N ALA A 19 -21.716 -7.043 -8.854 1.00 1.21 N ATOM 269 CA ALA A 19 -20.813 -7.825 -9.702 1.00 1.26 C ATOM 270 C ALA A 19 -19.398 -7.249 -9.889 1.00 1.09 C ATOM 271 O ALA A 19 -18.469 -8.013 -10.124 1.00 1.12 O ATOM 272 CB ALA A 19 -21.467 -8.123 -11.055 1.00 1.65 C ATOM 0 H ALA A 19 -21.961 -7.528 -7.991 1.00 1.21 H new ATOM 0 HA ALA A 19 -20.652 -8.751 -9.150 1.00 1.26 H new ATOM 0 HB1 ALA A 19 -20.781 -8.705 -11.671 1.00 1.65 H new ATOM 0 HB2 ALA A 19 -22.384 -8.691 -10.899 1.00 1.65 H new ATOM 0 HB3 ALA A 19 -21.702 -7.186 -11.560 1.00 1.65 H new ATOM 278 N CYS A 20 -19.201 -5.933 -9.799 1.00 0.95 N ATOM 279 CA CYS A 20 -17.950 -5.259 -10.111 1.00 0.85 C ATOM 280 C CYS A 20 -16.859 -5.738 -9.158 1.00 0.69 C ATOM 281 O CYS A 20 -15.817 -6.249 -9.568 1.00 0.67 O ATOM 282 CB CYS A 20 -18.164 -3.747 -9.973 1.00 0.85 C ATOM 283 SG CYS A 20 -18.588 -3.022 -11.576 1.00 0.87 S ATOM 0 H CYS A 20 -19.934 -5.291 -9.497 1.00 0.95 H new ATOM 0 HA CYS A 20 -17.638 -5.488 -11.130 1.00 0.85 H new ATOM 0 HB2 CYS A 20 -18.960 -3.550 -9.255 1.00 0.85 H new ATOM 0 HB3 CYS A 20 -17.260 -3.279 -9.583 1.00 0.85 H new ATOM 0 HG CYS A 20 -17.985 -1.878 -11.708 1.00 0.87 H new ATOM 289 N ALA A 21 -17.155 -5.610 -7.864 1.00 0.64 N ATOM 290 CA ALA A 21 -16.392 -6.228 -6.794 1.00 0.67 C ATOM 291 C ALA A 21 -16.087 -7.688 -7.129 1.00 0.67 C ATOM 292 O ALA A 21 -14.926 -8.072 -7.198 1.00 0.62 O ATOM 293 CB ALA A 21 -17.194 -6.121 -5.499 1.00 0.84 C ATOM 0 H ALA A 21 -17.948 -5.062 -7.530 1.00 0.64 H new ATOM 0 HA ALA A 21 -15.439 -5.713 -6.673 1.00 0.67 H new ATOM 0 HB1 ALA A 21 -16.634 -6.581 -4.685 1.00 0.84 H new ATOM 0 HB2 ALA A 21 -17.373 -5.071 -5.268 1.00 0.84 H new ATOM 0 HB3 ALA A 21 -18.148 -6.634 -5.618 1.00 0.84 H new ATOM 299 N ALA A 22 -17.119 -8.498 -7.380 1.00 0.76 N ATOM 300 CA ALA A 22 -16.943 -9.925 -7.656 1.00 0.83 C ATOM 301 C ALA A 22 -16.010 -10.159 -8.845 1.00 0.77 C ATOM 302 O ALA A 22 -15.227 -11.106 -8.844 1.00 0.77 O ATOM 303 CB ALA A 22 -18.303 -10.592 -7.870 1.00 1.02 C ATOM 0 H ALA A 22 -18.090 -8.187 -7.398 1.00 0.76 H new ATOM 0 HA ALA A 22 -16.468 -10.384 -6.789 1.00 0.83 H new ATOM 0 HB1 ALA A 22 -18.160 -11.653 -8.075 1.00 1.02 H new ATOM 0 HB2 ALA A 22 -18.911 -10.474 -6.973 1.00 1.02 H new ATOM 0 HB3 ALA A 22 -18.808 -10.125 -8.715 1.00 1.02 H new ATOM 309 N ARG A 23 -16.071 -9.296 -9.858 1.00 0.76 N ATOM 310 CA ARG A 23 -15.176 -9.327 -10.990 1.00 0.76 C ATOM 311 C ARG A 23 -13.735 -9.149 -10.529 1.00 0.69 C ATOM 312 O ARG A 23 -12.859 -9.889 -10.975 1.00 0.69 O ATOM 313 CB ARG A 23 -15.580 -8.243 -12.003 1.00 0.83 C ATOM 314 CG ARG A 23 -16.205 -8.847 -13.254 1.00 0.83 C ATOM 315 CD ARG A 23 -15.223 -9.817 -13.932 1.00 0.89 C ATOM 316 NE ARG A 23 -15.177 -9.632 -15.394 1.00 1.06 N ATOM 317 CZ ARG A 23 -16.192 -9.851 -16.246 1.00 1.80 C ATOM 318 NH1 ARG A 23 -17.357 -10.314 -15.784 1.00 3.57 N ATOM 319 NH2 ARG A 23 -16.038 -9.603 -17.552 1.00 1.67 N ATOM 0 H ARG A 23 -16.760 -8.546 -9.906 1.00 0.76 H new ATOM 0 HA ARG A 23 -15.249 -10.297 -11.482 1.00 0.76 H new ATOM 0 HB2 ARG A 23 -16.287 -7.556 -11.538 1.00 0.83 H new ATOM 0 HB3 ARG A 23 -14.703 -7.659 -12.280 1.00 0.83 H new ATOM 0 HG2 ARG A 23 -17.123 -9.374 -12.991 1.00 0.83 H new ATOM 0 HG3 ARG A 23 -16.480 -8.054 -13.949 1.00 0.83 H new ATOM 0 HD2 ARG A 23 -14.226 -9.670 -13.517 1.00 0.89 H new ATOM 0 HD3 ARG A 23 -15.514 -10.843 -13.706 1.00 0.89 H new ATOM 0 HE ARG A 23 -14.296 -9.309 -15.794 1.00 1.06 H new ATOM 0 HH11 ARG A 23 -17.473 -10.500 -14.788 1.00 3.57 H new ATOM 0 HH12 ARG A 23 -18.130 -10.482 -16.428 1.00 3.57 H new ATOM 0 HH21 ARG A 23 -15.149 -9.247 -17.902 1.00 1.67 H new ATOM 0 HH22 ARG A 23 -16.810 -9.770 -18.197 1.00 1.67 H new ATOM 333 N ILE A 24 -13.485 -8.183 -9.643 1.00 0.68 N ATOM 334 CA ILE A 24 -12.174 -8.004 -9.054 1.00 0.71 C ATOM 335 C ILE A 24 -11.821 -9.266 -8.267 1.00 0.71 C ATOM 336 O ILE A 24 -10.804 -9.876 -8.566 1.00 0.73 O ATOM 337 CB ILE A 24 -12.135 -6.715 -8.220 1.00 0.72 C ATOM 338 CG1 ILE A 24 -12.289 -5.503 -9.154 1.00 0.75 C ATOM 339 CG2 ILE A 24 -10.842 -6.583 -7.421 1.00 0.86 C ATOM 340 CD1 ILE A 24 -12.820 -4.272 -8.424 1.00 0.78 C ATOM 0 H ILE A 24 -14.184 -7.513 -9.322 1.00 0.68 H new ATOM 0 HA ILE A 24 -11.410 -7.875 -9.821 1.00 0.71 H new ATOM 0 HB ILE A 24 -12.958 -6.755 -7.506 1.00 0.72 H new ATOM 0 HG12 ILE A 24 -11.324 -5.268 -9.603 1.00 0.75 H new ATOM 0 HG13 ILE A 24 -12.966 -5.759 -9.969 1.00 0.75 H new ATOM 0 HG21 ILE A 24 -10.862 -5.656 -6.848 1.00 0.86 H new ATOM 0 HG22 ILE A 24 -10.747 -7.429 -6.740 1.00 0.86 H new ATOM 0 HG23 ILE A 24 -9.992 -6.570 -8.104 1.00 0.86 H new ATOM 0 HD11 ILE A 24 -12.911 -3.444 -9.126 1.00 0.78 H new ATOM 0 HD12 ILE A 24 -13.798 -4.495 -7.998 1.00 0.78 H new ATOM 0 HD13 ILE A 24 -12.131 -3.997 -7.626 1.00 0.78 H new ATOM 352 N GLU A 25 -12.642 -9.695 -7.306 1.00 0.72 N ATOM 353 CA GLU A 25 -12.331 -10.855 -6.478 1.00 0.76 C ATOM 354 C GLU A 25 -11.940 -12.041 -7.357 1.00 0.70 C ATOM 355 O GLU A 25 -10.875 -12.626 -7.172 1.00 0.64 O ATOM 356 CB GLU A 25 -13.500 -11.210 -5.548 1.00 0.92 C ATOM 357 CG GLU A 25 -13.811 -10.046 -4.601 1.00 0.99 C ATOM 358 CD GLU A 25 -14.897 -10.354 -3.581 1.00 2.62 C ATOM 359 OE1 GLU A 25 -15.643 -11.329 -3.820 1.00 4.03 O ATOM 360 OE2 GLU A 25 -14.973 -9.582 -2.598 1.00 3.20 O ATOM 0 H GLU A 25 -13.533 -9.251 -7.084 1.00 0.72 H new ATOM 0 HA GLU A 25 -11.482 -10.604 -5.843 1.00 0.76 H new ATOM 0 HB2 GLU A 25 -14.383 -11.449 -6.141 1.00 0.92 H new ATOM 0 HB3 GLU A 25 -13.254 -12.100 -4.969 1.00 0.92 H new ATOM 0 HG2 GLU A 25 -12.899 -9.766 -4.073 1.00 0.99 H new ATOM 0 HG3 GLU A 25 -14.115 -9.182 -5.191 1.00 0.99 H new ATOM 367 N LYS A 26 -12.770 -12.363 -8.351 1.00 0.73 N ATOM 368 CA LYS A 26 -12.516 -13.463 -9.257 1.00 0.75 C ATOM 369 C LYS A 26 -11.239 -13.223 -10.075 1.00 0.71 C ATOM 370 O LYS A 26 -10.392 -14.109 -10.187 1.00 0.77 O ATOM 371 CB LYS A 26 -13.747 -13.739 -10.139 1.00 0.85 C ATOM 372 CG LYS A 26 -13.652 -15.201 -10.609 1.00 1.09 C ATOM 373 CD LYS A 26 -14.270 -15.502 -11.981 1.00 1.14 C ATOM 374 CE LYS A 26 -15.800 -15.613 -11.933 1.00 1.38 C ATOM 375 NZ LYS A 26 -16.348 -16.167 -13.191 1.00 1.79 N ATOM 0 H LYS A 26 -13.637 -11.861 -8.543 1.00 0.73 H new ATOM 0 HA LYS A 26 -12.340 -14.364 -8.670 1.00 0.75 H new ATOM 0 HB2 LYS A 26 -14.667 -13.574 -9.578 1.00 0.85 H new ATOM 0 HB3 LYS A 26 -13.769 -13.061 -10.992 1.00 0.85 H new ATOM 0 HG2 LYS A 26 -12.601 -15.487 -10.634 1.00 1.09 H new ATOM 0 HG3 LYS A 26 -14.137 -15.834 -9.866 1.00 1.09 H new ATOM 0 HD2 LYS A 26 -13.989 -14.715 -12.681 1.00 1.14 H new ATOM 0 HD3 LYS A 26 -13.855 -16.434 -12.365 1.00 1.14 H new ATOM 0 HE2 LYS A 26 -16.093 -16.249 -11.097 1.00 1.38 H new ATOM 0 HE3 LYS A 26 -16.231 -14.628 -11.751 1.00 1.38 H new ATOM 0 HZ1 LYS A 26 -17.384 -16.227 -13.122 1.00 1.79 H new ATOM 0 HZ2 LYS A 26 -16.090 -15.547 -13.985 1.00 1.79 H new ATOM 0 HZ3 LYS A 26 -15.956 -17.117 -13.352 1.00 1.79 H new ATOM 389 N GLY A 27 -11.103 -12.034 -10.666 1.00 0.67 N ATOM 390 CA GLY A 27 -9.953 -11.667 -11.477 1.00 0.67 C ATOM 391 C GLY A 27 -8.651 -11.806 -10.691 1.00 0.59 C ATOM 392 O GLY A 27 -7.652 -12.303 -11.206 1.00 0.62 O ATOM 0 H GLY A 27 -11.800 -11.294 -10.590 1.00 0.67 H new ATOM 0 HA2 GLY A 27 -9.914 -12.300 -12.364 1.00 0.67 H new ATOM 0 HA3 GLY A 27 -10.063 -10.639 -11.823 1.00 0.67 H new ATOM 396 N LEU A 28 -8.657 -11.365 -9.436 1.00 0.53 N ATOM 397 CA LEU A 28 -7.525 -11.463 -8.536 1.00 0.49 C ATOM 398 C LEU A 28 -7.310 -12.919 -8.116 1.00 0.50 C ATOM 399 O LEU A 28 -6.169 -13.370 -8.092 1.00 0.51 O ATOM 400 CB LEU A 28 -7.698 -10.493 -7.351 1.00 0.48 C ATOM 401 CG LEU A 28 -7.253 -9.043 -7.651 1.00 0.55 C ATOM 402 CD1 LEU A 28 -5.732 -8.971 -7.822 1.00 1.32 C ATOM 403 CD2 LEU A 28 -7.951 -8.397 -8.850 1.00 1.60 C ATOM 0 H LEU A 28 -9.471 -10.920 -9.012 1.00 0.53 H new ATOM 0 HA LEU A 28 -6.613 -11.155 -9.048 1.00 0.49 H new ATOM 0 HB2 LEU A 28 -8.746 -10.485 -7.052 1.00 0.48 H new ATOM 0 HB3 LEU A 28 -7.127 -10.868 -6.502 1.00 0.48 H new ATOM 0 HG LEU A 28 -7.561 -8.462 -6.782 1.00 0.55 H new ATOM 0 HD11 LEU A 28 -5.438 -7.943 -8.033 1.00 1.32 H new ATOM 0 HD12 LEU A 28 -5.247 -9.307 -6.906 1.00 1.32 H new ATOM 0 HD13 LEU A 28 -5.428 -9.612 -8.650 1.00 1.32 H new ATOM 0 HD21 LEU A 28 -7.577 -7.382 -8.985 1.00 1.60 H new ATOM 0 HD22 LEU A 28 -7.748 -8.981 -9.747 1.00 1.60 H new ATOM 0 HD23 LEU A 28 -9.026 -8.367 -8.672 1.00 1.60 H new ATOM 415 N LYS A 29 -8.378 -13.684 -7.855 1.00 0.54 N ATOM 416 CA LYS A 29 -8.275 -15.112 -7.549 1.00 0.59 C ATOM 417 C LYS A 29 -7.538 -15.891 -8.649 1.00 0.63 C ATOM 418 O LYS A 29 -7.046 -16.987 -8.404 1.00 0.69 O ATOM 419 CB LYS A 29 -9.663 -15.731 -7.281 1.00 0.68 C ATOM 420 CG LYS A 29 -9.605 -16.790 -6.168 1.00 1.00 C ATOM 421 CD LYS A 29 -9.618 -16.126 -4.778 1.00 1.33 C ATOM 422 CE LYS A 29 -11.039 -15.888 -4.236 1.00 1.26 C ATOM 423 NZ LYS A 29 -11.599 -17.087 -3.577 1.00 2.25 N ATOM 0 H LYS A 29 -9.334 -13.329 -7.851 1.00 0.54 H new ATOM 0 HA LYS A 29 -7.681 -15.193 -6.639 1.00 0.59 H new ATOM 0 HB2 LYS A 29 -10.364 -14.945 -7.000 1.00 0.68 H new ATOM 0 HB3 LYS A 29 -10.043 -16.185 -8.196 1.00 0.68 H new ATOM 0 HG2 LYS A 29 -10.454 -17.467 -6.260 1.00 1.00 H new ATOM 0 HG3 LYS A 29 -8.703 -17.392 -6.280 1.00 1.00 H new ATOM 0 HD2 LYS A 29 -9.069 -16.754 -4.077 1.00 1.33 H new ATOM 0 HD3 LYS A 29 -9.092 -15.173 -4.832 1.00 1.33 H new ATOM 0 HE2 LYS A 29 -11.020 -15.062 -3.525 1.00 1.26 H new ATOM 0 HE3 LYS A 29 -11.692 -15.589 -5.056 1.00 1.26 H new ATOM 0 HZ1 LYS A 29 -12.556 -16.877 -3.229 1.00 2.25 H new ATOM 0 HZ2 LYS A 29 -11.643 -17.870 -4.260 1.00 2.25 H new ATOM 0 HZ3 LYS A 29 -10.992 -17.359 -2.777 1.00 2.25 H new ATOM 437 N ARG A 30 -7.472 -15.339 -9.865 1.00 0.64 N ATOM 438 CA ARG A 30 -6.697 -15.905 -10.959 1.00 0.70 C ATOM 439 C ARG A 30 -5.193 -15.982 -10.631 1.00 0.66 C ATOM 440 O ARG A 30 -4.494 -16.824 -11.189 1.00 0.74 O ATOM 441 CB ARG A 30 -6.944 -15.069 -12.227 1.00 0.75 C ATOM 442 CG ARG A 30 -6.964 -15.905 -13.513 1.00 0.92 C ATOM 443 CD ARG A 30 -8.338 -16.573 -13.696 1.00 1.67 C ATOM 444 NE ARG A 30 -8.432 -17.319 -14.963 1.00 2.03 N ATOM 445 CZ ARG A 30 -8.680 -16.780 -16.170 1.00 1.97 C ATOM 446 NH1 ARG A 30 -8.778 -15.453 -16.301 1.00 2.53 N ATOM 447 NH2 ARG A 30 -8.831 -17.571 -17.238 1.00 2.48 N ATOM 0 H ARG A 30 -7.962 -14.479 -10.113 1.00 0.64 H new ATOM 0 HA ARG A 30 -7.026 -16.931 -11.122 1.00 0.70 H new ATOM 0 HB2 ARG A 30 -7.895 -14.545 -12.128 1.00 0.75 H new ATOM 0 HB3 ARG A 30 -6.168 -14.308 -12.309 1.00 0.75 H new ATOM 0 HG2 ARG A 30 -6.744 -15.270 -14.371 1.00 0.92 H new ATOM 0 HG3 ARG A 30 -6.185 -16.666 -13.472 1.00 0.92 H new ATOM 0 HD2 ARG A 30 -8.524 -17.251 -12.863 1.00 1.67 H new ATOM 0 HD3 ARG A 30 -9.117 -15.811 -13.667 1.00 1.67 H new ATOM 0 HE ARG A 30 -8.298 -18.329 -14.921 1.00 2.03 H new ATOM 0 HH11 ARG A 30 -8.665 -14.850 -15.486 1.00 2.53 H new ATOM 0 HH12 ARG A 30 -8.966 -15.043 -17.216 1.00 2.53 H new ATOM 0 HH21 ARG A 30 -8.758 -18.583 -17.137 1.00 2.48 H new ATOM 0 HH22 ARG A 30 -9.019 -17.162 -18.153 1.00 2.48 H new ATOM 461 N MET A 31 -4.678 -15.085 -9.780 1.00 0.57 N ATOM 462 CA MET A 31 -3.267 -15.048 -9.405 1.00 0.55 C ATOM 463 C MET A 31 -2.973 -16.142 -8.366 1.00 0.56 C ATOM 464 O MET A 31 -3.825 -16.414 -7.524 1.00 0.62 O ATOM 465 CB MET A 31 -2.921 -13.668 -8.823 1.00 0.52 C ATOM 466 CG MET A 31 -3.146 -12.490 -9.786 1.00 0.71 C ATOM 467 SD MET A 31 -1.679 -11.799 -10.604 1.00 1.05 S ATOM 468 CE MET A 31 -1.184 -13.147 -11.699 1.00 1.58 C ATOM 0 H MET A 31 -5.238 -14.360 -9.331 1.00 0.57 H new ATOM 0 HA MET A 31 -2.657 -15.226 -10.290 1.00 0.55 H new ATOM 0 HB2 MET A 31 -3.520 -13.506 -7.927 1.00 0.52 H new ATOM 0 HB3 MET A 31 -1.876 -13.671 -8.512 1.00 0.52 H new ATOM 0 HG2 MET A 31 -3.844 -12.813 -10.559 1.00 0.71 H new ATOM 0 HG3 MET A 31 -3.634 -11.688 -9.232 1.00 0.71 H new ATOM 0 HE1 MET A 31 -0.505 -12.766 -12.461 1.00 1.58 H new ATOM 0 HE2 MET A 31 -0.681 -13.921 -11.119 1.00 1.58 H new ATOM 0 HE3 MET A 31 -2.067 -13.569 -12.178 1.00 1.58 H new ATOM 478 N PRO A 32 -1.775 -16.751 -8.379 1.00 0.62 N ATOM 479 CA PRO A 32 -1.434 -17.840 -7.475 1.00 0.65 C ATOM 480 C PRO A 32 -1.306 -17.353 -6.030 1.00 0.70 C ATOM 481 O PRO A 32 -1.877 -17.959 -5.128 1.00 1.25 O ATOM 482 CB PRO A 32 -0.123 -18.425 -8.006 1.00 0.79 C ATOM 483 CG PRO A 32 0.525 -17.254 -8.744 1.00 0.85 C ATOM 484 CD PRO A 32 -0.672 -16.470 -9.283 1.00 0.74 C ATOM 0 HA PRO A 32 -2.217 -18.598 -7.449 1.00 0.65 H new ATOM 0 HB2 PRO A 32 0.510 -18.788 -7.196 1.00 0.79 H new ATOM 0 HB3 PRO A 32 -0.302 -19.268 -8.673 1.00 0.79 H new ATOM 0 HG2 PRO A 32 1.136 -16.646 -8.076 1.00 0.85 H new ATOM 0 HG3 PRO A 32 1.176 -17.597 -9.548 1.00 0.85 H new ATOM 0 HD2 PRO A 32 -0.456 -15.402 -9.315 1.00 0.74 H new ATOM 0 HD3 PRO A 32 -0.913 -16.777 -10.301 1.00 0.74 H new ATOM 492 N GLY A 33 -0.587 -16.248 -5.798 1.00 0.56 N ATOM 493 CA GLY A 33 -0.270 -15.810 -4.452 1.00 0.52 C ATOM 494 C GLY A 33 -1.491 -15.241 -3.747 1.00 0.50 C ATOM 495 O GLY A 33 -1.452 -15.053 -2.536 1.00 0.59 O ATOM 0 H GLY A 33 -0.217 -15.646 -6.534 1.00 0.56 H new ATOM 0 HA2 GLY A 33 0.124 -16.649 -3.879 1.00 0.52 H new ATOM 0 HA3 GLY A 33 0.514 -15.054 -4.490 1.00 0.52 H new ATOM 499 N VAL A 34 -2.556 -14.916 -4.490 1.00 0.47 N ATOM 500 CA VAL A 34 -3.804 -14.462 -3.909 1.00 0.47 C ATOM 501 C VAL A 34 -4.388 -15.588 -3.064 1.00 0.52 C ATOM 502 O VAL A 34 -4.914 -16.563 -3.593 1.00 0.69 O ATOM 503 CB VAL A 34 -4.747 -13.939 -5.004 1.00 0.51 C ATOM 504 CG1 VAL A 34 -6.195 -13.853 -4.514 1.00 1.34 C ATOM 505 CG2 VAL A 34 -4.282 -12.536 -5.419 1.00 1.13 C ATOM 0 H VAL A 34 -2.567 -14.964 -5.509 1.00 0.47 H new ATOM 0 HA VAL A 34 -3.642 -13.614 -3.243 1.00 0.47 H new ATOM 0 HB VAL A 34 -4.715 -14.633 -5.844 1.00 0.51 H new ATOM 0 HG11 VAL A 34 -6.829 -13.479 -5.318 1.00 1.34 H new ATOM 0 HG12 VAL A 34 -6.537 -14.843 -4.213 1.00 1.34 H new ATOM 0 HG13 VAL A 34 -6.251 -13.175 -3.662 1.00 1.34 H new ATOM 0 HG21 VAL A 34 -4.941 -12.149 -6.196 1.00 1.13 H new ATOM 0 HG22 VAL A 34 -4.312 -11.872 -4.555 1.00 1.13 H new ATOM 0 HG23 VAL A 34 -3.262 -12.589 -5.801 1.00 1.13 H new ATOM 515 N THR A 35 -4.308 -15.426 -1.742 1.00 0.50 N ATOM 516 CA THR A 35 -4.855 -16.394 -0.820 1.00 0.56 C ATOM 517 C THR A 35 -6.338 -16.091 -0.642 1.00 0.62 C ATOM 518 O THR A 35 -7.167 -16.991 -0.776 1.00 0.72 O ATOM 519 CB THR A 35 -4.058 -16.415 0.490 1.00 0.61 C ATOM 520 OG1 THR A 35 -2.792 -16.976 0.219 1.00 0.69 O ATOM 521 CG2 THR A 35 -4.718 -17.316 1.538 1.00 0.74 C ATOM 0 H THR A 35 -3.864 -14.624 -1.294 1.00 0.50 H new ATOM 0 HA THR A 35 -4.767 -17.407 -1.214 1.00 0.56 H new ATOM 0 HB THR A 35 -4.002 -15.395 0.870 1.00 0.61 H new ATOM 0 HG1 THR A 35 -2.121 -16.263 0.177 1.00 0.69 H new ATOM 0 HG21 THR A 35 -4.125 -17.306 2.452 1.00 0.74 H new ATOM 0 HG22 THR A 35 -5.722 -16.950 1.753 1.00 0.74 H new ATOM 0 HG23 THR A 35 -4.778 -18.335 1.156 1.00 0.74 H new ATOM 529 N ASP A 36 -6.680 -14.827 -0.359 1.00 0.61 N ATOM 530 CA ASP A 36 -8.056 -14.456 -0.069 1.00 0.84 C ATOM 531 C ASP A 36 -8.305 -13.001 -0.485 1.00 0.78 C ATOM 532 O ASP A 36 -7.931 -12.062 0.216 1.00 1.25 O ATOM 533 CB ASP A 36 -8.333 -14.739 1.414 1.00 1.15 C ATOM 534 CG ASP A 36 -9.790 -14.546 1.783 1.00 1.61 C ATOM 535 OD1 ASP A 36 -10.629 -14.561 0.853 1.00 1.54 O ATOM 536 OD2 ASP A 36 -10.053 -14.365 2.987 1.00 2.75 O ATOM 0 H ASP A 36 -6.018 -14.051 -0.327 1.00 0.61 H new ATOM 0 HA ASP A 36 -8.762 -15.052 -0.648 1.00 0.84 H new ATOM 0 HB2 ASP A 36 -8.036 -15.762 1.646 1.00 1.15 H new ATOM 0 HB3 ASP A 36 -7.717 -14.081 2.027 1.00 1.15 H new ATOM 541 N ALA A 37 -8.877 -12.811 -1.678 1.00 0.66 N ATOM 542 CA ALA A 37 -9.176 -11.502 -2.250 1.00 0.57 C ATOM 543 C ALA A 37 -10.622 -11.131 -1.935 1.00 0.54 C ATOM 544 O ALA A 37 -11.520 -11.826 -2.407 1.00 0.62 O ATOM 545 CB ALA A 37 -8.957 -11.535 -3.766 1.00 0.63 C ATOM 0 H ALA A 37 -9.150 -13.584 -2.284 1.00 0.66 H new ATOM 0 HA ALA A 37 -8.512 -10.754 -1.817 1.00 0.57 H new ATOM 0 HB1 ALA A 37 -9.182 -10.555 -4.187 1.00 0.63 H new ATOM 0 HB2 ALA A 37 -7.919 -11.792 -3.978 1.00 0.63 H new ATOM 0 HB3 ALA A 37 -9.614 -12.281 -4.212 1.00 0.63 H new ATOM 551 N ASN A 38 -10.843 -10.058 -1.163 1.00 0.49 N ATOM 552 CA ASN A 38 -12.179 -9.610 -0.782 1.00 0.50 C ATOM 553 C ASN A 38 -12.310 -8.120 -1.079 1.00 0.50 C ATOM 554 O ASN A 38 -11.315 -7.396 -1.031 1.00 0.49 O ATOM 555 CB ASN A 38 -12.413 -9.862 0.712 1.00 0.52 C ATOM 556 CG ASN A 38 -12.505 -11.349 1.025 1.00 0.70 C ATOM 557 OD1 ASN A 38 -13.588 -11.884 1.235 1.00 1.82 O ATOM 558 ND2 ASN A 38 -11.357 -12.014 1.056 1.00 1.06 N ATOM 0 H ASN A 38 -10.093 -9.478 -0.786 1.00 0.49 H new ATOM 0 HA ASN A 38 -12.923 -10.166 -1.352 1.00 0.50 H new ATOM 0 HB2 ASN A 38 -11.600 -9.419 1.287 1.00 0.52 H new ATOM 0 HB3 ASN A 38 -13.332 -9.367 1.025 1.00 0.52 H new ATOM 0 HD21 ASN A 38 -11.352 -13.013 1.261 1.00 1.06 H new ATOM 0 HD22 ASN A 38 -10.480 -11.526 0.875 1.00 1.06 H new ATOM 565 N VAL A 39 -13.522 -7.644 -1.374 1.00 0.70 N ATOM 566 CA VAL A 39 -13.786 -6.214 -1.476 1.00 0.66 C ATOM 567 C VAL A 39 -15.191 -5.857 -0.990 1.00 0.83 C ATOM 568 O VAL A 39 -16.201 -6.292 -1.538 1.00 1.10 O ATOM 569 CB VAL A 39 -13.452 -5.688 -2.889 1.00 0.95 C ATOM 570 CG1 VAL A 39 -14.024 -6.575 -3.989 1.00 1.48 C ATOM 571 CG2 VAL A 39 -13.905 -4.239 -3.115 1.00 0.78 C ATOM 0 H VAL A 39 -14.336 -8.234 -1.546 1.00 0.70 H new ATOM 0 HA VAL A 39 -13.114 -5.690 -0.797 1.00 0.66 H new ATOM 0 HB VAL A 39 -12.364 -5.714 -2.946 1.00 0.95 H new ATOM 0 HG11 VAL A 39 -13.761 -6.162 -4.963 1.00 1.48 H new ATOM 0 HG12 VAL A 39 -13.611 -7.580 -3.898 1.00 1.48 H new ATOM 0 HG13 VAL A 39 -15.109 -6.618 -3.894 1.00 1.48 H new ATOM 0 HG21 VAL A 39 -13.641 -3.929 -4.126 1.00 0.78 H new ATOM 0 HG22 VAL A 39 -14.985 -4.171 -2.985 1.00 0.78 H new ATOM 0 HG23 VAL A 39 -13.411 -3.587 -2.395 1.00 0.78 H new ATOM 581 N ASN A 40 -15.259 -4.983 0.016 1.00 0.81 N ATOM 582 CA ASN A 40 -16.505 -4.444 0.521 1.00 1.06 C ATOM 583 C ASN A 40 -16.923 -3.304 -0.397 1.00 1.15 C ATOM 584 O ASN A 40 -16.707 -2.133 -0.084 1.00 1.15 O ATOM 585 CB ASN A 40 -16.345 -3.928 1.956 1.00 1.16 C ATOM 586 CG ASN A 40 -16.338 -5.046 2.991 1.00 1.26 C ATOM 587 OD1 ASN A 40 -15.333 -5.716 3.191 1.00 1.77 O ATOM 588 ND2 ASN A 40 -17.461 -5.245 3.678 1.00 1.79 N ATOM 0 H ASN A 40 -14.435 -4.631 0.503 1.00 0.81 H new ATOM 0 HA ASN A 40 -17.263 -5.227 0.538 1.00 1.06 H new ATOM 0 HB2 ASN A 40 -15.416 -3.363 2.032 1.00 1.16 H new ATOM 0 HB3 ASN A 40 -17.157 -3.237 2.181 1.00 1.16 H new ATOM 0 HD21 ASN A 40 -17.500 -5.971 4.393 1.00 1.79 H new ATOM 0 HD22 ASN A 40 -18.283 -4.671 3.489 1.00 1.79 H new ATOM 595 N LEU A 41 -17.596 -3.657 -1.495 1.00 1.24 N ATOM 596 CA LEU A 41 -18.305 -2.718 -2.364 1.00 1.31 C ATOM 597 C LEU A 41 -19.196 -1.764 -1.556 1.00 1.36 C ATOM 598 O LEU A 41 -19.402 -0.620 -1.945 1.00 1.44 O ATOM 599 CB LEU A 41 -19.109 -3.443 -3.466 1.00 1.35 C ATOM 600 CG LEU A 41 -20.002 -4.622 -3.037 1.00 1.60 C ATOM 601 CD1 LEU A 41 -21.137 -4.825 -4.048 1.00 2.70 C ATOM 602 CD2 LEU A 41 -19.255 -5.961 -2.909 1.00 2.14 C ATOM 0 H LEU A 41 -17.664 -4.625 -1.810 1.00 1.24 H new ATOM 0 HA LEU A 41 -17.547 -2.115 -2.865 1.00 1.31 H new ATOM 0 HB2 LEU A 41 -19.741 -2.706 -3.961 1.00 1.35 H new ATOM 0 HB3 LEU A 41 -18.403 -3.810 -4.211 1.00 1.35 H new ATOM 0 HG LEU A 41 -20.377 -4.348 -2.051 1.00 1.60 H new ATOM 0 HD11 LEU A 41 -21.760 -5.662 -3.732 1.00 2.70 H new ATOM 0 HD12 LEU A 41 -21.743 -3.921 -4.101 1.00 2.70 H new ATOM 0 HD13 LEU A 41 -20.715 -5.037 -5.031 1.00 2.70 H new ATOM 0 HD21 LEU A 41 -19.954 -6.740 -2.603 1.00 2.14 H new ATOM 0 HD22 LEU A 41 -18.815 -6.225 -3.870 1.00 2.14 H new ATOM 0 HD23 LEU A 41 -18.466 -5.868 -2.162 1.00 2.14 H new ATOM 614 N ALA A 42 -19.692 -2.227 -0.407 1.00 1.37 N ATOM 615 CA ALA A 42 -20.616 -1.497 0.444 1.00 1.49 C ATOM 616 C ALA A 42 -19.945 -0.324 1.160 1.00 1.30 C ATOM 617 O ALA A 42 -20.632 0.615 1.551 1.00 1.28 O ATOM 618 CB ALA A 42 -21.230 -2.458 1.465 1.00 1.68 C ATOM 0 H ALA A 42 -19.451 -3.147 -0.038 1.00 1.37 H new ATOM 0 HA ALA A 42 -21.395 -1.077 -0.192 1.00 1.49 H new ATOM 0 HB1 ALA A 42 -21.924 -1.914 2.105 1.00 1.68 H new ATOM 0 HB2 ALA A 42 -21.765 -3.251 0.942 1.00 1.68 H new ATOM 0 HB3 ALA A 42 -20.439 -2.894 2.075 1.00 1.68 H new ATOM 624 N THR A 43 -18.624 -0.390 1.375 1.00 1.17 N ATOM 625 CA THR A 43 -17.875 0.700 2.002 1.00 1.02 C ATOM 626 C THR A 43 -16.686 1.116 1.128 1.00 0.77 C ATOM 627 O THR A 43 -15.777 1.806 1.598 1.00 0.71 O ATOM 628 CB THR A 43 -17.443 0.293 3.420 1.00 1.10 C ATOM 629 OG1 THR A 43 -16.578 -0.820 3.373 1.00 0.94 O ATOM 630 CG2 THR A 43 -18.648 -0.073 4.295 1.00 1.45 C ATOM 0 H THR A 43 -18.051 -1.195 1.121 1.00 1.17 H new ATOM 0 HA THR A 43 -18.520 1.574 2.092 1.00 1.02 H new ATOM 0 HB THR A 43 -16.932 1.153 3.854 1.00 1.10 H new ATOM 0 HG1 THR A 43 -16.311 -1.065 4.283 1.00 0.94 H new ATOM 0 HG21 THR A 43 -18.303 -0.355 5.290 1.00 1.45 H new ATOM 0 HG22 THR A 43 -19.316 0.785 4.372 1.00 1.45 H new ATOM 0 HG23 THR A 43 -19.183 -0.910 3.846 1.00 1.45 H new ATOM 638 N GLU A 44 -16.703 0.680 -0.138 1.00 0.77 N ATOM 639 CA GLU A 44 -15.652 0.888 -1.114 1.00 0.70 C ATOM 640 C GLU A 44 -14.283 0.571 -0.517 1.00 0.57 C ATOM 641 O GLU A 44 -13.462 1.467 -0.327 1.00 0.90 O ATOM 642 CB GLU A 44 -15.724 2.315 -1.676 1.00 0.74 C ATOM 643 CG GLU A 44 -17.044 2.567 -2.415 1.00 0.96 C ATOM 644 CD GLU A 44 -17.113 4.006 -2.905 1.00 1.06 C ATOM 645 OE1 GLU A 44 -17.503 4.861 -2.081 1.00 1.45 O ATOM 646 OE2 GLU A 44 -16.755 4.222 -4.082 1.00 1.98 O ATOM 0 H GLU A 44 -17.489 0.151 -0.516 1.00 0.77 H new ATOM 0 HA GLU A 44 -15.800 0.199 -1.946 1.00 0.70 H new ATOM 0 HB2 GLU A 44 -15.620 3.032 -0.862 1.00 0.74 H new ATOM 0 HB3 GLU A 44 -14.889 2.481 -2.356 1.00 0.74 H new ATOM 0 HG2 GLU A 44 -17.131 1.884 -3.260 1.00 0.96 H new ATOM 0 HG3 GLU A 44 -17.884 2.362 -1.752 1.00 0.96 H new ATOM 653 N THR A 45 -14.016 -0.689 -0.162 1.00 0.64 N ATOM 654 CA THR A 45 -12.739 -1.052 0.431 1.00 0.53 C ATOM 655 C THR A 45 -12.339 -2.448 -0.040 1.00 0.42 C ATOM 656 O THR A 45 -13.020 -3.415 0.290 1.00 0.47 O ATOM 657 CB THR A 45 -12.853 -0.906 1.957 1.00 0.67 C ATOM 658 OG1 THR A 45 -13.006 0.472 2.253 1.00 0.96 O ATOM 659 CG2 THR A 45 -11.614 -1.444 2.664 1.00 0.63 C ATOM 0 H THR A 45 -14.667 -1.466 -0.277 1.00 0.64 H new ATOM 0 HA THR A 45 -11.936 -0.389 0.109 1.00 0.53 H new ATOM 0 HB THR A 45 -13.709 -1.482 2.309 1.00 0.67 H new ATOM 0 HG1 THR A 45 -13.945 0.729 2.138 1.00 0.96 H new ATOM 0 HG21 THR A 45 -11.729 -1.325 3.741 1.00 0.63 H new ATOM 0 HG22 THR A 45 -11.490 -2.501 2.427 1.00 0.63 H new ATOM 0 HG23 THR A 45 -10.736 -0.892 2.330 1.00 0.63 H new ATOM 667 N VAL A 46 -11.266 -2.543 -0.834 1.00 0.36 N ATOM 668 CA VAL A 46 -10.687 -3.789 -1.295 1.00 0.36 C ATOM 669 C VAL A 46 -9.662 -4.241 -0.264 1.00 0.35 C ATOM 670 O VAL A 46 -8.735 -3.497 0.042 1.00 0.40 O ATOM 671 CB VAL A 46 -10.123 -3.627 -2.720 1.00 0.41 C ATOM 672 CG1 VAL A 46 -8.981 -2.602 -2.849 1.00 0.55 C ATOM 673 CG2 VAL A 46 -9.616 -4.963 -3.265 1.00 0.37 C ATOM 0 H VAL A 46 -10.768 -1.722 -1.179 1.00 0.36 H new ATOM 0 HA VAL A 46 -11.439 -4.574 -1.378 1.00 0.36 H new ATOM 0 HB VAL A 46 -10.968 -3.253 -3.299 1.00 0.41 H new ATOM 0 HG11 VAL A 46 -8.649 -2.556 -3.886 1.00 0.55 H new ATOM 0 HG12 VAL A 46 -9.337 -1.620 -2.538 1.00 0.55 H new ATOM 0 HG13 VAL A 46 -8.148 -2.903 -2.214 1.00 0.55 H new ATOM 0 HG21 VAL A 46 -9.224 -4.820 -4.272 1.00 0.37 H new ATOM 0 HG22 VAL A 46 -8.826 -5.343 -2.618 1.00 0.37 H new ATOM 0 HG23 VAL A 46 -10.437 -5.679 -3.294 1.00 0.37 H new ATOM 683 N ASN A 47 -9.846 -5.435 0.297 1.00 0.38 N ATOM 684 CA ASN A 47 -8.941 -6.038 1.256 1.00 0.43 C ATOM 685 C ASN A 47 -8.438 -7.347 0.666 1.00 0.43 C ATOM 686 O ASN A 47 -9.126 -8.368 0.686 1.00 0.59 O ATOM 687 CB ASN A 47 -9.591 -6.186 2.635 1.00 0.62 C ATOM 688 CG ASN A 47 -10.852 -7.045 2.644 1.00 1.55 C ATOM 689 OD1 ASN A 47 -11.791 -6.801 1.891 1.00 2.91 O ATOM 690 ND2 ASN A 47 -10.904 -8.044 3.519 1.00 2.46 N ATOM 0 H ASN A 47 -10.654 -6.021 0.086 1.00 0.38 H new ATOM 0 HA ASN A 47 -8.082 -5.391 1.434 1.00 0.43 H new ATOM 0 HB2 ASN A 47 -8.864 -6.620 3.322 1.00 0.62 H new ATOM 0 HB3 ASN A 47 -9.837 -5.195 3.016 1.00 0.62 H new ATOM 0 HD21 ASN A 47 -11.738 -8.629 3.576 1.00 2.46 H new ATOM 0 HD22 ASN A 47 -10.110 -8.226 4.133 1.00 2.46 H new ATOM 697 N VAL A 48 -7.236 -7.297 0.087 1.00 0.38 N ATOM 698 CA VAL A 48 -6.653 -8.448 -0.591 1.00 0.38 C ATOM 699 C VAL A 48 -5.620 -9.076 0.335 1.00 0.43 C ATOM 700 O VAL A 48 -4.776 -8.355 0.870 1.00 0.46 O ATOM 701 CB VAL A 48 -6.034 -8.058 -1.949 1.00 0.35 C ATOM 702 CG1 VAL A 48 -5.931 -9.298 -2.847 1.00 0.35 C ATOM 703 CG2 VAL A 48 -6.871 -7.010 -2.690 1.00 0.38 C ATOM 0 H VAL A 48 -6.647 -6.464 0.077 1.00 0.38 H new ATOM 0 HA VAL A 48 -7.436 -9.174 -0.813 1.00 0.38 H new ATOM 0 HB VAL A 48 -5.051 -7.637 -1.739 1.00 0.35 H new ATOM 0 HG11 VAL A 48 -5.493 -9.018 -3.805 1.00 0.35 H new ATOM 0 HG12 VAL A 48 -5.301 -10.045 -2.365 1.00 0.35 H new ATOM 0 HG13 VAL A 48 -6.926 -9.713 -3.010 1.00 0.35 H new ATOM 0 HG21 VAL A 48 -6.394 -6.769 -3.640 1.00 0.38 H new ATOM 0 HG22 VAL A 48 -7.869 -7.407 -2.876 1.00 0.38 H new ATOM 0 HG23 VAL A 48 -6.946 -6.108 -2.082 1.00 0.38 H new ATOM 713 N ILE A 49 -5.679 -10.398 0.525 1.00 0.50 N ATOM 714 CA ILE A 49 -4.690 -11.147 1.280 1.00 0.57 C ATOM 715 C ILE A 49 -3.945 -12.050 0.302 1.00 0.53 C ATOM 716 O ILE A 49 -4.564 -12.856 -0.402 1.00 0.52 O ATOM 717 CB ILE A 49 -5.352 -11.964 2.400 1.00 0.67 C ATOM 718 CG1 ILE A 49 -6.102 -11.033 3.369 1.00 0.74 C ATOM 719 CG2 ILE A 49 -4.289 -12.791 3.146 1.00 0.77 C ATOM 720 CD1 ILE A 49 -7.119 -11.771 4.242 1.00 1.21 C ATOM 0 H ILE A 49 -6.429 -10.979 0.150 1.00 0.50 H new ATOM 0 HA ILE A 49 -3.991 -10.465 1.764 1.00 0.57 H new ATOM 0 HB ILE A 49 -6.076 -12.649 1.960 1.00 0.67 H new ATOM 0 HG12 ILE A 49 -5.380 -10.528 4.010 1.00 0.74 H new ATOM 0 HG13 ILE A 49 -6.616 -10.260 2.797 1.00 0.74 H new ATOM 0 HG21 ILE A 49 -4.767 -13.367 3.938 1.00 0.77 H new ATOM 0 HG22 ILE A 49 -3.800 -13.470 2.447 1.00 0.77 H new ATOM 0 HG23 ILE A 49 -3.547 -12.122 3.581 1.00 0.77 H new ATOM 0 HD11 ILE A 49 -7.615 -11.060 4.903 1.00 1.21 H new ATOM 0 HD12 ILE A 49 -7.861 -12.254 3.607 1.00 1.21 H new ATOM 0 HD13 ILE A 49 -6.607 -12.525 4.839 1.00 1.21 H new ATOM 732 N TYR A 50 -2.619 -11.919 0.248 1.00 0.55 N ATOM 733 CA TYR A 50 -1.813 -12.674 -0.695 1.00 0.51 C ATOM 734 C TYR A 50 -0.402 -12.874 -0.170 1.00 0.54 C ATOM 735 O TYR A 50 -0.022 -12.286 0.848 1.00 0.57 O ATOM 736 CB TYR A 50 -1.766 -11.937 -2.042 1.00 0.50 C ATOM 737 CG TYR A 50 -1.286 -10.507 -1.955 1.00 0.52 C ATOM 738 CD1 TYR A 50 0.085 -10.189 -1.921 1.00 1.74 C ATOM 739 CD2 TYR A 50 -2.241 -9.482 -1.917 1.00 1.71 C ATOM 740 CE1 TYR A 50 0.489 -8.850 -1.772 1.00 1.75 C ATOM 741 CE2 TYR A 50 -1.835 -8.146 -1.870 1.00 1.72 C ATOM 742 CZ TYR A 50 -0.476 -7.830 -1.730 1.00 0.57 C ATOM 743 OH TYR A 50 -0.100 -6.542 -1.477 1.00 0.67 O ATOM 0 H TYR A 50 -2.085 -11.293 0.851 1.00 0.55 H new ATOM 0 HA TYR A 50 -2.270 -13.654 -0.828 1.00 0.51 H new ATOM 0 HB2 TYR A 50 -1.113 -12.486 -2.720 1.00 0.50 H new ATOM 0 HB3 TYR A 50 -2.763 -11.947 -2.482 1.00 0.50 H new ATOM 0 HD1 TYR A 50 0.825 -10.971 -2.009 1.00 1.74 H new ATOM 0 HD2 TYR A 50 -3.293 -9.725 -1.924 1.00 1.71 H new ATOM 0 HE1 TYR A 50 1.538 -8.607 -1.690 1.00 1.75 H new ATOM 0 HE2 TYR A 50 -2.568 -7.356 -1.942 1.00 1.72 H new ATOM 0 HH TYR A 50 -0.488 -5.949 -2.154 1.00 0.67 H new ATOM 753 N ASP A 51 0.370 -13.671 -0.911 1.00 0.57 N ATOM 754 CA ASP A 51 1.733 -14.005 -0.560 1.00 0.60 C ATOM 755 C ASP A 51 2.687 -12.999 -1.200 1.00 0.57 C ATOM 756 O ASP A 51 2.677 -12.840 -2.426 1.00 0.54 O ATOM 757 CB ASP A 51 2.049 -15.418 -1.052 1.00 0.66 C ATOM 758 CG ASP A 51 3.312 -15.891 -0.368 1.00 0.97 C ATOM 759 OD1 ASP A 51 4.371 -15.321 -0.703 1.00 2.30 O ATOM 760 OD2 ASP A 51 3.162 -16.750 0.528 1.00 1.81 O ATOM 0 H ASP A 51 0.054 -14.103 -1.779 1.00 0.57 H new ATOM 0 HA ASP A 51 1.855 -13.967 0.522 1.00 0.60 H new ATOM 0 HB2 ASP A 51 1.222 -16.091 -0.828 1.00 0.66 H new ATOM 0 HB3 ASP A 51 2.179 -15.422 -2.134 1.00 0.66 H new ATOM 765 N PRO A 52 3.523 -12.294 -0.421 1.00 0.64 N ATOM 766 CA PRO A 52 4.391 -11.253 -0.943 1.00 0.67 C ATOM 767 C PRO A 52 5.643 -11.827 -1.623 1.00 0.70 C ATOM 768 O PRO A 52 6.701 -11.200 -1.578 1.00 0.82 O ATOM 769 CB PRO A 52 4.732 -10.405 0.292 1.00 0.80 C ATOM 770 CG PRO A 52 4.777 -11.446 1.414 1.00 0.87 C ATOM 771 CD PRO A 52 3.669 -12.423 1.021 1.00 0.76 C ATOM 0 HA PRO A 52 3.913 -10.667 -1.727 1.00 0.67 H new ATOM 0 HB2 PRO A 52 5.686 -9.890 0.179 1.00 0.80 H new ATOM 0 HB3 PRO A 52 3.978 -9.641 0.479 1.00 0.80 H new ATOM 0 HG2 PRO A 52 5.748 -11.938 1.469 1.00 0.87 H new ATOM 0 HG3 PRO A 52 4.591 -10.996 2.389 1.00 0.87 H new ATOM 0 HD2 PRO A 52 3.931 -13.444 1.298 1.00 0.76 H new ATOM 0 HD3 PRO A 52 2.736 -12.183 1.532 1.00 0.76 H new ATOM 779 N ALA A 53 5.529 -12.987 -2.277 1.00 0.64 N ATOM 780 CA ALA A 53 6.659 -13.657 -2.922 1.00 0.69 C ATOM 781 C ALA A 53 6.231 -14.619 -4.029 1.00 0.71 C ATOM 782 O ALA A 53 7.004 -15.487 -4.431 1.00 1.02 O ATOM 783 CB ALA A 53 7.508 -14.388 -1.878 1.00 0.85 C ATOM 0 H ALA A 53 4.646 -13.489 -2.373 1.00 0.64 H new ATOM 0 HA ALA A 53 7.256 -12.879 -3.399 1.00 0.69 H new ATOM 0 HB1 ALA A 53 8.345 -14.882 -2.371 1.00 0.85 H new ATOM 0 HB2 ALA A 53 7.888 -13.670 -1.151 1.00 0.85 H new ATOM 0 HB3 ALA A 53 6.896 -15.132 -1.368 1.00 0.85 H new ATOM 789 N GLU A 54 5.032 -14.406 -4.565 1.00 0.61 N ATOM 790 CA GLU A 54 4.537 -15.062 -5.760 1.00 0.64 C ATOM 791 C GLU A 54 3.932 -14.025 -6.703 1.00 0.64 C ATOM 792 O GLU A 54 4.194 -14.053 -7.903 1.00 0.76 O ATOM 793 CB GLU A 54 3.474 -16.109 -5.414 1.00 0.65 C ATOM 794 CG GLU A 54 4.040 -17.334 -4.686 1.00 0.68 C ATOM 795 CD GLU A 54 3.088 -18.522 -4.777 1.00 0.74 C ATOM 796 OE1 GLU A 54 1.885 -18.274 -5.014 1.00 1.50 O ATOM 797 OE2 GLU A 54 3.586 -19.661 -4.652 1.00 1.81 O ATOM 0 H GLU A 54 4.362 -13.751 -4.163 1.00 0.61 H new ATOM 0 HA GLU A 54 5.375 -15.563 -6.244 1.00 0.64 H new ATOM 0 HB2 GLU A 54 2.709 -15.647 -4.791 1.00 0.65 H new ATOM 0 HB3 GLU A 54 2.984 -16.435 -6.331 1.00 0.65 H new ATOM 0 HG2 GLU A 54 5.004 -17.604 -5.118 1.00 0.68 H new ATOM 0 HG3 GLU A 54 4.218 -17.087 -3.639 1.00 0.68 H new ATOM 804 N THR A 55 3.096 -13.129 -6.166 1.00 0.57 N ATOM 805 CA THR A 55 2.270 -12.248 -6.965 1.00 0.57 C ATOM 806 C THR A 55 2.889 -10.850 -6.922 1.00 0.61 C ATOM 807 O THR A 55 3.587 -10.458 -7.852 1.00 0.72 O ATOM 808 CB THR A 55 0.838 -12.363 -6.428 1.00 0.48 C ATOM 809 OG1 THR A 55 0.297 -13.628 -6.758 1.00 0.53 O ATOM 810 CG2 THR A 55 -0.068 -11.284 -6.996 1.00 0.57 C ATOM 0 H THR A 55 2.981 -13.002 -5.160 1.00 0.57 H new ATOM 0 HA THR A 55 2.223 -12.510 -8.022 1.00 0.57 H new ATOM 0 HB THR A 55 0.889 -12.240 -5.346 1.00 0.48 H new ATOM 0 HG1 THR A 55 -0.617 -13.694 -6.410 1.00 0.53 H new ATOM 0 HG21 THR A 55 -1.073 -11.402 -6.590 1.00 0.57 H new ATOM 0 HG22 THR A 55 0.320 -10.303 -6.724 1.00 0.57 H new ATOM 0 HG23 THR A 55 -0.103 -11.373 -8.082 1.00 0.57 H new ATOM 818 N GLY A 56 2.664 -10.101 -5.836 1.00 0.57 N ATOM 819 CA GLY A 56 3.270 -8.801 -5.630 1.00 0.64 C ATOM 820 C GLY A 56 2.197 -7.730 -5.748 1.00 0.63 C ATOM 821 O GLY A 56 1.508 -7.651 -6.760 1.00 0.66 O ATOM 0 H GLY A 56 2.050 -10.392 -5.075 1.00 0.57 H new ATOM 0 HA2 GLY A 56 3.740 -8.756 -4.648 1.00 0.64 H new ATOM 0 HA3 GLY A 56 4.055 -8.630 -6.367 1.00 0.64 H new ATOM 825 N THR A 57 2.062 -6.914 -4.702 1.00 0.63 N ATOM 826 CA THR A 57 1.156 -5.766 -4.609 1.00 0.65 C ATOM 827 C THR A 57 0.962 -5.029 -5.948 1.00 0.71 C ATOM 828 O THR A 57 -0.163 -4.742 -6.353 1.00 0.69 O ATOM 829 CB THR A 57 1.610 -4.852 -3.460 1.00 0.72 C ATOM 830 OG1 THR A 57 0.621 -3.907 -3.116 1.00 0.81 O ATOM 831 CG2 THR A 57 2.937 -4.169 -3.749 1.00 0.88 C ATOM 0 H THR A 57 2.610 -7.042 -3.851 1.00 0.63 H new ATOM 0 HA THR A 57 0.157 -6.133 -4.375 1.00 0.65 H new ATOM 0 HB THR A 57 1.763 -5.503 -2.599 1.00 0.72 H new ATOM 0 HG1 THR A 57 0.946 -3.346 -2.381 1.00 0.81 H new ATOM 0 HG21 THR A 57 3.211 -3.535 -2.906 1.00 0.88 H new ATOM 0 HG22 THR A 57 3.709 -4.923 -3.902 1.00 0.88 H new ATOM 0 HG23 THR A 57 2.844 -3.558 -4.647 1.00 0.88 H new ATOM 839 N ALA A 58 2.053 -4.773 -6.675 1.00 0.80 N ATOM 840 CA ALA A 58 1.994 -4.102 -7.966 1.00 0.89 C ATOM 841 C ALA A 58 1.114 -4.865 -8.965 1.00 0.85 C ATOM 842 O ALA A 58 0.326 -4.261 -9.686 1.00 0.86 O ATOM 843 CB ALA A 58 3.410 -3.909 -8.511 1.00 1.03 C ATOM 0 H ALA A 58 2.997 -5.026 -6.382 1.00 0.80 H new ATOM 0 HA ALA A 58 1.533 -3.125 -7.824 1.00 0.89 H new ATOM 0 HB1 ALA A 58 3.363 -3.407 -9.477 1.00 1.03 H new ATOM 0 HB2 ALA A 58 3.988 -3.302 -7.814 1.00 1.03 H new ATOM 0 HB3 ALA A 58 3.889 -4.881 -8.630 1.00 1.03 H new ATOM 849 N ALA A 59 1.219 -6.195 -9.011 1.00 0.82 N ATOM 850 CA ALA A 59 0.378 -7.006 -9.880 1.00 0.82 C ATOM 851 C ALA A 59 -1.067 -7.019 -9.381 1.00 0.72 C ATOM 852 O ALA A 59 -2.007 -7.062 -10.173 1.00 0.79 O ATOM 853 CB ALA A 59 0.930 -8.425 -9.958 1.00 0.82 C ATOM 0 H ALA A 59 1.883 -6.731 -8.452 1.00 0.82 H new ATOM 0 HA ALA A 59 0.384 -6.568 -10.878 1.00 0.82 H new ATOM 0 HB1 ALA A 59 0.296 -9.027 -10.610 1.00 0.82 H new ATOM 0 HB2 ALA A 59 1.943 -8.400 -10.359 1.00 0.82 H new ATOM 0 HB3 ALA A 59 0.946 -8.865 -8.961 1.00 0.82 H new ATOM 859 N ILE A 60 -1.255 -6.981 -8.059 1.00 0.60 N ATOM 860 CA ILE A 60 -2.588 -6.895 -7.474 1.00 0.52 C ATOM 861 C ILE A 60 -3.260 -5.635 -8.028 1.00 0.56 C ATOM 862 O ILE A 60 -4.339 -5.701 -8.626 1.00 0.59 O ATOM 863 CB ILE A 60 -2.532 -6.872 -5.933 1.00 0.48 C ATOM 864 CG1 ILE A 60 -1.635 -7.957 -5.322 1.00 0.64 C ATOM 865 CG2 ILE A 60 -3.923 -6.932 -5.301 1.00 0.42 C ATOM 866 CD1 ILE A 60 -2.232 -9.358 -5.290 1.00 0.53 C ATOM 0 H ILE A 60 -0.498 -7.009 -7.376 1.00 0.60 H new ATOM 0 HA ILE A 60 -3.168 -7.778 -7.742 1.00 0.52 H new ATOM 0 HB ILE A 60 -2.076 -5.911 -5.696 1.00 0.48 H new ATOM 0 HG12 ILE A 60 -0.701 -7.991 -5.884 1.00 0.64 H new ATOM 0 HG13 ILE A 60 -1.383 -7.665 -4.303 1.00 0.64 H new ATOM 0 HG21 ILE A 60 -3.830 -6.913 -4.215 1.00 0.42 H new ATOM 0 HG22 ILE A 60 -4.509 -6.074 -5.630 1.00 0.42 H new ATOM 0 HG23 ILE A 60 -4.422 -7.852 -5.607 1.00 0.42 H new ATOM 0 HD11 ILE A 60 -1.518 -10.048 -4.840 1.00 0.53 H new ATOM 0 HD12 ILE A 60 -3.149 -9.349 -4.701 1.00 0.53 H new ATOM 0 HD13 ILE A 60 -2.457 -9.681 -6.306 1.00 0.53 H new ATOM 878 N GLN A 61 -2.591 -4.487 -7.871 1.00 0.62 N ATOM 879 CA GLN A 61 -3.125 -3.237 -8.383 1.00 0.70 C ATOM 880 C GLN A 61 -3.247 -3.294 -9.905 1.00 0.81 C ATOM 881 O GLN A 61 -4.270 -2.864 -10.425 1.00 0.84 O ATOM 882 CB GLN A 61 -2.409 -1.996 -7.825 1.00 0.81 C ATOM 883 CG GLN A 61 -1.223 -1.480 -8.646 1.00 1.00 C ATOM 884 CD GLN A 61 -0.690 -0.179 -8.069 1.00 0.86 C ATOM 885 OE1 GLN A 61 0.176 -0.190 -7.199 1.00 1.74 O ATOM 886 NE2 GLN A 61 -1.199 0.947 -8.547 1.00 1.11 N ATOM 0 H GLN A 61 -1.691 -4.406 -7.399 1.00 0.62 H new ATOM 0 HA GLN A 61 -4.140 -3.115 -8.005 1.00 0.70 H new ATOM 0 HB2 GLN A 61 -3.138 -1.191 -7.732 1.00 0.81 H new ATOM 0 HB3 GLN A 61 -2.057 -2.225 -6.819 1.00 0.81 H new ATOM 0 HG2 GLN A 61 -0.431 -2.229 -8.658 1.00 1.00 H new ATOM 0 HG3 GLN A 61 -1.531 -1.325 -9.680 1.00 1.00 H new ATOM 0 HE21 GLN A 61 -1.918 0.915 -9.270 1.00 1.11 H new ATOM 0 HE22 GLN A 61 -0.872 1.846 -8.192 1.00 1.11 H new ATOM 895 N GLU A 62 -2.275 -3.888 -10.617 1.00 0.90 N ATOM 896 CA GLU A 62 -2.394 -4.084 -12.060 1.00 1.06 C ATOM 897 C GLU A 62 -3.747 -4.721 -12.377 1.00 0.99 C ATOM 898 O GLU A 62 -4.443 -4.282 -13.290 1.00 1.05 O ATOM 899 CB GLU A 62 -1.262 -4.965 -12.624 1.00 1.30 C ATOM 900 CG GLU A 62 -1.292 -4.996 -14.165 1.00 1.44 C ATOM 901 CD GLU A 62 -0.788 -6.297 -14.780 1.00 2.21 C ATOM 902 OE1 GLU A 62 -1.307 -7.366 -14.384 1.00 3.48 O ATOM 903 OE2 GLU A 62 0.010 -6.204 -15.733 1.00 2.30 O ATOM 0 H GLU A 62 -1.405 -4.237 -10.214 1.00 0.90 H new ATOM 0 HA GLU A 62 -2.315 -3.106 -12.534 1.00 1.06 H new ATOM 0 HB2 GLU A 62 -0.299 -4.585 -12.284 1.00 1.30 H new ATOM 0 HB3 GLU A 62 -1.359 -5.979 -12.236 1.00 1.30 H new ATOM 0 HG2 GLU A 62 -2.315 -4.823 -14.500 1.00 1.44 H new ATOM 0 HG3 GLU A 62 -0.688 -4.171 -14.544 1.00 1.44 H new ATOM 910 N LYS A 63 -4.123 -5.768 -11.640 1.00 0.91 N ATOM 911 CA LYS A 63 -5.319 -6.507 -11.956 1.00 0.92 C ATOM 912 C LYS A 63 -6.546 -5.635 -11.695 1.00 0.88 C ATOM 913 O LYS A 63 -7.418 -5.550 -12.556 1.00 0.94 O ATOM 914 CB LYS A 63 -5.300 -7.831 -11.181 1.00 0.89 C ATOM 915 CG LYS A 63 -5.839 -8.998 -12.015 1.00 1.14 C ATOM 916 CD LYS A 63 -4.732 -9.754 -12.773 1.00 1.38 C ATOM 917 CE LYS A 63 -3.897 -8.834 -13.678 1.00 1.29 C ATOM 918 NZ LYS A 63 -2.731 -9.509 -14.275 1.00 2.33 N ATOM 0 H LYS A 63 -3.611 -6.112 -10.827 1.00 0.91 H new ATOM 0 HA LYS A 63 -5.365 -6.768 -13.013 1.00 0.92 H new ATOM 0 HB2 LYS A 63 -4.280 -8.052 -10.867 1.00 0.89 H new ATOM 0 HB3 LYS A 63 -5.897 -7.728 -10.275 1.00 0.89 H new ATOM 0 HG2 LYS A 63 -6.364 -9.694 -11.361 1.00 1.14 H new ATOM 0 HG3 LYS A 63 -6.569 -8.620 -12.730 1.00 1.14 H new ATOM 0 HD2 LYS A 63 -4.075 -10.244 -12.054 1.00 1.38 H new ATOM 0 HD3 LYS A 63 -5.184 -10.540 -13.379 1.00 1.38 H new ATOM 0 HE2 LYS A 63 -4.531 -8.446 -14.475 1.00 1.29 H new ATOM 0 HE3 LYS A 63 -3.555 -7.977 -13.097 1.00 1.29 H new ATOM 0 HZ1 LYS A 63 -1.912 -8.869 -14.255 1.00 2.33 H new ATOM 0 HZ2 LYS A 63 -2.512 -10.369 -13.732 1.00 2.33 H new ATOM 0 HZ3 LYS A 63 -2.945 -9.767 -15.259 1.00 2.33 H new ATOM 932 N ILE A 64 -6.599 -4.946 -10.551 1.00 0.79 N ATOM 933 CA ILE A 64 -7.658 -3.976 -10.276 1.00 0.75 C ATOM 934 C ILE A 64 -7.774 -2.994 -11.447 1.00 0.82 C ATOM 935 O ILE A 64 -8.851 -2.799 -12.006 1.00 0.87 O ATOM 936 CB ILE A 64 -7.380 -3.254 -8.940 1.00 0.62 C ATOM 937 CG1 ILE A 64 -7.480 -4.270 -7.784 1.00 0.61 C ATOM 938 CG2 ILE A 64 -8.383 -2.116 -8.721 1.00 0.58 C ATOM 939 CD1 ILE A 64 -6.946 -3.757 -6.443 1.00 0.69 C ATOM 0 H ILE A 64 -5.917 -5.044 -9.799 1.00 0.79 H new ATOM 0 HA ILE A 64 -8.614 -4.490 -10.176 1.00 0.75 H new ATOM 0 HB ILE A 64 -6.378 -2.826 -8.970 1.00 0.62 H new ATOM 0 HG12 ILE A 64 -8.524 -4.559 -7.659 1.00 0.61 H new ATOM 0 HG13 ILE A 64 -6.931 -5.171 -8.059 1.00 0.61 H new ATOM 0 HG21 ILE A 64 -8.170 -1.620 -7.774 1.00 0.58 H new ATOM 0 HG22 ILE A 64 -8.299 -1.396 -9.535 1.00 0.58 H new ATOM 0 HG23 ILE A 64 -9.394 -2.522 -8.698 1.00 0.58 H new ATOM 0 HD11 ILE A 64 -7.055 -4.534 -5.687 1.00 0.69 H new ATOM 0 HD12 ILE A 64 -5.893 -3.496 -6.547 1.00 0.69 H new ATOM 0 HD13 ILE A 64 -7.510 -2.875 -6.140 1.00 0.69 H new ATOM 951 N GLU A 65 -6.655 -2.387 -11.829 1.00 0.82 N ATOM 952 CA GLU A 65 -6.620 -1.376 -12.866 1.00 0.84 C ATOM 953 C GLU A 65 -7.133 -1.932 -14.190 1.00 0.92 C ATOM 954 O GLU A 65 -8.083 -1.398 -14.760 1.00 1.02 O ATOM 955 CB GLU A 65 -5.204 -0.797 -12.945 1.00 0.90 C ATOM 956 CG GLU A 65 -4.946 0.051 -11.685 1.00 0.85 C ATOM 957 CD GLU A 65 -3.555 0.665 -11.663 1.00 1.18 C ATOM 958 OE1 GLU A 65 -3.074 1.032 -12.755 1.00 1.64 O ATOM 959 OE2 GLU A 65 -2.997 0.761 -10.547 1.00 1.86 O ATOM 0 H GLU A 65 -5.742 -2.589 -11.421 1.00 0.82 H new ATOM 0 HA GLU A 65 -7.295 -0.556 -12.622 1.00 0.84 H new ATOM 0 HB2 GLU A 65 -4.471 -1.600 -13.016 1.00 0.90 H new ATOM 0 HB3 GLU A 65 -5.095 -0.186 -13.841 1.00 0.90 H new ATOM 0 HG2 GLU A 65 -5.690 0.846 -11.629 1.00 0.85 H new ATOM 0 HG3 GLU A 65 -5.077 -0.572 -10.800 1.00 0.85 H new ATOM 966 N LYS A 66 -6.552 -3.034 -14.660 1.00 0.92 N ATOM 967 CA LYS A 66 -6.973 -3.671 -15.896 1.00 1.00 C ATOM 968 C LYS A 66 -8.435 -4.120 -15.856 1.00 1.02 C ATOM 969 O LYS A 66 -9.096 -4.109 -16.892 1.00 1.12 O ATOM 970 CB LYS A 66 -6.058 -4.848 -16.229 1.00 1.02 C ATOM 971 CG LYS A 66 -4.661 -4.377 -16.657 1.00 1.07 C ATOM 972 CD LYS A 66 -3.993 -5.508 -17.446 1.00 1.91 C ATOM 973 CE LYS A 66 -2.508 -5.266 -17.754 1.00 1.86 C ATOM 974 NZ LYS A 66 -2.273 -4.097 -18.622 1.00 2.70 N ATOM 0 H LYS A 66 -5.778 -3.506 -14.192 1.00 0.92 H new ATOM 0 HA LYS A 66 -6.893 -2.923 -16.684 1.00 1.00 H new ATOM 0 HB2 LYS A 66 -5.972 -5.500 -15.359 1.00 1.02 H new ATOM 0 HB3 LYS A 66 -6.503 -5.440 -17.028 1.00 1.02 H new ATOM 0 HG2 LYS A 66 -4.734 -3.478 -17.270 1.00 1.07 H new ATOM 0 HG3 LYS A 66 -4.063 -4.119 -15.783 1.00 1.07 H new ATOM 0 HD2 LYS A 66 -4.089 -6.436 -16.882 1.00 1.91 H new ATOM 0 HD3 LYS A 66 -4.529 -5.648 -18.384 1.00 1.91 H new ATOM 0 HE2 LYS A 66 -1.968 -5.128 -16.817 1.00 1.86 H new ATOM 0 HE3 LYS A 66 -2.094 -6.154 -18.233 1.00 1.86 H new ATOM 0 HZ1 LYS A 66 -1.252 -3.990 -18.791 1.00 2.70 H new ATOM 0 HZ2 LYS A 66 -2.762 -4.235 -19.530 1.00 2.70 H new ATOM 0 HZ3 LYS A 66 -2.639 -3.241 -18.158 1.00 2.70 H new ATOM 988 N LEU A 67 -8.963 -4.502 -14.688 1.00 0.95 N ATOM 989 CA LEU A 67 -10.375 -4.811 -14.553 1.00 1.00 C ATOM 990 C LEU A 67 -11.267 -3.584 -14.796 1.00 1.07 C ATOM 991 O LEU A 67 -12.469 -3.748 -14.994 1.00 1.13 O ATOM 992 CB LEU A 67 -10.588 -5.496 -13.194 1.00 0.93 C ATOM 993 CG LEU A 67 -10.462 -7.031 -13.206 1.00 0.93 C ATOM 994 CD1 LEU A 67 -11.825 -7.661 -13.511 1.00 2.09 C ATOM 995 CD2 LEU A 67 -9.418 -7.628 -14.161 1.00 2.07 C ATOM 0 H LEU A 67 -8.426 -4.602 -13.827 1.00 0.95 H new ATOM 0 HA LEU A 67 -10.687 -5.507 -15.332 1.00 1.00 H new ATOM 0 HB2 LEU A 67 -9.864 -5.094 -12.485 1.00 0.93 H new ATOM 0 HB3 LEU A 67 -11.578 -5.232 -12.823 1.00 0.93 H new ATOM 0 HG LEU A 67 -10.103 -7.273 -12.206 1.00 0.93 H new ATOM 0 HD11 LEU A 67 -11.730 -8.747 -13.518 1.00 2.09 H new ATOM 0 HD12 LEU A 67 -12.542 -7.364 -12.746 1.00 2.09 H new ATOM 0 HD13 LEU A 67 -12.173 -7.321 -14.486 1.00 2.09 H new ATOM 0 HD21 LEU A 67 -9.427 -8.715 -14.076 1.00 2.07 H new ATOM 0 HD22 LEU A 67 -9.656 -7.342 -15.185 1.00 2.07 H new ATOM 0 HD23 LEU A 67 -8.429 -7.251 -13.900 1.00 2.07 H new ATOM 1007 N GLY A 68 -10.697 -2.373 -14.833 1.00 1.07 N ATOM 1008 CA GLY A 68 -11.384 -1.145 -15.208 1.00 1.11 C ATOM 1009 C GLY A 68 -11.748 -0.330 -13.973 1.00 0.95 C ATOM 1010 O GLY A 68 -12.852 0.202 -13.881 1.00 1.08 O ATOM 0 H GLY A 68 -9.717 -2.223 -14.595 1.00 1.07 H new ATOM 0 HA2 GLY A 68 -10.747 -0.553 -15.865 1.00 1.11 H new ATOM 0 HA3 GLY A 68 -12.287 -1.385 -15.770 1.00 1.11 H new ATOM 1014 N TYR A 69 -10.817 -0.248 -13.019 1.00 0.72 N ATOM 1015 CA TYR A 69 -11.000 0.440 -11.743 1.00 0.65 C ATOM 1016 C TYR A 69 -9.813 1.361 -11.464 1.00 0.55 C ATOM 1017 O TYR A 69 -8.860 1.383 -12.241 1.00 0.58 O ATOM 1018 CB TYR A 69 -11.161 -0.604 -10.636 1.00 0.63 C ATOM 1019 CG TYR A 69 -12.356 -1.505 -10.838 1.00 0.78 C ATOM 1020 CD1 TYR A 69 -12.256 -2.621 -11.687 1.00 1.90 C ATOM 1021 CD2 TYR A 69 -13.584 -1.201 -10.227 1.00 2.03 C ATOM 1022 CE1 TYR A 69 -13.388 -3.406 -11.954 1.00 1.96 C ATOM 1023 CE2 TYR A 69 -14.704 -2.010 -10.475 1.00 2.20 C ATOM 1024 CZ TYR A 69 -14.598 -3.119 -11.325 1.00 1.29 C ATOM 1025 OH TYR A 69 -15.642 -3.972 -11.489 1.00 1.66 O ATOM 0 H TYR A 69 -9.893 -0.669 -13.117 1.00 0.72 H new ATOM 0 HA TYR A 69 -11.896 1.059 -11.780 1.00 0.65 H new ATOM 0 HB2 TYR A 69 -10.259 -1.214 -10.586 1.00 0.63 H new ATOM 0 HB3 TYR A 69 -11.255 -0.095 -9.677 1.00 0.63 H new ATOM 0 HD1 TYR A 69 -11.306 -2.875 -12.134 1.00 1.90 H new ATOM 0 HD2 TYR A 69 -13.666 -0.348 -9.569 1.00 2.03 H new ATOM 0 HE1 TYR A 69 -13.322 -4.232 -12.647 1.00 1.96 H new ATOM 0 HE2 TYR A 69 -15.650 -1.777 -10.009 1.00 2.20 H new ATOM 0 HH TYR A 69 -16.446 -3.464 -11.725 1.00 1.66 H new ATOM 1035 N HIS A 70 -9.863 2.129 -10.369 1.00 0.51 N ATOM 1036 CA HIS A 70 -8.765 3.019 -10.000 1.00 0.42 C ATOM 1037 C HIS A 70 -8.624 3.120 -8.483 1.00 0.33 C ATOM 1038 O HIS A 70 -9.619 3.280 -7.780 1.00 0.51 O ATOM 1039 CB HIS A 70 -8.981 4.409 -10.621 1.00 0.52 C ATOM 1040 CG HIS A 70 -7.838 4.836 -11.504 1.00 0.66 C ATOM 1041 ND1 HIS A 70 -6.646 5.385 -11.082 1.00 1.96 N ATOM 1042 CD2 HIS A 70 -7.784 4.720 -12.868 1.00 1.77 C ATOM 1043 CE1 HIS A 70 -5.897 5.603 -12.176 1.00 1.79 C ATOM 1044 NE2 HIS A 70 -6.548 5.224 -13.288 1.00 1.46 N ATOM 0 H HIS A 70 -10.654 2.149 -9.725 1.00 0.51 H new ATOM 0 HA HIS A 70 -7.838 2.601 -10.391 1.00 0.42 H new ATOM 0 HB2 HIS A 70 -9.902 4.403 -11.204 1.00 0.52 H new ATOM 0 HB3 HIS A 70 -9.113 5.142 -9.825 1.00 0.52 H new ATOM 0 HD2 HIS A 70 -8.556 4.313 -13.504 1.00 1.77 H new ATOM 0 HE1 HIS A 70 -4.904 6.027 -12.163 1.00 1.79 H new ATOM 0 HE2 HIS A 70 -6.209 5.290 -14.248 1.00 1.46 H new ATOM 1052 N VAL A 71 -7.389 3.035 -7.983 1.00 0.38 N ATOM 1053 CA VAL A 71 -7.080 3.083 -6.561 1.00 0.43 C ATOM 1054 C VAL A 71 -6.984 4.537 -6.089 1.00 0.50 C ATOM 1055 O VAL A 71 -6.337 5.363 -6.732 1.00 0.56 O ATOM 1056 CB VAL A 71 -5.807 2.266 -6.272 1.00 0.49 C ATOM 1057 CG1 VAL A 71 -5.989 0.805 -6.705 1.00 0.56 C ATOM 1058 CG2 VAL A 71 -4.546 2.830 -6.945 1.00 0.50 C ATOM 0 H VAL A 71 -6.563 2.929 -8.571 1.00 0.38 H new ATOM 0 HA VAL A 71 -7.886 2.624 -5.989 1.00 0.43 H new ATOM 0 HB VAL A 71 -5.659 2.331 -5.194 1.00 0.49 H new ATOM 0 HG11 VAL A 71 -5.078 0.246 -6.492 1.00 0.56 H new ATOM 0 HG12 VAL A 71 -6.822 0.364 -6.157 1.00 0.56 H new ATOM 0 HG13 VAL A 71 -6.197 0.766 -7.774 1.00 0.56 H new ATOM 0 HG21 VAL A 71 -3.690 2.203 -6.697 1.00 0.50 H new ATOM 0 HG22 VAL A 71 -4.685 2.842 -8.026 1.00 0.50 H new ATOM 0 HG23 VAL A 71 -4.367 3.845 -6.590 1.00 0.50 H new ATOM 1068 N VAL A 72 -7.613 4.864 -4.957 1.00 0.55 N ATOM 1069 CA VAL A 72 -7.645 6.226 -4.427 1.00 0.67 C ATOM 1070 C VAL A 72 -6.409 6.425 -3.549 1.00 0.68 C ATOM 1071 O VAL A 72 -6.496 6.572 -2.333 1.00 0.92 O ATOM 1072 CB VAL A 72 -8.986 6.460 -3.709 1.00 0.84 C ATOM 1073 CG1 VAL A 72 -9.141 7.907 -3.217 1.00 1.04 C ATOM 1074 CG2 VAL A 72 -10.126 6.153 -4.690 1.00 0.95 C ATOM 0 H VAL A 72 -8.115 4.188 -4.382 1.00 0.55 H new ATOM 0 HA VAL A 72 -7.597 6.979 -5.213 1.00 0.67 H new ATOM 0 HB VAL A 72 -9.017 5.806 -2.838 1.00 0.84 H new ATOM 0 HG11 VAL A 72 -10.103 8.020 -2.718 1.00 1.04 H new ATOM 0 HG12 VAL A 72 -8.339 8.141 -2.517 1.00 1.04 H new ATOM 0 HG13 VAL A 72 -9.091 8.588 -4.067 1.00 1.04 H new ATOM 0 HG21 VAL A 72 -11.084 6.314 -4.196 1.00 0.95 H new ATOM 0 HG22 VAL A 72 -10.049 6.811 -5.555 1.00 0.95 H new ATOM 0 HG23 VAL A 72 -10.056 5.115 -5.016 1.00 0.95 H new ATOM 1084 N THR A 73 -5.239 6.356 -4.186 1.00 0.59 N ATOM 1085 CA THR A 73 -3.953 6.241 -3.515 1.00 0.58 C ATOM 1086 C THR A 73 -3.018 7.316 -4.063 1.00 0.65 C ATOM 1087 O THR A 73 -2.943 7.471 -5.281 1.00 0.76 O ATOM 1088 CB THR A 73 -3.415 4.828 -3.765 1.00 0.57 C ATOM 1089 OG1 THR A 73 -4.455 3.891 -3.540 1.00 0.65 O ATOM 1090 CG2 THR A 73 -2.279 4.487 -2.812 1.00 0.83 C ATOM 0 H THR A 73 -5.163 6.379 -5.203 1.00 0.59 H new ATOM 0 HA THR A 73 -4.040 6.393 -2.439 1.00 0.58 H new ATOM 0 HB THR A 73 -3.049 4.788 -4.791 1.00 0.57 H new ATOM 0 HG1 THR A 73 -4.239 3.048 -3.990 1.00 0.65 H new ATOM 0 HG21 THR A 73 -1.922 3.478 -3.018 1.00 0.83 H new ATOM 0 HG22 THR A 73 -1.463 5.196 -2.950 1.00 0.83 H new ATOM 0 HG23 THR A 73 -2.637 4.542 -1.784 1.00 0.83 H new ATOM 1098 N GLU A 74 -2.336 8.057 -3.183 1.00 0.66 N ATOM 1099 CA GLU A 74 -1.589 9.257 -3.554 1.00 0.73 C ATOM 1100 C GLU A 74 -0.105 9.080 -3.244 1.00 0.65 C ATOM 1101 O GLU A 74 0.240 8.583 -2.171 1.00 0.64 O ATOM 1102 CB GLU A 74 -2.150 10.465 -2.789 1.00 0.83 C ATOM 1103 CG GLU A 74 -3.555 10.874 -3.262 1.00 1.44 C ATOM 1104 CD GLU A 74 -3.517 11.789 -4.483 1.00 2.38 C ATOM 1105 OE1 GLU A 74 -2.754 11.473 -5.421 1.00 3.17 O ATOM 1106 OE2 GLU A 74 -4.243 12.805 -4.446 1.00 3.12 O ATOM 0 H GLU A 74 -2.288 7.837 -2.188 1.00 0.66 H new ATOM 0 HA GLU A 74 -1.697 9.426 -4.625 1.00 0.73 H new ATOM 0 HB2 GLU A 74 -2.184 10.231 -1.725 1.00 0.83 H new ATOM 0 HB3 GLU A 74 -1.472 11.310 -2.907 1.00 0.83 H new ATOM 0 HG2 GLU A 74 -4.130 9.979 -3.500 1.00 1.44 H new ATOM 0 HG3 GLU A 74 -4.076 11.380 -2.449 1.00 1.44 H new ATOM 1113 N LYS A 75 0.760 9.522 -4.168 1.00 0.67 N ATOM 1114 CA LYS A 75 2.210 9.461 -4.032 1.00 0.63 C ATOM 1115 C LYS A 75 2.710 10.647 -3.210 1.00 0.57 C ATOM 1116 O LYS A 75 3.348 11.555 -3.747 1.00 0.75 O ATOM 1117 CB LYS A 75 2.901 9.385 -5.406 1.00 0.82 C ATOM 1118 CG LYS A 75 2.489 10.498 -6.380 1.00 0.92 C ATOM 1119 CD LYS A 75 3.613 10.850 -7.372 1.00 1.66 C ATOM 1120 CE LYS A 75 4.525 12.010 -6.922 1.00 3.18 C ATOM 1121 NZ LYS A 75 5.242 11.758 -5.656 1.00 4.53 N ATOM 0 H LYS A 75 0.457 9.940 -5.048 1.00 0.67 H new ATOM 0 HA LYS A 75 2.470 8.546 -3.500 1.00 0.63 H new ATOM 0 HB2 LYS A 75 3.980 9.426 -5.260 1.00 0.82 H new ATOM 0 HB3 LYS A 75 2.678 8.419 -5.860 1.00 0.82 H new ATOM 0 HG2 LYS A 75 1.604 10.185 -6.933 1.00 0.92 H new ATOM 0 HG3 LYS A 75 2.213 11.389 -5.815 1.00 0.92 H new ATOM 0 HD2 LYS A 75 4.227 9.964 -7.535 1.00 1.66 H new ATOM 0 HD3 LYS A 75 3.165 11.108 -8.332 1.00 1.66 H new ATOM 0 HE2 LYS A 75 5.255 12.209 -7.707 1.00 3.18 H new ATOM 0 HE3 LYS A 75 3.921 12.911 -6.812 1.00 3.18 H new ATOM 0 HZ1 LYS A 75 5.738 12.623 -5.360 1.00 4.53 H new ATOM 0 HZ2 LYS A 75 4.561 11.481 -4.921 1.00 4.53 H new ATOM 0 HZ3 LYS A 75 5.933 10.993 -5.795 1.00 4.53 H new ATOM 1135 N ALA A 76 2.458 10.635 -1.904 1.00 0.54 N ATOM 1136 CA ALA A 76 2.835 11.769 -1.065 1.00 0.57 C ATOM 1137 C ALA A 76 4.321 11.657 -0.722 1.00 0.56 C ATOM 1138 O ALA A 76 4.876 10.562 -0.784 1.00 0.62 O ATOM 1139 CB ALA A 76 1.957 11.811 0.185 1.00 0.64 C ATOM 0 H ALA A 76 2.003 9.867 -1.410 1.00 0.54 H new ATOM 0 HA ALA A 76 2.677 12.706 -1.598 1.00 0.57 H new ATOM 0 HB1 ALA A 76 2.246 12.660 0.804 1.00 0.64 H new ATOM 0 HB2 ALA A 76 0.912 11.914 -0.108 1.00 0.64 H new ATOM 0 HB3 ALA A 76 2.086 10.889 0.751 1.00 0.64 H new ATOM 1145 N GLU A 77 4.985 12.772 -0.405 1.00 0.63 N ATOM 1146 CA GLU A 77 6.430 12.816 -0.228 1.00 0.62 C ATOM 1147 C GLU A 77 6.803 13.303 1.167 1.00 0.56 C ATOM 1148 O GLU A 77 6.315 14.323 1.656 1.00 0.62 O ATOM 1149 CB GLU A 77 7.088 13.641 -1.336 1.00 0.70 C ATOM 1150 CG GLU A 77 6.803 12.995 -2.698 1.00 1.11 C ATOM 1151 CD GLU A 77 7.633 13.589 -3.826 1.00 1.75 C ATOM 1152 OE1 GLU A 77 8.633 14.274 -3.523 1.00 2.17 O ATOM 1153 OE2 GLU A 77 7.239 13.310 -4.980 1.00 2.78 O ATOM 0 H GLU A 77 4.528 13.673 -0.264 1.00 0.63 H new ATOM 0 HA GLU A 77 6.819 11.801 -0.313 1.00 0.62 H new ATOM 0 HB2 GLU A 77 6.705 14.662 -1.319 1.00 0.70 H new ATOM 0 HB3 GLU A 77 8.163 13.701 -1.169 1.00 0.70 H new ATOM 0 HG2 GLU A 77 7.001 11.925 -2.634 1.00 1.11 H new ATOM 0 HG3 GLU A 77 5.745 13.110 -2.934 1.00 1.11 H new ATOM 1160 N PHE A 78 7.684 12.538 1.806 1.00 0.57 N ATOM 1161 CA PHE A 78 8.087 12.698 3.183 1.00 0.46 C ATOM 1162 C PHE A 78 9.612 12.754 3.253 1.00 0.46 C ATOM 1163 O PHE A 78 10.314 12.284 2.359 1.00 0.71 O ATOM 1164 CB PHE A 78 7.507 11.542 4.005 1.00 0.46 C ATOM 1165 CG PHE A 78 6.043 11.692 4.386 1.00 0.43 C ATOM 1166 CD1 PHE A 78 5.034 11.600 3.410 1.00 1.62 C ATOM 1167 CD2 PHE A 78 5.679 11.923 5.725 1.00 1.63 C ATOM 1168 CE1 PHE A 78 3.689 11.806 3.756 1.00 1.58 C ATOM 1169 CE2 PHE A 78 4.333 12.077 6.079 1.00 1.79 C ATOM 1170 CZ PHE A 78 3.338 12.049 5.093 1.00 0.76 C ATOM 0 H PHE A 78 8.153 11.756 1.349 1.00 0.57 H new ATOM 0 HA PHE A 78 7.704 13.629 3.601 1.00 0.46 H new ATOM 0 HB2 PHE A 78 7.626 10.618 3.438 1.00 0.46 H new ATOM 0 HB3 PHE A 78 8.094 11.435 4.917 1.00 0.46 H new ATOM 0 HD1 PHE A 78 5.296 11.369 2.388 1.00 1.62 H new ATOM 0 HD2 PHE A 78 6.443 11.982 6.486 1.00 1.63 H new ATOM 0 HE1 PHE A 78 2.925 11.777 2.994 1.00 1.58 H new ATOM 0 HE2 PHE A 78 4.061 12.218 7.115 1.00 1.79 H new ATOM 0 HZ PHE A 78 2.305 12.214 5.361 1.00 0.76 H new ATOM 1180 N ASP A 79 10.100 13.377 4.318 1.00 0.40 N ATOM 1181 CA ASP A 79 11.491 13.609 4.664 1.00 0.49 C ATOM 1182 C ASP A 79 11.805 12.794 5.925 1.00 0.49 C ATOM 1183 O ASP A 79 10.907 12.567 6.734 1.00 0.53 O ATOM 1184 CB ASP A 79 11.624 15.120 4.881 1.00 0.61 C ATOM 1185 CG ASP A 79 12.956 15.522 5.484 1.00 0.90 C ATOM 1186 OD1 ASP A 79 13.042 15.472 6.729 1.00 2.57 O ATOM 1187 OD2 ASP A 79 13.827 15.920 4.683 1.00 1.54 O ATOM 0 H ASP A 79 9.474 13.766 5.023 1.00 0.40 H new ATOM 0 HA ASP A 79 12.197 13.296 3.895 1.00 0.49 H new ATOM 0 HB2 ASP A 79 11.496 15.630 3.926 1.00 0.61 H new ATOM 0 HB3 ASP A 79 10.820 15.459 5.534 1.00 0.61 H new ATOM 1192 N ILE A 80 13.025 12.271 6.072 1.00 0.51 N ATOM 1193 CA ILE A 80 13.417 11.440 7.204 1.00 0.55 C ATOM 1194 C ILE A 80 14.546 12.140 7.954 1.00 0.64 C ATOM 1195 O ILE A 80 15.470 12.630 7.311 1.00 0.83 O ATOM 1196 CB ILE A 80 13.900 10.073 6.693 1.00 0.59 C ATOM 1197 CG1 ILE A 80 12.997 9.546 5.565 1.00 0.52 C ATOM 1198 CG2 ILE A 80 13.976 9.089 7.871 1.00 0.70 C ATOM 1199 CD1 ILE A 80 13.587 8.300 4.931 1.00 0.66 C ATOM 0 H ILE A 80 13.775 12.417 5.397 1.00 0.51 H new ATOM 0 HA ILE A 80 12.568 11.289 7.871 1.00 0.55 H new ATOM 0 HB ILE A 80 14.897 10.183 6.265 1.00 0.59 H new ATOM 0 HG12 ILE A 80 12.007 9.322 5.962 1.00 0.52 H new ATOM 0 HG13 ILE A 80 12.869 10.318 4.806 1.00 0.52 H new ATOM 0 HG21 ILE A 80 14.318 8.118 7.513 1.00 0.70 H new ATOM 0 HG22 ILE A 80 14.675 9.468 8.617 1.00 0.70 H new ATOM 0 HG23 ILE A 80 12.989 8.982 8.320 1.00 0.70 H new ATOM 0 HD11 ILE A 80 12.928 7.949 4.137 1.00 0.66 H new ATOM 0 HD12 ILE A 80 14.566 8.533 4.513 1.00 0.66 H new ATOM 0 HD13 ILE A 80 13.691 7.522 5.687 1.00 0.66 H new ATOM 1211 N GLU A 81 14.524 12.122 9.294 1.00 0.62 N ATOM 1212 CA GLU A 81 15.698 12.514 10.068 1.00 0.68 C ATOM 1213 C GLU A 81 16.174 11.276 10.815 1.00 0.72 C ATOM 1214 O GLU A 81 15.783 11.050 11.961 1.00 1.16 O ATOM 1215 CB GLU A 81 15.408 13.705 10.995 1.00 0.92 C ATOM 1216 CG GLU A 81 14.897 14.934 10.228 1.00 1.18 C ATOM 1217 CD GLU A 81 14.414 16.029 11.168 1.00 1.39 C ATOM 1218 OE1 GLU A 81 15.254 16.624 11.868 1.00 2.07 O ATOM 1219 OE2 GLU A 81 13.184 16.258 11.207 1.00 2.23 O ATOM 0 H GLU A 81 13.717 11.844 9.853 1.00 0.62 H new ATOM 0 HA GLU A 81 16.491 12.872 9.411 1.00 0.68 H new ATOM 0 HB2 GLU A 81 14.668 13.411 11.739 1.00 0.92 H new ATOM 0 HB3 GLU A 81 16.316 13.970 11.536 1.00 0.92 H new ATOM 0 HG2 GLU A 81 15.694 15.324 9.595 1.00 1.18 H new ATOM 0 HG3 GLU A 81 14.082 14.637 9.568 1.00 1.18 H new ATOM 1226 N GLY A 82 16.988 10.465 10.136 1.00 0.77 N ATOM 1227 CA GLY A 82 17.621 9.289 10.712 1.00 1.03 C ATOM 1228 C GLY A 82 17.460 8.037 9.848 1.00 1.44 C ATOM 1229 O GLY A 82 17.018 7.008 10.356 1.00 2.84 O ATOM 0 H GLY A 82 17.226 10.614 9.155 1.00 0.77 H new ATOM 0 HA2 GLY A 82 18.683 9.489 10.857 1.00 1.03 H new ATOM 0 HA3 GLY A 82 17.195 9.100 11.697 1.00 1.03 H new ATOM 1233 N MET A 83 17.855 8.091 8.569 1.00 0.95 N ATOM 1234 CA MET A 83 17.998 6.888 7.749 1.00 1.50 C ATOM 1235 C MET A 83 19.467 6.454 7.628 1.00 2.03 C ATOM 1236 O MET A 83 19.768 5.281 7.375 1.00 3.78 O ATOM 1237 CB MET A 83 17.344 7.086 6.385 1.00 1.63 C ATOM 1238 CG MET A 83 17.939 8.192 5.513 1.00 1.46 C ATOM 1239 SD MET A 83 18.294 7.753 3.792 1.00 2.56 S ATOM 1240 CE MET A 83 20.053 7.384 3.952 1.00 3.31 C ATOM 0 H MET A 83 18.081 8.958 8.082 1.00 0.95 H new ATOM 0 HA MET A 83 17.475 6.073 8.251 1.00 1.50 H new ATOM 0 HB2 MET A 83 17.402 6.146 5.836 1.00 1.63 H new ATOM 0 HB3 MET A 83 16.286 7.300 6.538 1.00 1.63 H new ATOM 0 HG2 MET A 83 17.251 9.037 5.516 1.00 1.46 H new ATOM 0 HG3 MET A 83 18.864 8.533 5.977 1.00 1.46 H new ATOM 0 HE1 MET A 83 20.465 7.143 2.972 1.00 3.31 H new ATOM 0 HE2 MET A 83 20.571 8.252 4.359 1.00 3.31 H new ATOM 0 HE3 MET A 83 20.187 6.534 4.621 1.00 3.31 H new ATOM 1250 N THR A 84 20.386 7.403 7.804 1.00 1.78 N ATOM 1251 CA THR A 84 21.820 7.209 7.682 1.00 2.02 C ATOM 1252 C THR A 84 22.368 6.571 8.956 1.00 1.80 C ATOM 1253 O THR A 84 23.088 7.206 9.722 1.00 2.61 O ATOM 1254 CB THR A 84 22.483 8.565 7.392 1.00 3.20 C ATOM 1255 OG1 THR A 84 21.779 9.196 6.349 1.00 4.88 O ATOM 1256 CG2 THR A 84 23.952 8.426 6.976 1.00 4.35 C ATOM 0 H THR A 84 20.137 8.362 8.044 1.00 1.78 H new ATOM 0 HA THR A 84 22.043 6.533 6.857 1.00 2.02 H new ATOM 0 HB THR A 84 22.453 9.150 8.311 1.00 3.20 H new ATOM 0 HG1 THR A 84 22.191 10.064 6.155 1.00 4.88 H new ATOM 0 HG21 THR A 84 24.371 9.414 6.783 1.00 4.35 H new ATOM 0 HG22 THR A 84 24.513 7.944 7.777 1.00 4.35 H new ATOM 0 HG23 THR A 84 24.018 7.821 6.072 1.00 4.35 H new ATOM 1264 N CYS A 85 22.056 5.295 9.174 1.00 1.93 N ATOM 1265 CA CYS A 85 22.735 4.502 10.190 1.00 3.15 C ATOM 1266 C CYS A 85 22.883 3.081 9.668 1.00 2.89 C ATOM 1267 O CYS A 85 22.029 2.228 9.898 1.00 4.14 O ATOM 1268 CB CYS A 85 22.015 4.589 11.537 1.00 4.70 C ATOM 1269 SG CYS A 85 23.121 3.910 12.797 1.00 6.29 S ATOM 0 H CYS A 85 21.336 4.790 8.658 1.00 1.93 H new ATOM 0 HA CYS A 85 23.733 4.898 10.380 1.00 3.15 H new ATOM 0 HB2 CYS A 85 21.761 5.623 11.769 1.00 4.70 H new ATOM 0 HB3 CYS A 85 21.080 4.030 11.508 1.00 4.70 H new ATOM 0 HG CYS A 85 22.542 3.969 13.960 1.00 6.29 H new ATOM 1275 N ALA A 86 23.939 2.860 8.880 1.00 2.30 N ATOM 1276 CA ALA A 86 24.151 1.681 8.050 1.00 2.57 C ATOM 1277 C ALA A 86 23.117 1.613 6.924 1.00 2.02 C ATOM 1278 O ALA A 86 23.470 1.746 5.755 1.00 3.00 O ATOM 1279 CB ALA A 86 24.213 0.388 8.877 1.00 3.60 C ATOM 0 H ALA A 86 24.702 3.532 8.803 1.00 2.30 H new ATOM 0 HA ALA A 86 25.131 1.778 7.583 1.00 2.57 H new ATOM 0 HB1 ALA A 86 24.372 -0.461 8.213 1.00 3.60 H new ATOM 0 HB2 ALA A 86 25.036 0.451 9.589 1.00 3.60 H new ATOM 0 HB3 ALA A 86 23.275 0.256 9.417 1.00 3.60 H new ATOM 1285 N ALA A 87 21.843 1.395 7.263 1.00 1.20 N ATOM 1286 CA ALA A 87 20.817 1.070 6.283 1.00 1.16 C ATOM 1287 C ALA A 87 19.421 1.283 6.869 1.00 0.95 C ATOM 1288 O ALA A 87 18.520 0.470 6.641 1.00 1.01 O ATOM 1289 CB ALA A 87 21.041 -0.379 5.822 1.00 1.77 C ATOM 0 H ALA A 87 21.500 1.440 8.223 1.00 1.20 H new ATOM 0 HA ALA A 87 20.888 1.732 5.420 1.00 1.16 H new ATOM 0 HB1 ALA A 87 20.284 -0.648 5.086 1.00 1.77 H new ATOM 0 HB2 ALA A 87 22.031 -0.469 5.374 1.00 1.77 H new ATOM 0 HB3 ALA A 87 20.968 -1.049 6.679 1.00 1.77 H new ATOM 1295 N CYS A 88 19.211 2.370 7.625 1.00 0.77 N ATOM 1296 CA CYS A 88 17.938 2.528 8.308 1.00 0.68 C ATOM 1297 C CYS A 88 16.853 2.853 7.294 1.00 0.60 C ATOM 1298 O CYS A 88 15.763 2.306 7.403 1.00 0.61 O ATOM 1299 CB CYS A 88 18.025 3.496 9.491 1.00 0.83 C ATOM 1300 SG CYS A 88 18.818 2.621 10.858 1.00 1.47 S ATOM 0 H CYS A 88 19.884 3.122 7.771 1.00 0.77 H new ATOM 0 HA CYS A 88 17.657 1.584 8.775 1.00 0.68 H new ATOM 0 HB2 CYS A 88 18.599 4.382 9.219 1.00 0.83 H new ATOM 0 HB3 CYS A 88 17.031 3.837 9.780 1.00 0.83 H new ATOM 0 HG CYS A 88 18.331 3.046 11.986 1.00 1.47 H new ATOM 1306 N ALA A 89 17.167 3.640 6.255 1.00 0.60 N ATOM 1307 CA ALA A 89 16.267 3.849 5.120 1.00 0.60 C ATOM 1308 C ALA A 89 15.861 2.508 4.537 1.00 0.64 C ATOM 1309 O ALA A 89 14.688 2.236 4.327 1.00 0.57 O ATOM 1310 CB ALA A 89 16.928 4.677 4.009 1.00 0.68 C ATOM 0 H ALA A 89 18.049 4.146 6.181 1.00 0.60 H new ATOM 0 HA ALA A 89 15.398 4.393 5.491 1.00 0.60 H new ATOM 0 HB1 ALA A 89 16.225 4.808 3.186 1.00 0.68 H new ATOM 0 HB2 ALA A 89 17.212 5.653 4.403 1.00 0.68 H new ATOM 0 HB3 ALA A 89 17.816 4.159 3.648 1.00 0.68 H new ATOM 1316 N ASN A 90 16.847 1.660 4.262 1.00 0.86 N ATOM 1317 CA ASN A 90 16.549 0.363 3.667 1.00 0.99 C ATOM 1318 C ASN A 90 15.582 -0.415 4.561 1.00 0.97 C ATOM 1319 O ASN A 90 14.611 -0.987 4.071 1.00 1.03 O ATOM 1320 CB ASN A 90 17.807 -0.453 3.375 1.00 1.18 C ATOM 1321 CG ASN A 90 18.502 -0.003 2.096 1.00 1.46 C ATOM 1322 OD1 ASN A 90 18.184 -0.488 1.017 1.00 2.17 O ATOM 1323 ND2 ASN A 90 19.462 0.914 2.195 1.00 2.20 N ATOM 0 H ASN A 90 17.836 1.841 4.436 1.00 0.86 H new ATOM 0 HA ASN A 90 16.073 0.547 2.704 1.00 0.99 H new ATOM 0 HB2 ASN A 90 18.498 -0.363 4.213 1.00 1.18 H new ATOM 0 HB3 ASN A 90 17.543 -1.507 3.291 1.00 1.18 H new ATOM 0 HD21 ASN A 90 19.954 1.230 1.359 1.00 2.20 H new ATOM 0 HD22 ASN A 90 19.706 1.301 3.107 1.00 2.20 H new ATOM 1330 N ARG A 91 15.811 -0.438 5.875 1.00 0.94 N ATOM 1331 CA ARG A 91 14.864 -1.099 6.765 1.00 1.02 C ATOM 1332 C ARG A 91 13.480 -0.442 6.705 1.00 0.90 C ATOM 1333 O ARG A 91 12.461 -1.129 6.610 1.00 0.93 O ATOM 1334 CB ARG A 91 15.382 -1.139 8.209 1.00 1.06 C ATOM 1335 CG ARG A 91 15.176 -2.567 8.738 1.00 1.30 C ATOM 1336 CD ARG A 91 15.170 -2.672 10.268 1.00 1.53 C ATOM 1337 NE ARG A 91 16.514 -2.547 10.857 1.00 2.00 N ATOM 1338 CZ ARG A 91 17.366 -3.567 11.064 1.00 2.68 C ATOM 1339 NH1 ARG A 91 17.113 -4.770 10.532 1.00 3.37 N ATOM 1340 NH2 ARG A 91 18.465 -3.384 11.805 1.00 3.84 N ATOM 0 H ARG A 91 16.620 -0.019 6.334 1.00 0.94 H new ATOM 0 HA ARG A 91 14.763 -2.126 6.415 1.00 1.02 H new ATOM 0 HB2 ARG A 91 16.437 -0.866 8.245 1.00 1.06 H new ATOM 0 HB3 ARG A 91 14.845 -0.420 8.828 1.00 1.06 H new ATOM 0 HG2 ARG A 91 14.232 -2.953 8.354 1.00 1.30 H new ATOM 0 HG3 ARG A 91 15.965 -3.207 8.343 1.00 1.30 H new ATOM 0 HD2 ARG A 91 14.526 -1.894 10.678 1.00 1.53 H new ATOM 0 HD3 ARG A 91 14.739 -3.630 10.560 1.00 1.53 H new ATOM 0 HE ARG A 91 16.823 -1.614 11.129 1.00 2.00 H new ATOM 0 HH11 ARG A 91 16.274 -4.913 9.970 1.00 3.37 H new ATOM 0 HH12 ARG A 91 17.759 -5.543 10.689 1.00 3.37 H new ATOM 0 HH21 ARG A 91 18.658 -2.470 12.214 1.00 3.84 H new ATOM 0 HH22 ARG A 91 19.110 -4.159 11.961 1.00 3.84 H new ATOM 1354 N ILE A 92 13.452 0.891 6.787 1.00 0.80 N ATOM 1355 CA ILE A 92 12.233 1.682 6.766 1.00 0.74 C ATOM 1356 C ILE A 92 11.458 1.385 5.481 1.00 0.65 C ATOM 1357 O ILE A 92 10.240 1.272 5.530 1.00 0.63 O ATOM 1358 CB ILE A 92 12.543 3.185 6.993 1.00 0.87 C ATOM 1359 CG1 ILE A 92 11.724 3.749 8.161 1.00 1.78 C ATOM 1360 CG2 ILE A 92 12.360 4.063 5.752 1.00 2.83 C ATOM 1361 CD1 ILE A 92 12.088 5.207 8.463 1.00 2.38 C ATOM 0 H ILE A 92 14.297 1.456 6.871 1.00 0.80 H new ATOM 0 HA ILE A 92 11.584 1.401 7.595 1.00 0.74 H new ATOM 0 HB ILE A 92 13.605 3.220 7.236 1.00 0.87 H new ATOM 0 HG12 ILE A 92 10.662 3.681 7.926 1.00 1.78 H new ATOM 0 HG13 ILE A 92 11.893 3.141 9.050 1.00 1.78 H new ATOM 0 HG21 ILE A 92 12.598 5.097 6.000 1.00 2.83 H new ATOM 0 HG22 ILE A 92 13.025 3.718 4.961 1.00 2.83 H new ATOM 0 HG23 ILE A 92 11.327 4.000 5.411 1.00 2.83 H new ATOM 0 HD11 ILE A 92 11.485 5.567 9.296 1.00 2.38 H new ATOM 0 HD12 ILE A 92 13.144 5.272 8.725 1.00 2.38 H new ATOM 0 HD13 ILE A 92 11.894 5.820 7.583 1.00 2.38 H new ATOM 1373 N GLU A 93 12.161 1.205 4.357 1.00 0.65 N ATOM 1374 CA GLU A 93 11.607 0.942 3.049 1.00 0.68 C ATOM 1375 C GLU A 93 10.745 -0.299 3.163 1.00 0.71 C ATOM 1376 O GLU A 93 9.529 -0.196 3.080 1.00 0.66 O ATOM 1377 CB GLU A 93 12.752 0.810 2.028 1.00 0.78 C ATOM 1378 CG GLU A 93 12.257 0.695 0.586 1.00 0.98 C ATOM 1379 CD GLU A 93 11.977 -0.747 0.182 1.00 1.17 C ATOM 1380 OE1 GLU A 93 12.968 -1.462 -0.084 1.00 1.77 O ATOM 1381 OE2 GLU A 93 10.787 -1.129 0.189 1.00 2.64 O ATOM 0 H GLU A 93 13.180 1.243 4.348 1.00 0.65 H new ATOM 0 HA GLU A 93 10.978 1.757 2.691 1.00 0.68 H new ATOM 0 HB2 GLU A 93 13.409 1.676 2.113 1.00 0.78 H new ATOM 0 HB3 GLU A 93 13.350 -0.068 2.272 1.00 0.78 H new ATOM 0 HG2 GLU A 93 11.348 1.286 0.468 1.00 0.98 H new ATOM 0 HG3 GLU A 93 13.002 1.120 -0.086 1.00 0.98 H new ATOM 1388 N LYS A 94 11.366 -1.443 3.474 1.00 0.82 N ATOM 1389 CA LYS A 94 10.664 -2.716 3.602 1.00 0.86 C ATOM 1390 C LYS A 94 9.420 -2.582 4.483 1.00 0.85 C ATOM 1391 O LYS A 94 8.421 -3.251 4.225 1.00 0.98 O ATOM 1392 CB LYS A 94 11.590 -3.810 4.164 1.00 0.86 C ATOM 1393 CG LYS A 94 12.421 -4.539 3.095 1.00 0.99 C ATOM 1394 CD LYS A 94 13.347 -3.571 2.353 1.00 1.52 C ATOM 1395 CE LYS A 94 14.288 -4.233 1.342 1.00 2.23 C ATOM 1396 NZ LYS A 94 15.407 -4.938 1.999 1.00 2.99 N ATOM 0 H LYS A 94 12.370 -1.507 3.643 1.00 0.82 H new ATOM 0 HA LYS A 94 10.348 -3.009 2.601 1.00 0.86 H new ATOM 0 HB2 LYS A 94 12.267 -3.360 4.891 1.00 0.86 H new ATOM 0 HB3 LYS A 94 10.986 -4.542 4.701 1.00 0.86 H new ATOM 0 HG2 LYS A 94 13.014 -5.324 3.565 1.00 0.99 H new ATOM 0 HG3 LYS A 94 11.755 -5.026 2.383 1.00 0.99 H new ATOM 0 HD2 LYS A 94 12.737 -2.833 1.832 1.00 1.52 H new ATOM 0 HD3 LYS A 94 13.946 -3.029 3.085 1.00 1.52 H new ATOM 0 HE2 LYS A 94 13.724 -4.939 0.732 1.00 2.23 H new ATOM 0 HE3 LYS A 94 14.685 -3.475 0.667 1.00 2.23 H new ATOM 0 HZ1 LYS A 94 16.017 -5.370 1.276 1.00 2.99 H new ATOM 0 HZ2 LYS A 94 15.962 -4.261 2.561 1.00 2.99 H new ATOM 0 HZ3 LYS A 94 15.031 -5.680 2.623 1.00 2.99 H new ATOM 1410 N ARG A 95 9.486 -1.763 5.539 1.00 0.74 N ATOM 1411 CA ARG A 95 8.320 -1.570 6.397 1.00 0.68 C ATOM 1412 C ARG A 95 7.258 -0.726 5.686 1.00 0.55 C ATOM 1413 O ARG A 95 6.170 -1.214 5.370 1.00 0.55 O ATOM 1414 CB ARG A 95 8.738 -1.010 7.767 1.00 0.75 C ATOM 1415 CG ARG A 95 8.899 -2.147 8.788 1.00 1.01 C ATOM 1416 CD ARG A 95 10.001 -3.147 8.424 1.00 2.60 C ATOM 1417 NE ARG A 95 9.951 -4.301 9.335 1.00 2.56 N ATOM 1418 CZ ARG A 95 10.341 -5.547 9.023 1.00 3.76 C ATOM 1419 NH1 ARG A 95 11.045 -5.762 7.906 1.00 5.39 N ATOM 1420 NH2 ARG A 95 10.021 -6.568 9.825 1.00 3.83 N ATOM 0 H ARG A 95 10.315 -1.236 5.813 1.00 0.74 H new ATOM 0 HA ARG A 95 7.855 -2.536 6.595 1.00 0.68 H new ATOM 0 HB2 ARG A 95 9.676 -0.463 7.672 1.00 0.75 H new ATOM 0 HB3 ARG A 95 7.990 -0.300 8.120 1.00 0.75 H new ATOM 0 HG2 ARG A 95 9.118 -1.718 9.766 1.00 1.01 H new ATOM 0 HG3 ARG A 95 7.952 -2.679 8.879 1.00 1.01 H new ATOM 0 HD2 ARG A 95 9.876 -3.480 7.394 1.00 2.60 H new ATOM 0 HD3 ARG A 95 10.977 -2.665 8.487 1.00 2.60 H new ATOM 0 HE ARG A 95 9.592 -4.142 10.277 1.00 2.56 H new ATOM 0 HH11 ARG A 95 11.283 -4.981 7.295 1.00 5.39 H new ATOM 0 HH12 ARG A 95 11.343 -6.707 7.665 1.00 5.39 H new ATOM 0 HH21 ARG A 95 9.481 -6.400 10.674 1.00 3.83 H new ATOM 0 HH22 ARG A 95 10.317 -7.515 9.588 1.00 3.83 H new ATOM 1434 N LEU A 96 7.578 0.543 5.434 1.00 0.51 N ATOM 1435 CA LEU A 96 6.663 1.504 4.846 1.00 0.49 C ATOM 1436 C LEU A 96 6.052 0.979 3.538 1.00 0.60 C ATOM 1437 O LEU A 96 4.894 1.260 3.251 1.00 0.74 O ATOM 1438 CB LEU A 96 7.323 2.879 4.697 1.00 0.54 C ATOM 1439 CG LEU A 96 7.816 3.528 6.017 1.00 0.80 C ATOM 1440 CD1 LEU A 96 8.006 5.024 5.760 1.00 0.85 C ATOM 1441 CD2 LEU A 96 6.897 3.360 7.232 1.00 2.01 C ATOM 0 H LEU A 96 8.498 0.933 5.639 1.00 0.51 H new ATOM 0 HA LEU A 96 5.826 1.638 5.532 1.00 0.49 H new ATOM 0 HB2 LEU A 96 8.172 2.784 4.020 1.00 0.54 H new ATOM 0 HB3 LEU A 96 6.611 3.555 4.223 1.00 0.54 H new ATOM 0 HG LEU A 96 8.736 3.006 6.279 1.00 0.80 H new ATOM 0 HD11 LEU A 96 8.353 5.509 6.672 1.00 0.85 H new ATOM 0 HD12 LEU A 96 8.743 5.167 4.970 1.00 0.85 H new ATOM 0 HD13 LEU A 96 7.057 5.464 5.454 1.00 0.85 H new ATOM 0 HD21 LEU A 96 7.342 3.853 8.096 1.00 2.01 H new ATOM 0 HD22 LEU A 96 5.926 3.808 7.019 1.00 2.01 H new ATOM 0 HD23 LEU A 96 6.768 2.299 7.446 1.00 2.01 H new ATOM 1453 N ASN A 97 6.803 0.171 2.780 1.00 0.60 N ATOM 1454 CA ASN A 97 6.402 -0.497 1.540 1.00 0.82 C ATOM 1455 C ASN A 97 4.982 -1.067 1.614 1.00 0.84 C ATOM 1456 O ASN A 97 4.250 -1.014 0.630 1.00 0.91 O ATOM 1457 CB ASN A 97 7.420 -1.604 1.211 1.00 1.09 C ATOM 1458 CG ASN A 97 7.385 -2.074 -0.240 1.00 1.28 C ATOM 1459 OD1 ASN A 97 6.404 -2.651 -0.705 1.00 1.78 O ATOM 1460 ND2 ASN A 97 8.485 -1.908 -0.965 1.00 1.35 N ATOM 0 H ASN A 97 7.767 -0.046 3.034 1.00 0.60 H new ATOM 0 HA ASN A 97 6.392 0.246 0.743 1.00 0.82 H new ATOM 0 HB2 ASN A 97 8.422 -1.240 1.439 1.00 1.09 H new ATOM 0 HB3 ASN A 97 7.235 -2.458 1.862 1.00 1.09 H new ATOM 0 HD21 ASN A 97 8.524 -2.261 -1.921 1.00 1.35 H new ATOM 0 HD22 ASN A 97 9.291 -1.427 -0.566 1.00 1.35 H new ATOM 1467 N LYS A 98 4.600 -1.638 2.765 1.00 0.80 N ATOM 1468 CA LYS A 98 3.243 -2.117 3.008 1.00 0.83 C ATOM 1469 C LYS A 98 2.951 -2.097 4.508 1.00 0.82 C ATOM 1470 O LYS A 98 2.916 -3.148 5.144 1.00 0.92 O ATOM 1471 CB LYS A 98 2.973 -3.493 2.368 1.00 0.89 C ATOM 1472 CG LYS A 98 4.068 -4.538 2.664 1.00 1.02 C ATOM 1473 CD LYS A 98 5.110 -4.667 1.546 1.00 2.91 C ATOM 1474 CE LYS A 98 4.592 -5.319 0.254 1.00 4.39 C ATOM 1475 NZ LYS A 98 5.575 -5.187 -0.841 1.00 5.93 N ATOM 0 H LYS A 98 5.231 -1.779 3.554 1.00 0.80 H new ATOM 0 HA LYS A 98 2.548 -1.437 2.515 1.00 0.83 H new ATOM 0 HB2 LYS A 98 2.016 -3.870 2.728 1.00 0.89 H new ATOM 0 HB3 LYS A 98 2.882 -3.371 1.289 1.00 0.89 H new ATOM 0 HG2 LYS A 98 4.574 -4.270 3.592 1.00 1.02 H new ATOM 0 HG3 LYS A 98 3.599 -5.508 2.826 1.00 1.02 H new ATOM 0 HD2 LYS A 98 5.491 -3.674 1.308 1.00 2.91 H new ATOM 0 HD3 LYS A 98 5.952 -5.251 1.919 1.00 2.91 H new ATOM 0 HE2 LYS A 98 4.383 -6.374 0.434 1.00 4.39 H new ATOM 0 HE3 LYS A 98 3.651 -4.853 -0.040 1.00 4.39 H new ATOM 0 HZ1 LYS A 98 5.154 -5.528 -1.729 1.00 5.93 H new ATOM 0 HZ2 LYS A 98 5.844 -4.188 -0.947 1.00 5.93 H new ATOM 0 HZ3 LYS A 98 6.420 -5.751 -0.619 1.00 5.93 H new ATOM 1489 N ILE A 99 2.731 -0.904 5.066 1.00 0.78 N ATOM 1490 CA ILE A 99 2.309 -0.773 6.461 1.00 0.81 C ATOM 1491 C ILE A 99 0.948 -1.446 6.611 1.00 0.80 C ATOM 1492 O ILE A 99 0.784 -2.390 7.378 1.00 1.13 O ATOM 1493 CB ILE A 99 2.216 0.691 6.922 1.00 0.80 C ATOM 1494 CG1 ILE A 99 3.482 1.470 6.570 1.00 1.48 C ATOM 1495 CG2 ILE A 99 1.992 0.722 8.442 1.00 0.91 C ATOM 1496 CD1 ILE A 99 3.273 2.964 6.774 1.00 3.32 C ATOM 0 H ILE A 99 2.838 -0.017 4.574 1.00 0.78 H new ATOM 0 HA ILE A 99 3.061 -1.250 7.090 1.00 0.81 H new ATOM 0 HB ILE A 99 1.381 1.165 6.406 1.00 0.80 H new ATOM 0 HG12 ILE A 99 4.310 1.126 7.190 1.00 1.48 H new ATOM 0 HG13 ILE A 99 3.758 1.275 5.534 1.00 1.48 H new ATOM 0 HG21 ILE A 99 1.925 1.756 8.779 1.00 0.91 H new ATOM 0 HG22 ILE A 99 1.066 0.201 8.684 1.00 0.91 H new ATOM 0 HG23 ILE A 99 2.826 0.231 8.943 1.00 0.91 H new ATOM 0 HD11 ILE A 99 4.188 3.498 6.517 1.00 3.32 H new ATOM 0 HD12 ILE A 99 2.460 3.308 6.135 1.00 3.32 H new ATOM 0 HD13 ILE A 99 3.021 3.157 7.817 1.00 3.32 H new ATOM 1508 N GLU A 100 -0.012 -0.926 5.843 1.00 0.73 N ATOM 1509 CA GLU A 100 -1.352 -1.454 5.696 1.00 0.76 C ATOM 1510 C GLU A 100 -1.822 -1.044 4.294 1.00 0.73 C ATOM 1511 O GLU A 100 -1.335 -1.616 3.317 1.00 1.09 O ATOM 1512 CB GLU A 100 -2.227 -1.030 6.892 1.00 0.77 C ATOM 1513 CG GLU A 100 -3.251 -2.119 7.241 1.00 1.56 C ATOM 1514 CD GLU A 100 -4.337 -2.284 6.188 1.00 3.35 C ATOM 1515 OE1 GLU A 100 -4.026 -2.810 5.094 1.00 4.58 O ATOM 1516 OE2 GLU A 100 -5.468 -1.867 6.504 1.00 4.12 O ATOM 0 H GLU A 100 0.140 -0.086 5.284 1.00 0.73 H new ATOM 0 HA GLU A 100 -1.414 -2.541 5.739 1.00 0.76 H new ATOM 0 HB2 GLU A 100 -1.594 -0.831 7.757 1.00 0.77 H new ATOM 0 HB3 GLU A 100 -2.746 -0.101 6.656 1.00 0.77 H new ATOM 0 HG2 GLU A 100 -2.732 -3.069 7.369 1.00 1.56 H new ATOM 0 HG3 GLU A 100 -3.715 -1.878 8.197 1.00 1.56 H new ATOM 1523 N GLY A 101 -2.627 0.017 4.146 1.00 0.56 N ATOM 1524 CA GLY A 101 -3.134 0.453 2.854 1.00 0.58 C ATOM 1525 C GLY A 101 -2.119 1.309 2.108 1.00 0.58 C ATOM 1526 O GLY A 101 -2.428 2.424 1.682 1.00 0.72 O ATOM 0 H GLY A 101 -2.941 0.594 4.927 1.00 0.56 H new ATOM 0 HA2 GLY A 101 -3.388 -0.418 2.250 1.00 0.58 H new ATOM 0 HA3 GLY A 101 -4.053 1.021 2.997 1.00 0.58 H new ATOM 1530 N VAL A 102 -0.908 0.772 1.954 1.00 0.57 N ATOM 1531 CA VAL A 102 0.203 1.389 1.252 1.00 0.55 C ATOM 1532 C VAL A 102 0.489 0.540 0.021 1.00 0.57 C ATOM 1533 O VAL A 102 0.790 -0.646 0.145 1.00 0.61 O ATOM 1534 CB VAL A 102 1.422 1.523 2.177 1.00 0.53 C ATOM 1535 CG1 VAL A 102 2.517 2.323 1.464 1.00 0.53 C ATOM 1536 CG2 VAL A 102 1.066 2.179 3.516 1.00 0.53 C ATOM 0 H VAL A 102 -0.671 -0.144 2.334 1.00 0.57 H new ATOM 0 HA VAL A 102 -0.042 2.404 0.938 1.00 0.55 H new ATOM 0 HB VAL A 102 1.784 0.520 2.403 1.00 0.53 H new ATOM 0 HG11 VAL A 102 3.383 2.419 2.119 1.00 0.53 H new ATOM 0 HG12 VAL A 102 2.809 1.806 0.550 1.00 0.53 H new ATOM 0 HG13 VAL A 102 2.139 3.315 1.215 1.00 0.53 H new ATOM 0 HG21 VAL A 102 1.960 2.251 4.135 1.00 0.53 H new ATOM 0 HG22 VAL A 102 0.667 3.177 3.337 1.00 0.53 H new ATOM 0 HG23 VAL A 102 0.318 1.575 4.029 1.00 0.53 H new ATOM 1546 N ALA A 103 0.367 1.140 -1.165 1.00 0.57 N ATOM 1547 CA ALA A 103 0.689 0.466 -2.407 1.00 0.59 C ATOM 1548 C ALA A 103 2.198 0.271 -2.495 1.00 0.56 C ATOM 1549 O ALA A 103 2.665 -0.833 -2.771 1.00 0.59 O ATOM 1550 CB ALA A 103 0.189 1.258 -3.618 1.00 0.65 C ATOM 0 H ALA A 103 0.044 2.100 -1.283 1.00 0.57 H new ATOM 0 HA ALA A 103 0.189 -0.502 -2.416 1.00 0.59 H new ATOM 0 HB1 ALA A 103 0.447 0.725 -4.533 1.00 0.65 H new ATOM 0 HB2 ALA A 103 -0.893 1.372 -3.557 1.00 0.65 H new ATOM 0 HB3 ALA A 103 0.657 2.242 -3.627 1.00 0.65 H new ATOM 1556 N ASN A 104 2.941 1.363 -2.278 1.00 0.54 N ATOM 1557 CA ASN A 104 4.390 1.415 -2.429 1.00 0.57 C ATOM 1558 C ASN A 104 4.943 2.474 -1.487 1.00 0.54 C ATOM 1559 O ASN A 104 4.196 3.306 -0.972 1.00 0.51 O ATOM 1560 CB ASN A 104 4.793 1.785 -3.865 1.00 0.64 C ATOM 1561 CG ASN A 104 4.345 0.760 -4.895 1.00 0.66 C ATOM 1562 OD1 ASN A 104 4.884 -0.341 -4.955 1.00 0.74 O ATOM 1563 ND2 ASN A 104 3.372 1.118 -5.721 1.00 0.66 N ATOM 0 H ASN A 104 2.537 2.253 -1.986 1.00 0.54 H new ATOM 0 HA ASN A 104 4.793 0.429 -2.197 1.00 0.57 H new ATOM 0 HB2 ASN A 104 4.365 2.755 -4.117 1.00 0.64 H new ATOM 0 HB3 ASN A 104 5.877 1.892 -3.915 1.00 0.64 H new ATOM 0 HD21 ASN A 104 3.047 0.469 -6.438 1.00 0.66 H new ATOM 0 HD22 ASN A 104 2.948 2.042 -5.640 1.00 0.66 H new ATOM 1570 N ALA A 105 6.265 2.478 -1.305 1.00 0.56 N ATOM 1571 CA ALA A 105 6.938 3.509 -0.522 1.00 0.58 C ATOM 1572 C ALA A 105 8.444 3.574 -0.818 1.00 0.62 C ATOM 1573 O ALA A 105 9.244 3.198 0.038 1.00 0.64 O ATOM 1574 CB ALA A 105 6.691 3.294 0.979 1.00 0.62 C ATOM 0 H ALA A 105 6.892 1.773 -1.693 1.00 0.56 H new ATOM 0 HA ALA A 105 6.511 4.467 -0.817 1.00 0.58 H new ATOM 0 HB1 ALA A 105 7.201 4.072 1.547 1.00 0.62 H new ATOM 0 HB2 ALA A 105 5.621 3.339 1.182 1.00 0.62 H new ATOM 0 HB3 ALA A 105 7.076 2.318 1.275 1.00 0.62 H new ATOM 1580 N PRO A 106 8.867 4.011 -2.015 1.00 0.64 N ATOM 1581 CA PRO A 106 10.276 4.038 -2.366 1.00 0.65 C ATOM 1582 C PRO A 106 11.017 5.125 -1.574 1.00 0.61 C ATOM 1583 O PRO A 106 10.543 6.259 -1.459 1.00 0.62 O ATOM 1584 CB PRO A 106 10.322 4.260 -3.879 1.00 0.70 C ATOM 1585 CG PRO A 106 9.021 5.006 -4.171 1.00 0.70 C ATOM 1586 CD PRO A 106 8.043 4.452 -3.128 1.00 0.67 C ATOM 0 HA PRO A 106 10.785 3.109 -2.108 1.00 0.65 H new ATOM 0 HB2 PRO A 106 11.194 4.844 -4.172 1.00 0.70 H new ATOM 0 HB3 PRO A 106 10.374 3.316 -4.422 1.00 0.70 H new ATOM 0 HG2 PRO A 106 9.146 6.084 -4.070 1.00 0.70 H new ATOM 0 HG3 PRO A 106 8.672 4.820 -5.187 1.00 0.70 H new ATOM 0 HD2 PRO A 106 7.333 5.216 -2.811 1.00 0.67 H new ATOM 0 HD3 PRO A 106 7.461 3.626 -3.536 1.00 0.67 H new ATOM 1594 N VAL A 107 12.180 4.752 -1.027 1.00 0.59 N ATOM 1595 CA VAL A 107 13.036 5.577 -0.185 1.00 0.57 C ATOM 1596 C VAL A 107 14.285 5.970 -0.978 1.00 0.63 C ATOM 1597 O VAL A 107 14.791 5.161 -1.756 1.00 0.71 O ATOM 1598 CB VAL A 107 13.423 4.782 1.076 1.00 0.61 C ATOM 1599 CG1 VAL A 107 14.285 5.620 2.025 1.00 2.02 C ATOM 1600 CG2 VAL A 107 12.190 4.307 1.851 1.00 2.53 C ATOM 0 H VAL A 107 12.564 3.818 -1.171 1.00 0.59 H new ATOM 0 HA VAL A 107 12.510 6.482 0.119 1.00 0.57 H new ATOM 0 HB VAL A 107 13.988 3.919 0.725 1.00 0.61 H new ATOM 0 HG11 VAL A 107 14.540 5.028 2.904 1.00 2.02 H new ATOM 0 HG12 VAL A 107 15.199 5.923 1.514 1.00 2.02 H new ATOM 0 HG13 VAL A 107 13.731 6.506 2.333 1.00 2.02 H new ATOM 0 HG21 VAL A 107 12.507 3.750 2.733 1.00 2.53 H new ATOM 0 HG22 VAL A 107 11.599 5.170 2.159 1.00 2.53 H new ATOM 0 HG23 VAL A 107 11.585 3.662 1.213 1.00 2.53 H new ATOM 1610 N ASN A 108 14.802 7.183 -0.764 1.00 0.66 N ATOM 1611 CA ASN A 108 16.023 7.665 -1.392 1.00 0.82 C ATOM 1612 C ASN A 108 17.143 7.671 -0.361 1.00 0.94 C ATOM 1613 O ASN A 108 16.888 7.764 0.836 1.00 1.92 O ATOM 1614 CB ASN A 108 15.837 9.089 -1.920 1.00 0.85 C ATOM 1615 CG ASN A 108 14.928 9.165 -3.148 1.00 1.03 C ATOM 1616 OD1 ASN A 108 14.029 8.354 -3.335 1.00 1.38 O ATOM 1617 ND2 ASN A 108 15.166 10.136 -4.027 1.00 1.66 N ATOM 0 H ASN A 108 14.373 7.865 -0.138 1.00 0.66 H new ATOM 0 HA ASN A 108 16.268 7.007 -2.225 1.00 0.82 H new ATOM 0 HB2 ASN A 108 15.419 9.711 -1.128 1.00 0.85 H new ATOM 0 HB3 ASN A 108 16.812 9.506 -2.172 1.00 0.85 H new ATOM 0 HD21 ASN A 108 14.596 10.212 -4.870 1.00 1.66 H new ATOM 0 HD22 ASN A 108 15.918 10.804 -3.858 1.00 1.66 H new ATOM 1624 N PHE A 109 18.388 7.612 -0.842 1.00 0.91 N ATOM 1625 CA PHE A 109 19.586 7.537 -0.017 1.00 0.90 C ATOM 1626 C PHE A 109 20.428 8.814 -0.092 1.00 1.11 C ATOM 1627 O PHE A 109 21.411 8.941 0.631 1.00 1.55 O ATOM 1628 CB PHE A 109 20.410 6.309 -0.437 1.00 0.84 C ATOM 1629 CG PHE A 109 20.870 5.477 0.738 1.00 1.04 C ATOM 1630 CD1 PHE A 109 19.916 4.743 1.463 1.00 1.73 C ATOM 1631 CD2 PHE A 109 22.197 5.549 1.197 1.00 2.30 C ATOM 1632 CE1 PHE A 109 20.288 4.079 2.640 1.00 1.88 C ATOM 1633 CE2 PHE A 109 22.572 4.865 2.366 1.00 2.54 C ATOM 1634 CZ PHE A 109 21.620 4.126 3.089 1.00 1.66 C ATOM 0 H PHE A 109 18.590 7.615 -1.842 1.00 0.91 H new ATOM 0 HA PHE A 109 19.278 7.436 1.024 1.00 0.90 H new ATOM 0 HB2 PHE A 109 19.812 5.687 -1.103 1.00 0.84 H new ATOM 0 HB3 PHE A 109 21.280 6.639 -1.004 1.00 0.84 H new ATOM 0 HD1 PHE A 109 18.896 4.690 1.113 1.00 1.73 H new ATOM 0 HD2 PHE A 109 22.927 6.129 0.652 1.00 2.30 H new ATOM 0 HE1 PHE A 109 19.549 3.529 3.204 1.00 1.88 H new ATOM 0 HE2 PHE A 109 23.595 4.907 2.710 1.00 2.54 H new ATOM 0 HZ PHE A 109 21.910 3.597 3.985 1.00 1.66 H new ATOM 1644 N ALA A 110 20.066 9.737 -0.990 1.00 1.00 N ATOM 1645 CA ALA A 110 20.790 10.981 -1.218 1.00 1.26 C ATOM 1646 C ALA A 110 20.057 12.131 -0.534 1.00 1.31 C ATOM 1647 O ALA A 110 20.666 12.975 0.114 1.00 1.66 O ATOM 1648 CB ALA A 110 20.903 11.230 -2.726 1.00 1.44 C ATOM 0 H ALA A 110 19.246 9.633 -1.587 1.00 1.00 H new ATOM 0 HA ALA A 110 21.793 10.912 -0.797 1.00 1.26 H new ATOM 0 HB1 ALA A 110 21.444 12.160 -2.902 1.00 1.44 H new ATOM 0 HB2 ALA A 110 21.440 10.404 -3.192 1.00 1.44 H new ATOM 0 HB3 ALA A 110 19.905 11.304 -3.158 1.00 1.44 H new ATOM 1654 N LEU A 111 18.734 12.164 -0.708 1.00 1.08 N ATOM 1655 CA LEU A 111 17.888 13.244 -0.226 1.00 1.08 C ATOM 1656 C LEU A 111 17.485 13.045 1.245 1.00 0.99 C ATOM 1657 O LEU A 111 16.994 13.986 1.861 1.00 1.01 O ATOM 1658 CB LEU A 111 16.632 13.333 -1.109 1.00 1.17 C ATOM 1659 CG LEU A 111 16.863 13.274 -2.630 1.00 1.20 C ATOM 1660 CD1 LEU A 111 15.529 13.483 -3.358 1.00 1.34 C ATOM 1661 CD2 LEU A 111 17.861 14.334 -3.113 1.00 1.35 C ATOM 0 H LEU A 111 18.219 11.430 -1.194 1.00 1.08 H new ATOM 0 HA LEU A 111 18.455 14.173 -0.284 1.00 1.08 H new ATOM 0 HB2 LEU A 111 15.961 12.520 -0.833 1.00 1.17 H new ATOM 0 HB3 LEU A 111 16.116 14.265 -0.877 1.00 1.17 H new ATOM 0 HG LEU A 111 17.281 12.293 -2.855 1.00 1.20 H new ATOM 0 HD11 LEU A 111 15.692 13.441 -4.435 1.00 1.34 H new ATOM 0 HD12 LEU A 111 14.829 12.700 -3.066 1.00 1.34 H new ATOM 0 HD13 LEU A 111 15.117 14.456 -3.091 1.00 1.34 H new ATOM 0 HD21 LEU A 111 17.988 14.249 -4.192 1.00 1.35 H new ATOM 0 HD22 LEU A 111 17.484 15.327 -2.869 1.00 1.35 H new ATOM 0 HD23 LEU A 111 18.822 14.180 -2.621 1.00 1.35 H new ATOM 1673 N GLU A 112 17.612 11.818 1.772 1.00 0.94 N ATOM 1674 CA GLU A 112 16.945 11.359 2.992 1.00 0.82 C ATOM 1675 C GLU A 112 15.435 11.622 2.932 1.00 0.62 C ATOM 1676 O GLU A 112 14.834 12.118 3.884 1.00 0.63 O ATOM 1677 CB GLU A 112 17.588 11.924 4.272 1.00 1.07 C ATOM 1678 CG GLU A 112 19.018 11.416 4.504 1.00 1.46 C ATOM 1679 CD GLU A 112 19.406 11.510 5.987 1.00 2.81 C ATOM 1680 OE1 GLU A 112 18.823 10.747 6.800 1.00 4.38 O ATOM 1681 OE2 GLU A 112 20.274 12.357 6.285 1.00 2.82 O ATOM 0 H GLU A 112 18.199 11.100 1.347 1.00 0.94 H new ATOM 0 HA GLU A 112 17.086 10.279 3.044 1.00 0.82 H new ATOM 0 HB2 GLU A 112 17.601 13.012 4.215 1.00 1.07 H new ATOM 0 HB3 GLU A 112 16.971 11.657 5.130 1.00 1.07 H new ATOM 0 HG2 GLU A 112 19.098 10.382 4.169 1.00 1.46 H new ATOM 0 HG3 GLU A 112 19.716 12.000 3.905 1.00 1.46 H new ATOM 1688 N THR A 113 14.809 11.247 1.812 1.00 0.58 N ATOM 1689 CA THR A 113 13.372 11.360 1.624 1.00 0.54 C ATOM 1690 C THR A 113 12.786 9.995 1.288 1.00 0.53 C ATOM 1691 O THR A 113 13.503 9.070 0.900 1.00 0.58 O ATOM 1692 CB THR A 113 13.049 12.389 0.530 1.00 0.66 C ATOM 1693 OG1 THR A 113 13.586 11.970 -0.709 1.00 0.85 O ATOM 1694 CG2 THR A 113 13.616 13.767 0.879 1.00 0.83 C ATOM 0 H THR A 113 15.296 10.854 1.007 1.00 0.58 H new ATOM 0 HA THR A 113 12.918 11.711 2.551 1.00 0.54 H new ATOM 0 HB THR A 113 11.964 12.463 0.458 1.00 0.66 H new ATOM 0 HG1 THR A 113 13.373 12.632 -1.399 1.00 0.85 H new ATOM 0 HG21 THR A 113 13.371 14.473 0.086 1.00 0.83 H new ATOM 0 HG22 THR A 113 13.183 14.112 1.818 1.00 0.83 H new ATOM 0 HG23 THR A 113 14.699 13.699 0.982 1.00 0.83 H new ATOM 1702 N VAL A 114 11.468 9.889 1.438 1.00 0.56 N ATOM 1703 CA VAL A 114 10.688 8.724 1.071 1.00 0.56 C ATOM 1704 C VAL A 114 9.387 9.197 0.438 1.00 0.53 C ATOM 1705 O VAL A 114 8.714 10.069 0.986 1.00 0.54 O ATOM 1706 CB VAL A 114 10.483 7.810 2.294 1.00 0.56 C ATOM 1707 CG1 VAL A 114 10.001 8.543 3.553 1.00 0.60 C ATOM 1708 CG2 VAL A 114 9.500 6.670 1.998 1.00 0.59 C ATOM 0 H VAL A 114 10.901 10.640 1.832 1.00 0.56 H new ATOM 0 HA VAL A 114 11.213 8.116 0.334 1.00 0.56 H new ATOM 0 HB VAL A 114 11.478 7.413 2.495 1.00 0.56 H new ATOM 0 HG11 VAL A 114 9.882 7.828 4.367 1.00 0.60 H new ATOM 0 HG12 VAL A 114 10.734 9.298 3.838 1.00 0.60 H new ATOM 0 HG13 VAL A 114 9.044 9.024 3.350 1.00 0.60 H new ATOM 0 HG21 VAL A 114 9.384 6.050 2.887 1.00 0.59 H new ATOM 0 HG22 VAL A 114 8.533 7.087 1.718 1.00 0.59 H new ATOM 0 HG23 VAL A 114 9.884 6.062 1.179 1.00 0.59 H new ATOM 1718 N THR A 115 9.029 8.620 -0.709 1.00 0.54 N ATOM 1719 CA THR A 115 7.676 8.752 -1.218 1.00 0.54 C ATOM 1720 C THR A 115 6.869 7.675 -0.506 1.00 0.54 C ATOM 1721 O THR A 115 7.359 6.560 -0.357 1.00 0.71 O ATOM 1722 CB THR A 115 7.668 8.525 -2.731 1.00 0.61 C ATOM 1723 OG1 THR A 115 8.535 9.441 -3.363 1.00 0.69 O ATOM 1724 CG2 THR A 115 6.271 8.681 -3.334 1.00 0.65 C ATOM 0 H THR A 115 9.653 8.064 -1.293 1.00 0.54 H new ATOM 0 HA THR A 115 7.260 9.744 -1.039 1.00 0.54 H new ATOM 0 HB THR A 115 8.002 7.501 -2.898 1.00 0.61 H new ATOM 0 HG1 THR A 115 8.525 9.287 -4.331 1.00 0.69 H new ATOM 0 HG21 THR A 115 6.318 8.510 -4.410 1.00 0.65 H new ATOM 0 HG22 THR A 115 5.596 7.955 -2.881 1.00 0.65 H new ATOM 0 HG23 THR A 115 5.902 9.689 -3.142 1.00 0.65 H new ATOM 1732 N VAL A 116 5.653 7.995 -0.075 1.00 0.49 N ATOM 1733 CA VAL A 116 4.687 7.043 0.427 1.00 0.46 C ATOM 1734 C VAL A 116 3.510 7.070 -0.548 1.00 0.48 C ATOM 1735 O VAL A 116 2.897 8.115 -0.760 1.00 0.50 O ATOM 1736 CB VAL A 116 4.314 7.378 1.881 1.00 0.51 C ATOM 1737 CG1 VAL A 116 3.651 8.749 2.049 1.00 0.61 C ATOM 1738 CG2 VAL A 116 3.409 6.278 2.439 1.00 0.61 C ATOM 0 H VAL A 116 5.309 8.955 -0.068 1.00 0.49 H new ATOM 0 HA VAL A 116 5.079 6.027 0.472 1.00 0.46 H new ATOM 0 HB VAL A 116 5.247 7.428 2.443 1.00 0.51 H new ATOM 0 HG11 VAL A 116 3.417 8.914 3.101 1.00 0.61 H new ATOM 0 HG12 VAL A 116 4.331 9.527 1.702 1.00 0.61 H new ATOM 0 HG13 VAL A 116 2.732 8.783 1.464 1.00 0.61 H new ATOM 0 HG21 VAL A 116 3.143 6.513 3.470 1.00 0.61 H new ATOM 0 HG22 VAL A 116 2.503 6.212 1.837 1.00 0.61 H new ATOM 0 HG23 VAL A 116 3.935 5.324 2.409 1.00 0.61 H new ATOM 1748 N GLU A 117 3.232 5.929 -1.176 1.00 0.52 N ATOM 1749 CA GLU A 117 2.119 5.756 -2.089 1.00 0.55 C ATOM 1750 C GLU A 117 1.059 4.984 -1.314 1.00 0.56 C ATOM 1751 O GLU A 117 1.112 3.755 -1.254 1.00 0.55 O ATOM 1752 CB GLU A 117 2.597 4.982 -3.329 1.00 0.62 C ATOM 1753 CG GLU A 117 2.384 5.777 -4.616 1.00 0.80 C ATOM 1754 CD GLU A 117 2.641 4.948 -5.869 1.00 1.52 C ATOM 1755 OE1 GLU A 117 2.613 3.701 -5.755 1.00 2.10 O ATOM 1756 OE2 GLU A 117 2.874 5.583 -6.917 1.00 2.60 O ATOM 0 H GLU A 117 3.791 5.084 -1.057 1.00 0.52 H new ATOM 0 HA GLU A 117 1.712 6.703 -2.442 1.00 0.55 H new ATOM 0 HB2 GLU A 117 3.655 4.742 -3.222 1.00 0.62 H new ATOM 0 HB3 GLU A 117 2.061 4.035 -3.395 1.00 0.62 H new ATOM 0 HG2 GLU A 117 1.362 6.156 -4.639 1.00 0.80 H new ATOM 0 HG3 GLU A 117 3.045 6.643 -4.617 1.00 0.80 H new ATOM 1763 N TYR A 118 0.128 5.691 -0.671 1.00 0.58 N ATOM 1764 CA TYR A 118 -0.826 5.055 0.226 1.00 0.58 C ATOM 1765 C TYR A 118 -2.195 5.704 0.153 1.00 0.61 C ATOM 1766 O TYR A 118 -2.376 6.718 -0.524 1.00 0.68 O ATOM 1767 CB TYR A 118 -0.311 5.073 1.667 1.00 0.56 C ATOM 1768 CG TYR A 118 -0.521 6.363 2.436 1.00 0.53 C ATOM 1769 CD1 TYR A 118 0.135 7.546 2.054 1.00 2.01 C ATOM 1770 CD2 TYR A 118 -1.347 6.364 3.574 1.00 1.84 C ATOM 1771 CE1 TYR A 118 0.049 8.693 2.863 1.00 2.00 C ATOM 1772 CE2 TYR A 118 -1.421 7.505 4.386 1.00 1.84 C ATOM 1773 CZ TYR A 118 -0.704 8.661 4.048 1.00 0.49 C ATOM 1774 OH TYR A 118 -0.726 9.741 4.882 1.00 0.61 O ATOM 0 H TYR A 118 0.018 6.701 -0.757 1.00 0.58 H new ATOM 0 HA TYR A 118 -0.931 4.021 -0.101 1.00 0.58 H new ATOM 0 HB2 TYR A 118 -0.796 4.265 2.214 1.00 0.56 H new ATOM 0 HB3 TYR A 118 0.756 4.853 1.652 1.00 0.56 H new ATOM 0 HD1 TYR A 118 0.706 7.574 1.138 1.00 2.01 H new ATOM 0 HD2 TYR A 118 -1.925 5.486 3.823 1.00 1.84 H new ATOM 0 HE1 TYR A 118 0.562 9.598 2.573 1.00 2.00 H new ATOM 0 HE2 TYR A 118 -2.033 7.493 5.276 1.00 1.84 H new ATOM 0 HH TYR A 118 -0.606 10.561 4.359 1.00 0.61 H new ATOM 1784 N ASN A 119 -3.154 5.057 0.820 1.00 0.57 N ATOM 1785 CA ASN A 119 -4.561 5.390 0.730 1.00 0.54 C ATOM 1786 C ASN A 119 -4.962 6.222 1.955 1.00 0.52 C ATOM 1787 O ASN A 119 -5.175 5.657 3.031 1.00 0.60 O ATOM 1788 CB ASN A 119 -5.349 4.080 0.623 1.00 0.64 C ATOM 1789 CG ASN A 119 -6.679 4.300 -0.078 1.00 0.98 C ATOM 1790 OD1 ASN A 119 -7.608 4.843 0.511 1.00 1.36 O ATOM 1791 ND2 ASN A 119 -6.768 3.859 -1.336 1.00 2.25 N ATOM 0 H ASN A 119 -2.962 4.275 1.446 1.00 0.57 H new ATOM 0 HA ASN A 119 -4.779 5.994 -0.151 1.00 0.54 H new ATOM 0 HB2 ASN A 119 -4.763 3.343 0.075 1.00 0.64 H new ATOM 0 HB3 ASN A 119 -5.522 3.673 1.619 1.00 0.64 H new ATOM 0 HD21 ASN A 119 -7.640 3.967 -1.854 1.00 2.25 H new ATOM 0 HD22 ASN A 119 -5.964 3.414 -1.779 1.00 2.25 H new ATOM 1798 N PRO A 120 -5.083 7.557 1.835 1.00 0.50 N ATOM 1799 CA PRO A 120 -5.244 8.449 2.980 1.00 0.50 C ATOM 1800 C PRO A 120 -6.631 8.347 3.634 1.00 0.53 C ATOM 1801 O PRO A 120 -6.956 9.142 4.513 1.00 0.61 O ATOM 1802 CB PRO A 120 -4.979 9.854 2.430 1.00 0.54 C ATOM 1803 CG PRO A 120 -5.467 9.747 0.988 1.00 0.53 C ATOM 1804 CD PRO A 120 -5.044 8.331 0.601 1.00 0.52 C ATOM 0 HA PRO A 120 -4.554 8.181 3.780 1.00 0.50 H new ATOM 0 HB2 PRO A 120 -5.524 10.616 2.987 1.00 0.54 H new ATOM 0 HB3 PRO A 120 -3.922 10.116 2.482 1.00 0.54 H new ATOM 0 HG2 PRO A 120 -6.546 9.883 0.913 1.00 0.53 H new ATOM 0 HG3 PRO A 120 -5.006 10.498 0.347 1.00 0.53 H new ATOM 0 HD2 PRO A 120 -5.718 7.911 -0.146 1.00 0.52 H new ATOM 0 HD3 PRO A 120 -4.044 8.326 0.167 1.00 0.52 H new ATOM 1812 N LYS A 121 -7.459 7.389 3.206 1.00 0.61 N ATOM 1813 CA LYS A 121 -8.726 7.064 3.837 1.00 0.65 C ATOM 1814 C LYS A 121 -8.483 5.965 4.872 1.00 0.62 C ATOM 1815 O LYS A 121 -9.110 5.956 5.929 1.00 0.78 O ATOM 1816 CB LYS A 121 -9.749 6.731 2.739 1.00 0.73 C ATOM 1817 CG LYS A 121 -10.096 5.252 2.559 1.00 2.25 C ATOM 1818 CD LYS A 121 -11.194 4.816 3.536 1.00 3.93 C ATOM 1819 CE LYS A 121 -11.499 3.312 3.377 1.00 6.05 C ATOM 1820 NZ LYS A 121 -12.923 2.967 3.187 1.00 7.37 N ATOM 0 H LYS A 121 -7.255 6.809 2.392 1.00 0.61 H new ATOM 0 HA LYS A 121 -9.155 7.899 4.391 1.00 0.65 H new ATOM 0 HB2 LYS A 121 -10.669 7.274 2.953 1.00 0.73 H new ATOM 0 HB3 LYS A 121 -9.368 7.111 1.791 1.00 0.73 H new ATOM 0 HG2 LYS A 121 -10.426 5.075 1.535 1.00 2.25 H new ATOM 0 HG3 LYS A 121 -9.204 4.645 2.716 1.00 2.25 H new ATOM 0 HD2 LYS A 121 -10.880 5.022 4.559 1.00 3.93 H new ATOM 0 HD3 LYS A 121 -12.099 5.397 3.357 1.00 3.93 H new ATOM 0 HE2 LYS A 121 -10.935 2.933 2.525 1.00 6.05 H new ATOM 0 HE3 LYS A 121 -11.132 2.790 4.260 1.00 6.05 H new ATOM 0 HZ1 LYS A 121 -13.023 1.935 3.108 1.00 7.37 H new ATOM 0 HZ2 LYS A 121 -13.474 3.306 4.001 1.00 7.37 H new ATOM 0 HZ3 LYS A 121 -13.276 3.417 2.318 1.00 7.37 H new ATOM 1834 N GLU A 122 -7.586 5.026 4.551 1.00 0.60 N ATOM 1835 CA GLU A 122 -7.349 3.838 5.350 1.00 0.59 C ATOM 1836 C GLU A 122 -6.376 4.182 6.477 1.00 0.54 C ATOM 1837 O GLU A 122 -6.567 3.768 7.619 1.00 0.61 O ATOM 1838 CB GLU A 122 -6.806 2.721 4.441 1.00 0.66 C ATOM 1839 CG GLU A 122 -7.498 1.377 4.708 1.00 0.69 C ATOM 1840 CD GLU A 122 -8.848 1.259 4.008 1.00 1.50 C ATOM 1841 OE1 GLU A 122 -8.894 1.548 2.790 1.00 2.59 O ATOM 1842 OE2 GLU A 122 -9.828 0.912 4.700 1.00 2.52 O ATOM 0 H GLU A 122 -7.001 5.079 3.717 1.00 0.60 H new ATOM 0 HA GLU A 122 -8.275 3.482 5.802 1.00 0.59 H new ATOM 0 HB2 GLU A 122 -6.948 3.001 3.397 1.00 0.66 H new ATOM 0 HB3 GLU A 122 -5.733 2.614 4.599 1.00 0.66 H new ATOM 0 HG2 GLU A 122 -6.849 0.567 4.375 1.00 0.69 H new ATOM 0 HG3 GLU A 122 -7.638 1.253 5.782 1.00 0.69 H new ATOM 1849 N ALA A 123 -5.330 4.947 6.146 1.00 0.52 N ATOM 1850 CA ALA A 123 -4.311 5.387 7.092 1.00 0.49 C ATOM 1851 C ALA A 123 -4.092 6.894 6.914 1.00 0.46 C ATOM 1852 O ALA A 123 -4.773 7.524 6.108 1.00 0.49 O ATOM 1853 CB ALA A 123 -3.036 4.558 6.880 1.00 0.50 C ATOM 0 H ALA A 123 -5.169 5.281 5.196 1.00 0.52 H new ATOM 0 HA ALA A 123 -4.625 5.226 8.123 1.00 0.49 H new ATOM 0 HB1 ALA A 123 -2.270 4.882 7.584 1.00 0.50 H new ATOM 0 HB2 ALA A 123 -3.256 3.503 7.044 1.00 0.50 H new ATOM 0 HB3 ALA A 123 -2.675 4.699 5.861 1.00 0.50 H new ATOM 1859 N SER A 124 -3.161 7.497 7.659 1.00 0.45 N ATOM 1860 CA SER A 124 -2.846 8.924 7.595 1.00 0.43 C ATOM 1861 C SER A 124 -1.465 9.144 8.208 1.00 0.41 C ATOM 1862 O SER A 124 -0.936 8.239 8.842 1.00 0.43 O ATOM 1863 CB SER A 124 -3.915 9.729 8.347 1.00 0.49 C ATOM 1864 OG SER A 124 -5.096 9.843 7.578 1.00 2.17 O ATOM 0 H SER A 124 -2.593 6.993 8.339 1.00 0.45 H new ATOM 0 HA SER A 124 -2.838 9.264 6.559 1.00 0.43 H new ATOM 0 HB2 SER A 124 -4.140 9.243 9.297 1.00 0.49 H new ATOM 0 HB3 SER A 124 -3.531 10.722 8.580 1.00 0.49 H new ATOM 0 HG SER A 124 -5.124 9.124 6.912 1.00 2.17 H new ATOM 1870 N VAL A 125 -0.896 10.343 8.054 1.00 0.41 N ATOM 1871 CA VAL A 125 0.382 10.764 8.624 1.00 0.46 C ATOM 1872 C VAL A 125 0.667 10.163 10.004 1.00 0.39 C ATOM 1873 O VAL A 125 1.769 9.683 10.253 1.00 0.38 O ATOM 1874 CB VAL A 125 0.441 12.303 8.697 1.00 0.71 C ATOM 1875 CG1 VAL A 125 1.855 12.741 9.088 1.00 1.73 C ATOM 1876 CG2 VAL A 125 0.001 12.958 7.380 1.00 1.16 C ATOM 0 H VAL A 125 -1.336 11.079 7.502 1.00 0.41 H new ATOM 0 HA VAL A 125 1.158 10.385 7.958 1.00 0.46 H new ATOM 0 HB VAL A 125 -0.262 12.638 9.460 1.00 0.71 H new ATOM 0 HG11 VAL A 125 1.898 13.829 9.140 1.00 1.73 H new ATOM 0 HG12 VAL A 125 2.110 12.321 10.061 1.00 1.73 H new ATOM 0 HG13 VAL A 125 2.565 12.385 8.342 1.00 1.73 H new ATOM 0 HG21 VAL A 125 0.058 14.042 7.476 1.00 1.16 H new ATOM 0 HG22 VAL A 125 0.657 12.630 6.574 1.00 1.16 H new ATOM 0 HG23 VAL A 125 -1.025 12.667 7.154 1.00 1.16 H new ATOM 1886 N SER A 126 -0.301 10.205 10.919 1.00 0.46 N ATOM 1887 CA SER A 126 -0.163 9.645 12.255 1.00 0.55 C ATOM 1888 C SER A 126 0.359 8.206 12.226 1.00 0.52 C ATOM 1889 O SER A 126 1.256 7.862 12.992 1.00 0.57 O ATOM 1890 CB SER A 126 -1.529 9.719 12.942 1.00 0.73 C ATOM 1891 OG SER A 126 -2.085 11.001 12.704 1.00 0.81 O ATOM 0 H SER A 126 -1.210 10.634 10.748 1.00 0.46 H new ATOM 0 HA SER A 126 0.574 10.223 12.812 1.00 0.55 H new ATOM 0 HB2 SER A 126 -2.189 8.942 12.556 1.00 0.73 H new ATOM 0 HB3 SER A 126 -1.424 9.545 14.013 1.00 0.73 H new ATOM 0 HG SER A 126 -2.962 11.063 13.137 1.00 0.81 H new ATOM 1897 N ASP A 127 -0.189 7.392 11.323 1.00 0.50 N ATOM 1898 CA ASP A 127 0.181 6.002 11.112 1.00 0.62 C ATOM 1899 C ASP A 127 1.658 5.918 10.727 1.00 0.58 C ATOM 1900 O ASP A 127 2.430 5.191 11.340 1.00 0.66 O ATOM 1901 CB ASP A 127 -0.719 5.428 10.011 1.00 0.71 C ATOM 1902 CG ASP A 127 -0.486 3.946 9.805 1.00 1.03 C ATOM 1903 OD1 ASP A 127 0.564 3.632 9.208 1.00 2.22 O ATOM 1904 OD2 ASP A 127 -1.375 3.170 10.209 1.00 1.92 O ATOM 0 H ASP A 127 -0.932 7.701 10.696 1.00 0.50 H new ATOM 0 HA ASP A 127 0.043 5.420 12.023 1.00 0.62 H new ATOM 0 HB2 ASP A 127 -1.764 5.598 10.271 1.00 0.71 H new ATOM 0 HB3 ASP A 127 -0.532 5.958 9.077 1.00 0.71 H new ATOM 1909 N LEU A 128 2.064 6.735 9.751 1.00 0.50 N ATOM 1910 CA LEU A 128 3.439 6.799 9.269 1.00 0.51 C ATOM 1911 C LEU A 128 4.387 7.169 10.406 1.00 0.41 C ATOM 1912 O LEU A 128 5.404 6.510 10.639 1.00 0.41 O ATOM 1913 CB LEU A 128 3.549 7.817 8.127 1.00 0.62 C ATOM 1914 CG LEU A 128 2.951 7.265 6.829 1.00 0.88 C ATOM 1915 CD1 LEU A 128 2.685 8.420 5.868 1.00 0.94 C ATOM 1916 CD2 LEU A 128 3.913 6.278 6.155 1.00 1.52 C ATOM 0 H LEU A 128 1.435 7.378 9.269 1.00 0.50 H new ATOM 0 HA LEU A 128 3.724 5.817 8.892 1.00 0.51 H new ATOM 0 HB2 LEU A 128 3.033 8.736 8.405 1.00 0.62 H new ATOM 0 HB3 LEU A 128 4.596 8.075 7.967 1.00 0.62 H new ATOM 0 HG LEU A 128 2.025 6.744 7.073 1.00 0.88 H new ATOM 0 HD11 LEU A 128 2.259 8.033 4.942 1.00 0.94 H new ATOM 0 HD12 LEU A 128 1.985 9.119 6.325 1.00 0.94 H new ATOM 0 HD13 LEU A 128 3.621 8.934 5.649 1.00 0.94 H new ATOM 0 HD21 LEU A 128 3.463 5.902 5.236 1.00 1.52 H new ATOM 0 HD22 LEU A 128 4.849 6.785 5.920 1.00 1.52 H new ATOM 0 HD23 LEU A 128 4.111 5.445 6.830 1.00 1.52 H new ATOM 1928 N LYS A 129 4.043 8.246 11.112 1.00 0.40 N ATOM 1929 CA LYS A 129 4.800 8.703 12.259 1.00 0.43 C ATOM 1930 C LYS A 129 4.920 7.577 13.287 1.00 0.48 C ATOM 1931 O LYS A 129 6.030 7.300 13.737 1.00 0.53 O ATOM 1932 CB LYS A 129 4.184 9.998 12.815 1.00 0.50 C ATOM 1933 CG LYS A 129 4.339 11.132 11.782 1.00 0.53 C ATOM 1934 CD LYS A 129 4.582 12.534 12.363 1.00 0.60 C ATOM 1935 CE LYS A 129 3.354 13.245 12.943 1.00 2.19 C ATOM 1936 NZ LYS A 129 2.693 12.471 14.013 1.00 3.10 N ATOM 0 H LYS A 129 3.229 8.822 10.898 1.00 0.40 H new ATOM 0 HA LYS A 129 5.819 8.956 11.967 1.00 0.43 H new ATOM 0 HB2 LYS A 129 3.130 9.842 13.043 1.00 0.50 H new ATOM 0 HB3 LYS A 129 4.674 10.274 13.749 1.00 0.50 H new ATOM 0 HG2 LYS A 129 5.169 10.884 11.120 1.00 0.53 H new ATOM 0 HG3 LYS A 129 3.439 11.164 11.168 1.00 0.53 H new ATOM 0 HD2 LYS A 129 5.335 12.455 13.147 1.00 0.60 H new ATOM 0 HD3 LYS A 129 5.004 13.162 11.578 1.00 0.60 H new ATOM 0 HE2 LYS A 129 3.655 14.216 13.337 1.00 2.19 H new ATOM 0 HE3 LYS A 129 2.638 13.434 12.143 1.00 2.19 H new ATOM 0 HZ1 LYS A 129 2.066 13.097 14.558 1.00 3.10 H new ATOM 0 HZ2 LYS A 129 2.134 11.703 13.591 1.00 3.10 H new ATOM 0 HZ3 LYS A 129 3.413 12.067 14.645 1.00 3.10 H new ATOM 1950 N GLU A 130 3.819 6.898 13.629 1.00 0.56 N ATOM 1951 CA GLU A 130 3.899 5.809 14.584 1.00 0.67 C ATOM 1952 C GLU A 130 4.774 4.677 14.035 1.00 0.71 C ATOM 1953 O GLU A 130 5.625 4.157 14.744 1.00 0.81 O ATOM 1954 CB GLU A 130 2.514 5.301 15.018 1.00 0.73 C ATOM 1955 CG GLU A 130 2.628 4.832 16.479 1.00 1.51 C ATOM 1956 CD GLU A 130 1.696 3.691 16.860 1.00 1.97 C ATOM 1957 OE1 GLU A 130 0.608 3.601 16.258 1.00 2.86 O ATOM 1958 OE2 GLU A 130 2.104 2.924 17.764 1.00 2.89 O ATOM 0 H GLU A 130 2.885 7.084 13.263 1.00 0.56 H new ATOM 0 HA GLU A 130 4.371 6.200 15.485 1.00 0.67 H new ATOM 0 HB2 GLU A 130 1.770 6.092 14.927 1.00 0.73 H new ATOM 0 HB3 GLU A 130 2.188 4.482 14.377 1.00 0.73 H new ATOM 0 HG2 GLU A 130 3.656 4.520 16.666 1.00 1.51 H new ATOM 0 HG3 GLU A 130 2.428 5.680 17.134 1.00 1.51 H new ATOM 1965 N ALA A 131 4.614 4.289 12.770 1.00 0.67 N ATOM 1966 CA ALA A 131 5.413 3.223 12.183 1.00 0.71 C ATOM 1967 C ALA A 131 6.899 3.509 12.411 1.00 0.59 C ATOM 1968 O ALA A 131 7.626 2.699 12.986 1.00 0.62 O ATOM 1969 CB ALA A 131 5.078 3.074 10.695 1.00 0.79 C ATOM 0 H ALA A 131 3.933 4.702 12.132 1.00 0.67 H new ATOM 0 HA ALA A 131 5.178 2.275 12.666 1.00 0.71 H new ATOM 0 HB1 ALA A 131 5.681 2.274 10.265 1.00 0.79 H new ATOM 0 HB2 ALA A 131 4.021 2.833 10.582 1.00 0.79 H new ATOM 0 HB3 ALA A 131 5.294 4.009 10.178 1.00 0.79 H new ATOM 1975 N VAL A 132 7.348 4.698 12.009 1.00 0.47 N ATOM 1976 CA VAL A 132 8.725 5.101 12.194 1.00 0.42 C ATOM 1977 C VAL A 132 9.085 5.253 13.674 1.00 0.49 C ATOM 1978 O VAL A 132 10.238 5.011 14.041 1.00 0.52 O ATOM 1979 CB VAL A 132 9.006 6.343 11.344 1.00 0.50 C ATOM 1980 CG1 VAL A 132 10.413 6.868 11.637 1.00 1.55 C ATOM 1981 CG2 VAL A 132 8.873 5.938 9.868 1.00 1.10 C ATOM 0 H VAL A 132 6.765 5.398 11.550 1.00 0.47 H new ATOM 0 HA VAL A 132 9.390 4.313 11.840 1.00 0.42 H new ATOM 0 HB VAL A 132 8.299 7.139 11.577 1.00 0.50 H new ATOM 0 HG11 VAL A 132 10.606 7.752 11.029 1.00 1.55 H new ATOM 0 HG12 VAL A 132 10.491 7.130 12.692 1.00 1.55 H new ATOM 0 HG13 VAL A 132 11.146 6.097 11.399 1.00 1.55 H new ATOM 0 HG21 VAL A 132 9.068 6.803 9.234 1.00 1.10 H new ATOM 0 HG22 VAL A 132 9.593 5.152 9.640 1.00 1.10 H new ATOM 0 HG23 VAL A 132 7.864 5.571 9.681 1.00 1.10 H new ATOM 1991 N ASP A 133 8.120 5.606 14.529 1.00 0.64 N ATOM 1992 CA ASP A 133 8.336 5.589 15.968 1.00 0.89 C ATOM 1993 C ASP A 133 8.759 4.194 16.418 1.00 0.91 C ATOM 1994 O ASP A 133 9.799 4.020 17.046 1.00 0.97 O ATOM 1995 CB ASP A 133 7.087 6.028 16.740 1.00 1.16 C ATOM 1996 CG ASP A 133 7.359 6.119 18.231 1.00 2.68 C ATOM 1997 OD1 ASP A 133 7.862 7.181 18.653 1.00 2.94 O ATOM 1998 OD2 ASP A 133 7.037 5.124 18.920 1.00 4.06 O ATOM 0 H ASP A 133 7.187 5.905 14.245 1.00 0.64 H new ATOM 0 HA ASP A 133 9.130 6.302 16.188 1.00 0.89 H new ATOM 0 HB2 ASP A 133 6.751 6.997 16.370 1.00 1.16 H new ATOM 0 HB3 ASP A 133 6.278 5.320 16.559 1.00 1.16 H new ATOM 2003 N LYS A 134 7.969 3.189 16.031 1.00 0.89 N ATOM 2004 CA LYS A 134 8.265 1.792 16.306 1.00 0.97 C ATOM 2005 C LYS A 134 9.640 1.398 15.742 1.00 0.84 C ATOM 2006 O LYS A 134 10.403 0.726 16.433 1.00 0.88 O ATOM 2007 CB LYS A 134 7.153 0.879 15.768 1.00 1.06 C ATOM 2008 CG LYS A 134 6.026 0.557 16.766 1.00 1.24 C ATOM 2009 CD LYS A 134 5.083 1.746 16.995 1.00 1.39 C ATOM 2010 CE LYS A 134 5.239 2.448 18.352 1.00 2.42 C ATOM 2011 NZ LYS A 134 4.120 2.116 19.253 1.00 2.61 N ATOM 0 H LYS A 134 7.101 3.329 15.514 1.00 0.89 H new ATOM 0 HA LYS A 134 8.305 1.661 17.387 1.00 0.97 H new ATOM 0 HB2 LYS A 134 6.714 1.349 14.888 1.00 1.06 H new ATOM 0 HB3 LYS A 134 7.602 -0.058 15.438 1.00 1.06 H new ATOM 0 HG2 LYS A 134 5.451 -0.292 16.397 1.00 1.24 H new ATOM 0 HG3 LYS A 134 6.464 0.256 17.718 1.00 1.24 H new ATOM 0 HD2 LYS A 134 5.247 2.478 16.204 1.00 1.39 H new ATOM 0 HD3 LYS A 134 4.054 1.398 16.899 1.00 1.39 H new ATOM 0 HE2 LYS A 134 6.181 2.151 18.812 1.00 2.42 H new ATOM 0 HE3 LYS A 134 5.283 3.527 18.204 1.00 2.42 H new ATOM 0 HZ1 LYS A 134 4.076 2.814 20.023 1.00 2.61 H new ATOM 0 HZ2 LYS A 134 3.228 2.133 18.719 1.00 2.61 H new ATOM 0 HZ3 LYS A 134 4.266 1.167 19.653 1.00 2.61 H new ATOM 2025 N LEU A 135 9.973 1.786 14.501 1.00 0.75 N ATOM 2026 CA LEU A 135 11.324 1.545 13.980 1.00 0.65 C ATOM 2027 C LEU A 135 12.387 2.238 14.845 1.00 0.72 C ATOM 2028 O LEU A 135 13.479 1.700 15.023 1.00 0.90 O ATOM 2029 CB LEU A 135 11.492 2.017 12.525 1.00 0.50 C ATOM 2030 CG LEU A 135 11.072 1.050 11.406 1.00 0.60 C ATOM 2031 CD1 LEU A 135 11.864 -0.264 11.419 1.00 0.56 C ATOM 2032 CD2 LEU A 135 9.569 0.802 11.395 1.00 0.99 C ATOM 0 H LEU A 135 9.341 2.257 13.854 1.00 0.75 H new ATOM 0 HA LEU A 135 11.463 0.464 14.012 1.00 0.65 H new ATOM 0 HB2 LEU A 135 10.922 2.938 12.403 1.00 0.50 H new ATOM 0 HB3 LEU A 135 12.542 2.269 12.374 1.00 0.50 H new ATOM 0 HG LEU A 135 11.325 1.550 10.471 1.00 0.60 H new ATOM 0 HD11 LEU A 135 11.521 -0.904 10.606 1.00 0.56 H new ATOM 0 HD12 LEU A 135 12.925 -0.051 11.290 1.00 0.56 H new ATOM 0 HD13 LEU A 135 11.709 -0.773 12.370 1.00 0.56 H new ATOM 0 HD21 LEU A 135 9.320 0.113 10.588 1.00 0.99 H new ATOM 0 HD22 LEU A 135 9.265 0.370 12.348 1.00 0.99 H new ATOM 0 HD23 LEU A 135 9.046 1.746 11.241 1.00 0.99 H new ATOM 2044 N GLY A 136 12.087 3.439 15.340 1.00 0.67 N ATOM 2045 CA GLY A 136 12.951 4.211 16.218 1.00 0.74 C ATOM 2046 C GLY A 136 13.745 5.267 15.451 1.00 0.72 C ATOM 2047 O GLY A 136 14.925 5.461 15.735 1.00 0.87 O ATOM 0 H GLY A 136 11.207 3.912 15.131 1.00 0.67 H new ATOM 0 HA2 GLY A 136 12.348 4.696 16.985 1.00 0.74 H new ATOM 0 HA3 GLY A 136 13.640 3.540 16.731 1.00 0.74 H new ATOM 2051 N TYR A 137 13.102 5.967 14.509 1.00 0.61 N ATOM 2052 CA TYR A 137 13.660 7.164 13.869 1.00 0.67 C ATOM 2053 C TYR A 137 12.622 8.282 13.987 1.00 0.73 C ATOM 2054 O TYR A 137 11.781 8.223 14.883 1.00 0.92 O ATOM 2055 CB TYR A 137 14.070 6.869 12.415 1.00 0.59 C ATOM 2056 CG TYR A 137 14.802 5.553 12.232 1.00 0.55 C ATOM 2057 CD1 TYR A 137 16.009 5.327 12.916 1.00 1.78 C ATOM 2058 CD2 TYR A 137 14.217 4.510 11.490 1.00 1.78 C ATOM 2059 CE1 TYR A 137 16.531 4.026 13.004 1.00 1.70 C ATOM 2060 CE2 TYR A 137 14.801 3.231 11.497 1.00 1.92 C ATOM 2061 CZ TYR A 137 15.880 2.966 12.353 1.00 0.77 C ATOM 2062 OH TYR A 137 16.334 1.687 12.495 1.00 1.02 O ATOM 0 H TYR A 137 12.174 5.717 14.167 1.00 0.61 H new ATOM 0 HA TYR A 137 14.575 7.484 14.367 1.00 0.67 H new ATOM 0 HB2 TYR A 137 13.177 6.865 11.791 1.00 0.59 H new ATOM 0 HB3 TYR A 137 14.706 7.679 12.057 1.00 0.59 H new ATOM 0 HD1 TYR A 137 16.534 6.153 13.373 1.00 1.78 H new ATOM 0 HD2 TYR A 137 13.321 4.692 10.916 1.00 1.78 H new ATOM 0 HE1 TYR A 137 17.431 3.841 13.571 1.00 1.70 H new ATOM 0 HE2 TYR A 137 14.421 2.457 10.847 1.00 1.92 H new ATOM 0 HH TYR A 137 17.179 1.584 12.009 1.00 1.02 H new ATOM 2072 N LYS A 138 12.614 9.274 13.088 1.00 0.68 N ATOM 2073 CA LYS A 138 11.493 10.196 13.006 1.00 0.75 C ATOM 2074 C LYS A 138 11.240 10.526 11.541 1.00 0.70 C ATOM 2075 O LYS A 138 12.165 10.495 10.724 1.00 0.77 O ATOM 2076 CB LYS A 138 11.745 11.438 13.873 1.00 0.86 C ATOM 2077 CG LYS A 138 12.693 12.428 13.186 1.00 0.87 C ATOM 2078 CD LYS A 138 11.936 13.517 12.403 1.00 2.69 C ATOM 2079 CE LYS A 138 11.747 14.785 13.245 1.00 3.23 C ATOM 2080 NZ LYS A 138 10.941 14.543 14.457 1.00 4.52 N ATOM 0 H LYS A 138 13.364 9.451 12.419 1.00 0.68 H new ATOM 0 HA LYS A 138 10.590 9.736 13.407 1.00 0.75 H new ATOM 0 HB2 LYS A 138 10.797 11.931 14.086 1.00 0.86 H new ATOM 0 HB3 LYS A 138 12.168 11.134 14.830 1.00 0.86 H new ATOM 0 HG2 LYS A 138 13.329 12.899 13.936 1.00 0.87 H new ATOM 0 HG3 LYS A 138 13.350 11.886 12.506 1.00 0.87 H new ATOM 0 HD2 LYS A 138 12.485 13.761 11.494 1.00 2.69 H new ATOM 0 HD3 LYS A 138 10.963 13.135 12.095 1.00 2.69 H new ATOM 0 HE2 LYS A 138 12.723 15.175 13.534 1.00 3.23 H new ATOM 0 HE3 LYS A 138 11.264 15.551 12.639 1.00 3.23 H new ATOM 0 HZ1 LYS A 138 10.842 15.430 14.991 1.00 4.52 H new ATOM 0 HZ2 LYS A 138 9.999 14.197 14.184 1.00 4.52 H new ATOM 0 HZ3 LYS A 138 11.413 13.832 15.051 1.00 4.52 H new ATOM 2094 N LEU A 139 9.984 10.852 11.237 1.00 0.70 N ATOM 2095 CA LEU A 139 9.498 11.105 9.894 1.00 0.72 C ATOM 2096 C LEU A 139 8.918 12.518 9.840 1.00 0.72 C ATOM 2097 O LEU A 139 8.357 12.998 10.827 1.00 0.80 O ATOM 2098 CB LEU A 139 8.459 10.010 9.557 1.00 0.98 C ATOM 2099 CG LEU A 139 8.688 9.211 8.264 1.00 0.41 C ATOM 2100 CD1 LEU A 139 8.116 9.937 7.057 1.00 1.80 C ATOM 2101 CD2 LEU A 139 10.155 8.870 7.989 1.00 1.43 C ATOM 0 H LEU A 139 9.258 10.949 11.947 1.00 0.70 H new ATOM 0 HA LEU A 139 10.292 11.058 9.148 1.00 0.72 H new ATOM 0 HB2 LEU A 139 8.425 9.307 10.389 1.00 0.98 H new ATOM 0 HB3 LEU A 139 7.478 10.480 9.496 1.00 0.98 H new ATOM 0 HG LEU A 139 8.162 8.270 8.425 1.00 0.41 H new ATOM 0 HD11 LEU A 139 8.294 9.346 6.159 1.00 1.80 H new ATOM 0 HD12 LEU A 139 7.044 10.078 7.192 1.00 1.80 H new ATOM 0 HD13 LEU A 139 8.599 10.908 6.954 1.00 1.80 H new ATOM 0 HD21 LEU A 139 10.229 8.306 7.059 1.00 1.43 H new ATOM 0 HD22 LEU A 139 10.732 9.790 7.903 1.00 1.43 H new ATOM 0 HD23 LEU A 139 10.549 8.270 8.809 1.00 1.43 H new ATOM 2113 N LYS A 140 9.099 13.191 8.704 1.00 0.71 N ATOM 2114 CA LYS A 140 8.673 14.556 8.419 1.00 0.71 C ATOM 2115 C LYS A 140 7.967 14.551 7.068 1.00 0.64 C ATOM 2116 O LYS A 140 8.171 13.640 6.274 1.00 0.55 O ATOM 2117 CB LYS A 140 9.912 15.454 8.309 1.00 0.72 C ATOM 2118 CG LYS A 140 10.409 16.019 9.638 1.00 0.87 C ATOM 2119 CD LYS A 140 9.635 17.295 10.013 1.00 1.72 C ATOM 2120 CE LYS A 140 10.275 18.087 11.165 1.00 2.05 C ATOM 2121 NZ LYS A 140 11.698 18.403 10.913 1.00 2.19 N ATOM 0 H LYS A 140 9.578 12.768 7.909 1.00 0.71 H new ATOM 0 HA LYS A 140 8.015 14.922 9.207 1.00 0.71 H new ATOM 0 HB2 LYS A 140 10.718 14.883 7.848 1.00 0.72 H new ATOM 0 HB3 LYS A 140 9.685 16.283 7.639 1.00 0.72 H new ATOM 0 HG2 LYS A 140 10.290 15.272 10.423 1.00 0.87 H new ATOM 0 HG3 LYS A 140 11.474 16.241 9.568 1.00 0.87 H new ATOM 0 HD2 LYS A 140 9.565 17.938 9.136 1.00 1.72 H new ATOM 0 HD3 LYS A 140 8.617 17.024 10.291 1.00 1.72 H new ATOM 0 HE2 LYS A 140 9.722 19.014 11.316 1.00 2.05 H new ATOM 0 HE3 LYS A 140 10.192 17.512 12.087 1.00 2.05 H new ATOM 0 HZ1 LYS A 140 11.910 19.357 11.269 1.00 2.19 H new ATOM 0 HZ2 LYS A 140 12.299 17.709 11.401 1.00 2.19 H new ATOM 0 HZ3 LYS A 140 11.886 18.366 9.891 1.00 2.19 H new ATOM 2135 N LEU A 141 7.164 15.574 6.785 1.00 0.72 N ATOM 2136 CA LEU A 141 6.554 15.758 5.480 1.00 0.59 C ATOM 2137 C LEU A 141 7.443 16.667 4.628 1.00 0.65 C ATOM 2138 O LEU A 141 8.115 17.548 5.170 1.00 0.89 O ATOM 2139 CB LEU A 141 5.166 16.381 5.640 1.00 0.64 C ATOM 2140 CG LEU A 141 4.302 15.656 6.687 1.00 0.86 C ATOM 2141 CD1 LEU A 141 4.348 16.335 8.065 1.00 1.16 C ATOM 2142 CD2 LEU A 141 2.849 15.636 6.217 1.00 1.73 C ATOM 0 H LEU A 141 6.920 16.299 7.460 1.00 0.72 H new ATOM 0 HA LEU A 141 6.451 14.792 4.987 1.00 0.59 H new ATOM 0 HB2 LEU A 141 5.274 17.427 5.926 1.00 0.64 H new ATOM 0 HB3 LEU A 141 4.653 16.365 4.678 1.00 0.64 H new ATOM 0 HG LEU A 141 4.705 14.648 6.789 1.00 0.86 H new ATOM 0 HD11 LEU A 141 3.721 15.782 8.764 1.00 1.16 H new ATOM 0 HD12 LEU A 141 5.375 16.348 8.430 1.00 1.16 H new ATOM 0 HD13 LEU A 141 3.981 17.358 7.979 1.00 1.16 H new ATOM 0 HD21 LEU A 141 2.234 15.123 6.957 1.00 1.73 H new ATOM 0 HD22 LEU A 141 2.492 16.659 6.095 1.00 1.73 H new ATOM 0 HD23 LEU A 141 2.782 15.112 5.264 1.00 1.73 H new ATOM 2154 N LYS A 142 7.401 16.533 3.299 1.00 0.56 N ATOM 2155 CA LYS A 142 8.113 17.465 2.429 1.00 0.72 C ATOM 2156 C LYS A 142 7.298 18.758 2.325 1.00 1.09 C ATOM 2157 O LYS A 142 6.588 19.002 1.352 1.00 1.31 O ATOM 2158 CB LYS A 142 8.345 16.846 1.042 1.00 0.68 C ATOM 2159 CG LYS A 142 9.426 15.752 1.061 1.00 1.00 C ATOM 2160 CD LYS A 142 10.543 16.061 0.056 1.00 1.02 C ATOM 2161 CE LYS A 142 11.449 17.191 0.576 1.00 1.92 C ATOM 2162 NZ LYS A 142 12.354 17.702 -0.472 1.00 2.82 N ATOM 0 H LYS A 142 6.889 15.799 2.811 1.00 0.56 H new ATOM 0 HA LYS A 142 9.093 17.687 2.852 1.00 0.72 H new ATOM 0 HB2 LYS A 142 7.410 16.423 0.675 1.00 0.68 H new ATOM 0 HB3 LYS A 142 8.637 17.629 0.342 1.00 0.68 H new ATOM 0 HG2 LYS A 142 9.847 15.670 2.063 1.00 1.00 H new ATOM 0 HG3 LYS A 142 8.976 14.788 0.824 1.00 1.00 H new ATOM 0 HD2 LYS A 142 11.137 15.165 -0.121 1.00 1.02 H new ATOM 0 HD3 LYS A 142 10.108 16.349 -0.901 1.00 1.02 H new ATOM 0 HE2 LYS A 142 10.831 18.007 0.951 1.00 1.92 H new ATOM 0 HE3 LYS A 142 12.038 16.825 1.417 1.00 1.92 H new ATOM 0 HZ1 LYS A 142 12.946 18.461 -0.079 1.00 2.82 H new ATOM 0 HZ2 LYS A 142 12.962 16.930 -0.812 1.00 2.82 H new ATOM 0 HZ3 LYS A 142 11.792 18.075 -1.264 1.00 2.82 H new ATOM 2176 N GLY A 143 7.405 19.604 3.352 1.00 1.40 N ATOM 2177 CA GLY A 143 6.766 20.908 3.412 1.00 1.89 C ATOM 2178 C GLY A 143 5.287 20.774 3.761 1.00 1.96 C ATOM 2179 O GLY A 143 4.838 21.313 4.768 1.00 2.47 O ATOM 0 H GLY A 143 7.955 19.389 4.184 1.00 1.40 H new ATOM 0 HA2 GLY A 143 7.265 21.528 4.157 1.00 1.89 H new ATOM 0 HA3 GLY A 143 6.873 21.414 2.453 1.00 1.89 H new ATOM 2183 N GLU A 144 4.536 20.074 2.906 1.00 1.67 N ATOM 2184 CA GLU A 144 3.097 19.877 3.015 1.00 1.86 C ATOM 2185 C GLU A 144 2.353 21.205 3.206 1.00 2.41 C ATOM 2186 O GLU A 144 1.376 21.301 3.944 1.00 2.66 O ATOM 2187 CB GLU A 144 2.786 18.828 4.086 1.00 1.94 C ATOM 2188 CG GLU A 144 1.453 18.124 3.800 1.00 2.69 C ATOM 2189 CD GLU A 144 1.493 17.231 2.564 1.00 3.02 C ATOM 2190 OE1 GLU A 144 2.549 16.597 2.350 1.00 3.53 O ATOM 2191 OE2 GLU A 144 0.464 17.200 1.857 1.00 4.13 O ATOM 0 H GLU A 144 4.935 19.613 2.088 1.00 1.67 H new ATOM 0 HA GLU A 144 2.720 19.480 2.073 1.00 1.86 H new ATOM 0 HB2 GLU A 144 3.589 18.092 4.122 1.00 1.94 H new ATOM 0 HB3 GLU A 144 2.746 19.305 5.065 1.00 1.94 H new ATOM 0 HG2 GLU A 144 1.175 17.522 4.665 1.00 2.69 H new ATOM 0 HG3 GLU A 144 0.674 18.875 3.671 1.00 2.69 H new ATOM 2198 N GLN A 145 2.835 22.232 2.503 1.00 2.97 N ATOM 2199 CA GLN A 145 2.253 23.554 2.398 1.00 3.78 C ATOM 2200 C GLN A 145 2.764 24.185 1.103 1.00 4.10 C ATOM 2201 O GLN A 145 1.977 24.567 0.240 1.00 4.82 O ATOM 2202 CB GLN A 145 2.651 24.420 3.603 1.00 4.46 C ATOM 2203 CG GLN A 145 1.937 24.027 4.903 1.00 4.77 C ATOM 2204 CD GLN A 145 1.821 25.204 5.866 1.00 5.76 C ATOM 2205 OE1 GLN A 145 2.759 25.530 6.586 1.00 6.57 O ATOM 2206 NE2 GLN A 145 0.657 25.849 5.900 1.00 6.18 N ATOM 0 H GLN A 145 3.695 22.148 1.962 1.00 2.97 H new ATOM 0 HA GLN A 145 1.165 23.484 2.388 1.00 3.78 H new ATOM 0 HB2 GLN A 145 3.728 24.346 3.753 1.00 4.46 H new ATOM 0 HB3 GLN A 145 2.431 25.464 3.378 1.00 4.46 H new ATOM 0 HG2 GLN A 145 0.942 23.649 4.670 1.00 4.77 H new ATOM 0 HG3 GLN A 145 2.482 23.215 5.385 1.00 4.77 H new ATOM 0 HE21 GLN A 145 -0.106 25.556 5.290 1.00 6.18 H new ATOM 0 HE22 GLN A 145 0.528 26.636 6.536 1.00 6.18 H new ATOM 2215 N ASP A 146 4.096 24.235 0.969 1.00 3.78 N ATOM 2216 CA ASP A 146 4.796 25.112 0.027 1.00 4.35 C ATOM 2217 C ASP A 146 5.790 24.326 -0.832 1.00 4.45 C ATOM 2218 O ASP A 146 6.496 24.897 -1.657 1.00 5.25 O ATOM 2219 CB ASP A 146 5.526 26.223 0.806 1.00 5.19 C ATOM 2220 CG ASP A 146 4.631 27.387 1.220 1.00 6.22 C ATOM 2221 OD1 ASP A 146 3.469 27.123 1.595 1.00 6.72 O ATOM 2222 OD2 ASP A 146 5.141 28.527 1.180 1.00 7.09 O ATOM 0 H ASP A 146 4.727 23.656 1.523 1.00 3.78 H new ATOM 0 HA ASP A 146 4.060 25.558 -0.643 1.00 4.35 H new ATOM 0 HB2 ASP A 146 5.976 25.790 1.699 1.00 5.19 H new ATOM 0 HB3 ASP A 146 6.341 26.606 0.192 1.00 5.19 H new ATOM 2227 N SER A 147 5.854 23.007 -0.629 1.00 4.46 N ATOM 2228 CA SER A 147 6.711 22.093 -1.375 1.00 5.82 C ATOM 2229 C SER A 147 5.877 20.882 -1.821 1.00 6.32 C ATOM 2230 O SER A 147 6.415 19.805 -2.070 1.00 7.64 O ATOM 2231 CB SER A 147 7.913 21.714 -0.489 1.00 6.73 C ATOM 2232 OG SER A 147 9.085 21.422 -1.228 1.00 7.87 O ATOM 0 H SER A 147 5.293 22.536 0.081 1.00 4.46 H new ATOM 0 HA SER A 147 7.108 22.555 -2.279 1.00 5.82 H new ATOM 0 HB2 SER A 147 8.121 22.533 0.199 1.00 6.73 H new ATOM 0 HB3 SER A 147 7.649 20.848 0.118 1.00 6.73 H new ATOM 0 HG SER A 147 9.811 21.191 -0.612 1.00 7.87 H new ATOM 2238 N ILE A 148 4.551 21.055 -1.922 1.00 5.71 N ATOM 2239 CA ILE A 148 3.647 20.024 -2.435 1.00 6.57 C ATOM 2240 C ILE A 148 3.873 19.854 -3.947 1.00 7.85 C ATOM 2241 O ILE A 148 3.080 20.320 -4.763 1.00 8.09 O ATOM 2242 CB ILE A 148 2.174 20.338 -2.086 1.00 6.55 C ATOM 2243 CG1 ILE A 148 2.011 20.571 -0.572 1.00 6.13 C ATOM 2244 CG2 ILE A 148 1.266 19.165 -2.507 1.00 7.60 C ATOM 2245 CD1 ILE A 148 0.595 20.994 -0.168 1.00 6.96 C ATOM 0 H ILE A 148 4.078 21.916 -1.649 1.00 5.71 H new ATOM 0 HA ILE A 148 3.872 19.074 -1.950 1.00 6.57 H new ATOM 0 HB ILE A 148 1.887 21.241 -2.624 1.00 6.55 H new ATOM 0 HG12 ILE A 148 2.274 19.656 -0.041 1.00 6.13 H new ATOM 0 HG13 ILE A 148 2.716 21.338 -0.252 1.00 6.13 H new ATOM 0 HG21 ILE A 148 0.231 19.398 -2.256 1.00 7.60 H new ATOM 0 HG22 ILE A 148 1.352 19.006 -3.582 1.00 7.60 H new ATOM 0 HG23 ILE A 148 1.572 18.261 -1.981 1.00 7.60 H new ATOM 0 HD11 ILE A 148 0.553 21.141 0.911 1.00 6.96 H new ATOM 0 HD12 ILE A 148 0.336 21.926 -0.671 1.00 6.96 H new ATOM 0 HD13 ILE A 148 -0.113 20.217 -0.456 1.00 6.96 H new ATOM 2257 N GLU A 149 4.967 19.183 -4.313 1.00 9.13 N ATOM 2258 CA GLU A 149 5.307 18.831 -5.685 1.00 10.76 C ATOM 2259 C GLU A 149 4.126 18.137 -6.383 1.00 11.64 C ATOM 2260 O GLU A 149 3.909 16.941 -6.187 1.00 12.17 O ATOM 2261 CB GLU A 149 6.569 17.943 -5.689 1.00 12.02 C ATOM 2262 CG GLU A 149 7.802 18.700 -6.202 1.00 13.01 C ATOM 2263 CD GLU A 149 7.703 19.055 -7.685 1.00 14.13 C ATOM 2264 OE1 GLU A 149 6.895 18.403 -8.383 1.00 14.34 O ATOM 2265 OE2 GLU A 149 8.437 19.979 -8.091 1.00 15.04 O ATOM 0 H GLU A 149 5.660 18.861 -3.638 1.00 9.13 H new ATOM 0 HA GLU A 149 5.520 19.740 -6.247 1.00 10.76 H new ATOM 0 HB2 GLU A 149 6.760 17.580 -4.679 1.00 12.02 H new ATOM 0 HB3 GLU A 149 6.395 17.068 -6.315 1.00 12.02 H new ATOM 0 HG2 GLU A 149 7.929 19.614 -5.622 1.00 13.01 H new ATOM 0 HG3 GLU A 149 8.691 18.091 -6.037 1.00 13.01 H new ATOM 2272 N GLY A 150 3.365 18.884 -7.193 1.00 12.16 N ATOM 2273 CA GLY A 150 2.345 18.319 -8.066 1.00 13.44 C ATOM 2274 C GLY A 150 1.097 19.187 -8.230 1.00 13.75 C ATOM 2275 O GLY A 150 0.481 19.141 -9.293 1.00 14.61 O ATOM 0 H GLY A 150 3.445 19.899 -7.257 1.00 12.16 H new ATOM 0 HA2 GLY A 150 2.782 18.145 -9.049 1.00 13.44 H new ATOM 0 HA3 GLY A 150 2.047 17.347 -7.673 1.00 13.44 H new ATOM 2279 N ARG A 151 0.677 19.910 -7.186 1.00 13.29 N ATOM 2280 CA ARG A 151 -0.670 20.474 -7.091 1.00 13.72 C ATOM 2281 C ARG A 151 -0.590 21.959 -6.722 1.00 13.41 C ATOM 2282 O ARG A 151 -1.537 22.701 -7.072 1.00 13.42 O ATOM 2283 CB ARG A 151 -1.446 19.664 -6.036 1.00 13.88 C ATOM 2284 CG ARG A 151 -2.960 19.548 -6.277 1.00 14.51 C ATOM 2285 CD ARG A 151 -3.658 20.908 -6.259 1.00 14.26 C ATOM 2286 NE ARG A 151 -5.093 20.790 -5.972 1.00 14.75 N ATOM 2287 CZ ARG A 151 -5.894 21.850 -5.786 1.00 14.74 C ATOM 2288 NH1 ARG A 151 -5.402 23.083 -5.951 1.00 14.39 N ATOM 2289 NH2 ARG A 151 -7.173 21.668 -5.434 1.00 15.32 N ATOM 2290 OXT ARG A 151 0.409 22.324 -6.067 1.00 13.57 O ATOM 0 H ARG A 151 1.266 20.120 -6.380 1.00 13.29 H new ATOM 0 HA ARG A 151 -1.190 20.410 -8.047 1.00 13.72 H new ATOM 0 HB2 ARG A 151 -1.024 18.660 -5.991 1.00 13.88 H new ATOM 0 HB3 ARG A 151 -1.284 20.122 -5.060 1.00 13.88 H new ATOM 0 HG2 ARG A 151 -3.136 19.065 -7.238 1.00 14.51 H new ATOM 0 HG3 ARG A 151 -3.399 18.907 -5.512 1.00 14.51 H new ATOM 0 HD2 ARG A 151 -3.190 21.545 -5.508 1.00 14.26 H new ATOM 0 HD3 ARG A 151 -3.521 21.398 -7.223 1.00 14.26 H new ATOM 0 HE ARG A 151 -5.501 19.857 -5.911 1.00 14.75 H new ATOM 0 HH11 ARG A 151 -4.425 23.211 -6.216 1.00 14.39 H new ATOM 0 HH12 ARG A 151 -6.003 23.895 -5.812 1.00 14.39 H new ATOM 0 HH21 ARG A 151 -7.538 20.724 -5.307 1.00 15.32 H new ATOM 0 HH22 ARG A 151 -7.783 22.473 -5.292 1.00 15.32 H new TER 2304 ARG A 151