USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 950 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 107 ASN : amide:sc= -0.604 K(o=-0.5,f=0.54) USER MOD Set 1.2: A 109 SER OG : rot 180:sc= 0.109 USER MOD Set 2.1: A 104 SER OG : rot 180:sc= 1.05 USER MOD Set 2.2: A 106 THR OG1 : rot 90:sc= 1.25 USER MOD Set 3.1: A 100 LYS NZ :NH3+ 156:sc= 1.09 (180deg=0) USER MOD Set 3.2: A 101 ASN : amide:sc= -3.64! C(o=-2.5!,f=-13!) USER MOD Set 4.1: A 85 ASN : amide:sc= -5.39 K(o=-9.7,f=-11!) USER MOD Set 4.2: A 97 MET CE :methyl -179:sc= -4.33! (180deg=-4.51!) USER MOD Set 5.1: A 38 THR OG1 : rot 177:sc= -2.11! USER MOD Set 5.2: A 42 ASN : amide:sc= -1.86 K(o=-4,f=-5.5!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.523 X(o=-0.52,f=-0.2) USER MOD Single : A 11 ASN : amide:sc= -2.54! C(o=-2.5!,f=-3.3!) USER MOD Single : A 12 GLN : amide:sc= -2.73! K(o=-2.7!,f=-1.8) USER MOD Single : A 14 LYS NZ :NH3+ -129:sc= -1.26! (180deg=-3.49!) USER MOD Single : A 15 SER OG : rot 104:sc= 1.16 USER MOD Single : A 20 SER OG : rot 171:sc= -2.91! USER MOD Single : A 25 ASN : amide:sc= -2.54 K(o=-2.5,f=-11!) USER MOD Single : A 29 TYR OH : rot 131:sc= -4.83! USER MOD Single : A 30 HIS : no HD1:sc= -1.51 X(o=-1.5,f=-1.8) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -122:sc= 0.0998 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 178:sc= 0.248 (180deg=0.247) USER MOD Single : A 49 ASN : amide:sc= 1.16 K(o=1.2,f=-0.044) USER MOD Single : A 50 LYS NZ :NH3+ -132:sc= 1.09 (180deg=-1.38) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0477! USER MOD Single : A 59 ASN : amide:sc= -2.93! K(o=-2.9!,f=-1.2) USER MOD Single : A 62 LYS NZ :NH3+ -145:sc= 0.937 (180deg=-1.62!) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -3.16 K(o=-3.2,f=-4!) USER MOD Single : A 74 SER OG : rot 180:sc= -1.25 USER MOD Single : A 80 SER OG : rot -49:sc= 0.622 USER MOD Single : A 81 THR OG1 : rot 2:sc= -1.49! USER MOD Single : A 87 ASN : amide:sc= -2.33 K(o=-2.3,f=-13!) USER MOD Single : A 89 LYS NZ :NH3+ -164:sc= -1.08 (180deg=-1.42) USER MOD Single : A 99 SER OG : rot -118:sc=0.000361 USER MOD Single : A 105 THR OG1 : rot 180:sc= -0.14 USER MOD Single : A 108 THR OG1 : rot 165:sc= -1.06 USER MOD Single : A 113 ASN : amide:sc= -11! C(o=-11!,f=-14!) USER MOD Single : A 114 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0143) USER MOD Single : A 117 SER OG : rot 55:sc= -0.179 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc=-0.000833 USER MOD Single : A 127 ASN : amide:sc= -2.83 K(o=-2.8,f=-5.6!) USER MOD Single : A 128 HIS : no HD1:sc= -0.272 X(o=-0.27,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -16.292 20.589 -1.088 1.00 0.00 N ATOM 33 CA LYS A 3 -15.188 19.777 -0.590 1.00 0.00 C ATOM 34 C LYS A 3 -15.105 18.454 -1.340 1.00 0.00 C ATOM 35 O LYS A 3 -14.884 17.401 -0.739 1.00 0.00 O ATOM 36 CB LYS A 3 -15.353 19.515 0.906 1.00 0.00 C ATOM 37 CG LYS A 3 -14.888 20.670 1.776 1.00 0.00 C ATOM 38 CD LYS A 3 -15.796 21.877 1.622 1.00 0.00 C ATOM 39 CE LYS A 3 -17.207 21.569 2.089 1.00 0.00 C ATOM 40 NZ LYS A 3 -18.080 22.775 2.058 1.00 0.00 N ATOM 0 HA LYS A 3 -14.263 20.329 -0.756 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -16.402 19.310 1.118 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -14.793 18.619 1.174 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -14.869 20.357 2.820 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -13.868 20.943 1.507 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -15.395 22.712 2.196 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -15.816 22.189 0.578 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -17.637 20.793 1.456 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -17.175 21.171 3.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -19.034 22.521 2.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -17.684 23.506 2.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -18.132 23.141 1.086 1.00 0.00 H new ATOM 54 N THR A 4 -15.283 18.512 -2.655 1.00 0.00 N ATOM 55 CA THR A 4 -15.228 17.316 -3.492 1.00 0.00 C ATOM 56 C THR A 4 -14.025 16.451 -3.129 1.00 0.00 C ATOM 57 O THR A 4 -14.149 15.240 -2.961 1.00 0.00 O ATOM 58 CB THR A 4 -15.162 17.697 -4.972 1.00 0.00 C ATOM 59 OG1 THR A 4 -16.289 18.472 -5.340 1.00 0.00 O ATOM 60 CG2 THR A 4 -15.104 16.501 -5.899 1.00 0.00 C ATOM 0 H THR A 4 -15.467 19.375 -3.166 1.00 0.00 H new ATOM 0 HA THR A 4 -16.137 16.743 -3.313 1.00 0.00 H new ATOM 0 HB THR A 4 -14.238 18.265 -5.082 1.00 0.00 H new ATOM 0 HG1 THR A 4 -16.228 18.707 -6.289 1.00 0.00 H new ATOM 0 HG21 THR A 4 -15.059 16.844 -6.933 1.00 0.00 H new ATOM 0 HG22 THR A 4 -14.217 15.909 -5.674 1.00 0.00 H new ATOM 0 HG23 THR A 4 -15.994 15.888 -5.759 1.00 0.00 H new ATOM 68 N ASN A 5 -12.861 17.081 -3.004 1.00 0.00 N ATOM 69 CA ASN A 5 -11.638 16.366 -2.659 1.00 0.00 C ATOM 70 C ASN A 5 -11.842 15.489 -1.425 1.00 0.00 C ATOM 71 O ASN A 5 -11.160 14.480 -1.250 1.00 0.00 O ATOM 72 CB ASN A 5 -10.492 17.353 -2.427 1.00 0.00 C ATOM 73 CG ASN A 5 -9.387 17.202 -3.455 1.00 0.00 C ATOM 74 OD1 ASN A 5 -8.203 17.270 -3.125 1.00 0.00 O ATOM 75 ND2 ASN A 5 -9.771 16.995 -4.710 1.00 0.00 N ATOM 0 H ASN A 5 -12.739 18.085 -3.137 1.00 0.00 H new ATOM 0 HA ASN A 5 -11.380 15.717 -3.495 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -10.880 18.371 -2.460 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -10.081 17.201 -1.429 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -9.073 16.885 -5.445 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -10.764 16.946 -4.938 1.00 0.00 H new ATOM 82 N LEU A 6 -12.794 15.871 -0.578 1.00 0.00 N ATOM 83 CA LEU A 6 -13.095 15.114 0.619 1.00 0.00 C ATOM 84 C LEU A 6 -14.180 14.097 0.329 1.00 0.00 C ATOM 85 O LEU A 6 -13.926 12.899 0.341 1.00 0.00 O ATOM 86 CB LEU A 6 -13.527 16.052 1.737 1.00 0.00 C ATOM 87 CG LEU A 6 -12.381 16.818 2.393 1.00 0.00 C ATOM 88 CD1 LEU A 6 -12.672 18.310 2.416 1.00 0.00 C ATOM 89 CD2 LEU A 6 -12.131 16.286 3.793 1.00 0.00 C ATOM 0 H LEU A 6 -13.368 16.704 -0.705 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.198 14.584 0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -14.245 16.768 1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -14.046 15.473 2.501 1.00 0.00 H new ATOM 0 HG LEU A 6 -11.477 16.668 1.803 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -11.842 18.835 2.888 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -12.797 18.672 1.396 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -13.586 18.494 2.981 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -11.312 16.839 4.252 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -13.032 16.407 4.394 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -11.870 15.229 3.739 1.00 0.00 H new ATOM 101 N GLY A 7 -15.385 14.580 0.037 1.00 0.00 N ATOM 102 CA GLY A 7 -16.483 13.684 -0.284 1.00 0.00 C ATOM 103 C GLY A 7 -16.086 12.656 -1.328 1.00 0.00 C ATOM 104 O GLY A 7 -16.662 11.572 -1.399 1.00 0.00 O ATOM 0 H GLY A 7 -15.620 15.572 0.017 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.812 13.174 0.621 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.330 14.264 -0.649 1.00 0.00 H new ATOM 108 N GLU A 8 -15.091 13.007 -2.134 1.00 0.00 N ATOM 109 CA GLU A 8 -14.596 12.124 -3.182 1.00 0.00 C ATOM 110 C GLU A 8 -13.506 11.200 -2.648 1.00 0.00 C ATOM 111 O GLU A 8 -13.260 10.129 -3.206 1.00 0.00 O ATOM 112 CB GLU A 8 -14.044 12.955 -4.342 1.00 0.00 C ATOM 113 CG GLU A 8 -13.862 12.173 -5.631 1.00 0.00 C ATOM 114 CD GLU A 8 -12.633 11.287 -5.609 1.00 0.00 C ATOM 115 OE1 GLU A 8 -11.514 11.828 -5.474 1.00 0.00 O ATOM 116 OE2 GLU A 8 -12.787 10.054 -5.728 1.00 0.00 O ATOM 0 H GLU A 8 -14.608 13.904 -2.080 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.426 11.511 -3.533 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -14.717 13.792 -4.529 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -13.084 13.378 -4.047 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -14.745 11.558 -5.806 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -13.788 12.869 -6.466 1.00 0.00 H new ATOM 123 N LEU A 9 -12.852 11.616 -1.566 1.00 0.00 N ATOM 124 CA LEU A 9 -11.792 10.820 -0.968 1.00 0.00 C ATOM 125 C LEU A 9 -12.302 10.056 0.248 1.00 0.00 C ATOM 126 O LEU A 9 -11.701 9.066 0.667 1.00 0.00 O ATOM 127 CB LEU A 9 -10.617 11.715 -0.564 1.00 0.00 C ATOM 128 CG LEU A 9 -9.728 12.182 -1.719 1.00 0.00 C ATOM 129 CD1 LEU A 9 -8.572 13.021 -1.197 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.212 10.990 -2.510 1.00 0.00 C ATOM 0 H LEU A 9 -13.039 12.498 -1.089 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.453 10.099 -1.712 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -11.009 12.593 -0.050 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -9.999 11.175 0.154 1.00 0.00 H new ATOM 0 HG LEU A 9 -10.327 12.802 -2.386 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -7.951 13.344 -2.032 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -8.963 13.895 -0.676 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -7.973 12.426 -0.508 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -8.582 11.341 -3.327 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.629 10.343 -1.854 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.055 10.431 -2.916 1.00 0.00 H new ATOM 142 N ILE A 10 -13.404 10.529 0.823 1.00 0.00 N ATOM 143 CA ILE A 10 -13.971 9.893 1.999 1.00 0.00 C ATOM 144 C ILE A 10 -14.995 8.827 1.631 1.00 0.00 C ATOM 145 O ILE A 10 -14.913 7.698 2.111 1.00 0.00 O ATOM 146 CB ILE A 10 -14.610 10.915 2.962 1.00 0.00 C ATOM 147 CG1 ILE A 10 -15.741 11.722 2.296 1.00 0.00 C ATOM 148 CG2 ILE A 10 -13.561 11.860 3.493 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.175 12.954 3.093 1.00 0.00 C ATOM 0 H ILE A 10 -13.917 11.346 0.493 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.137 9.413 2.511 1.00 0.00 H new ATOM 0 HB ILE A 10 -15.048 10.347 3.783 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.414 12.039 1.306 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -16.604 11.071 2.154 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -14.026 12.576 4.171 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.799 11.294 4.029 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.099 12.394 2.663 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -16.974 13.469 2.560 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.534 12.644 4.074 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.326 13.627 3.213 1.00 0.00 H new ATOM 161 N ASN A 11 -15.956 9.179 0.776 1.00 0.00 N ATOM 162 CA ASN A 11 -16.982 8.223 0.353 1.00 0.00 C ATOM 163 C ASN A 11 -16.352 6.872 0.047 1.00 0.00 C ATOM 164 O ASN A 11 -16.913 5.821 0.358 1.00 0.00 O ATOM 165 CB ASN A 11 -17.719 8.738 -0.882 1.00 0.00 C ATOM 166 CG ASN A 11 -18.634 9.900 -0.568 1.00 0.00 C ATOM 167 OD1 ASN A 11 -18.989 10.133 0.588 1.00 0.00 O ATOM 168 ND2 ASN A 11 -19.021 10.638 -1.598 1.00 0.00 N ATOM 0 H ASN A 11 -16.046 10.109 0.366 1.00 0.00 H new ATOM 0 HA ASN A 11 -17.697 8.108 1.168 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -16.992 9.045 -1.633 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -18.303 7.927 -1.317 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -19.638 11.437 -1.450 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -18.702 10.408 -2.539 1.00 0.00 H new ATOM 175 N GLN A 12 -15.171 6.921 -0.552 1.00 0.00 N ATOM 176 CA GLN A 12 -14.431 5.715 -0.897 1.00 0.00 C ATOM 177 C GLN A 12 -13.603 5.237 0.291 1.00 0.00 C ATOM 178 O GLN A 12 -13.394 4.038 0.474 1.00 0.00 O ATOM 179 CB GLN A 12 -13.515 5.979 -2.094 1.00 0.00 C ATOM 180 CG GLN A 12 -12.338 6.889 -1.771 1.00 0.00 C ATOM 181 CD GLN A 12 -11.353 7.000 -2.917 1.00 0.00 C ATOM 182 OE1 GLN A 12 -11.427 6.251 -3.891 1.00 0.00 O ATOM 183 NE2 GLN A 12 -10.424 7.940 -2.804 1.00 0.00 N ATOM 0 H GLN A 12 -14.702 7.789 -0.811 1.00 0.00 H new ATOM 0 HA GLN A 12 -15.148 4.938 -1.161 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -13.136 5.028 -2.468 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -14.100 6.427 -2.897 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.710 7.882 -1.520 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.822 6.509 -0.889 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.401 8.538 -1.978 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.732 8.065 -3.543 1.00 0.00 H new ATOM 192 N GLY A 13 -13.127 6.187 1.091 1.00 0.00 N ATOM 193 CA GLY A 13 -12.320 5.849 2.248 1.00 0.00 C ATOM 194 C GLY A 13 -13.120 5.173 3.344 1.00 0.00 C ATOM 195 O GLY A 13 -12.809 4.053 3.749 1.00 0.00 O ATOM 0 H GLY A 13 -13.287 7.186 0.958 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.507 5.191 1.939 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -11.863 6.756 2.644 1.00 0.00 H new ATOM 199 N LYS A 14 -14.157 5.852 3.820 1.00 0.00 N ATOM 200 CA LYS A 14 -15.011 5.303 4.873 1.00 0.00 C ATOM 201 C LYS A 14 -15.669 4.018 4.381 1.00 0.00 C ATOM 202 O LYS A 14 -15.941 3.106 5.161 1.00 0.00 O ATOM 203 CB LYS A 14 -16.084 6.316 5.330 1.00 0.00 C ATOM 204 CG LYS A 14 -16.136 7.591 4.500 1.00 0.00 C ATOM 205 CD LYS A 14 -16.944 8.693 5.170 1.00 0.00 C ATOM 206 CE LYS A 14 -17.106 9.893 4.244 1.00 0.00 C ATOM 207 NZ LYS A 14 -18.513 10.380 4.196 1.00 0.00 N ATOM 0 H LYS A 14 -14.428 6.781 3.497 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.384 5.085 5.737 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -17.061 5.833 5.295 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -15.897 6.581 6.371 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -15.121 7.946 4.323 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -16.570 7.368 3.525 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -17.925 8.310 5.450 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -16.449 9.004 6.090 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.455 10.700 4.580 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -16.783 9.621 3.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -18.817 10.466 3.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -19.131 9.705 4.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -18.575 11.309 4.659 1.00 0.00 H new ATOM 221 N SER A 15 -15.895 3.946 3.072 1.00 0.00 N ATOM 222 CA SER A 15 -16.490 2.766 2.461 1.00 0.00 C ATOM 223 C SER A 15 -15.426 1.690 2.260 1.00 0.00 C ATOM 224 O SER A 15 -15.734 0.502 2.186 1.00 0.00 O ATOM 225 CB SER A 15 -17.133 3.122 1.121 1.00 0.00 C ATOM 226 OG SER A 15 -18.264 3.958 1.304 1.00 0.00 O ATOM 0 H SER A 15 -15.674 4.694 2.415 1.00 0.00 H new ATOM 0 HA SER A 15 -17.264 2.383 3.126 1.00 0.00 H new ATOM 0 HB2 SER A 15 -16.404 3.625 0.486 1.00 0.00 H new ATOM 0 HB3 SER A 15 -17.431 2.210 0.603 1.00 0.00 H new ATOM 0 HG SER A 15 -18.033 4.879 1.061 1.00 0.00 H new ATOM 232 N LEU A 16 -14.167 2.120 2.197 1.00 0.00 N ATOM 233 CA LEU A 16 -13.048 1.210 2.033 1.00 0.00 C ATOM 234 C LEU A 16 -12.798 0.504 3.352 1.00 0.00 C ATOM 235 O LEU A 16 -12.909 -0.715 3.443 1.00 0.00 O ATOM 236 CB LEU A 16 -11.805 1.990 1.590 1.00 0.00 C ATOM 237 CG LEU A 16 -10.487 1.211 1.588 1.00 0.00 C ATOM 238 CD1 LEU A 16 -10.638 -0.093 0.820 1.00 0.00 C ATOM 239 CD2 LEU A 16 -9.368 2.060 0.988 1.00 0.00 C ATOM 0 H LEU A 16 -13.901 3.103 2.258 1.00 0.00 H new ATOM 0 HA LEU A 16 -13.274 0.469 1.266 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -11.980 2.371 0.584 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -11.692 2.855 2.244 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.225 0.973 2.619 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.691 -0.633 0.830 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -11.409 -0.704 1.289 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -10.923 0.122 -0.210 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.438 1.492 0.994 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.624 2.327 -0.037 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.243 2.967 1.579 1.00 0.00 H new ATOM 251 N LEU A 17 -12.497 1.289 4.385 1.00 0.00 N ATOM 252 CA LEU A 17 -12.267 0.757 5.717 1.00 0.00 C ATOM 253 C LEU A 17 -13.433 -0.130 6.150 1.00 0.00 C ATOM 254 O LEU A 17 -13.235 -1.191 6.743 1.00 0.00 O ATOM 255 CB LEU A 17 -12.098 1.913 6.705 1.00 0.00 C ATOM 256 CG LEU A 17 -10.982 1.739 7.734 1.00 0.00 C ATOM 257 CD1 LEU A 17 -9.701 2.409 7.246 1.00 0.00 C ATOM 258 CD2 LEU A 17 -11.421 2.304 9.078 1.00 0.00 C ATOM 0 H LEU A 17 -12.407 2.303 4.318 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.360 0.152 5.703 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -11.909 2.826 6.141 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -13.039 2.055 7.236 1.00 0.00 H new ATOM 0 HG LEU A 17 -10.776 0.676 7.861 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -8.915 2.277 7.990 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -9.390 1.957 6.304 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -9.882 3.473 7.095 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -10.620 2.176 9.806 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -11.647 3.365 8.970 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -12.311 1.776 9.421 1.00 0.00 H new ATOM 270 N ASP A 18 -14.651 0.317 5.847 1.00 0.00 N ATOM 271 CA ASP A 18 -15.855 -0.430 6.205 1.00 0.00 C ATOM 272 C ASP A 18 -16.135 -1.562 5.214 1.00 0.00 C ATOM 273 O ASP A 18 -17.081 -2.330 5.395 1.00 0.00 O ATOM 274 CB ASP A 18 -17.058 0.512 6.269 1.00 0.00 C ATOM 275 CG ASP A 18 -17.057 1.367 7.521 1.00 0.00 C ATOM 276 OD1 ASP A 18 -16.137 2.198 7.672 1.00 0.00 O ATOM 277 OD2 ASP A 18 -17.977 1.207 8.350 1.00 0.00 O ATOM 0 H ASP A 18 -14.830 1.192 5.355 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.687 -0.876 7.185 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.057 1.158 5.391 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.977 -0.073 6.233 1.00 0.00 H new ATOM 282 N GLU A 19 -15.297 -1.683 4.188 1.00 0.00 N ATOM 283 CA GLU A 19 -15.441 -2.738 3.200 1.00 0.00 C ATOM 284 C GLU A 19 -14.350 -3.751 3.444 1.00 0.00 C ATOM 285 O GLU A 19 -14.555 -4.962 3.360 1.00 0.00 O ATOM 286 CB GLU A 19 -15.347 -2.175 1.778 1.00 0.00 C ATOM 287 CG GLU A 19 -15.288 -3.244 0.698 1.00 0.00 C ATOM 288 CD GLU A 19 -16.109 -2.881 -0.524 1.00 0.00 C ATOM 289 OE1 GLU A 19 -17.354 -2.903 -0.431 1.00 0.00 O ATOM 290 OE2 GLU A 19 -15.506 -2.576 -1.575 1.00 0.00 O ATOM 0 H GLU A 19 -14.508 -1.058 4.022 1.00 0.00 H new ATOM 0 HA GLU A 19 -16.421 -3.206 3.295 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -16.208 -1.533 1.594 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -14.459 -1.547 1.704 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -14.251 -3.400 0.402 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -15.648 -4.188 1.106 1.00 0.00 H new ATOM 297 N SER A 20 -13.184 -3.217 3.776 1.00 0.00 N ATOM 298 CA SER A 20 -12.033 -4.011 4.075 1.00 0.00 C ATOM 299 C SER A 20 -12.187 -4.619 5.445 1.00 0.00 C ATOM 300 O SER A 20 -13.116 -4.304 6.190 1.00 0.00 O ATOM 301 CB SER A 20 -10.778 -3.150 4.035 1.00 0.00 C ATOM 302 OG SER A 20 -11.089 -1.800 4.333 1.00 0.00 O ATOM 0 H SER A 20 -13.023 -2.212 3.842 1.00 0.00 H new ATOM 0 HA SER A 20 -11.942 -4.803 3.331 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.049 -3.527 4.752 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.318 -3.214 3.049 1.00 0.00 H new ATOM 0 HG SER A 20 -10.260 -1.292 4.452 1.00 0.00 H new ATOM 308 N VAL A 21 -11.272 -5.486 5.759 1.00 0.00 N ATOM 309 CA VAL A 21 -11.271 -6.166 7.036 1.00 0.00 C ATOM 310 C VAL A 21 -9.881 -6.643 7.407 1.00 0.00 C ATOM 311 O VAL A 21 -9.168 -7.202 6.582 1.00 0.00 O ATOM 312 CB VAL A 21 -12.226 -7.365 7.002 1.00 0.00 C ATOM 313 CG1 VAL A 21 -11.904 -8.263 5.820 1.00 0.00 C ATOM 314 CG2 VAL A 21 -12.186 -8.140 8.311 1.00 0.00 C ATOM 0 H VAL A 21 -10.502 -5.748 5.143 1.00 0.00 H new ATOM 0 HA VAL A 21 -11.606 -5.452 7.788 1.00 0.00 H new ATOM 0 HB VAL A 21 -13.242 -6.989 6.879 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.590 -9.110 5.809 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -12.010 -7.698 4.894 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.880 -8.627 5.908 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.874 -8.984 8.255 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.175 -8.507 8.486 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.481 -7.485 9.131 1.00 0.00 H new ATOM 324 N GLU A 22 -9.505 -6.436 8.655 1.00 0.00 N ATOM 325 CA GLU A 22 -8.199 -6.874 9.118 1.00 0.00 C ATOM 326 C GLU A 22 -8.215 -8.379 9.383 1.00 0.00 C ATOM 327 O GLU A 22 -8.836 -8.843 10.339 1.00 0.00 O ATOM 328 CB GLU A 22 -7.808 -6.136 10.399 1.00 0.00 C ATOM 329 CG GLU A 22 -8.907 -6.113 11.449 1.00 0.00 C ATOM 330 CD GLU A 22 -8.454 -6.679 12.782 1.00 0.00 C ATOM 331 OE1 GLU A 22 -7.694 -7.669 12.778 1.00 0.00 O ATOM 332 OE2 GLU A 22 -8.861 -6.132 13.828 1.00 0.00 O ATOM 0 H GLU A 22 -10.077 -5.973 9.361 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.467 -6.649 8.342 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.922 -6.607 10.823 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.535 -5.111 10.149 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -9.247 -5.087 11.591 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.762 -6.685 11.087 1.00 0.00 H new ATOM 339 N GLY A 23 -7.526 -9.133 8.533 1.00 0.00 N ATOM 340 CA GLY A 23 -7.469 -10.574 8.690 1.00 0.00 C ATOM 341 C GLY A 23 -6.046 -11.091 8.747 1.00 0.00 C ATOM 342 O GLY A 23 -5.442 -11.145 9.818 1.00 0.00 O ATOM 0 H GLY A 23 -7.004 -8.770 7.735 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.993 -10.859 9.602 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.993 -11.049 7.860 1.00 0.00 H new ATOM 346 N PHE A 24 -5.506 -11.471 7.589 1.00 0.00 N ATOM 347 CA PHE A 24 -4.140 -11.986 7.510 1.00 0.00 C ATOM 348 C PHE A 24 -3.862 -12.594 6.137 1.00 0.00 C ATOM 349 O PHE A 24 -3.229 -13.644 6.030 1.00 0.00 O ATOM 350 CB PHE A 24 -3.893 -13.037 8.598 1.00 0.00 C ATOM 351 CG PHE A 24 -5.048 -13.976 8.803 1.00 0.00 C ATOM 352 CD1 PHE A 24 -5.375 -14.914 7.837 1.00 0.00 C ATOM 353 CD2 PHE A 24 -5.804 -13.922 9.963 1.00 0.00 C ATOM 354 CE1 PHE A 24 -6.437 -15.779 8.022 1.00 0.00 C ATOM 355 CE2 PHE A 24 -6.867 -14.786 10.154 1.00 0.00 C ATOM 356 CZ PHE A 24 -7.183 -15.715 9.183 1.00 0.00 C ATOM 0 H PHE A 24 -5.993 -11.432 6.694 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.462 -11.147 7.665 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.007 -13.616 8.337 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.677 -12.530 9.538 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -4.793 -14.970 6.929 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -5.561 -13.198 10.726 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -6.683 -16.504 7.260 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -7.449 -14.734 11.062 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.012 -16.391 9.331 1.00 0.00 H new ATOM 366 N ASN A 25 -4.337 -11.930 5.086 1.00 0.00 N ATOM 367 CA ASN A 25 -4.132 -12.415 3.724 1.00 0.00 C ATOM 368 C ASN A 25 -4.737 -11.456 2.704 1.00 0.00 C ATOM 369 O ASN A 25 -5.361 -10.460 3.069 1.00 0.00 O ATOM 370 CB ASN A 25 -4.746 -13.806 3.557 1.00 0.00 C ATOM 371 CG ASN A 25 -3.983 -14.660 2.564 1.00 0.00 C ATOM 372 OD1 ASN A 25 -3.692 -14.226 1.450 1.00 0.00 O ATOM 373 ND2 ASN A 25 -3.654 -15.883 2.964 1.00 0.00 N ATOM 0 H ASN A 25 -4.864 -11.059 5.151 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.058 -12.474 3.547 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -4.767 -14.309 4.524 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.780 -13.706 3.227 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -3.140 -16.503 2.338 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -3.916 -16.202 3.897 1.00 0.00 H new ATOM 380 N VAL A 26 -4.554 -11.765 1.421 1.00 0.00 N ATOM 381 CA VAL A 26 -5.088 -10.929 0.351 1.00 0.00 C ATOM 382 C VAL A 26 -6.580 -10.686 0.550 1.00 0.00 C ATOM 383 O VAL A 26 -7.377 -11.623 0.557 1.00 0.00 O ATOM 384 CB VAL A 26 -4.854 -11.564 -1.036 1.00 0.00 C ATOM 385 CG1 VAL A 26 -5.590 -12.889 -1.154 1.00 0.00 C ATOM 386 CG2 VAL A 26 -5.279 -10.607 -2.141 1.00 0.00 C ATOM 0 H VAL A 26 -4.041 -12.586 1.100 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.557 -9.978 0.391 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.788 -11.760 -1.147 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.411 -13.318 -2.140 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.229 -13.575 -0.388 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.659 -12.725 -1.019 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.106 -11.072 -3.112 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.338 -10.374 -2.033 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.697 -9.688 -2.070 1.00 0.00 H new ATOM 396 N GLY A 27 -6.946 -9.423 0.731 1.00 0.00 N ATOM 397 CA GLY A 27 -8.336 -9.077 0.949 1.00 0.00 C ATOM 398 C GLY A 27 -8.573 -8.574 2.359 1.00 0.00 C ATOM 399 O GLY A 27 -9.523 -7.834 2.613 1.00 0.00 O ATOM 0 H GLY A 27 -6.303 -8.631 0.731 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.637 -8.311 0.234 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -8.962 -9.950 0.764 1.00 0.00 H new ATOM 403 N GLU A 28 -7.695 -8.973 3.276 1.00 0.00 N ATOM 404 CA GLU A 28 -7.790 -8.559 4.663 1.00 0.00 C ATOM 405 C GLU A 28 -6.424 -8.128 5.165 1.00 0.00 C ATOM 406 O GLU A 28 -5.427 -8.804 4.926 1.00 0.00 O ATOM 407 CB GLU A 28 -8.340 -9.697 5.527 1.00 0.00 C ATOM 408 CG GLU A 28 -9.520 -10.422 4.900 1.00 0.00 C ATOM 409 CD GLU A 28 -10.405 -11.097 5.932 1.00 0.00 C ATOM 410 OE1 GLU A 28 -10.363 -10.684 7.110 1.00 0.00 O ATOM 411 OE2 GLU A 28 -11.138 -12.036 5.560 1.00 0.00 O ATOM 0 H GLU A 28 -6.906 -9.587 3.076 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.477 -7.715 4.732 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -7.543 -10.415 5.717 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.644 -9.294 6.493 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -10.115 -9.712 4.326 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -9.151 -11.170 4.198 1.00 0.00 H new ATOM 418 N TYR A 29 -6.380 -6.994 5.846 1.00 0.00 N ATOM 419 CA TYR A 29 -5.117 -6.470 6.356 1.00 0.00 C ATOM 420 C TYR A 29 -4.860 -6.933 7.784 1.00 0.00 C ATOM 421 O TYR A 29 -5.684 -7.617 8.379 1.00 0.00 O ATOM 422 CB TYR A 29 -5.118 -4.944 6.273 1.00 0.00 C ATOM 423 CG TYR A 29 -6.056 -4.279 7.246 1.00 0.00 C ATOM 424 CD1 TYR A 29 -7.390 -4.046 6.918 1.00 0.00 C ATOM 425 CD2 TYR A 29 -5.602 -3.876 8.495 1.00 0.00 C ATOM 426 CE1 TYR A 29 -8.241 -3.431 7.810 1.00 0.00 C ATOM 427 CE2 TYR A 29 -6.450 -3.259 9.392 1.00 0.00 C ATOM 428 CZ TYR A 29 -7.769 -3.040 9.044 1.00 0.00 C ATOM 429 OH TYR A 29 -8.616 -2.433 9.936 1.00 0.00 O ATOM 0 H TYR A 29 -7.196 -6.420 6.059 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.308 -6.859 5.737 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.106 -4.580 6.452 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.389 -4.645 5.260 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.762 -4.352 5.951 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.571 -4.048 8.768 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -9.273 -3.256 7.543 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.085 -2.949 10.360 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.536 -2.867 10.811 1.00 0.00 H new ATOM 439 N HIS A 30 -3.706 -6.572 8.335 1.00 0.00 N ATOM 440 CA HIS A 30 -3.373 -6.980 9.697 1.00 0.00 C ATOM 441 C HIS A 30 -3.184 -5.776 10.611 1.00 0.00 C ATOM 442 O HIS A 30 -2.060 -5.420 10.965 1.00 0.00 O ATOM 443 CB HIS A 30 -2.116 -7.847 9.702 1.00 0.00 C ATOM 444 CG HIS A 30 -2.234 -9.066 10.563 1.00 0.00 C ATOM 445 ND1 HIS A 30 -2.074 -10.347 10.079 1.00 0.00 N ATOM 446 CD2 HIS A 30 -2.498 -9.196 11.884 1.00 0.00 C ATOM 447 CE1 HIS A 30 -2.235 -11.212 11.065 1.00 0.00 C ATOM 448 NE2 HIS A 30 -2.492 -10.539 12.171 1.00 0.00 N ATOM 0 H HIS A 30 -2.995 -6.007 7.870 1.00 0.00 H new ATOM 0 HA HIS A 30 -4.210 -7.564 10.080 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.892 -8.154 8.680 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.273 -7.248 10.047 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -2.680 -8.393 12.583 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -2.168 -12.287 10.980 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -2.659 -10.950 13.090 1.00 0.00 H new ATOM 457 N LYS A 31 -4.296 -5.161 10.999 1.00 0.00 N ATOM 458 CA LYS A 31 -4.261 -4.001 11.882 1.00 0.00 C ATOM 459 C LYS A 31 -3.424 -2.879 11.279 1.00 0.00 C ATOM 460 O LYS A 31 -2.600 -3.109 10.395 1.00 0.00 O ATOM 461 CB LYS A 31 -3.699 -4.393 13.249 1.00 0.00 C ATOM 462 CG LYS A 31 -4.362 -3.670 14.409 1.00 0.00 C ATOM 463 CD LYS A 31 -4.473 -4.564 15.633 1.00 0.00 C ATOM 464 CE LYS A 31 -3.109 -4.851 16.239 1.00 0.00 C ATOM 465 NZ LYS A 31 -2.805 -3.946 17.381 1.00 0.00 N ATOM 0 H LYS A 31 -5.233 -5.447 10.716 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.282 -3.640 12.005 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.817 -5.468 13.386 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.629 -4.185 13.266 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.787 -2.778 14.659 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.355 -3.335 14.110 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.110 -4.086 16.377 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -4.954 -5.502 15.357 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.073 -5.886 16.577 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -2.341 -4.739 15.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -1.866 -4.175 17.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -2.814 -2.959 17.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -3.523 -4.071 18.123 1.00 0.00 H new ATOM 479 N GLY A 32 -3.642 -1.662 11.762 1.00 0.00 N ATOM 480 CA GLY A 32 -2.899 -0.523 11.260 1.00 0.00 C ATOM 481 C GLY A 32 -3.598 0.169 10.106 1.00 0.00 C ATOM 482 O GLY A 32 -3.394 1.362 9.880 1.00 0.00 O ATOM 0 H GLY A 32 -4.320 -1.444 12.492 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.747 0.192 12.069 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.912 -0.852 10.936 1.00 0.00 H new ATOM 486 N ALA A 33 -4.421 -0.573 9.371 1.00 0.00 N ATOM 487 CA ALA A 33 -5.140 -0.007 8.239 1.00 0.00 C ATOM 488 C ALA A 33 -6.333 0.820 8.704 1.00 0.00 C ATOM 489 O ALA A 33 -6.422 2.010 8.403 1.00 0.00 O ATOM 490 CB ALA A 33 -5.591 -1.108 7.290 1.00 0.00 C ATOM 0 H ALA A 33 -4.605 -1.562 9.539 1.00 0.00 H new ATOM 0 HA ALA A 33 -4.459 0.656 7.705 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -6.127 -0.667 6.450 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -4.720 -1.650 6.921 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -6.250 -1.797 7.819 1.00 0.00 H new ATOM 496 N LYS A 34 -7.249 0.180 9.435 1.00 0.00 N ATOM 497 CA LYS A 34 -8.448 0.854 9.940 1.00 0.00 C ATOM 498 C LYS A 34 -8.176 2.318 10.301 1.00 0.00 C ATOM 499 O LYS A 34 -8.654 3.231 9.635 1.00 0.00 O ATOM 500 CB LYS A 34 -8.979 0.123 11.179 1.00 0.00 C ATOM 501 CG LYS A 34 -10.480 -0.116 11.154 1.00 0.00 C ATOM 502 CD LYS A 34 -10.880 -1.053 10.026 1.00 0.00 C ATOM 503 CE LYS A 34 -12.306 -0.801 9.565 1.00 0.00 C ATOM 504 NZ LYS A 34 -13.120 -2.048 9.569 1.00 0.00 N ATOM 0 H LYS A 34 -7.183 -0.805 9.691 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.190 0.833 9.142 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.469 -0.836 11.270 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -8.728 0.703 12.067 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.798 -0.538 12.108 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.998 0.836 11.038 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.198 -0.923 9.186 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -10.782 -2.086 10.359 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.772 -0.061 10.216 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.293 -0.379 8.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.494 -2.222 8.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.525 -2.850 9.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.911 -1.944 10.237 1.00 0.00 H new ATOM 518 N ASP A 35 -7.412 2.528 11.368 1.00 0.00 N ATOM 519 CA ASP A 35 -7.088 3.875 11.842 1.00 0.00 C ATOM 520 C ASP A 35 -6.728 4.839 10.709 1.00 0.00 C ATOM 521 O ASP A 35 -7.480 5.755 10.421 1.00 0.00 O ATOM 522 CB ASP A 35 -5.941 3.807 12.844 1.00 0.00 C ATOM 523 CG ASP A 35 -5.927 4.990 13.792 1.00 0.00 C ATOM 524 OD1 ASP A 35 -6.952 5.221 14.468 1.00 0.00 O ATOM 525 OD2 ASP A 35 -4.892 5.686 13.858 1.00 0.00 O ATOM 0 H ASP A 35 -7.002 1.779 11.926 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.986 4.267 12.319 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -6.020 2.885 13.420 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -4.994 3.766 12.305 1.00 0.00 H new ATOM 530 N GLY A 36 -5.571 4.633 10.084 1.00 0.00 N ATOM 531 CA GLY A 36 -5.120 5.500 9.004 1.00 0.00 C ATOM 532 C GLY A 36 -6.239 5.963 8.094 1.00 0.00 C ATOM 533 O GLY A 36 -6.720 7.089 8.213 1.00 0.00 O ATOM 0 H GLY A 36 -4.930 3.872 10.309 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.625 6.372 9.431 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.375 4.970 8.410 1.00 0.00 H new ATOM 537 N LEU A 37 -6.651 5.096 7.178 1.00 0.00 N ATOM 538 CA LEU A 37 -7.712 5.421 6.241 1.00 0.00 C ATOM 539 C LEU A 37 -8.956 5.968 6.955 1.00 0.00 C ATOM 540 O LEU A 37 -9.790 6.613 6.332 1.00 0.00 O ATOM 541 CB LEU A 37 -8.063 4.194 5.403 1.00 0.00 C ATOM 542 CG LEU A 37 -9.473 4.184 4.812 1.00 0.00 C ATOM 543 CD1 LEU A 37 -9.719 5.452 4.019 1.00 0.00 C ATOM 544 CD2 LEU A 37 -9.670 2.962 3.938 1.00 0.00 C ATOM 0 H LEU A 37 -6.263 4.159 7.066 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.348 6.209 5.582 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.345 4.115 4.587 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.941 3.305 6.022 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.194 4.142 5.628 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.727 5.432 3.604 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.614 6.317 4.674 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.994 5.521 3.208 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.679 2.969 3.525 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.944 2.975 3.125 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.529 2.061 4.535 1.00 0.00 H new ATOM 556 N THR A 38 -9.080 5.722 8.256 1.00 0.00 N ATOM 557 CA THR A 38 -10.228 6.229 9.005 1.00 0.00 C ATOM 558 C THR A 38 -9.881 7.566 9.645 1.00 0.00 C ATOM 559 O THR A 38 -10.678 8.500 9.637 1.00 0.00 O ATOM 560 CB THR A 38 -10.684 5.217 10.061 1.00 0.00 C ATOM 561 OG1 THR A 38 -12.086 5.026 9.990 1.00 0.00 O ATOM 562 CG2 THR A 38 -10.364 5.606 11.484 1.00 0.00 C ATOM 0 H THR A 38 -8.412 5.184 8.808 1.00 0.00 H new ATOM 0 HA THR A 38 -11.057 6.379 8.313 1.00 0.00 H new ATOM 0 HB THR A 38 -10.128 4.310 9.826 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.356 4.341 10.637 1.00 0.00 H new ATOM 0 HG21 THR A 38 -10.723 4.832 12.162 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.286 5.716 11.597 1.00 0.00 H new ATOM 0 HG23 THR A 38 -10.852 6.551 11.721 1.00 0.00 H new ATOM 570 N VAL A 39 -8.672 7.647 10.180 1.00 0.00 N ATOM 571 CA VAL A 39 -8.177 8.861 10.806 1.00 0.00 C ATOM 572 C VAL A 39 -8.325 10.021 9.838 1.00 0.00 C ATOM 573 O VAL A 39 -8.614 11.151 10.230 1.00 0.00 O ATOM 574 CB VAL A 39 -6.704 8.674 11.224 1.00 0.00 C ATOM 575 CG1 VAL A 39 -6.024 9.996 11.541 1.00 0.00 C ATOM 576 CG2 VAL A 39 -6.629 7.732 12.410 1.00 0.00 C ATOM 0 H VAL A 39 -8.008 6.873 10.192 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.758 9.078 11.703 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.167 8.241 10.380 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.989 9.813 11.830 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.046 10.637 10.660 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.548 10.487 12.361 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.588 7.600 12.705 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.192 8.151 13.244 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.053 6.766 12.135 1.00 0.00 H new ATOM 586 N GLU A 40 -8.168 9.707 8.560 1.00 0.00 N ATOM 587 CA GLU A 40 -8.328 10.687 7.507 1.00 0.00 C ATOM 588 C GLU A 40 -9.809 10.997 7.352 1.00 0.00 C ATOM 589 O GLU A 40 -10.187 12.120 7.044 1.00 0.00 O ATOM 590 CB GLU A 40 -7.765 10.143 6.197 1.00 0.00 C ATOM 591 CG GLU A 40 -8.322 8.776 5.839 1.00 0.00 C ATOM 592 CD GLU A 40 -8.616 8.629 4.357 1.00 0.00 C ATOM 593 OE1 GLU A 40 -7.667 8.705 3.549 1.00 0.00 O ATOM 594 OE2 GLU A 40 -9.798 8.437 4.004 1.00 0.00 O ATOM 0 H GLU A 40 -7.928 8.772 8.230 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.786 11.597 7.762 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.989 10.843 5.392 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.679 10.080 6.272 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.610 8.008 6.141 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.237 8.602 6.405 1.00 0.00 H new ATOM 601 N ILE A 41 -10.636 9.976 7.589 1.00 0.00 N ATOM 602 CA ILE A 41 -12.084 10.105 7.503 1.00 0.00 C ATOM 603 C ILE A 41 -12.621 10.865 8.707 1.00 0.00 C ATOM 604 O ILE A 41 -13.203 11.938 8.556 1.00 0.00 O ATOM 605 CB ILE A 41 -12.763 8.724 7.426 1.00 0.00 C ATOM 606 CG1 ILE A 41 -12.200 7.933 6.244 1.00 0.00 C ATOM 607 CG2 ILE A 41 -14.274 8.869 7.314 1.00 0.00 C ATOM 608 CD1 ILE A 41 -12.641 8.442 4.889 1.00 0.00 C ATOM 0 H ILE A 41 -10.317 9.041 7.845 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.313 10.658 6.592 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.551 8.177 8.344 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.111 7.956 6.291 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.501 6.890 6.343 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.731 7.881 7.261 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.654 9.399 8.187 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.520 9.431 6.413 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -12.197 7.826 4.107 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -13.728 8.392 4.818 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -12.316 9.475 4.765 1.00 0.00 H new ATOM 620 N ASN A 42 -12.407 10.316 9.910 1.00 0.00 N ATOM 621 CA ASN A 42 -12.859 10.977 11.131 1.00 0.00 C ATOM 622 C ASN A 42 -12.544 12.464 11.048 1.00 0.00 C ATOM 623 O ASN A 42 -13.335 13.310 11.465 1.00 0.00 O ATOM 624 CB ASN A 42 -12.181 10.372 12.363 1.00 0.00 C ATOM 625 CG ASN A 42 -12.179 8.858 12.350 1.00 0.00 C ATOM 626 OD1 ASN A 42 -12.860 8.229 11.540 1.00 0.00 O ATOM 627 ND2 ASN A 42 -11.408 8.262 13.254 1.00 0.00 N ATOM 0 H ASN A 42 -11.929 9.427 10.059 1.00 0.00 H new ATOM 0 HA ASN A 42 -13.935 10.832 11.227 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.153 10.731 12.419 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.691 10.722 13.261 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.364 7.244 13.295 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -10.860 8.823 13.906 1.00 0.00 H new ATOM 634 N LYS A 43 -11.377 12.766 10.487 1.00 0.00 N ATOM 635 CA LYS A 43 -10.938 14.147 10.321 1.00 0.00 C ATOM 636 C LYS A 43 -11.532 14.767 9.051 1.00 0.00 C ATOM 637 O LYS A 43 -11.938 15.929 9.053 1.00 0.00 O ATOM 638 CB LYS A 43 -9.411 14.215 10.268 1.00 0.00 C ATOM 639 CG LYS A 43 -8.832 15.441 10.955 1.00 0.00 C ATOM 640 CD LYS A 43 -7.321 15.500 10.808 1.00 0.00 C ATOM 641 CE LYS A 43 -6.906 16.430 9.679 1.00 0.00 C ATOM 642 NZ LYS A 43 -6.523 17.778 10.182 1.00 0.00 N ATOM 0 H LYS A 43 -10.717 12.071 10.139 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.293 14.717 11.179 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.999 13.320 10.734 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.091 14.208 9.226 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.275 16.341 10.529 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.095 15.425 12.013 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -6.877 15.841 11.743 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.934 14.499 10.617 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -6.067 15.992 9.138 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -7.727 16.527 8.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -6.214 18.371 9.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -7.341 18.221 10.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.745 17.685 10.866 1.00 0.00 H new ATOM 656 N ALA A 44 -11.571 13.990 7.967 1.00 0.00 N ATOM 657 CA ALA A 44 -12.106 14.471 6.695 1.00 0.00 C ATOM 658 C ALA A 44 -13.593 14.766 6.788 1.00 0.00 C ATOM 659 O ALA A 44 -14.031 15.883 6.520 1.00 0.00 O ATOM 660 CB ALA A 44 -11.853 13.456 5.596 1.00 0.00 C ATOM 0 H ALA A 44 -11.238 13.026 7.946 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.590 15.401 6.455 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.258 13.830 4.655 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -10.780 13.294 5.491 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.339 12.514 5.851 1.00 0.00 H new ATOM 666 N GLU A 45 -14.371 13.755 7.160 1.00 0.00 N ATOM 667 CA GLU A 45 -15.816 13.907 7.283 1.00 0.00 C ATOM 668 C GLU A 45 -16.163 15.146 8.092 1.00 0.00 C ATOM 669 O GLU A 45 -17.050 15.916 7.723 1.00 0.00 O ATOM 670 CB GLU A 45 -16.419 12.668 7.933 1.00 0.00 C ATOM 671 CG GLU A 45 -16.551 11.503 6.974 1.00 0.00 C ATOM 672 CD GLU A 45 -17.982 11.016 6.851 1.00 0.00 C ATOM 673 OE1 GLU A 45 -18.828 11.783 6.344 1.00 0.00 O ATOM 674 OE2 GLU A 45 -18.257 9.870 7.263 1.00 0.00 O ATOM 0 H GLU A 45 -14.025 12.821 7.382 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.235 14.024 6.284 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.798 12.368 8.777 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.402 12.916 8.333 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.186 11.801 5.991 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.919 10.683 7.314 1.00 0.00 H new ATOM 681 N GLU A 46 -15.442 15.344 9.188 1.00 0.00 N ATOM 682 CA GLU A 46 -15.658 16.504 10.038 1.00 0.00 C ATOM 683 C GLU A 46 -15.444 17.783 9.237 1.00 0.00 C ATOM 684 O GLU A 46 -15.949 18.844 9.600 1.00 0.00 O ATOM 685 CB GLU A 46 -14.710 16.470 11.238 1.00 0.00 C ATOM 686 CG GLU A 46 -15.134 15.491 12.321 1.00 0.00 C ATOM 687 CD GLU A 46 -15.811 16.175 13.492 1.00 0.00 C ATOM 688 OE1 GLU A 46 -16.812 16.887 13.267 1.00 0.00 O ATOM 689 OE2 GLU A 46 -15.339 16.000 14.635 1.00 0.00 O ATOM 0 H GLU A 46 -14.704 14.717 9.508 1.00 0.00 H new ATOM 0 HA GLU A 46 -16.684 16.482 10.406 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -13.710 16.207 10.893 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -14.646 17.469 11.668 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -15.813 14.754 11.893 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -14.259 14.949 12.678 1.00 0.00 H new ATOM 696 N VAL A 47 -14.696 17.667 8.137 1.00 0.00 N ATOM 697 CA VAL A 47 -14.420 18.799 7.268 1.00 0.00 C ATOM 698 C VAL A 47 -15.392 18.823 6.090 1.00 0.00 C ATOM 699 O VAL A 47 -15.994 19.854 5.791 1.00 0.00 O ATOM 700 CB VAL A 47 -12.952 18.782 6.767 1.00 0.00 C ATOM 701 CG1 VAL A 47 -12.837 19.134 5.288 1.00 0.00 C ATOM 702 CG2 VAL A 47 -12.127 19.751 7.590 1.00 0.00 C ATOM 0 H VAL A 47 -14.271 16.792 7.831 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.561 19.709 7.851 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.576 17.766 6.887 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.789 19.108 4.988 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -13.402 18.413 4.697 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -13.238 20.134 5.120 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.095 19.740 7.239 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.535 20.756 7.485 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.157 19.455 8.639 1.00 0.00 H new ATOM 712 N PHE A 48 -15.542 17.678 5.427 1.00 0.00 N ATOM 713 CA PHE A 48 -16.441 17.568 4.282 1.00 0.00 C ATOM 714 C PHE A 48 -17.804 18.171 4.598 1.00 0.00 C ATOM 715 O PHE A 48 -18.357 18.933 3.804 1.00 0.00 O ATOM 716 CB PHE A 48 -16.606 16.102 3.871 1.00 0.00 C ATOM 717 CG PHE A 48 -17.571 15.903 2.735 1.00 0.00 C ATOM 718 CD1 PHE A 48 -17.324 16.465 1.493 1.00 0.00 C ATOM 719 CD2 PHE A 48 -18.726 15.158 2.913 1.00 0.00 C ATOM 720 CE1 PHE A 48 -18.211 16.287 0.449 1.00 0.00 C ATOM 721 CE2 PHE A 48 -19.616 14.976 1.872 1.00 0.00 C ATOM 722 CZ PHE A 48 -19.359 15.542 0.638 1.00 0.00 C ATOM 0 H PHE A 48 -15.053 16.815 5.663 1.00 0.00 H new ATOM 0 HA PHE A 48 -15.999 18.124 3.455 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -15.633 15.701 3.586 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -16.947 15.528 4.732 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -16.428 17.049 1.339 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -18.933 14.715 3.876 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -18.007 16.730 -0.515 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.512 14.392 2.023 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.054 15.402 -0.177 1.00 0.00 H new ATOM 732 N ASN A 49 -18.340 17.827 5.762 1.00 0.00 N ATOM 733 CA ASN A 49 -19.639 18.338 6.180 1.00 0.00 C ATOM 734 C ASN A 49 -19.491 19.609 7.014 1.00 0.00 C ATOM 735 O ASN A 49 -20.466 20.096 7.586 1.00 0.00 O ATOM 736 CB ASN A 49 -20.392 17.275 6.981 1.00 0.00 C ATOM 737 CG ASN A 49 -20.400 15.926 6.289 1.00 0.00 C ATOM 738 OD1 ASN A 49 -21.293 15.627 5.497 1.00 0.00 O ATOM 739 ND2 ASN A 49 -19.401 15.103 6.586 1.00 0.00 N ATOM 0 H ASN A 49 -17.897 17.198 6.432 1.00 0.00 H new ATOM 0 HA ASN A 49 -20.207 18.583 5.283 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -19.933 17.173 7.965 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -21.419 17.604 7.141 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -19.353 14.181 6.151 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -18.682 15.392 7.249 1.00 0.00 H new ATOM 746 N LYS A 50 -18.272 20.139 7.091 1.00 0.00 N ATOM 747 CA LYS A 50 -18.024 21.350 7.873 1.00 0.00 C ATOM 748 C LYS A 50 -18.218 22.617 7.043 1.00 0.00 C ATOM 749 O LYS A 50 -18.286 22.567 5.815 1.00 0.00 O ATOM 750 CB LYS A 50 -16.606 21.326 8.436 1.00 0.00 C ATOM 751 CG LYS A 50 -16.531 21.590 9.930 1.00 0.00 C ATOM 752 CD LYS A 50 -15.100 21.843 10.377 1.00 0.00 C ATOM 753 CE LYS A 50 -14.843 23.321 10.617 1.00 0.00 C ATOM 754 NZ LYS A 50 -15.566 23.824 11.817 1.00 0.00 N ATOM 0 H LYS A 50 -17.449 19.755 6.628 1.00 0.00 H new ATOM 0 HA LYS A 50 -18.750 21.366 8.686 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -16.159 20.354 8.226 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -16.006 22.072 7.915 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -17.150 22.452 10.180 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -16.938 20.737 10.473 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -14.900 21.285 11.292 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -14.410 21.471 9.619 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -13.773 23.488 10.742 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -15.154 23.890 9.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -16.061 24.707 11.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -16.258 23.113 12.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -14.885 24.004 12.582 1.00 0.00 H new ATOM 768 N GLU A 51 -18.289 23.753 7.733 1.00 0.00 N ATOM 769 CA GLU A 51 -18.453 25.047 7.080 1.00 0.00 C ATOM 770 C GLU A 51 -17.119 25.747 6.965 1.00 0.00 C ATOM 771 O GLU A 51 -16.881 26.488 6.009 1.00 0.00 O ATOM 772 CB GLU A 51 -19.455 25.920 7.838 1.00 0.00 C ATOM 773 CG GLU A 51 -19.846 27.185 7.092 1.00 0.00 C ATOM 774 CD GLU A 51 -20.772 28.075 7.899 1.00 0.00 C ATOM 775 OE1 GLU A 51 -21.702 27.540 8.538 1.00 0.00 O ATOM 776 OE2 GLU A 51 -20.567 29.307 7.891 1.00 0.00 O ATOM 0 H GLU A 51 -18.235 23.802 8.750 1.00 0.00 H new ATOM 0 HA GLU A 51 -18.847 24.877 6.078 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -20.353 25.336 8.041 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.028 26.194 8.803 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -18.946 27.743 6.833 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -20.333 26.914 6.155 1.00 0.00 H new ATOM 783 N ASP A 52 -16.223 25.478 7.905 1.00 0.00 N ATOM 784 CA ASP A 52 -14.902 26.065 7.833 1.00 0.00 C ATOM 785 C ASP A 52 -14.033 25.233 6.912 1.00 0.00 C ATOM 786 O ASP A 52 -12.815 25.394 6.881 1.00 0.00 O ATOM 787 CB ASP A 52 -14.238 26.193 9.200 1.00 0.00 C ATOM 788 CG ASP A 52 -15.209 26.606 10.289 1.00 0.00 C ATOM 789 OD1 ASP A 52 -16.242 25.922 10.455 1.00 0.00 O ATOM 790 OD2 ASP A 52 -14.939 27.613 10.976 1.00 0.00 O ATOM 0 H ASP A 52 -16.385 24.870 8.708 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.014 27.076 7.440 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.783 25.240 9.468 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.433 26.925 9.141 1.00 0.00 H new ATOM 795 N ALA A 53 -14.676 24.375 6.122 1.00 0.00 N ATOM 796 CA ALA A 53 -13.976 23.561 5.162 1.00 0.00 C ATOM 797 C ALA A 53 -13.625 24.447 3.991 1.00 0.00 C ATOM 798 O ALA A 53 -13.948 24.166 2.843 1.00 0.00 O ATOM 799 CB ALA A 53 -14.820 22.375 4.729 1.00 0.00 C ATOM 0 H ALA A 53 -15.686 24.234 6.137 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.070 23.146 5.603 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.265 21.779 4.004 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.058 21.761 5.598 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -15.744 22.733 4.274 1.00 0.00 H new ATOM 805 N THR A 54 -12.988 25.547 4.331 1.00 0.00 N ATOM 806 CA THR A 54 -12.577 26.546 3.377 1.00 0.00 C ATOM 807 C THR A 54 -11.163 26.266 2.896 1.00 0.00 C ATOM 808 O THR A 54 -10.864 25.183 2.397 1.00 0.00 O ATOM 809 CB THR A 54 -12.702 27.929 4.028 1.00 0.00 C ATOM 810 OG1 THR A 54 -11.673 28.134 4.981 1.00 0.00 O ATOM 811 CG2 THR A 54 -14.028 28.133 4.736 1.00 0.00 C ATOM 0 H THR A 54 -12.739 25.773 5.294 1.00 0.00 H new ATOM 0 HA THR A 54 -13.221 26.518 2.498 1.00 0.00 H new ATOM 0 HB THR A 54 -12.626 28.643 3.208 1.00 0.00 H new ATOM 0 HG1 THR A 54 -11.771 29.023 5.382 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.056 29.130 5.176 1.00 0.00 H new ATOM 0 HG22 THR A 54 -14.843 28.030 4.019 1.00 0.00 H new ATOM 0 HG23 THR A 54 -14.139 27.386 5.522 1.00 0.00 H new ATOM 819 N GLU A 55 -10.313 27.246 3.039 1.00 0.00 N ATOM 820 CA GLU A 55 -8.923 27.125 2.614 1.00 0.00 C ATOM 821 C GLU A 55 -8.035 26.559 3.723 1.00 0.00 C ATOM 822 O GLU A 55 -6.900 26.161 3.470 1.00 0.00 O ATOM 823 CB GLU A 55 -8.390 28.486 2.167 1.00 0.00 C ATOM 824 CG GLU A 55 -8.649 28.790 0.701 1.00 0.00 C ATOM 825 CD GLU A 55 -7.899 30.016 0.218 1.00 0.00 C ATOM 826 OE1 GLU A 55 -7.869 31.023 0.956 1.00 0.00 O ATOM 827 OE2 GLU A 55 -7.344 29.970 -0.899 1.00 0.00 O ATOM 0 H GLU A 55 -10.550 28.149 3.449 1.00 0.00 H new ATOM 0 HA GLU A 55 -8.896 26.428 1.777 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.848 29.264 2.777 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.317 28.525 2.353 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -8.358 27.930 0.098 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -9.718 28.939 0.548 1.00 0.00 H new ATOM 834 N GLU A 56 -8.534 26.558 4.956 1.00 0.00 N ATOM 835 CA GLU A 56 -7.751 26.069 6.087 1.00 0.00 C ATOM 836 C GLU A 56 -8.059 24.619 6.476 1.00 0.00 C ATOM 837 O GLU A 56 -7.148 23.867 6.819 1.00 0.00 O ATOM 838 CB GLU A 56 -7.958 26.977 7.301 1.00 0.00 C ATOM 839 CG GLU A 56 -6.787 27.909 7.567 1.00 0.00 C ATOM 840 CD GLU A 56 -6.531 28.867 6.421 1.00 0.00 C ATOM 841 OE1 GLU A 56 -5.891 28.452 5.432 1.00 0.00 O ATOM 842 OE2 GLU A 56 -6.970 30.033 6.512 1.00 0.00 O ATOM 0 H GLU A 56 -9.469 26.887 5.197 1.00 0.00 H new ATOM 0 HA GLU A 56 -6.711 26.090 5.762 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -8.859 27.572 7.151 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.128 26.359 8.183 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.981 28.479 8.476 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -5.890 27.317 7.747 1.00 0.00 H new ATOM 849 N GLU A 57 -9.337 24.243 6.492 1.00 0.00 N ATOM 850 CA GLU A 57 -9.724 22.896 6.927 1.00 0.00 C ATOM 851 C GLU A 57 -9.678 21.831 5.825 1.00 0.00 C ATOM 852 O GLU A 57 -9.294 20.693 6.091 1.00 0.00 O ATOM 853 CB GLU A 57 -11.121 22.933 7.547 1.00 0.00 C ATOM 854 CG GLU A 57 -11.197 22.267 8.912 1.00 0.00 C ATOM 855 CD GLU A 57 -10.586 23.116 10.010 1.00 0.00 C ATOM 856 OE1 GLU A 57 -10.738 24.354 9.956 1.00 0.00 O ATOM 857 OE2 GLU A 57 -9.957 22.542 10.924 1.00 0.00 O ATOM 0 H GLU A 57 -10.115 24.841 6.213 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.976 22.598 7.662 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.441 23.971 7.640 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.822 22.442 6.872 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.240 22.062 9.154 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -10.684 21.306 8.872 1.00 0.00 H new ATOM 864 N ILE A 58 -10.087 22.172 4.609 1.00 0.00 N ATOM 865 CA ILE A 58 -10.100 21.194 3.520 1.00 0.00 C ATOM 866 C ILE A 58 -8.732 20.559 3.316 1.00 0.00 C ATOM 867 O ILE A 58 -8.562 19.357 3.513 1.00 0.00 O ATOM 868 CB ILE A 58 -10.558 21.821 2.195 1.00 0.00 C ATOM 869 CG1 ILE A 58 -11.895 22.527 2.399 1.00 0.00 C ATOM 870 CG2 ILE A 58 -10.663 20.759 1.106 1.00 0.00 C ATOM 871 CD1 ILE A 58 -12.502 23.083 1.130 1.00 0.00 C ATOM 0 H ILE A 58 -10.411 23.104 4.351 1.00 0.00 H new ATOM 0 HA ILE A 58 -10.812 20.424 3.815 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.819 22.554 1.873 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -12.599 21.826 2.848 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -11.758 23.341 3.110 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -10.989 21.223 0.175 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.689 20.293 0.957 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.386 20.001 1.406 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -13.450 23.568 1.362 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -11.820 23.810 0.689 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -12.674 22.271 0.423 1.00 0.00 H new ATOM 883 N ASN A 59 -7.759 21.369 2.920 1.00 0.00 N ATOM 884 CA ASN A 59 -6.403 20.869 2.693 1.00 0.00 C ATOM 885 C ASN A 59 -5.885 20.184 3.948 1.00 0.00 C ATOM 886 O ASN A 59 -5.114 19.227 3.880 1.00 0.00 O ATOM 887 CB ASN A 59 -5.448 21.999 2.288 1.00 0.00 C ATOM 888 CG ASN A 59 -6.128 23.085 1.479 1.00 0.00 C ATOM 889 OD1 ASN A 59 -6.145 23.043 0.249 1.00 0.00 O ATOM 890 ND2 ASN A 59 -6.690 24.065 2.173 1.00 0.00 N ATOM 0 H ASN A 59 -7.878 22.368 2.750 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.445 20.151 1.874 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.014 22.440 3.185 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -4.625 21.582 1.707 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -7.162 24.828 1.688 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -6.650 24.056 3.192 1.00 0.00 H new ATOM 897 N LEU A 60 -6.330 20.683 5.093 1.00 0.00 N ATOM 898 CA LEU A 60 -5.937 20.131 6.378 1.00 0.00 C ATOM 899 C LEU A 60 -6.620 18.785 6.609 1.00 0.00 C ATOM 900 O LEU A 60 -6.090 17.921 7.308 1.00 0.00 O ATOM 901 CB LEU A 60 -6.308 21.109 7.495 1.00 0.00 C ATOM 902 CG LEU A 60 -5.172 22.018 7.972 1.00 0.00 C ATOM 903 CD1 LEU A 60 -4.571 22.788 6.804 1.00 0.00 C ATOM 904 CD2 LEU A 60 -5.673 22.979 9.043 1.00 0.00 C ATOM 0 H LEU A 60 -6.969 21.476 5.156 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.858 19.976 6.382 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.131 21.734 7.149 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.677 20.539 8.347 1.00 0.00 H new ATOM 0 HG LEU A 60 -4.392 21.392 8.405 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.766 23.428 7.166 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.175 22.086 6.070 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.341 23.403 6.339 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.853 23.618 9.371 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.472 23.596 8.633 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -6.053 22.411 9.892 1.00 0.00 H new ATOM 916 N ALA A 61 -7.803 18.620 6.020 1.00 0.00 N ATOM 917 CA ALA A 61 -8.565 17.385 6.165 1.00 0.00 C ATOM 918 C ALA A 61 -8.332 16.430 4.993 1.00 0.00 C ATOM 919 O ALA A 61 -8.626 15.239 5.086 1.00 0.00 O ATOM 920 CB ALA A 61 -10.043 17.712 6.285 1.00 0.00 C ATOM 0 H ALA A 61 -8.253 19.327 5.438 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.222 16.882 7.069 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.612 16.789 6.393 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -10.206 18.344 7.158 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.373 18.239 5.390 1.00 0.00 H new ATOM 926 N LYS A 62 -7.813 16.960 3.891 1.00 0.00 N ATOM 927 CA LYS A 62 -7.555 16.160 2.703 1.00 0.00 C ATOM 928 C LYS A 62 -6.195 15.465 2.787 1.00 0.00 C ATOM 929 O LYS A 62 -5.975 14.432 2.153 1.00 0.00 O ATOM 930 CB LYS A 62 -7.623 17.041 1.448 1.00 0.00 C ATOM 931 CG LYS A 62 -6.330 17.781 1.135 1.00 0.00 C ATOM 932 CD LYS A 62 -5.387 16.928 0.299 1.00 0.00 C ATOM 933 CE LYS A 62 -5.421 17.332 -1.166 1.00 0.00 C ATOM 934 NZ LYS A 62 -4.061 17.335 -1.775 1.00 0.00 N ATOM 0 H LYS A 62 -7.562 17.944 3.797 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.323 15.389 2.641 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.888 16.418 0.594 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.425 17.769 1.572 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -6.558 18.703 0.601 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.838 18.065 2.065 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -4.371 17.026 0.681 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -5.663 15.878 0.394 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -6.064 16.645 -1.717 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.862 18.325 -1.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.994 18.104 -2.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -3.348 17.479 -1.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.890 16.424 -2.247 1.00 0.00 H new ATOM 948 N GLU A 63 -5.285 16.047 3.566 1.00 0.00 N ATOM 949 CA GLU A 63 -3.939 15.500 3.731 1.00 0.00 C ATOM 950 C GLU A 63 -3.963 13.987 3.942 1.00 0.00 C ATOM 951 O GLU A 63 -3.386 13.234 3.158 1.00 0.00 O ATOM 952 CB GLU A 63 -3.237 16.175 4.912 1.00 0.00 C ATOM 953 CG GLU A 63 -1.726 16.240 4.763 1.00 0.00 C ATOM 954 CD GLU A 63 -1.294 16.931 3.484 1.00 0.00 C ATOM 955 OE1 GLU A 63 -1.728 18.080 3.255 1.00 0.00 O ATOM 956 OE2 GLU A 63 -0.524 16.323 2.712 1.00 0.00 O ATOM 0 H GLU A 63 -5.457 16.902 4.095 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.388 15.702 2.812 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.627 17.187 5.026 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.481 15.634 5.827 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -1.303 16.768 5.617 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.319 15.229 4.780 1.00 0.00 H new ATOM 963 N SER A 64 -4.629 13.549 5.005 1.00 0.00 N ATOM 964 CA SER A 64 -4.720 12.129 5.315 1.00 0.00 C ATOM 965 C SER A 64 -5.699 11.421 4.380 1.00 0.00 C ATOM 966 O SER A 64 -5.724 10.196 4.312 1.00 0.00 O ATOM 967 CB SER A 64 -5.151 11.934 6.769 1.00 0.00 C ATOM 968 OG SER A 64 -4.347 12.703 7.647 1.00 0.00 O ATOM 0 H SER A 64 -5.113 14.157 5.665 1.00 0.00 H new ATOM 0 HA SER A 64 -3.734 11.689 5.170 1.00 0.00 H new ATOM 0 HB2 SER A 64 -6.196 12.221 6.883 1.00 0.00 H new ATOM 0 HB3 SER A 64 -5.079 10.879 7.035 1.00 0.00 H new ATOM 0 HG SER A 64 -4.644 12.562 8.570 1.00 0.00 H new ATOM 974 N LEU A 65 -6.495 12.192 3.652 1.00 0.00 N ATOM 975 CA LEU A 65 -7.455 11.620 2.725 1.00 0.00 C ATOM 976 C LEU A 65 -6.738 11.084 1.502 1.00 0.00 C ATOM 977 O LEU A 65 -7.079 10.027 0.975 1.00 0.00 O ATOM 978 CB LEU A 65 -8.473 12.673 2.306 1.00 0.00 C ATOM 979 CG LEU A 65 -9.804 12.619 3.045 1.00 0.00 C ATOM 980 CD1 LEU A 65 -10.635 13.843 2.706 1.00 0.00 C ATOM 981 CD2 LEU A 65 -10.551 11.343 2.695 1.00 0.00 C ATOM 0 H LEU A 65 -6.493 13.211 3.687 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.976 10.801 3.221 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.033 13.659 2.454 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.664 12.566 1.238 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.615 12.617 4.118 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.585 13.797 3.238 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.096 14.743 3.003 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.822 13.870 1.632 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.500 11.318 3.231 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.739 11.314 1.622 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.950 10.480 2.981 1.00 0.00 H new ATOM 993 N GLU A 66 -5.742 11.835 1.055 1.00 0.00 N ATOM 994 CA GLU A 66 -4.969 11.450 -0.111 1.00 0.00 C ATOM 995 C GLU A 66 -3.743 10.619 0.273 1.00 0.00 C ATOM 996 O GLU A 66 -3.048 10.094 -0.598 1.00 0.00 O ATOM 997 CB GLU A 66 -4.532 12.692 -0.891 1.00 0.00 C ATOM 998 CG GLU A 66 -3.511 13.544 -0.156 1.00 0.00 C ATOM 999 CD GLU A 66 -2.849 14.569 -1.056 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -3.400 14.852 -2.141 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -1.779 15.091 -0.675 1.00 0.00 O ATOM 0 H GLU A 66 -5.452 12.714 1.484 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.610 10.833 -0.741 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.112 12.381 -1.848 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.409 13.300 -1.111 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.000 14.056 0.673 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -2.747 12.897 0.275 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.470 10.509 1.573 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.316 9.751 2.022 1.00 0.00 C ATOM 1010 C GLY A 67 -2.673 8.543 2.871 1.00 0.00 C ATOM 1011 O GLY A 67 -1.830 7.675 3.099 1.00 0.00 O ATOM 0 H GLY A 67 -4.025 10.930 2.318 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.750 9.418 1.152 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.662 10.407 2.596 1.00 0.00 H new ATOM 1015 N ALA A 68 -3.914 8.479 3.348 1.00 0.00 N ATOM 1016 CA ALA A 68 -4.342 7.359 4.180 1.00 0.00 C ATOM 1017 C ALA A 68 -5.007 6.267 3.345 1.00 0.00 C ATOM 1018 O ALA A 68 -4.712 5.084 3.519 1.00 0.00 O ATOM 1019 CB ALA A 68 -5.274 7.836 5.277 1.00 0.00 C ATOM 0 H ALA A 68 -4.633 9.181 3.175 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.454 6.928 4.642 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.583 6.987 5.887 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.757 8.564 5.903 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -6.153 8.301 4.831 1.00 0.00 H new ATOM 1025 N ILE A 69 -5.883 6.658 2.418 1.00 0.00 N ATOM 1026 CA ILE A 69 -6.541 5.696 1.558 1.00 0.00 C ATOM 1027 C ILE A 69 -5.488 5.015 0.719 1.00 0.00 C ATOM 1028 O ILE A 69 -5.501 3.799 0.528 1.00 0.00 O ATOM 1029 CB ILE A 69 -7.569 6.363 0.619 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -6.893 7.426 -0.255 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -8.706 6.969 1.422 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -7.869 8.286 -1.036 1.00 0.00 C ATOM 0 H ILE A 69 -6.146 7.629 2.251 1.00 0.00 H new ATOM 0 HA ILE A 69 -7.077 4.985 2.187 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.983 5.598 -0.038 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.282 8.069 0.378 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.218 6.933 -0.954 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.422 7.435 0.745 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.204 6.187 1.994 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.309 7.721 2.104 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.317 9.014 -1.630 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.463 7.654 -1.696 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.529 8.808 -0.343 1.00 0.00 H new ATOM 1044 N ALA A 70 -4.554 5.827 0.243 1.00 0.00 N ATOM 1045 CA ALA A 70 -3.454 5.328 -0.556 1.00 0.00 C ATOM 1046 C ALA A 70 -2.657 4.304 0.240 1.00 0.00 C ATOM 1047 O ALA A 70 -2.027 3.410 -0.324 1.00 0.00 O ATOM 1048 CB ALA A 70 -2.561 6.469 -1.018 1.00 0.00 C ATOM 0 H ALA A 70 -4.540 6.835 0.399 1.00 0.00 H new ATOM 0 HA ALA A 70 -3.858 4.842 -1.444 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.742 6.070 -1.616 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -3.144 7.166 -1.620 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -2.157 6.989 -0.150 1.00 0.00 H new ATOM 1054 N ARG A 71 -2.712 4.439 1.561 1.00 0.00 N ATOM 1055 CA ARG A 71 -2.021 3.526 2.453 1.00 0.00 C ATOM 1056 C ARG A 71 -2.869 2.277 2.674 1.00 0.00 C ATOM 1057 O ARG A 71 -2.453 1.169 2.339 1.00 0.00 O ATOM 1058 CB ARG A 71 -1.718 4.219 3.786 1.00 0.00 C ATOM 1059 CG ARG A 71 -1.262 3.275 4.887 1.00 0.00 C ATOM 1060 CD ARG A 71 -2.340 3.096 5.944 1.00 0.00 C ATOM 1061 NE ARG A 71 -2.128 3.971 7.095 1.00 0.00 N ATOM 1062 CZ ARG A 71 -1.238 3.730 8.055 1.00 0.00 C ATOM 1063 NH1 ARG A 71 -0.476 2.644 8.006 1.00 0.00 N ATOM 1064 NH2 ARG A 71 -1.109 4.577 9.068 1.00 0.00 N ATOM 0 H ARG A 71 -3.232 5.177 2.036 1.00 0.00 H new ATOM 0 HA ARG A 71 -1.076 3.228 2.000 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -0.946 4.972 3.625 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.612 4.746 4.121 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -1.008 2.307 4.456 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -0.356 3.665 5.351 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -3.316 3.304 5.505 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -2.354 2.058 6.275 1.00 0.00 H new ATOM 0 HE ARG A 71 -2.695 4.816 7.167 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -0.571 1.989 7.230 1.00 0.00 H new ATOM 0 HH12 ARG A 71 0.204 2.465 8.745 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -1.692 5.413 9.111 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -0.427 4.392 9.804 1.00 0.00 H new ATOM 1078 N PHE A 72 -4.067 2.460 3.234 1.00 0.00 N ATOM 1079 CA PHE A 72 -4.968 1.347 3.489 1.00 0.00 C ATOM 1080 C PHE A 72 -5.166 0.487 2.241 1.00 0.00 C ATOM 1081 O PHE A 72 -5.244 -0.737 2.330 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.316 1.870 3.976 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.205 0.791 4.516 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -7.664 -0.218 3.690 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -7.580 0.788 5.847 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -8.479 -1.212 4.181 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -8.398 -0.203 6.346 1.00 0.00 C ATOM 1088 CZ PHE A 72 -8.847 -1.205 5.512 1.00 0.00 C ATOM 0 H PHE A 72 -4.430 3.370 3.517 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.517 0.722 4.260 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.150 2.618 4.751 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.823 2.372 3.152 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.380 -0.226 2.648 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -7.228 1.571 6.503 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -8.830 -1.996 3.527 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -8.686 -0.195 7.387 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.486 -1.984 5.900 1.00 0.00 H new ATOM 1098 N ASN A 73 -5.253 1.129 1.079 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.447 0.407 -0.178 1.00 0.00 C ATOM 1100 C ASN A 73 -4.510 -0.788 -0.261 1.00 0.00 C ATOM 1101 O ASN A 73 -4.885 -1.858 -0.743 1.00 0.00 O ATOM 1102 CB ASN A 73 -5.205 1.334 -1.370 1.00 0.00 C ATOM 1103 CG ASN A 73 -6.347 2.303 -1.589 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -7.507 1.978 -1.340 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -6.024 3.497 -2.063 1.00 0.00 N ATOM 0 H ASN A 73 -5.193 2.142 0.980 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.477 0.050 -0.207 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -4.283 1.893 -1.210 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -5.063 0.735 -2.270 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -6.751 4.191 -2.236 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.048 3.723 -2.255 1.00 0.00 H new ATOM 1112 N SER A 74 -3.288 -0.594 0.214 1.00 0.00 N ATOM 1113 CA SER A 74 -2.285 -1.653 0.197 1.00 0.00 C ATOM 1114 C SER A 74 -2.078 -2.257 1.587 1.00 0.00 C ATOM 1115 O SER A 74 -1.005 -2.779 1.887 1.00 0.00 O ATOM 1116 CB SER A 74 -0.957 -1.111 -0.333 1.00 0.00 C ATOM 1117 OG SER A 74 -0.987 -0.978 -1.745 1.00 0.00 O ATOM 0 H SER A 74 -2.966 0.286 0.616 1.00 0.00 H new ATOM 0 HA SER A 74 -2.648 -2.441 -0.463 1.00 0.00 H new ATOM 0 HB2 SER A 74 -0.748 -0.143 0.122 1.00 0.00 H new ATOM 0 HB3 SER A 74 -0.146 -1.780 -0.045 1.00 0.00 H new ATOM 0 HG SER A 74 -0.127 -0.628 -2.059 1.00 0.00 H new ATOM 1123 N LEU A 75 -3.106 -2.185 2.430 1.00 0.00 N ATOM 1124 CA LEU A 75 -3.020 -2.729 3.785 1.00 0.00 C ATOM 1125 C LEU A 75 -3.532 -4.168 3.838 1.00 0.00 C ATOM 1126 O LEU A 75 -3.026 -4.991 4.599 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.822 -1.860 4.763 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.995 -0.891 5.611 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -2.202 -1.646 6.665 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -2.069 -0.061 4.736 1.00 0.00 C ATOM 0 H LEU A 75 -4.004 -1.758 2.201 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.970 -2.725 4.077 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.554 -1.285 4.196 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.380 -2.516 5.431 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.681 -0.212 6.118 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.620 -0.940 7.258 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.887 -2.189 7.316 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.529 -2.352 6.178 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.492 0.620 5.361 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.390 -0.721 4.196 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.660 0.514 4.023 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.539 -4.461 3.022 1.00 0.00 N ATOM 1143 CA LEU A 76 -5.143 -5.792 2.959 1.00 0.00 C ATOM 1144 C LEU A 76 -4.226 -6.790 2.266 1.00 0.00 C ATOM 1145 O LEU A 76 -4.643 -7.486 1.339 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.472 -5.721 2.201 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.470 -4.856 0.927 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.858 -3.421 1.257 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -5.112 -4.902 0.213 1.00 0.00 C ATOM 0 H LEU A 76 -4.961 -3.785 2.385 1.00 0.00 H new ATOM 0 HA LEU A 76 -5.309 -6.131 3.982 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.769 -6.734 1.929 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.235 -5.336 2.878 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.212 -5.270 0.244 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.852 -2.824 0.345 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.856 -3.405 1.694 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.144 -3.005 1.968 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.150 -4.280 -0.681 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.336 -4.529 0.882 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.884 -5.930 -0.070 1.00 0.00 H new ATOM 1161 N ILE A 77 -2.972 -6.845 2.694 1.00 0.00 N ATOM 1162 CA ILE A 77 -2.011 -7.749 2.073 1.00 0.00 C ATOM 1163 C ILE A 77 -2.053 -7.549 0.582 1.00 0.00 C ATOM 1164 O ILE A 77 -2.391 -8.461 -0.172 1.00 0.00 O ATOM 1165 CB ILE A 77 -2.309 -9.223 2.411 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -2.659 -9.374 3.894 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -1.127 -10.105 2.046 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -1.642 -8.763 4.835 1.00 0.00 C ATOM 0 H ILE A 77 -2.599 -6.283 3.459 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.019 -7.520 2.462 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.168 -9.544 1.822 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.630 -8.912 4.076 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -2.762 -10.434 4.126 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.357 -11.142 2.292 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.927 -10.022 0.978 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.248 -9.785 2.606 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.964 -8.913 5.866 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.674 -9.240 4.684 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.555 -7.695 4.634 1.00 0.00 H new ATOM 1180 N GLU A 78 -1.731 -6.317 0.179 1.00 0.00 N ATOM 1181 CA GLU A 78 -1.739 -5.920 -1.219 1.00 0.00 C ATOM 1182 C GLU A 78 -1.896 -7.118 -2.131 1.00 0.00 C ATOM 1183 O GLU A 78 -1.097 -8.055 -2.100 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.476 -5.138 -1.568 1.00 0.00 C ATOM 1185 CG GLU A 78 -0.774 -3.744 -2.092 1.00 0.00 C ATOM 1186 CD GLU A 78 -0.590 -3.633 -3.593 1.00 0.00 C ATOM 1187 OE1 GLU A 78 -1.441 -4.165 -4.336 1.00 0.00 O ATOM 1188 OE2 GLU A 78 0.406 -3.015 -4.025 1.00 0.00 O ATOM 0 H GLU A 78 -1.458 -5.571 0.819 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.599 -5.269 -1.373 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.155 -5.061 -0.682 1.00 0.00 H new ATOM 0 HB3 GLU A 78 0.092 -5.689 -2.317 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.798 -3.474 -1.834 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.121 -3.026 -1.596 1.00 0.00 H new ATOM 1195 N GLU A 79 -2.949 -7.079 -2.924 1.00 0.00 N ATOM 1196 CA GLU A 79 -3.275 -8.148 -3.855 1.00 0.00 C ATOM 1197 C GLU A 79 -2.026 -8.777 -4.485 1.00 0.00 C ATOM 1198 O GLU A 79 -2.062 -9.925 -4.926 1.00 0.00 O ATOM 1199 CB GLU A 79 -4.222 -7.606 -4.924 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.345 -6.752 -4.340 1.00 0.00 C ATOM 1201 CD GLU A 79 -6.700 -7.084 -4.933 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -7.114 -8.260 -4.844 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -7.347 -6.170 -5.485 1.00 0.00 O ATOM 0 H GLU A 79 -3.608 -6.301 -2.943 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.767 -8.948 -3.301 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.654 -7.011 -5.639 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.655 -8.440 -5.476 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.381 -6.895 -3.260 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.124 -5.699 -4.515 1.00 0.00 H new ATOM 1210 N SER A 80 -0.919 -8.032 -4.514 1.00 0.00 N ATOM 1211 CA SER A 80 0.321 -8.549 -5.077 1.00 0.00 C ATOM 1212 C SER A 80 1.558 -8.111 -4.278 1.00 0.00 C ATOM 1213 O SER A 80 2.612 -7.874 -4.866 1.00 0.00 O ATOM 1214 CB SER A 80 0.463 -8.100 -6.532 1.00 0.00 C ATOM 1215 OG SER A 80 1.535 -8.768 -7.171 1.00 0.00 O ATOM 0 H SER A 80 -0.860 -7.078 -4.157 1.00 0.00 H new ATOM 0 HA SER A 80 0.267 -9.636 -5.025 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.465 -8.299 -7.069 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.628 -7.023 -6.569 1.00 0.00 H new ATOM 0 HG SER A 80 2.336 -8.714 -6.609 1.00 0.00 H new ATOM 1221 N THR A 81 1.451 -8.012 -2.943 1.00 0.00 N ATOM 1222 CA THR A 81 2.609 -7.613 -2.139 1.00 0.00 C ATOM 1223 C THR A 81 3.544 -8.791 -1.880 1.00 0.00 C ATOM 1224 O THR A 81 4.658 -8.608 -1.391 1.00 0.00 O ATOM 1225 CB THR A 81 2.168 -6.998 -0.814 1.00 0.00 C ATOM 1226 OG1 THR A 81 3.269 -6.884 0.071 1.00 0.00 O ATOM 1227 CG2 THR A 81 1.092 -7.795 -0.117 1.00 0.00 C ATOM 0 H THR A 81 0.599 -8.197 -2.413 1.00 0.00 H new ATOM 0 HA THR A 81 3.155 -6.863 -2.711 1.00 0.00 H new ATOM 0 HB THR A 81 1.761 -6.018 -1.065 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.082 -7.200 -0.376 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.824 -7.304 0.818 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.213 -7.859 -0.759 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.461 -8.799 0.093 1.00 0.00 H new ATOM 1235 N GLY A 82 3.098 -10.000 -2.217 1.00 0.00 N ATOM 1236 CA GLY A 82 3.930 -11.172 -2.016 1.00 0.00 C ATOM 1237 C GLY A 82 5.322 -10.987 -2.588 1.00 0.00 C ATOM 1238 O GLY A 82 6.283 -11.593 -2.117 1.00 0.00 O ATOM 0 H GLY A 82 2.181 -10.187 -2.623 1.00 0.00 H new ATOM 0 HA2 GLY A 82 4.002 -11.387 -0.950 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.458 -12.036 -2.484 1.00 0.00 H new ATOM 1242 N ASP A 83 5.428 -10.136 -3.605 1.00 0.00 N ATOM 1243 CA ASP A 83 6.709 -9.858 -4.244 1.00 0.00 C ATOM 1244 C ASP A 83 7.535 -8.899 -3.394 1.00 0.00 C ATOM 1245 O ASP A 83 7.618 -7.705 -3.685 1.00 0.00 O ATOM 1246 CB ASP A 83 6.492 -9.268 -5.638 1.00 0.00 C ATOM 1247 CG ASP A 83 7.637 -9.576 -6.582 1.00 0.00 C ATOM 1248 OD1 ASP A 83 8.393 -10.531 -6.306 1.00 0.00 O ATOM 1249 OD2 ASP A 83 7.779 -8.861 -7.597 1.00 0.00 O ATOM 0 H ASP A 83 4.640 -9.626 -4.004 1.00 0.00 H new ATOM 0 HA ASP A 83 7.254 -10.797 -4.340 1.00 0.00 H new ATOM 0 HB2 ASP A 83 5.565 -9.661 -6.055 1.00 0.00 H new ATOM 0 HB3 ASP A 83 6.372 -8.188 -5.557 1.00 0.00 H new ATOM 1254 N PHE A 84 8.137 -9.432 -2.338 1.00 0.00 N ATOM 1255 CA PHE A 84 8.954 -8.636 -1.431 1.00 0.00 C ATOM 1256 C PHE A 84 10.117 -7.979 -2.159 1.00 0.00 C ATOM 1257 O PHE A 84 10.169 -6.757 -2.295 1.00 0.00 O ATOM 1258 CB PHE A 84 9.488 -9.518 -0.305 1.00 0.00 C ATOM 1259 CG PHE A 84 8.524 -9.704 0.831 1.00 0.00 C ATOM 1260 CD1 PHE A 84 7.678 -8.679 1.225 1.00 0.00 C ATOM 1261 CD2 PHE A 84 8.467 -10.909 1.509 1.00 0.00 C ATOM 1262 CE1 PHE A 84 6.798 -8.854 2.268 1.00 0.00 C ATOM 1263 CE2 PHE A 84 7.587 -11.090 2.558 1.00 0.00 C ATOM 1264 CZ PHE A 84 6.751 -10.061 2.938 1.00 0.00 C ATOM 0 H PHE A 84 8.074 -10.419 -2.088 1.00 0.00 H new ATOM 0 HA PHE A 84 8.324 -7.849 -1.017 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.746 -10.495 -0.713 1.00 0.00 H new ATOM 0 HB3 PHE A 84 10.409 -9.080 0.081 1.00 0.00 H new ATOM 0 HD1 PHE A 84 7.710 -7.732 0.707 1.00 0.00 H new ATOM 0 HD2 PHE A 84 9.119 -11.718 1.214 1.00 0.00 H new ATOM 0 HE1 PHE A 84 6.144 -8.047 2.563 1.00 0.00 H new ATOM 0 HE2 PHE A 84 7.554 -12.035 3.080 1.00 0.00 H new ATOM 0 HZ PHE A 84 6.061 -10.199 3.758 1.00 0.00 H new ATOM 1274 N ASN A 85 11.049 -8.800 -2.624 1.00 0.00 N ATOM 1275 CA ASN A 85 12.217 -8.298 -3.338 1.00 0.00 C ATOM 1276 C ASN A 85 11.815 -7.634 -4.650 1.00 0.00 C ATOM 1277 O ASN A 85 12.621 -6.949 -5.280 1.00 0.00 O ATOM 1278 CB ASN A 85 13.197 -9.440 -3.620 1.00 0.00 C ATOM 1279 CG ASN A 85 13.902 -9.921 -2.367 1.00 0.00 C ATOM 1280 OD1 ASN A 85 14.903 -9.342 -1.944 1.00 0.00 O ATOM 1281 ND2 ASN A 85 13.383 -10.986 -1.769 1.00 0.00 N ATOM 0 H ASN A 85 11.020 -9.814 -2.520 1.00 0.00 H new ATOM 0 HA ASN A 85 12.700 -7.553 -2.706 1.00 0.00 H new ATOM 0 HB2 ASN A 85 12.659 -10.273 -4.073 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.939 -9.107 -4.346 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.815 -11.357 -0.923 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.552 -11.434 -2.156 1.00 0.00 H new ATOM 1288 N GLY A 86 10.570 -7.853 -5.070 1.00 0.00 N ATOM 1289 CA GLY A 86 10.105 -7.281 -6.315 1.00 0.00 C ATOM 1290 C GLY A 86 10.747 -7.947 -7.514 1.00 0.00 C ATOM 1291 O GLY A 86 10.599 -7.487 -8.646 1.00 0.00 O ATOM 0 H GLY A 86 9.881 -8.414 -4.570 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.022 -7.383 -6.380 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.327 -6.214 -6.330 1.00 0.00 H new ATOM 1295 N ASN A 87 11.469 -9.038 -7.261 1.00 0.00 N ATOM 1296 CA ASN A 87 12.144 -9.773 -8.326 1.00 0.00 C ATOM 1297 C ASN A 87 11.190 -10.744 -9.017 1.00 0.00 C ATOM 1298 O ASN A 87 11.395 -11.108 -10.176 1.00 0.00 O ATOM 1299 CB ASN A 87 13.346 -10.535 -7.764 1.00 0.00 C ATOM 1300 CG ASN A 87 12.974 -11.408 -6.581 1.00 0.00 C ATOM 1301 OD1 ASN A 87 11.797 -11.569 -6.259 1.00 0.00 O ATOM 1302 ND2 ASN A 87 13.980 -11.976 -5.926 1.00 0.00 N ATOM 0 H ASN A 87 11.600 -9.431 -6.329 1.00 0.00 H new ATOM 0 HA ASN A 87 12.490 -9.050 -9.065 1.00 0.00 H new ATOM 0 HB2 ASN A 87 13.779 -11.156 -8.549 1.00 0.00 H new ATOM 0 HB3 ASN A 87 14.114 -9.824 -7.460 1.00 0.00 H new ATOM 0 HD21 ASN A 87 13.792 -12.573 -5.121 1.00 0.00 H new ATOM 0 HD22 ASN A 87 14.941 -11.815 -6.228 1.00 0.00 H new ATOM 1309 N GLY A 88 10.149 -11.160 -8.303 1.00 0.00 N ATOM 1310 CA GLY A 88 9.183 -12.083 -8.872 1.00 0.00 C ATOM 1311 C GLY A 88 9.358 -13.500 -8.361 1.00 0.00 C ATOM 1312 O GLY A 88 9.325 -14.455 -9.137 1.00 0.00 O ATOM 0 H GLY A 88 9.957 -10.875 -7.343 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.176 -11.738 -8.638 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.278 -12.078 -9.958 1.00 0.00 H new ATOM 1316 N LYS A 89 9.539 -13.638 -7.051 1.00 0.00 N ATOM 1317 CA LYS A 89 9.715 -14.948 -6.437 1.00 0.00 C ATOM 1318 C LYS A 89 9.380 -14.894 -4.950 1.00 0.00 C ATOM 1319 O LYS A 89 10.048 -14.204 -4.180 1.00 0.00 O ATOM 1320 CB LYS A 89 11.149 -15.444 -6.636 1.00 0.00 C ATOM 1321 CG LYS A 89 12.190 -14.612 -5.901 1.00 0.00 C ATOM 1322 CD LYS A 89 12.765 -15.356 -4.704 1.00 0.00 C ATOM 1323 CE LYS A 89 14.270 -15.531 -4.827 1.00 0.00 C ATOM 1324 NZ LYS A 89 14.889 -15.940 -3.536 1.00 0.00 N ATOM 0 H LYS A 89 9.567 -12.858 -6.395 1.00 0.00 H new ATOM 0 HA LYS A 89 9.032 -15.646 -6.922 1.00 0.00 H new ATOM 0 HB2 LYS A 89 11.217 -16.478 -6.297 1.00 0.00 H new ATOM 0 HB3 LYS A 89 11.381 -15.442 -7.701 1.00 0.00 H new ATOM 0 HG2 LYS A 89 12.995 -14.349 -6.587 1.00 0.00 H new ATOM 0 HG3 LYS A 89 11.739 -13.678 -5.566 1.00 0.00 H new ATOM 0 HD2 LYS A 89 12.535 -14.809 -3.790 1.00 0.00 H new ATOM 0 HD3 LYS A 89 12.290 -16.333 -4.619 1.00 0.00 H new ATOM 0 HE2 LYS A 89 14.487 -16.281 -5.587 1.00 0.00 H new ATOM 0 HE3 LYS A 89 14.718 -14.596 -5.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 15.917 -15.788 -3.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 14.488 -15.371 -2.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 14.695 -16.947 -3.361 1.00 0.00 H new ATOM 1338 N ILE A 90 8.340 -15.618 -4.555 1.00 0.00 N ATOM 1339 CA ILE A 90 7.918 -15.643 -3.159 1.00 0.00 C ATOM 1340 C ILE A 90 8.253 -16.977 -2.505 1.00 0.00 C ATOM 1341 O ILE A 90 7.619 -17.995 -2.784 1.00 0.00 O ATOM 1342 CB ILE A 90 6.405 -15.376 -3.013 1.00 0.00 C ATOM 1343 CG1 ILE A 90 5.898 -14.481 -4.147 1.00 0.00 C ATOM 1344 CG2 ILE A 90 6.113 -14.738 -1.664 1.00 0.00 C ATOM 1345 CD1 ILE A 90 6.729 -13.231 -4.347 1.00 0.00 C ATOM 0 H ILE A 90 7.775 -16.194 -5.179 1.00 0.00 H new ATOM 0 HA ILE A 90 8.465 -14.846 -2.656 1.00 0.00 H new ATOM 0 HB ILE A 90 5.880 -16.330 -3.073 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.888 -15.054 -5.074 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.867 -14.193 -3.939 1.00 0.00 H new ATOM 0 HG21 ILE A 90 5.042 -14.554 -1.572 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.436 -15.408 -0.867 1.00 0.00 H new ATOM 0 HG23 ILE A 90 6.651 -13.794 -1.584 1.00 0.00 H new ATOM 0 HD11 ILE A 90 6.313 -12.644 -5.166 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.718 -12.637 -3.433 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.755 -13.511 -4.586 1.00 0.00 H new ATOM 1357 N ASP A 91 9.253 -16.961 -1.633 1.00 0.00 N ATOM 1358 CA ASP A 91 9.678 -18.168 -0.931 1.00 0.00 C ATOM 1359 C ASP A 91 10.487 -17.812 0.307 1.00 0.00 C ATOM 1360 O ASP A 91 10.048 -18.042 1.434 1.00 0.00 O ATOM 1361 CB ASP A 91 10.501 -19.062 -1.863 1.00 0.00 C ATOM 1362 CG ASP A 91 9.942 -20.467 -1.959 1.00 0.00 C ATOM 1363 OD1 ASP A 91 9.840 -21.138 -0.910 1.00 0.00 O ATOM 1364 OD2 ASP A 91 9.606 -20.897 -3.081 1.00 0.00 O ATOM 0 H ASP A 91 9.786 -16.125 -1.394 1.00 0.00 H new ATOM 0 HA ASP A 91 8.789 -18.714 -0.616 1.00 0.00 H new ATOM 0 HB2 ASP A 91 10.529 -18.617 -2.857 1.00 0.00 H new ATOM 0 HB3 ASP A 91 11.529 -19.107 -1.504 1.00 0.00 H new ATOM 1369 N ILE A 92 11.663 -17.238 0.094 1.00 0.00 N ATOM 1370 CA ILE A 92 12.517 -16.841 1.203 1.00 0.00 C ATOM 1371 C ILE A 92 12.322 -15.381 1.543 1.00 0.00 C ATOM 1372 O ILE A 92 12.780 -14.912 2.585 1.00 0.00 O ATOM 1373 CB ILE A 92 13.996 -17.098 0.916 1.00 0.00 C ATOM 1374 CG1 ILE A 92 14.383 -16.525 -0.444 1.00 0.00 C ATOM 1375 CG2 ILE A 92 14.261 -18.587 0.988 1.00 0.00 C ATOM 1376 CD1 ILE A 92 15.551 -15.566 -0.382 1.00 0.00 C ATOM 0 H ILE A 92 12.045 -17.038 -0.830 1.00 0.00 H new ATOM 0 HA ILE A 92 12.222 -17.456 2.053 1.00 0.00 H new ATOM 0 HB ILE A 92 14.610 -16.597 1.664 1.00 0.00 H new ATOM 0 HG12 ILE A 92 14.631 -17.345 -1.118 1.00 0.00 H new ATOM 0 HG13 ILE A 92 13.522 -16.010 -0.871 1.00 0.00 H new ATOM 0 HG21 ILE A 92 15.314 -18.779 0.784 1.00 0.00 H new ATOM 0 HG22 ILE A 92 14.011 -18.953 1.984 1.00 0.00 H new ATOM 0 HG23 ILE A 92 13.648 -19.102 0.248 1.00 0.00 H new ATOM 0 HD11 ILE A 92 15.772 -15.197 -1.383 1.00 0.00 H new ATOM 0 HD12 ILE A 92 15.299 -14.727 0.266 1.00 0.00 H new ATOM 0 HD13 ILE A 92 16.425 -16.082 0.016 1.00 0.00 H new ATOM 1388 N GLY A 93 11.603 -14.665 0.683 1.00 0.00 N ATOM 1389 CA GLY A 93 11.331 -13.276 0.957 1.00 0.00 C ATOM 1390 C GLY A 93 10.665 -13.118 2.307 1.00 0.00 C ATOM 1391 O GLY A 93 10.598 -12.019 2.858 1.00 0.00 O ATOM 0 H GLY A 93 11.210 -15.022 -0.188 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.260 -12.707 0.936 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.688 -12.866 0.178 1.00 0.00 H new ATOM 1395 N ASP A 94 10.182 -14.239 2.844 1.00 0.00 N ATOM 1396 CA ASP A 94 9.529 -14.254 4.140 1.00 0.00 C ATOM 1397 C ASP A 94 10.516 -14.676 5.219 1.00 0.00 C ATOM 1398 O ASP A 94 10.377 -14.300 6.383 1.00 0.00 O ATOM 1399 CB ASP A 94 8.333 -15.211 4.112 1.00 0.00 C ATOM 1400 CG ASP A 94 7.646 -15.340 5.460 1.00 0.00 C ATOM 1401 OD1 ASP A 94 8.329 -15.698 6.442 1.00 0.00 O ATOM 1402 OD2 ASP A 94 6.426 -15.088 5.530 1.00 0.00 O ATOM 0 H ASP A 94 10.235 -15.152 2.392 1.00 0.00 H new ATOM 0 HA ASP A 94 9.171 -13.250 4.368 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.611 -14.860 3.374 1.00 0.00 H new ATOM 0 HB3 ASP A 94 8.669 -16.195 3.786 1.00 0.00 H new ATOM 1407 N LEU A 95 11.512 -15.470 4.827 1.00 0.00 N ATOM 1408 CA LEU A 95 12.513 -15.947 5.773 1.00 0.00 C ATOM 1409 C LEU A 95 13.879 -15.314 5.523 1.00 0.00 C ATOM 1410 O LEU A 95 14.908 -15.925 5.813 1.00 0.00 O ATOM 1411 CB LEU A 95 12.628 -17.471 5.693 1.00 0.00 C ATOM 1412 CG LEU A 95 11.630 -18.243 6.558 1.00 0.00 C ATOM 1413 CD1 LEU A 95 11.700 -17.776 8.004 1.00 0.00 C ATOM 1414 CD2 LEU A 95 10.219 -18.086 6.012 1.00 0.00 C ATOM 0 H LEU A 95 11.645 -15.793 3.869 1.00 0.00 H new ATOM 0 HA LEU A 95 12.186 -15.654 6.771 1.00 0.00 H new ATOM 0 HB2 LEU A 95 12.497 -17.776 4.655 1.00 0.00 H new ATOM 0 HB3 LEU A 95 13.638 -17.760 5.985 1.00 0.00 H new ATOM 0 HG LEU A 95 11.895 -19.300 6.528 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.983 -18.337 8.603 1.00 0.00 H new ATOM 0 HD12 LEU A 95 12.705 -17.942 8.392 1.00 0.00 H new ATOM 0 HD13 LEU A 95 11.463 -16.713 8.055 1.00 0.00 H new ATOM 0 HD21 LEU A 95 9.522 -18.642 6.639 1.00 0.00 H new ATOM 0 HD22 LEU A 95 9.945 -17.031 6.011 1.00 0.00 H new ATOM 0 HD23 LEU A 95 10.178 -18.473 4.994 1.00 0.00 H new ATOM 1426 N ALA A 96 13.900 -14.092 4.989 1.00 0.00 N ATOM 1427 CA ALA A 96 15.172 -13.422 4.724 1.00 0.00 C ATOM 1428 C ALA A 96 15.002 -11.986 4.220 1.00 0.00 C ATOM 1429 O ALA A 96 15.859 -11.139 4.469 1.00 0.00 O ATOM 1430 CB ALA A 96 15.985 -14.229 3.723 1.00 0.00 C ATOM 0 H ALA A 96 13.070 -13.556 4.736 1.00 0.00 H new ATOM 0 HA ALA A 96 15.700 -13.362 5.676 1.00 0.00 H new ATOM 0 HB1 ALA A 96 16.931 -13.723 3.531 1.00 0.00 H new ATOM 0 HB2 ALA A 96 16.180 -15.222 4.129 1.00 0.00 H new ATOM 0 HB3 ALA A 96 15.427 -14.321 2.791 1.00 0.00 H new ATOM 1436 N MET A 97 13.925 -11.714 3.490 1.00 0.00 N ATOM 1437 CA MET A 97 13.709 -10.373 2.945 1.00 0.00 C ATOM 1438 C MET A 97 12.923 -9.468 3.894 1.00 0.00 C ATOM 1439 O MET A 97 13.490 -8.560 4.501 1.00 0.00 O ATOM 1440 CB MET A 97 12.996 -10.459 1.593 1.00 0.00 C ATOM 1441 CG MET A 97 13.431 -9.400 0.591 1.00 0.00 C ATOM 1442 SD MET A 97 13.566 -7.750 1.310 1.00 0.00 S ATOM 1443 CE MET A 97 13.529 -6.743 -0.168 1.00 0.00 C ATOM 0 H MET A 97 13.197 -12.391 3.263 1.00 0.00 H new ATOM 0 HA MET A 97 14.693 -9.923 2.815 1.00 0.00 H new ATOM 0 HB2 MET A 97 13.174 -11.445 1.163 1.00 0.00 H new ATOM 0 HB3 MET A 97 11.922 -10.371 1.755 1.00 0.00 H new ATOM 0 HG2 MET A 97 14.394 -9.684 0.168 1.00 0.00 H new ATOM 0 HG3 MET A 97 12.717 -9.373 -0.232 1.00 0.00 H new ATOM 0 HE1 MET A 97 13.622 -5.692 0.105 1.00 0.00 H new ATOM 0 HE2 MET A 97 14.357 -7.023 -0.820 1.00 0.00 H new ATOM 0 HE3 MET A 97 12.586 -6.900 -0.692 1.00 0.00 H new ATOM 1453 N VAL A 98 11.615 -9.689 3.996 1.00 0.00 N ATOM 1454 CA VAL A 98 10.771 -8.855 4.846 1.00 0.00 C ATOM 1455 C VAL A 98 11.150 -8.947 6.324 1.00 0.00 C ATOM 1456 O VAL A 98 11.363 -7.925 6.976 1.00 0.00 O ATOM 1457 CB VAL A 98 9.264 -9.176 4.666 1.00 0.00 C ATOM 1458 CG1 VAL A 98 8.828 -10.382 5.487 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.427 -7.964 5.031 1.00 0.00 C ATOM 0 H VAL A 98 11.120 -10.433 3.504 1.00 0.00 H new ATOM 0 HA VAL A 98 10.948 -7.831 4.518 1.00 0.00 H new ATOM 0 HB VAL A 98 9.108 -9.426 3.617 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.766 -10.566 5.327 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.399 -11.258 5.178 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.007 -10.186 6.544 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.371 -8.199 4.901 1.00 0.00 H new ATOM 0 HG22 VAL A 98 8.614 -7.692 6.070 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.695 -7.129 4.384 1.00 0.00 H new ATOM 1469 N SER A 99 11.218 -10.161 6.860 1.00 0.00 N ATOM 1470 CA SER A 99 11.547 -10.338 8.268 1.00 0.00 C ATOM 1471 C SER A 99 12.931 -9.795 8.612 1.00 0.00 C ATOM 1472 O SER A 99 13.270 -9.659 9.787 1.00 0.00 O ATOM 1473 CB SER A 99 11.447 -11.803 8.681 1.00 0.00 C ATOM 1474 OG SER A 99 12.525 -12.559 8.156 1.00 0.00 O ATOM 0 H SER A 99 11.052 -11.027 6.347 1.00 0.00 H new ATOM 0 HA SER A 99 10.812 -9.761 8.830 1.00 0.00 H new ATOM 0 HB2 SER A 99 11.443 -11.877 9.768 1.00 0.00 H new ATOM 0 HB3 SER A 99 10.503 -12.219 8.330 1.00 0.00 H new ATOM 0 HG SER A 99 12.177 -13.252 7.557 1.00 0.00 H new ATOM 1480 N LYS A 100 13.731 -9.487 7.599 1.00 0.00 N ATOM 1481 CA LYS A 100 15.068 -8.965 7.837 1.00 0.00 C ATOM 1482 C LYS A 100 15.010 -7.544 8.372 1.00 0.00 C ATOM 1483 O LYS A 100 15.812 -7.158 9.221 1.00 0.00 O ATOM 1484 CB LYS A 100 15.905 -9.026 6.555 1.00 0.00 C ATOM 1485 CG LYS A 100 17.218 -8.253 6.626 1.00 0.00 C ATOM 1486 CD LYS A 100 17.049 -6.793 6.220 1.00 0.00 C ATOM 1487 CE LYS A 100 16.351 -6.654 4.876 1.00 0.00 C ATOM 1488 NZ LYS A 100 16.746 -5.404 4.169 1.00 0.00 N ATOM 0 H LYS A 100 13.480 -9.588 6.616 1.00 0.00 H new ATOM 0 HA LYS A 100 15.546 -9.590 8.591 1.00 0.00 H new ATOM 0 HB2 LYS A 100 16.123 -10.069 6.326 1.00 0.00 H new ATOM 0 HB3 LYS A 100 15.311 -8.636 5.728 1.00 0.00 H new ATOM 0 HG2 LYS A 100 17.613 -8.303 7.641 1.00 0.00 H new ATOM 0 HG3 LYS A 100 17.952 -8.727 5.975 1.00 0.00 H new ATOM 0 HD2 LYS A 100 16.474 -6.268 6.983 1.00 0.00 H new ATOM 0 HD3 LYS A 100 18.027 -6.314 6.172 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.591 -7.515 4.252 1.00 0.00 H new ATOM 0 HE3 LYS A 100 15.271 -6.660 5.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 16.599 -5.522 3.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 16.166 -4.612 4.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.750 -5.203 4.354 1.00 0.00 H new ATOM 1502 N ASN A 101 14.056 -6.771 7.881 1.00 0.00 N ATOM 1503 CA ASN A 101 13.901 -5.399 8.327 1.00 0.00 C ATOM 1504 C ASN A 101 13.077 -5.363 9.604 1.00 0.00 C ATOM 1505 O ASN A 101 13.506 -4.811 10.616 1.00 0.00 O ATOM 1506 CB ASN A 101 13.224 -4.559 7.241 1.00 0.00 C ATOM 1507 CG ASN A 101 13.823 -4.796 5.868 1.00 0.00 C ATOM 1508 OD1 ASN A 101 14.852 -4.219 5.519 1.00 0.00 O ATOM 1509 ND2 ASN A 101 13.178 -5.649 5.081 1.00 0.00 N ATOM 0 H ASN A 101 13.381 -7.069 7.177 1.00 0.00 H new ATOM 0 HA ASN A 101 14.887 -4.980 8.526 1.00 0.00 H new ATOM 0 HB2 ASN A 101 12.160 -4.793 7.215 1.00 0.00 H new ATOM 0 HB3 ASN A 101 13.312 -3.503 7.495 1.00 0.00 H new ATOM 0 HD21 ASN A 101 13.533 -5.848 4.146 1.00 0.00 H new ATOM 0 HD22 ASN A 101 12.328 -6.105 5.412 1.00 0.00 H new ATOM 1516 N ILE A 102 11.885 -5.950 9.531 1.00 0.00 N ATOM 1517 CA ILE A 102 10.955 -5.996 10.652 1.00 0.00 C ATOM 1518 C ILE A 102 10.968 -4.691 11.429 1.00 0.00 C ATOM 1519 O ILE A 102 11.842 -4.443 12.260 1.00 0.00 O ATOM 1520 CB ILE A 102 11.234 -7.182 11.601 1.00 0.00 C ATOM 1521 CG1 ILE A 102 11.022 -8.504 10.858 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.345 -7.109 12.843 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.566 -8.931 10.742 1.00 0.00 C ATOM 0 H ILE A 102 11.537 -6.408 8.689 1.00 0.00 H new ATOM 0 HA ILE A 102 9.963 -6.143 10.224 1.00 0.00 H new ATOM 0 HB ILE A 102 12.271 -7.127 11.932 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.443 -8.416 9.857 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.579 -9.289 11.370 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.561 -7.955 13.495 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.542 -6.180 13.377 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.298 -7.140 12.543 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.506 -9.876 10.203 1.00 0.00 H new ATOM 0 HD12 ILE A 102 9.143 -9.054 11.739 1.00 0.00 H new ATOM 0 HD13 ILE A 102 9.005 -8.169 10.201 1.00 0.00 H new ATOM 1535 N GLY A 103 9.979 -3.869 11.145 1.00 0.00 N ATOM 1536 CA GLY A 103 9.861 -2.586 11.811 1.00 0.00 C ATOM 1537 C GLY A 103 11.059 -1.692 11.555 1.00 0.00 C ATOM 1538 O GLY A 103 11.578 -1.059 12.475 1.00 0.00 O ATOM 0 H GLY A 103 9.248 -4.064 10.461 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.956 -2.084 11.469 1.00 0.00 H new ATOM 0 HA3 GLY A 103 9.752 -2.745 12.884 1.00 0.00 H new ATOM 1542 N SER A 104 11.499 -1.645 10.303 1.00 0.00 N ATOM 1543 CA SER A 104 12.647 -0.827 9.924 1.00 0.00 C ATOM 1544 C SER A 104 12.255 0.644 9.801 1.00 0.00 C ATOM 1545 O SER A 104 13.076 1.533 10.025 1.00 0.00 O ATOM 1546 CB SER A 104 13.231 -1.324 8.600 1.00 0.00 C ATOM 1547 OG SER A 104 13.983 -0.309 7.957 1.00 0.00 O ATOM 0 H SER A 104 11.079 -2.164 9.532 1.00 0.00 H new ATOM 0 HA SER A 104 13.401 -0.916 10.706 1.00 0.00 H new ATOM 0 HB2 SER A 104 13.867 -2.190 8.783 1.00 0.00 H new ATOM 0 HB3 SER A 104 12.424 -1.653 7.945 1.00 0.00 H new ATOM 0 HG SER A 104 14.345 -0.654 7.115 1.00 0.00 H new ATOM 1553 N THR A 105 11.000 0.892 9.442 1.00 0.00 N ATOM 1554 CA THR A 105 10.505 2.255 9.287 1.00 0.00 C ATOM 1555 C THR A 105 11.221 2.967 8.142 1.00 0.00 C ATOM 1556 O THR A 105 11.338 4.192 8.136 1.00 0.00 O ATOM 1557 CB THR A 105 10.688 3.041 10.586 1.00 0.00 C ATOM 1558 OG1 THR A 105 10.655 2.173 11.706 1.00 0.00 O ATOM 1559 CG2 THR A 105 9.629 4.101 10.798 1.00 0.00 C ATOM 0 H THR A 105 10.307 0.167 9.253 1.00 0.00 H new ATOM 0 HA THR A 105 9.442 2.203 9.051 1.00 0.00 H new ATOM 0 HB THR A 105 11.657 3.531 10.493 1.00 0.00 H new ATOM 0 HG1 THR A 105 10.775 2.694 12.527 1.00 0.00 H new ATOM 0 HG21 THR A 105 9.818 4.621 11.737 1.00 0.00 H new ATOM 0 HG22 THR A 105 9.659 4.815 9.975 1.00 0.00 H new ATOM 0 HG23 THR A 105 8.646 3.631 10.835 1.00 0.00 H new ATOM 1567 N THR A 106 11.696 2.189 7.173 1.00 0.00 N ATOM 1568 CA THR A 106 12.397 2.741 6.019 1.00 0.00 C ATOM 1569 C THR A 106 11.934 2.063 4.735 1.00 0.00 C ATOM 1570 O THR A 106 11.270 2.676 3.900 1.00 0.00 O ATOM 1571 CB THR A 106 13.909 2.575 6.185 1.00 0.00 C ATOM 1572 OG1 THR A 106 14.249 2.399 7.548 1.00 0.00 O ATOM 1573 CG2 THR A 106 14.702 3.754 5.663 1.00 0.00 C ATOM 0 H THR A 106 11.608 1.173 7.165 1.00 0.00 H new ATOM 0 HA THR A 106 12.165 3.804 5.954 1.00 0.00 H new ATOM 0 HB THR A 106 14.168 1.694 5.597 1.00 0.00 H new ATOM 0 HG1 THR A 106 14.241 1.444 7.767 1.00 0.00 H new ATOM 0 HG21 THR A 106 15.766 3.571 5.812 1.00 0.00 H new ATOM 0 HG22 THR A 106 14.501 3.885 4.600 1.00 0.00 H new ATOM 0 HG23 THR A 106 14.410 4.656 6.201 1.00 0.00 H new ATOM 1581 N ASN A 107 12.280 0.787 4.588 1.00 0.00 N ATOM 1582 CA ASN A 107 11.893 0.019 3.411 1.00 0.00 C ATOM 1583 C ASN A 107 10.521 -0.613 3.618 1.00 0.00 C ATOM 1584 O ASN A 107 10.411 -1.742 4.095 1.00 0.00 O ATOM 1585 CB ASN A 107 12.931 -1.064 3.116 1.00 0.00 C ATOM 1586 CG ASN A 107 12.620 -1.830 1.846 1.00 0.00 C ATOM 1587 OD1 ASN A 107 13.241 -1.608 0.807 1.00 0.00 O ATOM 1588 ND2 ASN A 107 11.654 -2.737 1.924 1.00 0.00 N ATOM 0 H ASN A 107 12.828 0.264 5.271 1.00 0.00 H new ATOM 0 HA ASN A 107 11.842 0.696 2.558 1.00 0.00 H new ATOM 0 HB2 ASN A 107 13.916 -0.606 3.029 1.00 0.00 H new ATOM 0 HB3 ASN A 107 12.976 -1.759 3.955 1.00 0.00 H new ATOM 0 HD21 ASN A 107 11.400 -3.284 1.101 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.166 -2.887 2.807 1.00 0.00 H new ATOM 1595 N THR A 108 9.476 0.129 3.266 1.00 0.00 N ATOM 1596 CA THR A 108 8.108 -0.351 3.424 1.00 0.00 C ATOM 1597 C THR A 108 7.607 -1.072 2.173 1.00 0.00 C ATOM 1598 O THR A 108 6.480 -1.568 2.146 1.00 0.00 O ATOM 1599 CB THR A 108 7.180 0.816 3.756 1.00 0.00 C ATOM 1600 OG1 THR A 108 7.639 1.511 4.903 1.00 0.00 O ATOM 1601 CG2 THR A 108 5.755 0.387 4.019 1.00 0.00 C ATOM 0 H THR A 108 9.551 1.066 2.869 1.00 0.00 H new ATOM 0 HA THR A 108 8.105 -1.069 4.244 1.00 0.00 H new ATOM 0 HB THR A 108 7.193 1.457 2.875 1.00 0.00 H new ATOM 0 HG1 THR A 108 7.188 2.379 4.962 1.00 0.00 H new ATOM 0 HG21 THR A 108 5.148 1.263 4.249 1.00 0.00 H new ATOM 0 HG22 THR A 108 5.356 -0.110 3.135 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.732 -0.302 4.863 1.00 0.00 H new ATOM 1609 N SER A 109 8.442 -1.132 1.140 1.00 0.00 N ATOM 1610 CA SER A 109 8.069 -1.796 -0.105 1.00 0.00 C ATOM 1611 C SER A 109 7.619 -3.234 0.147 1.00 0.00 C ATOM 1612 O SER A 109 6.903 -3.822 -0.664 1.00 0.00 O ATOM 1613 CB SER A 109 9.243 -1.783 -1.085 1.00 0.00 C ATOM 1614 OG SER A 109 10.369 -2.449 -0.540 1.00 0.00 O ATOM 0 H SER A 109 9.379 -0.730 1.140 1.00 0.00 H new ATOM 0 HA SER A 109 7.233 -1.247 -0.538 1.00 0.00 H new ATOM 0 HB2 SER A 109 8.948 -2.264 -2.017 1.00 0.00 H new ATOM 0 HB3 SER A 109 9.507 -0.754 -1.327 1.00 0.00 H new ATOM 0 HG SER A 109 11.106 -2.428 -1.186 1.00 0.00 H new ATOM 1620 N LEU A 110 8.048 -3.801 1.273 1.00 0.00 N ATOM 1621 CA LEU A 110 7.693 -5.171 1.624 1.00 0.00 C ATOM 1622 C LEU A 110 6.373 -5.230 2.386 1.00 0.00 C ATOM 1623 O LEU A 110 5.488 -6.013 2.043 1.00 0.00 O ATOM 1624 CB LEU A 110 8.794 -5.797 2.477 1.00 0.00 C ATOM 1625 CG LEU A 110 10.201 -5.700 1.898 1.00 0.00 C ATOM 1626 CD1 LEU A 110 11.227 -5.686 3.020 1.00 0.00 C ATOM 1627 CD2 LEU A 110 10.459 -6.851 0.935 1.00 0.00 C ATOM 0 H LEU A 110 8.642 -3.331 1.957 1.00 0.00 H new ATOM 0 HA LEU A 110 7.580 -5.729 0.695 1.00 0.00 H new ATOM 0 HB2 LEU A 110 8.788 -5.319 3.457 1.00 0.00 H new ATOM 0 HB3 LEU A 110 8.555 -6.849 2.634 1.00 0.00 H new ATOM 0 HG LEU A 110 10.291 -4.768 1.340 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.229 -5.617 2.596 1.00 0.00 H new ATOM 0 HD12 LEU A 110 11.047 -4.828 3.667 1.00 0.00 H new ATOM 0 HD13 LEU A 110 11.142 -6.604 3.602 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.468 -6.768 0.530 1.00 0.00 H new ATOM 0 HD22 LEU A 110 10.358 -7.798 1.465 1.00 0.00 H new ATOM 0 HD23 LEU A 110 9.736 -6.812 0.120 1.00 0.00 H new ATOM 1639 N ASP A 111 6.259 -4.404 3.428 1.00 0.00 N ATOM 1640 CA ASP A 111 5.077 -4.348 4.262 1.00 0.00 C ATOM 1641 C ASP A 111 3.817 -4.664 3.477 1.00 0.00 C ATOM 1642 O ASP A 111 3.238 -3.791 2.830 1.00 0.00 O ATOM 1643 CB ASP A 111 4.953 -2.964 4.899 1.00 0.00 C ATOM 1644 CG ASP A 111 5.927 -2.758 6.040 1.00 0.00 C ATOM 1645 OD1 ASP A 111 5.753 -3.408 7.088 1.00 0.00 O ATOM 1646 OD2 ASP A 111 6.863 -1.947 5.883 1.00 0.00 O ATOM 0 H ASP A 111 6.993 -3.755 3.711 1.00 0.00 H new ATOM 0 HA ASP A 111 5.186 -5.104 5.039 1.00 0.00 H new ATOM 0 HB2 ASP A 111 5.123 -2.202 4.139 1.00 0.00 H new ATOM 0 HB3 ASP A 111 3.936 -2.827 5.265 1.00 0.00 H new ATOM 1651 N LEU A 112 3.375 -5.912 3.573 1.00 0.00 N ATOM 1652 CA LEU A 112 2.153 -6.339 2.907 1.00 0.00 C ATOM 1653 C LEU A 112 1.044 -5.346 3.236 1.00 0.00 C ATOM 1654 O LEU A 112 0.080 -5.177 2.491 1.00 0.00 O ATOM 1655 CB LEU A 112 1.764 -7.736 3.389 1.00 0.00 C ATOM 1656 CG LEU A 112 2.478 -8.904 2.699 1.00 0.00 C ATOM 1657 CD1 LEU A 112 3.933 -9.006 3.129 1.00 0.00 C ATOM 1658 CD2 LEU A 112 1.757 -10.215 2.978 1.00 0.00 C ATOM 0 H LEU A 112 3.845 -6.645 4.105 1.00 0.00 H new ATOM 0 HA LEU A 112 2.308 -6.372 1.829 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.959 -7.797 4.460 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.690 -7.860 3.253 1.00 0.00 H new ATOM 0 HG LEU A 112 2.458 -8.709 1.627 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.405 -9.845 2.619 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.454 -8.084 2.870 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.984 -9.161 4.207 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.280 -11.031 2.479 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.739 -10.399 4.052 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.735 -10.155 2.603 1.00 0.00 H new ATOM 1670 N ASN A 113 1.229 -4.686 4.374 1.00 0.00 N ATOM 1671 CA ASN A 113 0.314 -3.687 4.877 1.00 0.00 C ATOM 1672 C ASN A 113 0.712 -2.307 4.379 1.00 0.00 C ATOM 1673 O ASN A 113 -0.085 -1.580 3.792 1.00 0.00 O ATOM 1674 CB ASN A 113 0.387 -3.694 6.396 1.00 0.00 C ATOM 1675 CG ASN A 113 -0.844 -4.303 7.038 1.00 0.00 C ATOM 1676 OD1 ASN A 113 -1.463 -5.211 6.484 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -1.204 -3.807 8.216 1.00 0.00 N ATOM 0 H ASN A 113 2.036 -4.839 4.978 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.695 -3.914 4.531 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.269 -4.251 6.711 1.00 0.00 H new ATOM 0 HB3 ASN A 113 0.511 -2.672 6.754 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -2.023 -4.179 8.697 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.662 -3.054 8.639 1.00 0.00 H new ATOM 1684 N LYS A 114 1.965 -1.965 4.666 1.00 0.00 N ATOM 1685 CA LYS A 114 2.556 -0.676 4.315 1.00 0.00 C ATOM 1686 C LYS A 114 2.376 0.298 5.466 1.00 0.00 C ATOM 1687 O LYS A 114 2.198 1.499 5.260 1.00 0.00 O ATOM 1688 CB LYS A 114 1.956 -0.093 3.036 1.00 0.00 C ATOM 1689 CG LYS A 114 1.958 -1.060 1.866 1.00 0.00 C ATOM 1690 CD LYS A 114 1.994 -0.317 0.543 1.00 0.00 C ATOM 1691 CE LYS A 114 3.411 0.095 0.173 1.00 0.00 C ATOM 1692 NZ LYS A 114 4.197 -1.046 -0.370 1.00 0.00 N ATOM 0 H LYS A 114 2.609 -2.585 5.157 1.00 0.00 H new ATOM 0 HA LYS A 114 3.617 -0.839 4.128 1.00 0.00 H new ATOM 0 HB2 LYS A 114 0.931 0.220 3.236 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.514 0.801 2.758 1.00 0.00 H new ATOM 0 HG2 LYS A 114 2.821 -1.722 1.939 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.069 -1.690 1.909 1.00 0.00 H new ATOM 0 HD2 LYS A 114 1.581 -0.950 -0.242 1.00 0.00 H new ATOM 0 HD3 LYS A 114 1.361 0.568 0.604 1.00 0.00 H new ATOM 0 HE2 LYS A 114 3.375 0.895 -0.566 1.00 0.00 H new ATOM 0 HE3 LYS A 114 3.914 0.496 1.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 5.133 -0.710 -0.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 4.311 -1.771 0.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.697 -1.456 -1.184 1.00 0.00 H new ATOM 1706 N ASP A 115 2.429 -0.232 6.683 1.00 0.00 N ATOM 1707 CA ASP A 115 2.276 0.587 7.877 1.00 0.00 C ATOM 1708 C ASP A 115 3.587 1.289 8.225 1.00 0.00 C ATOM 1709 O ASP A 115 3.640 2.096 9.154 1.00 0.00 O ATOM 1710 CB ASP A 115 1.808 -0.271 9.054 1.00 0.00 C ATOM 1711 CG ASP A 115 1.576 0.545 10.311 1.00 0.00 C ATOM 1712 OD1 ASP A 115 1.214 1.734 10.188 1.00 0.00 O ATOM 1713 OD2 ASP A 115 1.757 -0.004 11.418 1.00 0.00 O ATOM 0 H ASP A 115 2.577 -1.224 6.867 1.00 0.00 H new ATOM 0 HA ASP A 115 1.522 1.348 7.674 1.00 0.00 H new ATOM 0 HB2 ASP A 115 0.885 -0.783 8.782 1.00 0.00 H new ATOM 0 HB3 ASP A 115 2.552 -1.041 9.257 1.00 0.00 H new ATOM 1718 N GLY A 116 4.644 0.973 7.480 1.00 0.00 N ATOM 1719 CA GLY A 116 5.937 1.582 7.737 1.00 0.00 C ATOM 1720 C GLY A 116 6.723 0.816 8.778 1.00 0.00 C ATOM 1721 O GLY A 116 7.437 1.404 9.590 1.00 0.00 O ATOM 0 H GLY A 116 4.628 0.309 6.706 1.00 0.00 H new ATOM 0 HA2 GLY A 116 6.509 1.626 6.810 1.00 0.00 H new ATOM 0 HA3 GLY A 116 5.794 2.609 8.073 1.00 0.00 H new ATOM 1725 N SER A 117 6.577 -0.500 8.754 1.00 0.00 N ATOM 1726 CA SER A 117 7.263 -1.372 9.704 1.00 0.00 C ATOM 1727 C SER A 117 6.967 -2.819 9.398 1.00 0.00 C ATOM 1728 O SER A 117 5.836 -3.278 9.552 1.00 0.00 O ATOM 1729 CB SER A 117 6.815 -1.062 11.135 1.00 0.00 C ATOM 1730 OG SER A 117 7.768 -0.255 11.808 1.00 0.00 O ATOM 0 H SER A 117 5.987 -0.993 8.084 1.00 0.00 H new ATOM 0 HA SER A 117 8.334 -1.193 9.613 1.00 0.00 H new ATOM 0 HB2 SER A 117 5.852 -0.552 11.115 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.671 -1.993 11.683 1.00 0.00 H new ATOM 0 HG SER A 117 7.941 0.554 11.283 1.00 0.00 H new ATOM 1736 N ILE A 118 7.989 -3.547 8.987 1.00 0.00 N ATOM 1737 CA ILE A 118 7.814 -4.947 8.693 1.00 0.00 C ATOM 1738 C ILE A 118 7.468 -5.682 9.966 1.00 0.00 C ATOM 1739 O ILE A 118 8.290 -5.868 10.858 1.00 0.00 O ATOM 1740 CB ILE A 118 9.059 -5.551 8.024 1.00 0.00 C ATOM 1741 CG1 ILE A 118 9.190 -5.015 6.598 1.00 0.00 C ATOM 1742 CG2 ILE A 118 8.999 -7.071 8.033 1.00 0.00 C ATOM 1743 CD1 ILE A 118 7.892 -4.997 5.815 1.00 0.00 C ATOM 0 H ILE A 118 8.936 -3.193 8.852 1.00 0.00 H new ATOM 0 HA ILE A 118 6.996 -5.054 7.981 1.00 0.00 H new ATOM 0 HB ILE A 118 9.941 -5.256 8.592 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.590 -4.002 6.639 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.917 -5.623 6.059 1.00 0.00 H new ATOM 0 HG21 ILE A 118 9.892 -7.473 7.554 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.948 -7.427 9.062 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.114 -7.403 7.490 1.00 0.00 H new ATOM 0 HD11 ILE A 118 8.075 -4.603 4.815 1.00 0.00 H new ATOM 0 HD12 ILE A 118 7.499 -6.011 5.739 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.167 -4.364 6.327 1.00 0.00 H new ATOM 1755 N ASP A 119 6.217 -6.052 10.053 1.00 0.00 N ATOM 1756 CA ASP A 119 5.714 -6.733 11.238 1.00 0.00 C ATOM 1757 C ASP A 119 4.849 -7.944 10.886 1.00 0.00 C ATOM 1758 O ASP A 119 5.081 -8.611 9.882 1.00 0.00 O ATOM 1759 CB ASP A 119 4.945 -5.739 12.112 1.00 0.00 C ATOM 1760 CG ASP A 119 5.139 -6.000 13.593 1.00 0.00 C ATOM 1761 OD1 ASP A 119 6.270 -6.349 13.992 1.00 0.00 O ATOM 1762 OD2 ASP A 119 4.159 -5.854 14.355 1.00 0.00 O ATOM 0 H ASP A 119 5.521 -5.898 9.323 1.00 0.00 H new ATOM 0 HA ASP A 119 6.568 -7.117 11.797 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.272 -4.726 11.879 1.00 0.00 H new ATOM 0 HB3 ASP A 119 3.883 -5.794 11.872 1.00 0.00 H new ATOM 1767 N GLU A 120 3.868 -8.236 11.734 1.00 0.00 N ATOM 1768 CA GLU A 120 2.986 -9.384 11.528 1.00 0.00 C ATOM 1769 C GLU A 120 2.034 -9.179 10.351 1.00 0.00 C ATOM 1770 O GLU A 120 1.454 -10.140 9.844 1.00 0.00 O ATOM 1771 CB GLU A 120 2.182 -9.662 12.798 1.00 0.00 C ATOM 1772 CG GLU A 120 2.904 -10.558 13.792 1.00 0.00 C ATOM 1773 CD GLU A 120 1.979 -11.564 14.448 1.00 0.00 C ATOM 1774 OE1 GLU A 120 0.982 -11.138 15.068 1.00 0.00 O ATOM 1775 OE2 GLU A 120 2.251 -12.778 14.341 1.00 0.00 O ATOM 0 H GLU A 120 3.662 -7.693 12.573 1.00 0.00 H new ATOM 0 HA GLU A 120 3.620 -10.240 11.294 1.00 0.00 H new ATOM 0 HB2 GLU A 120 1.944 -8.715 13.282 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.235 -10.127 12.524 1.00 0.00 H new ATOM 0 HG2 GLU A 120 3.708 -11.088 13.281 1.00 0.00 H new ATOM 0 HG3 GLU A 120 3.368 -9.941 14.561 1.00 0.00 H new ATOM 1782 N TYR A 121 1.865 -7.934 9.925 1.00 0.00 N ATOM 1783 CA TYR A 121 0.967 -7.629 8.817 1.00 0.00 C ATOM 1784 C TYR A 121 1.527 -8.116 7.483 1.00 0.00 C ATOM 1785 O TYR A 121 0.782 -8.249 6.512 1.00 0.00 O ATOM 1786 CB TYR A 121 0.667 -6.126 8.732 1.00 0.00 C ATOM 1787 CG TYR A 121 1.312 -5.281 9.806 1.00 0.00 C ATOM 1788 CD1 TYR A 121 0.879 -5.346 11.125 1.00 0.00 C ATOM 1789 CD2 TYR A 121 2.353 -4.416 9.498 1.00 0.00 C ATOM 1790 CE1 TYR A 121 1.466 -4.572 12.107 1.00 0.00 C ATOM 1791 CE2 TYR A 121 2.946 -3.639 10.475 1.00 0.00 C ATOM 1792 CZ TYR A 121 2.499 -3.719 11.777 1.00 0.00 C ATOM 1793 OH TYR A 121 3.088 -2.947 12.752 1.00 0.00 O ATOM 0 H TYR A 121 2.335 -7.123 10.327 1.00 0.00 H new ATOM 0 HA TYR A 121 0.037 -8.162 9.017 1.00 0.00 H new ATOM 0 HB2 TYR A 121 0.994 -5.761 7.759 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.413 -5.984 8.779 1.00 0.00 H new ATOM 0 HD1 TYR A 121 0.070 -6.013 11.386 1.00 0.00 H new ATOM 0 HD2 TYR A 121 2.705 -4.349 8.479 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.118 -4.634 13.128 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.756 -2.972 10.220 1.00 0.00 H new ATOM 0 HH TYR A 121 3.799 -2.403 12.353 1.00 0.00 H new ATOM 1803 N GLU A 122 2.831 -8.380 7.422 1.00 0.00 N ATOM 1804 CA GLU A 122 3.427 -8.844 6.173 1.00 0.00 C ATOM 1805 C GLU A 122 3.441 -10.367 6.104 1.00 0.00 C ATOM 1806 O GLU A 122 2.620 -10.982 5.426 1.00 0.00 O ATOM 1807 CB GLU A 122 4.859 -8.306 5.984 1.00 0.00 C ATOM 1808 CG GLU A 122 5.329 -7.347 7.063 1.00 0.00 C ATOM 1809 CD GLU A 122 4.454 -6.113 7.171 1.00 0.00 C ATOM 1810 OE1 GLU A 122 3.573 -5.930 6.305 1.00 0.00 O ATOM 1811 OE2 GLU A 122 4.647 -5.332 8.125 1.00 0.00 O ATOM 0 H GLU A 122 3.481 -8.284 8.202 1.00 0.00 H new ATOM 0 HA GLU A 122 2.806 -8.455 5.366 1.00 0.00 H new ATOM 0 HB2 GLU A 122 5.547 -9.151 5.944 1.00 0.00 H new ATOM 0 HB3 GLU A 122 4.918 -7.802 5.019 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.341 -7.864 8.023 1.00 0.00 H new ATOM 0 HG3 GLU A 122 6.354 -7.043 6.852 1.00 0.00 H new ATOM 1818 N ILE A 123 4.386 -10.960 6.811 1.00 0.00 N ATOM 1819 CA ILE A 123 4.548 -12.412 6.854 1.00 0.00 C ATOM 1820 C ILE A 123 3.205 -13.137 6.936 1.00 0.00 C ATOM 1821 O ILE A 123 3.073 -14.265 6.460 1.00 0.00 O ATOM 1822 CB ILE A 123 5.419 -12.848 8.050 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.112 -11.982 9.285 1.00 0.00 C ATOM 1824 CG2 ILE A 123 6.895 -12.786 7.673 1.00 0.00 C ATOM 1825 CD1 ILE A 123 6.208 -11.000 9.652 1.00 0.00 C ATOM 0 H ILE A 123 5.067 -10.452 7.375 1.00 0.00 H new ATOM 0 HA ILE A 123 5.043 -12.687 5.923 1.00 0.00 H new ATOM 0 HB ILE A 123 5.181 -13.880 8.307 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.191 -11.428 9.105 1.00 0.00 H new ATOM 0 HG13 ILE A 123 4.929 -12.637 10.136 1.00 0.00 H new ATOM 0 HG21 ILE A 123 7.501 -13.096 8.524 1.00 0.00 H new ATOM 0 HG22 ILE A 123 7.084 -13.452 6.831 1.00 0.00 H new ATOM 0 HG23 ILE A 123 7.157 -11.765 7.393 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.908 -10.432 10.533 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.127 -11.545 9.867 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.378 -10.317 8.820 1.00 0.00 H new ATOM 1837 N SER A 124 2.217 -12.485 7.547 1.00 0.00 N ATOM 1838 CA SER A 124 0.878 -13.059 7.706 1.00 0.00 C ATOM 1839 C SER A 124 0.450 -13.873 6.483 1.00 0.00 C ATOM 1840 O SER A 124 -0.255 -14.873 6.611 1.00 0.00 O ATOM 1841 CB SER A 124 -0.143 -11.952 7.972 1.00 0.00 C ATOM 1842 OG SER A 124 0.020 -10.878 7.061 1.00 0.00 O ATOM 0 H SER A 124 2.319 -11.551 7.944 1.00 0.00 H new ATOM 0 HA SER A 124 0.917 -13.737 8.559 1.00 0.00 H new ATOM 0 HB2 SER A 124 -1.152 -12.355 7.887 1.00 0.00 H new ATOM 0 HB3 SER A 124 -0.031 -11.587 8.993 1.00 0.00 H new ATOM 0 HG SER A 124 -0.645 -10.184 7.251 1.00 0.00 H new ATOM 1848 N PHE A 125 0.875 -13.438 5.302 1.00 0.00 N ATOM 1849 CA PHE A 125 0.527 -14.134 4.067 1.00 0.00 C ATOM 1850 C PHE A 125 1.535 -15.233 3.751 1.00 0.00 C ATOM 1851 O PHE A 125 1.235 -16.420 3.889 1.00 0.00 O ATOM 1852 CB PHE A 125 0.448 -13.145 2.903 1.00 0.00 C ATOM 1853 CG PHE A 125 0.070 -13.780 1.595 1.00 0.00 C ATOM 1854 CD1 PHE A 125 -0.966 -14.697 1.530 1.00 0.00 C ATOM 1855 CD2 PHE A 125 0.751 -13.460 0.432 1.00 0.00 C ATOM 1856 CE1 PHE A 125 -1.317 -15.284 0.329 1.00 0.00 C ATOM 1857 CE2 PHE A 125 0.405 -14.042 -0.773 1.00 0.00 C ATOM 1858 CZ PHE A 125 -0.630 -14.955 -0.825 1.00 0.00 C ATOM 0 H PHE A 125 1.458 -12.611 5.173 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.449 -14.597 4.208 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -0.280 -12.371 3.145 1.00 0.00 H new ATOM 0 HB3 PHE A 125 1.413 -12.651 2.791 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.506 -14.956 2.429 1.00 0.00 H new ATOM 0 HD2 PHE A 125 1.562 -12.747 0.467 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -2.126 -15.998 0.292 1.00 0.00 H new ATOM 0 HE2 PHE A 125 0.943 -13.783 -1.673 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.902 -15.411 -1.765 1.00 0.00 H new ATOM 1868 N ILE A 126 2.729 -14.831 3.318 1.00 0.00 N ATOM 1869 CA ILE A 126 3.790 -15.783 2.970 1.00 0.00 C ATOM 1870 C ILE A 126 3.877 -16.926 3.979 1.00 0.00 C ATOM 1871 O ILE A 126 3.732 -18.093 3.614 1.00 0.00 O ATOM 1872 CB ILE A 126 5.185 -15.111 2.850 1.00 0.00 C ATOM 1873 CG1 ILE A 126 5.208 -13.717 3.506 1.00 0.00 C ATOM 1874 CG2 ILE A 126 5.608 -15.030 1.389 1.00 0.00 C ATOM 1875 CD1 ILE A 126 4.899 -12.573 2.557 1.00 0.00 C ATOM 0 H ILE A 126 2.989 -13.852 3.199 1.00 0.00 H new ATOM 0 HA ILE A 126 3.514 -16.179 1.993 1.00 0.00 H new ATOM 0 HB ILE A 126 5.901 -15.732 3.389 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.486 -13.701 4.322 1.00 0.00 H new ATOM 0 HG13 ILE A 126 6.191 -13.552 3.947 1.00 0.00 H new ATOM 0 HG21 ILE A 126 6.587 -14.557 1.319 1.00 0.00 H new ATOM 0 HG22 ILE A 126 5.660 -16.034 0.969 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.880 -14.441 0.832 1.00 0.00 H new ATOM 0 HD11 ILE A 126 4.936 -11.629 3.101 1.00 0.00 H new ATOM 0 HD12 ILE A 126 5.635 -12.558 1.753 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.903 -12.709 2.135 1.00 0.00 H new ATOM 1887 N ASN A 127 4.117 -16.589 5.245 1.00 0.00 N ATOM 1888 CA ASN A 127 4.226 -17.597 6.300 1.00 0.00 C ATOM 1889 C ASN A 127 3.122 -18.645 6.180 1.00 0.00 C ATOM 1890 O ASN A 127 3.315 -19.808 6.532 1.00 0.00 O ATOM 1891 CB ASN A 127 4.165 -16.938 7.680 1.00 0.00 C ATOM 1892 CG ASN A 127 5.540 -16.605 8.224 1.00 0.00 C ATOM 1893 OD1 ASN A 127 6.557 -16.966 7.633 1.00 0.00 O ATOM 1894 ND2 ASN A 127 5.575 -15.916 9.358 1.00 0.00 N ATOM 0 H ASN A 127 4.240 -15.628 5.565 1.00 0.00 H new ATOM 0 HA ASN A 127 5.189 -18.095 6.183 1.00 0.00 H new ATOM 0 HB2 ASN A 127 3.571 -16.026 7.618 1.00 0.00 H new ATOM 0 HB3 ASN A 127 3.654 -17.604 8.375 1.00 0.00 H new ATOM 0 HD21 ASN A 127 6.471 -15.665 9.775 1.00 0.00 H new ATOM 0 HD22 ASN A 127 4.705 -15.638 9.813 1.00 0.00 H new ATOM 1901 N HIS A 128 1.965 -18.222 5.680 1.00 0.00 N ATOM 1902 CA HIS A 128 0.833 -19.125 5.513 1.00 0.00 C ATOM 1903 C HIS A 128 0.813 -19.728 4.110 1.00 0.00 C ATOM 1904 O HIS A 128 0.793 -20.948 3.949 1.00 0.00 O ATOM 1905 CB HIS A 128 -0.480 -18.388 5.784 1.00 0.00 C ATOM 1906 CG HIS A 128 -0.915 -18.452 7.215 1.00 0.00 C ATOM 1907 ND1 HIS A 128 -0.723 -19.560 8.013 1.00 0.00 N ATOM 1908 CD2 HIS A 128 -1.539 -17.535 7.993 1.00 0.00 C ATOM 1909 CE1 HIS A 128 -1.209 -19.323 9.219 1.00 0.00 C ATOM 1910 NE2 HIS A 128 -1.709 -18.101 9.233 1.00 0.00 N ATOM 0 H HIS A 128 1.788 -17.262 5.384 1.00 0.00 H new ATOM 0 HA HIS A 128 0.942 -19.936 6.233 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -0.368 -17.344 5.493 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -1.263 -18.813 5.155 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -1.846 -16.544 7.694 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -1.199 -20.011 10.051 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -2.150 -17.650 10.035 1.00 0.00 H new ATOM 1919 N ARG A 129 0.816 -18.864 3.098 1.00 0.00 N ATOM 1920 CA ARG A 129 0.795 -19.312 1.707 1.00 0.00 C ATOM 1921 C ARG A 129 1.871 -20.365 1.455 1.00 0.00 C ATOM 1922 O ARG A 129 1.684 -21.278 0.650 1.00 0.00 O ATOM 1923 CB ARG A 129 0.998 -18.124 0.764 1.00 0.00 C ATOM 1924 CG ARG A 129 0.311 -18.291 -0.581 1.00 0.00 C ATOM 1925 CD ARG A 129 1.142 -19.139 -1.531 1.00 0.00 C ATOM 1926 NE ARG A 129 1.862 -18.323 -2.505 1.00 0.00 N ATOM 1927 CZ ARG A 129 2.370 -18.800 -3.640 1.00 0.00 C ATOM 1928 NH1 ARG A 129 2.240 -20.085 -3.945 1.00 0.00 N ATOM 1929 NH2 ARG A 129 3.011 -17.989 -4.471 1.00 0.00 N ATOM 0 H ARG A 129 0.833 -17.851 3.214 1.00 0.00 H new ATOM 0 HA ARG A 129 -0.179 -19.761 1.512 1.00 0.00 H new ATOM 0 HB2 ARG A 129 0.622 -17.221 1.245 1.00 0.00 H new ATOM 0 HB3 ARG A 129 2.066 -17.978 0.602 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -0.665 -18.755 -0.437 1.00 0.00 H new ATOM 0 HG3 ARG A 129 0.136 -17.311 -1.025 1.00 0.00 H new ATOM 0 HD2 ARG A 129 1.854 -19.733 -0.958 1.00 0.00 H new ATOM 0 HD3 ARG A 129 0.492 -19.840 -2.055 1.00 0.00 H new ATOM 0 HE ARG A 129 1.983 -17.330 -2.304 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.749 -20.713 -3.309 1.00 0.00 H new ATOM 0 HH12 ARG A 129 2.631 -20.445 -4.816 1.00 0.00 H new ATOM 0 HH21 ARG A 129 3.115 -17.001 -4.241 1.00 0.00 H new ATOM 0 HH22 ARG A 129 3.400 -18.354 -5.340 1.00 0.00 H new ATOM 1943 N ILE A 130 2.994 -20.230 2.151 1.00 0.00 N ATOM 1944 CA ILE A 130 4.098 -21.171 2.009 1.00 0.00 C ATOM 1945 C ILE A 130 3.670 -22.577 2.420 1.00 0.00 C ATOM 1946 O ILE A 130 3.638 -23.493 1.597 1.00 0.00 O ATOM 1947 CB ILE A 130 5.311 -20.738 2.859 1.00 0.00 C ATOM 1948 CG1 ILE A 130 5.835 -19.382 2.389 1.00 0.00 C ATOM 1949 CG2 ILE A 130 6.416 -21.784 2.798 1.00 0.00 C ATOM 1950 CD1 ILE A 130 6.428 -18.551 3.505 1.00 0.00 C ATOM 0 H ILE A 130 3.164 -19.478 2.819 1.00 0.00 H new ATOM 0 HA ILE A 130 4.387 -21.177 0.958 1.00 0.00 H new ATOM 0 HB ILE A 130 4.985 -20.646 3.895 1.00 0.00 H new ATOM 0 HG12 ILE A 130 6.592 -19.539 1.621 1.00 0.00 H new ATOM 0 HG13 ILE A 130 5.020 -18.826 1.925 1.00 0.00 H new ATOM 0 HG21 ILE A 130 7.260 -21.457 3.405 1.00 0.00 H new ATOM 0 HG22 ILE A 130 6.040 -22.733 3.181 1.00 0.00 H new ATOM 0 HG23 ILE A 130 6.739 -21.912 1.765 1.00 0.00 H new ATOM 0 HD11 ILE A 130 6.781 -17.601 3.103 1.00 0.00 H new ATOM 0 HD12 ILE A 130 5.667 -18.364 4.263 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.264 -19.088 3.954 1.00 0.00 H new