USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1085 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 12 LYS NZ :NH3+ 165:sc= 1.18 (180deg=0) USER MOD Set 1.2: A 89 HIS : no HD1:sc= 0.578 K(o=1.8,f=-5.6!) USER MOD Set 2.1: A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.1: A 29 TYR OH : rot 151:sc= 1.15 USER MOD Set 3.2: A 97 THR OG1 : rot 107:sc= 1.87 USER MOD Single : A 5 ASN : amide:sc= -0.0559 X(o=-0.056,f=-0.049) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -139:sc= 0.205 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= 0.27 K(o=0.27,f=-6.5!) USER MOD Single : A 39 ASN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0.463 USER MOD Single : A 54 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.00183) USER MOD Single : A 57 CYS SG : rot -21:sc= 0.901 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00857) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc=-0.00493 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot -106:sc= 0.331 USER MOD Single : A 80 ASN : amide:sc= -0.0364 K(o=-0.036,f=-2!) USER MOD Single : A 81 THR OG1 : rot 71:sc= 0.739 USER MOD Single : A 83 CYS SG : rot -58:sc= 1.18 USER MOD Single : A 87 CYS SG : rot 87:sc= -2.4! USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ -108:sc= -0.0777 (180deg=-0.498) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 HIS : no HD1:sc= 0.422 K(o=0.42,f=-1.9!) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot -45:sc= 0.893 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0.0112 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ -165:sc= -0.0367 (180deg=-0.255) USER MOD Single : A 134 ASN :FLIP amide:sc= -0.0581 F(o=-0.86,f=-0.058) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 -3.364 -4.625 -15.569 1.00 13.00 N ATOM 2 CA GLY A 2 -3.923 -4.157 -14.315 1.00 45.03 C ATOM 3 C GLY A 2 -3.668 -2.681 -14.080 1.00 33.24 C ATOM 4 O GLY A 2 -2.889 -2.058 -14.801 1.00 54.04 O ATOM 0 HA2 GLY A 2 -4.997 -4.342 -14.308 1.00 45.03 H new ATOM 0 HA3 GLY A 2 -3.495 -4.732 -13.493 1.00 45.03 H new ATOM 8 N ALA A 3 -4.326 -2.120 -13.072 1.00 23.41 N ATOM 9 CA ALA A 3 -4.166 -0.709 -12.745 1.00 61.32 C ATOM 10 C ALA A 3 -3.059 -0.506 -11.716 1.00 14.22 C ATOM 11 O ALA A 3 -3.293 -0.599 -10.512 1.00 61.35 O ATOM 12 CB ALA A 3 -5.477 -0.134 -12.231 1.00 64.40 C ATOM 0 H ALA A 3 -4.976 -2.622 -12.467 1.00 23.41 H new ATOM 0 HA ALA A 3 -3.882 -0.181 -13.655 1.00 61.32 H new ATOM 0 HB1 ALA A 3 -5.342 0.921 -11.991 1.00 64.40 H new ATOM 0 HB2 ALA A 3 -6.245 -0.236 -12.998 1.00 64.40 H new ATOM 0 HB3 ALA A 3 -5.785 -0.674 -11.335 1.00 64.40 H new ATOM 18 N ARG A 4 -1.852 -0.230 -12.199 1.00 14.33 N ATOM 19 CA ARG A 4 -0.708 -0.016 -11.322 1.00 40.30 C ATOM 20 C ARG A 4 0.476 0.552 -12.100 1.00 22.21 C ATOM 21 O ARG A 4 0.967 -0.068 -13.041 1.00 12.24 O ATOM 22 CB ARG A 4 -0.305 -1.328 -10.645 1.00 2.24 C ATOM 23 CG ARG A 4 -0.215 -1.230 -9.131 1.00 64.01 C ATOM 24 CD ARG A 4 0.420 -2.473 -8.529 1.00 11.43 C ATOM 25 NE ARG A 4 0.957 -2.221 -7.194 1.00 20.42 N ATOM 26 CZ ARG A 4 0.209 -2.188 -6.097 1.00 43.41 C ATOM 27 NH1 ARG A 4 -1.099 -2.388 -6.175 1.00 11.12 N ATOM 28 NH2 ARG A 4 0.770 -1.952 -4.917 1.00 54.11 N ATOM 0 H ARG A 4 -1.641 -0.149 -13.194 1.00 14.33 H new ATOM 0 HA ARG A 4 -0.998 0.705 -10.558 1.00 40.30 H new ATOM 0 HB2 ARG A 4 -1.028 -2.100 -10.908 1.00 2.24 H new ATOM 0 HB3 ARG A 4 0.660 -1.648 -11.038 1.00 2.24 H new ATOM 0 HG2 ARG A 4 0.370 -0.352 -8.856 1.00 64.01 H new ATOM 0 HG3 ARG A 4 -1.213 -1.092 -8.714 1.00 64.01 H new ATOM 0 HD2 ARG A 4 -0.322 -3.270 -8.477 1.00 11.43 H new ATOM 0 HD3 ARG A 4 1.220 -2.824 -9.181 1.00 11.43 H new ATOM 0 HE ARG A 4 1.960 -2.062 -7.099 1.00 20.42 H new ATOM 0 HH11 ARG A 4 -1.534 -2.568 -7.080 1.00 11.12 H new ATOM 0 HH12 ARG A 4 -1.670 -2.362 -5.330 1.00 11.12 H new ATOM 0 HH21 ARG A 4 1.776 -1.796 -4.853 1.00 54.11 H new ATOM 0 HH22 ARG A 4 0.195 -1.927 -4.075 1.00 54.11 H new ATOM 42 N ASN A 5 0.927 1.736 -11.698 1.00 11.12 N ATOM 43 CA ASN A 5 2.053 2.389 -12.359 1.00 65.45 C ATOM 44 C ASN A 5 3.378 1.813 -11.870 1.00 22.23 C ATOM 45 O ASN A 5 3.536 1.504 -10.689 1.00 64.51 O ATOM 46 CB ASN A 5 2.015 3.897 -12.104 1.00 22.02 C ATOM 47 CG ASN A 5 1.807 4.693 -13.379 1.00 55.34 C ATOM 48 OD1 ASN A 5 2.582 5.596 -13.692 1.00 52.22 O ATOM 49 ND2 ASN A 5 0.756 4.360 -14.119 1.00 41.33 N ATOM 0 H ASN A 5 0.531 2.263 -10.919 1.00 11.12 H new ATOM 0 HA ASN A 5 1.970 2.206 -13.430 1.00 65.45 H new ATOM 0 HB2 ASN A 5 1.213 4.124 -11.402 1.00 22.02 H new ATOM 0 HB3 ASN A 5 2.948 4.207 -11.633 1.00 22.02 H new ATOM 0 HD21 ASN A 5 0.564 4.860 -14.987 1.00 41.33 H new ATOM 0 HD22 ASN A 5 0.140 3.604 -13.820 1.00 41.33 H new ATOM 56 N SER A 6 4.329 1.670 -12.788 1.00 23.35 N ATOM 57 CA SER A 6 5.640 1.128 -12.453 1.00 54.00 C ATOM 58 C SER A 6 6.740 1.848 -13.229 1.00 74.23 C ATOM 59 O SER A 6 7.595 1.215 -13.847 1.00 34.12 O ATOM 60 CB SER A 6 5.687 -0.371 -12.752 1.00 55.21 C ATOM 61 OG SER A 6 4.798 -1.087 -11.912 1.00 22.42 O ATOM 0 H SER A 6 4.215 1.922 -13.770 1.00 23.35 H new ATOM 0 HA SER A 6 5.809 1.284 -11.388 1.00 54.00 H new ATOM 0 HB2 SER A 6 5.426 -0.545 -13.796 1.00 55.21 H new ATOM 0 HB3 SER A 6 6.703 -0.741 -12.612 1.00 55.21 H new ATOM 0 HG SER A 6 4.846 -2.043 -12.124 1.00 22.42 H new ATOM 67 N VAL A 7 6.711 3.175 -13.190 1.00 3.50 N ATOM 68 CA VAL A 7 7.705 3.983 -13.887 1.00 44.11 C ATOM 69 C VAL A 7 9.104 3.718 -13.346 1.00 14.44 C ATOM 70 O VAL A 7 10.060 3.568 -14.111 1.00 62.14 O ATOM 71 CB VAL A 7 7.394 5.486 -13.763 1.00 43.43 C ATOM 72 CG1 VAL A 7 8.465 6.312 -14.459 1.00 41.45 C ATOM 73 CG2 VAL A 7 6.017 5.795 -14.333 1.00 14.21 C ATOM 0 H VAL A 7 6.010 3.715 -12.683 1.00 3.50 H new ATOM 0 HA VAL A 7 7.665 3.698 -14.938 1.00 44.11 H new ATOM 0 HB VAL A 7 7.392 5.752 -12.706 1.00 43.43 H new ATOM 0 HG11 VAL A 7 8.228 7.371 -14.361 1.00 41.45 H new ATOM 0 HG12 VAL A 7 9.434 6.113 -14.000 1.00 41.45 H new ATOM 0 HG13 VAL A 7 8.502 6.045 -15.515 1.00 41.45 H new ATOM 0 HG21 VAL A 7 5.814 6.862 -14.237 1.00 14.21 H new ATOM 0 HG22 VAL A 7 5.987 5.514 -15.386 1.00 14.21 H new ATOM 0 HG23 VAL A 7 5.262 5.231 -13.785 1.00 14.21 H new ATOM 83 N LEU A 8 9.221 3.662 -12.024 1.00 52.40 N ATOM 84 CA LEU A 8 10.507 3.415 -11.380 1.00 41.52 C ATOM 85 C LEU A 8 10.384 2.322 -10.322 1.00 14.44 C ATOM 86 O LEU A 8 9.541 2.400 -9.429 1.00 2.31 O ATOM 87 CB LEU A 8 11.035 4.701 -10.741 1.00 11.21 C ATOM 88 CG LEU A 8 11.460 5.806 -11.709 1.00 24.33 C ATOM 89 CD1 LEU A 8 12.072 6.973 -10.951 1.00 63.14 C ATOM 90 CD2 LEU A 8 12.438 5.265 -12.741 1.00 73.34 C ATOM 0 H LEU A 8 8.442 3.784 -11.377 1.00 52.40 H new ATOM 0 HA LEU A 8 11.210 3.080 -12.143 1.00 41.52 H new ATOM 0 HB2 LEU A 8 10.263 5.099 -10.083 1.00 11.21 H new ATOM 0 HB3 LEU A 8 11.889 4.447 -10.113 1.00 11.21 H new ATOM 0 HG LEU A 8 10.574 6.165 -12.232 1.00 24.33 H new ATOM 0 HD11 LEU A 8 12.368 7.750 -11.656 1.00 63.14 H new ATOM 0 HD12 LEU A 8 11.339 7.377 -10.253 1.00 63.14 H new ATOM 0 HD13 LEU A 8 12.948 6.630 -10.400 1.00 63.14 H new ATOM 0 HD21 LEU A 8 12.729 6.066 -13.421 1.00 73.34 H new ATOM 0 HD22 LEU A 8 13.323 4.878 -12.236 1.00 73.34 H new ATOM 0 HD23 LEU A 8 11.964 4.463 -13.307 1.00 73.34 H new ATOM 102 N ARG A 9 11.233 1.304 -10.431 1.00 64.41 N ATOM 103 CA ARG A 9 11.219 0.196 -9.483 1.00 34.53 C ATOM 104 C ARG A 9 11.963 0.565 -8.204 1.00 12.21 C ATOM 105 O ARG A 9 12.302 1.727 -7.984 1.00 45.53 O ATOM 106 CB ARG A 9 11.852 -1.047 -10.113 1.00 64.53 C ATOM 107 CG ARG A 9 13.341 -0.904 -10.379 1.00 30.34 C ATOM 108 CD ARG A 9 13.759 -1.668 -11.626 1.00 24.24 C ATOM 109 NE ARG A 9 13.518 -3.102 -11.496 1.00 32.40 N ATOM 110 CZ ARG A 9 13.846 -3.991 -12.427 1.00 15.54 C ATOM 111 NH1 ARG A 9 14.428 -3.594 -13.551 1.00 62.42 N ATOM 112 NH2 ARG A 9 13.594 -5.280 -12.236 1.00 53.40 N ATOM 0 H ARG A 9 11.937 1.224 -11.164 1.00 64.41 H new ATOM 0 HA ARG A 9 10.181 -0.020 -9.229 1.00 34.53 H new ATOM 0 HB2 ARG A 9 11.690 -1.900 -9.455 1.00 64.53 H new ATOM 0 HB3 ARG A 9 11.343 -1.267 -11.052 1.00 64.53 H new ATOM 0 HG2 ARG A 9 13.591 0.150 -10.496 1.00 30.34 H new ATOM 0 HG3 ARG A 9 13.902 -1.272 -9.520 1.00 30.34 H new ATOM 0 HD2 ARG A 9 13.211 -1.285 -12.487 1.00 24.24 H new ATOM 0 HD3 ARG A 9 14.818 -1.494 -11.820 1.00 24.24 H new ATOM 0 HE ARG A 9 13.073 -3.440 -10.643 1.00 32.40 H new ATOM 0 HH11 ARG A 9 14.624 -2.605 -13.702 1.00 62.42 H new ATOM 0 HH12 ARG A 9 14.679 -4.278 -14.265 1.00 62.42 H new ATOM 0 HH21 ARG A 9 13.148 -5.590 -11.373 1.00 53.40 H new ATOM 0 HH22 ARG A 9 13.847 -5.961 -12.952 1.00 53.40 H new ATOM 126 N GLY A 10 12.214 -0.433 -7.361 1.00 44.01 N ATOM 127 CA GLY A 10 12.914 -0.191 -6.113 1.00 33.55 C ATOM 128 C GLY A 10 14.357 0.221 -6.330 1.00 40.44 C ATOM 129 O GLY A 10 14.849 1.146 -5.683 1.00 14.40 O ATOM 0 H GLY A 10 11.945 -1.404 -7.520 1.00 44.01 H new ATOM 0 HA2 GLY A 10 12.396 0.589 -5.555 1.00 33.55 H new ATOM 0 HA3 GLY A 10 12.885 -1.093 -5.502 1.00 33.55 H new ATOM 133 N LYS A 11 15.038 -0.467 -7.240 1.00 41.55 N ATOM 134 CA LYS A 11 16.433 -0.168 -7.540 1.00 43.14 C ATOM 135 C LYS A 11 16.552 1.125 -8.341 1.00 44.40 C ATOM 136 O LYS A 11 17.564 1.823 -8.267 1.00 54.03 O ATOM 137 CB LYS A 11 17.067 -1.323 -8.318 1.00 54.21 C ATOM 138 CG LYS A 11 18.276 -1.930 -7.628 1.00 11.30 C ATOM 139 CD LYS A 11 19.575 -1.430 -8.236 1.00 52.43 C ATOM 140 CE LYS A 11 20.767 -2.239 -7.747 1.00 11.43 C ATOM 141 NZ LYS A 11 21.242 -1.777 -6.414 1.00 54.30 N ATOM 0 H LYS A 11 14.646 -1.236 -7.783 1.00 41.55 H new ATOM 0 HA LYS A 11 16.963 -0.040 -6.596 1.00 43.14 H new ATOM 0 HB2 LYS A 11 16.319 -2.100 -8.472 1.00 54.21 H new ATOM 0 HB3 LYS A 11 17.363 -0.966 -9.304 1.00 54.21 H new ATOM 0 HG2 LYS A 11 18.252 -1.684 -6.566 1.00 11.30 H new ATOM 0 HG3 LYS A 11 18.232 -3.016 -7.704 1.00 11.30 H new ATOM 0 HD2 LYS A 11 19.515 -1.488 -9.323 1.00 52.43 H new ATOM 0 HD3 LYS A 11 19.717 -0.380 -7.981 1.00 52.43 H new ATOM 0 HE2 LYS A 11 20.492 -3.292 -7.689 1.00 11.43 H new ATOM 0 HE3 LYS A 11 21.580 -2.161 -8.469 1.00 11.43 H new ATOM 0 HZ1 LYS A 11 22.055 -2.353 -6.116 1.00 54.30 H new ATOM 0 HZ2 LYS A 11 21.529 -0.779 -6.474 1.00 54.30 H new ATOM 0 HZ3 LYS A 11 20.475 -1.875 -5.719 1.00 54.30 H new ATOM 155 N LYS A 12 15.512 1.440 -9.105 1.00 14.04 N ATOM 156 CA LYS A 12 15.498 2.651 -9.918 1.00 71.13 C ATOM 157 C LYS A 12 15.136 3.868 -9.074 1.00 3.14 C ATOM 158 O LYS A 12 15.681 4.955 -9.269 1.00 4.04 O ATOM 159 CB LYS A 12 14.505 2.503 -11.073 1.00 63.42 C ATOM 160 CG LYS A 12 14.981 1.566 -12.169 1.00 62.34 C ATOM 161 CD LYS A 12 14.011 1.537 -13.338 1.00 35.32 C ATOM 162 CE LYS A 12 14.455 0.549 -14.406 1.00 71.43 C ATOM 163 NZ LYS A 12 13.769 0.791 -15.705 1.00 41.00 N ATOM 0 H LYS A 12 14.667 0.873 -9.179 1.00 14.04 H new ATOM 0 HA LYS A 12 16.499 2.798 -10.325 1.00 71.13 H new ATOM 0 HB2 LYS A 12 13.556 2.137 -10.681 1.00 63.42 H new ATOM 0 HB3 LYS A 12 14.314 3.485 -11.504 1.00 63.42 H new ATOM 0 HG2 LYS A 12 15.964 1.883 -12.518 1.00 62.34 H new ATOM 0 HG3 LYS A 12 15.095 0.560 -11.765 1.00 62.34 H new ATOM 0 HD2 LYS A 12 13.017 1.266 -12.981 1.00 35.32 H new ATOM 0 HD3 LYS A 12 13.933 2.534 -13.772 1.00 35.32 H new ATOM 0 HE2 LYS A 12 15.533 0.625 -14.545 1.00 71.43 H new ATOM 0 HE3 LYS A 12 14.248 -0.467 -14.070 1.00 71.43 H new ATOM 0 HZ1 LYS A 12 14.268 0.281 -16.462 1.00 41.00 H new ATOM 0 HZ2 LYS A 12 12.788 0.452 -15.648 1.00 41.00 H new ATOM 0 HZ3 LYS A 12 13.771 1.810 -15.914 1.00 41.00 H new ATOM 177 N ALA A 13 14.214 3.679 -8.135 1.00 10.12 N ATOM 178 CA ALA A 13 13.782 4.762 -7.260 1.00 53.13 C ATOM 179 C ALA A 13 14.974 5.424 -6.578 1.00 40.43 C ATOM 180 O ALA A 13 15.020 6.647 -6.440 1.00 53.40 O ATOM 181 CB ALA A 13 12.800 4.240 -6.221 1.00 24.22 C ATOM 0 H ALA A 13 13.752 2.786 -7.961 1.00 10.12 H new ATOM 0 HA ALA A 13 13.283 5.514 -7.871 1.00 53.13 H new ATOM 0 HB1 ALA A 13 12.485 5.059 -5.574 1.00 24.22 H new ATOM 0 HB2 ALA A 13 11.929 3.819 -6.723 1.00 24.22 H new ATOM 0 HB3 ALA A 13 13.281 3.468 -5.621 1.00 24.22 H new ATOM 187 N ASP A 14 15.934 4.611 -6.153 1.00 22.01 N ATOM 188 CA ASP A 14 17.127 5.120 -5.485 1.00 25.31 C ATOM 189 C ASP A 14 17.878 6.098 -6.383 1.00 45.00 C ATOM 190 O ASP A 14 18.092 7.253 -6.016 1.00 70.55 O ATOM 191 CB ASP A 14 18.047 3.964 -5.088 1.00 41.44 C ATOM 192 CG ASP A 14 18.404 3.988 -3.615 1.00 20.40 C ATOM 193 OD1 ASP A 14 19.403 4.647 -3.258 1.00 12.02 O ATOM 194 OD2 ASP A 14 17.686 3.347 -2.820 1.00 43.04 O ATOM 0 H ASP A 14 15.910 3.597 -6.259 1.00 22.01 H new ATOM 0 HA ASP A 14 16.812 5.649 -4.586 1.00 25.31 H new ATOM 0 HB2 ASP A 14 17.560 3.018 -5.326 1.00 41.44 H new ATOM 0 HB3 ASP A 14 18.960 4.010 -5.681 1.00 41.44 H new ATOM 199 N GLU A 15 18.275 5.627 -7.562 1.00 63.45 N ATOM 200 CA GLU A 15 19.003 6.461 -8.510 1.00 24.45 C ATOM 201 C GLU A 15 18.323 7.817 -8.677 1.00 30.44 C ATOM 202 O GLU A 15 18.986 8.840 -8.853 1.00 71.11 O ATOM 203 CB GLU A 15 19.106 5.759 -9.865 1.00 25.45 C ATOM 204 CG GLU A 15 20.497 5.232 -10.175 1.00 24.22 C ATOM 205 CD GLU A 15 20.748 3.862 -9.574 1.00 52.35 C ATOM 206 OE1 GLU A 15 21.137 3.796 -8.389 1.00 45.44 O ATOM 207 OE2 GLU A 15 20.555 2.857 -10.288 1.00 31.04 O ATOM 0 H GLU A 15 18.105 4.674 -7.882 1.00 63.45 H new ATOM 0 HA GLU A 15 20.006 6.624 -8.116 1.00 24.45 H new ATOM 0 HB2 GLU A 15 18.399 4.930 -9.889 1.00 25.45 H new ATOM 0 HB3 GLU A 15 18.808 6.455 -10.649 1.00 25.45 H new ATOM 0 HG2 GLU A 15 20.630 5.181 -11.256 1.00 24.22 H new ATOM 0 HG3 GLU A 15 21.240 5.933 -9.795 1.00 24.22 H new ATOM 214 N LEU A 16 16.995 7.817 -8.621 1.00 33.22 N ATOM 215 CA LEU A 16 16.224 9.046 -8.766 1.00 62.01 C ATOM 216 C LEU A 16 16.479 9.991 -7.596 1.00 12.43 C ATOM 217 O LEU A 16 16.847 11.149 -7.791 1.00 34.21 O ATOM 218 CB LEU A 16 14.731 8.726 -8.860 1.00 32.11 C ATOM 219 CG LEU A 16 13.814 9.898 -9.214 1.00 55.40 C ATOM 220 CD1 LEU A 16 13.586 10.783 -7.998 1.00 0.14 C ATOM 221 CD2 LEU A 16 14.401 10.706 -10.362 1.00 51.50 C ATOM 0 H LEU A 16 16.431 6.980 -8.476 1.00 33.22 H new ATOM 0 HA LEU A 16 16.543 9.539 -9.684 1.00 62.01 H new ATOM 0 HB2 LEU A 16 14.594 7.945 -9.608 1.00 32.11 H new ATOM 0 HB3 LEU A 16 14.407 8.313 -7.904 1.00 32.11 H new ATOM 0 HG LEU A 16 12.851 9.498 -9.533 1.00 55.40 H new ATOM 0 HD11 LEU A 16 12.931 11.612 -8.269 1.00 0.14 H new ATOM 0 HD12 LEU A 16 13.122 10.198 -7.204 1.00 0.14 H new ATOM 0 HD13 LEU A 16 14.541 11.175 -7.649 1.00 0.14 H new ATOM 0 HD21 LEU A 16 13.736 11.536 -10.601 1.00 51.50 H new ATOM 0 HD22 LEU A 16 15.377 11.095 -10.071 1.00 51.50 H new ATOM 0 HD23 LEU A 16 14.512 10.066 -11.238 1.00 51.50 H new ATOM 233 N GLU A 17 16.284 9.488 -6.382 1.00 41.03 N ATOM 234 CA GLU A 17 16.495 10.288 -5.181 1.00 54.14 C ATOM 235 C GLU A 17 17.955 10.719 -5.065 1.00 42.12 C ATOM 236 O GLU A 17 18.275 11.680 -4.365 1.00 71.22 O ATOM 237 CB GLU A 17 16.085 9.498 -3.937 1.00 61.02 C ATOM 238 CG GLU A 17 14.888 10.089 -3.209 1.00 11.12 C ATOM 239 CD GLU A 17 14.487 9.277 -1.993 1.00 25.14 C ATOM 240 OE1 GLU A 17 15.352 9.037 -1.127 1.00 52.15 O ATOM 241 OE2 GLU A 17 13.304 8.882 -1.908 1.00 15.21 O ATOM 0 H GLU A 17 15.980 8.531 -6.204 1.00 41.03 H new ATOM 0 HA GLU A 17 15.875 11.181 -5.256 1.00 54.14 H new ATOM 0 HB2 GLU A 17 15.854 8.473 -4.227 1.00 61.02 H new ATOM 0 HB3 GLU A 17 16.931 9.452 -3.251 1.00 61.02 H new ATOM 0 HG2 GLU A 17 15.122 11.108 -2.900 1.00 11.12 H new ATOM 0 HG3 GLU A 17 14.044 10.150 -3.895 1.00 11.12 H new ATOM 248 N ARG A 18 18.835 10.000 -5.754 1.00 64.22 N ATOM 249 CA ARG A 18 20.260 10.306 -5.726 1.00 31.52 C ATOM 250 C ARG A 18 20.564 11.553 -6.551 1.00 53.42 C ATOM 251 O ARG A 18 21.511 12.285 -6.261 1.00 55.31 O ATOM 252 CB ARG A 18 21.068 9.121 -6.259 1.00 62.05 C ATOM 253 CG ARG A 18 21.743 8.305 -5.168 1.00 61.12 C ATOM 254 CD ARG A 18 23.221 8.644 -5.052 1.00 11.32 C ATOM 255 NE ARG A 18 23.579 9.077 -3.704 1.00 41.30 N ATOM 256 CZ ARG A 18 23.782 8.240 -2.694 1.00 53.24 C ATOM 257 NH1 ARG A 18 23.663 6.933 -2.876 1.00 22.15 N ATOM 258 NH2 ARG A 18 24.106 8.712 -1.495 1.00 35.41 N ATOM 0 H ARG A 18 18.586 9.202 -6.338 1.00 64.22 H new ATOM 0 HA ARG A 18 20.545 10.496 -4.691 1.00 31.52 H new ATOM 0 HB2 ARG A 18 20.408 8.470 -6.832 1.00 62.05 H new ATOM 0 HB3 ARG A 18 21.828 9.490 -6.948 1.00 62.05 H new ATOM 0 HG2 ARG A 18 21.250 8.492 -4.214 1.00 61.12 H new ATOM 0 HG3 ARG A 18 21.628 7.243 -5.383 1.00 61.12 H new ATOM 0 HD2 ARG A 18 23.815 7.771 -5.322 1.00 11.32 H new ATOM 0 HD3 ARG A 18 23.469 9.431 -5.764 1.00 11.32 H new ATOM 0 HE ARG A 18 23.678 10.077 -3.529 1.00 41.30 H new ATOM 0 HH11 ARG A 18 23.415 6.567 -3.795 1.00 22.15 H new ATOM 0 HH12 ARG A 18 23.820 6.293 -2.097 1.00 22.15 H new ATOM 0 HH21 ARG A 18 24.199 9.717 -1.351 1.00 35.41 H new ATOM 0 HH22 ARG A 18 24.262 8.069 -0.719 1.00 35.41 H new ATOM 272 N ILE A 19 19.755 11.790 -7.577 1.00 25.32 N ATOM 273 CA ILE A 19 19.936 12.948 -8.443 1.00 13.50 C ATOM 274 C ILE A 19 19.543 14.236 -7.727 1.00 1.22 C ATOM 275 O ILE A 19 18.529 14.285 -7.030 1.00 43.21 O ATOM 276 CB ILE A 19 19.112 12.820 -9.737 1.00 40.21 C ATOM 277 CG1 ILE A 19 19.526 11.567 -10.510 1.00 72.25 C ATOM 278 CG2 ILE A 19 19.283 14.062 -10.600 1.00 72.43 C ATOM 279 CD1 ILE A 19 18.383 10.905 -11.246 1.00 23.53 C ATOM 0 H ILE A 19 18.966 11.194 -7.829 1.00 25.32 H new ATOM 0 HA ILE A 19 20.994 12.986 -8.701 1.00 13.50 H new ATOM 0 HB ILE A 19 18.059 12.728 -9.471 1.00 40.21 H new ATOM 0 HG12 ILE A 19 20.303 11.832 -11.227 1.00 72.25 H new ATOM 0 HG13 ILE A 19 19.964 10.850 -9.816 1.00 72.25 H new ATOM 0 HG21 ILE A 19 18.694 13.956 -11.511 1.00 72.43 H new ATOM 0 HG22 ILE A 19 18.943 14.938 -10.048 1.00 72.43 H new ATOM 0 HG23 ILE A 19 20.335 14.183 -10.860 1.00 72.43 H new ATOM 0 HD11 ILE A 19 18.751 10.024 -11.771 1.00 23.53 H new ATOM 0 HD12 ILE A 19 17.614 10.608 -10.533 1.00 23.53 H new ATOM 0 HD13 ILE A 19 17.959 11.606 -11.965 1.00 23.53 H new ATOM 291 N ARG A 20 20.350 15.276 -7.906 1.00 43.44 N ATOM 292 CA ARG A 20 20.085 16.566 -7.277 1.00 20.11 C ATOM 293 C ARG A 20 19.290 17.472 -8.212 1.00 11.31 C ATOM 294 O ARG A 20 19.571 17.548 -9.409 1.00 24.11 O ATOM 295 CB ARG A 20 21.398 17.245 -6.885 1.00 11.44 C ATOM 296 CG ARG A 20 21.896 16.857 -5.502 1.00 25.33 C ATOM 297 CD ARG A 20 23.415 16.859 -5.436 1.00 0.34 C ATOM 298 NE ARG A 20 23.920 15.906 -4.451 1.00 14.44 N ATOM 299 CZ ARG A 20 23.849 16.098 -3.139 1.00 15.40 C ATOM 300 NH1 ARG A 20 23.295 17.202 -2.656 1.00 30.15 N ATOM 301 NH2 ARG A 20 24.332 15.185 -2.307 1.00 71.04 N ATOM 0 H ARG A 20 21.192 15.252 -8.481 1.00 43.44 H new ATOM 0 HA ARG A 20 19.493 16.390 -6.379 1.00 20.11 H new ATOM 0 HB2 ARG A 20 22.161 16.992 -7.621 1.00 11.44 H new ATOM 0 HB3 ARG A 20 21.264 18.326 -6.923 1.00 11.44 H new ATOM 0 HG2 ARG A 20 21.498 17.552 -4.763 1.00 25.33 H new ATOM 0 HG3 ARG A 20 21.521 15.867 -5.244 1.00 25.33 H new ATOM 0 HD2 ARG A 20 23.821 16.615 -6.418 1.00 0.34 H new ATOM 0 HD3 ARG A 20 23.766 17.860 -5.185 1.00 0.34 H new ATOM 0 HE ARG A 20 24.351 15.046 -4.790 1.00 14.44 H new ATOM 0 HH11 ARG A 20 22.922 17.906 -3.293 1.00 30.15 H new ATOM 0 HH12 ARG A 20 23.242 17.347 -1.648 1.00 30.15 H new ATOM 0 HH21 ARG A 20 24.758 14.335 -2.675 1.00 71.04 H new ATOM 0 HH22 ARG A 20 24.277 15.333 -1.299 1.00 71.04 H new ATOM 315 N LEU A 21 18.297 18.159 -7.657 1.00 21.04 N ATOM 316 CA LEU A 21 17.460 19.061 -8.442 1.00 44.05 C ATOM 317 C LEU A 21 18.298 20.161 -9.084 1.00 31.13 C ATOM 318 O LEU A 21 18.073 20.534 -10.236 1.00 61.31 O ATOM 319 CB LEU A 21 16.376 19.681 -7.556 1.00 51.50 C ATOM 320 CG LEU A 21 15.139 18.818 -7.306 1.00 72.42 C ATOM 321 CD1 LEU A 21 14.336 19.364 -6.135 1.00 34.33 C ATOM 322 CD2 LEU A 21 14.278 18.744 -8.557 1.00 4.45 C ATOM 0 H LEU A 21 18.052 18.109 -6.668 1.00 21.04 H new ATOM 0 HA LEU A 21 16.987 18.481 -9.235 1.00 44.05 H new ATOM 0 HB2 LEU A 21 16.821 19.931 -6.593 1.00 51.50 H new ATOM 0 HB3 LEU A 21 16.055 20.618 -8.011 1.00 51.50 H new ATOM 0 HG LEU A 21 15.468 17.809 -7.056 1.00 72.42 H new ATOM 0 HD11 LEU A 21 13.459 18.737 -5.971 1.00 34.33 H new ATOM 0 HD12 LEU A 21 14.955 19.364 -5.238 1.00 34.33 H new ATOM 0 HD13 LEU A 21 14.018 20.383 -6.356 1.00 34.33 H new ATOM 0 HD21 LEU A 21 13.402 18.126 -8.360 1.00 4.45 H new ATOM 0 HD22 LEU A 21 13.958 19.747 -8.838 1.00 4.45 H new ATOM 0 HD23 LEU A 21 14.856 18.306 -9.371 1.00 4.45 H new ATOM 334 N ARG A 22 19.266 20.675 -8.333 1.00 33.03 N ATOM 335 CA ARG A 22 20.140 21.732 -8.831 1.00 20.51 C ATOM 336 C ARG A 22 21.605 21.312 -8.746 1.00 64.30 C ATOM 337 O ARG A 22 21.973 20.405 -7.998 1.00 3.23 O ATOM 338 CB ARG A 22 19.921 23.020 -8.037 1.00 44.03 C ATOM 339 CG ARG A 22 18.969 23.996 -8.708 1.00 22.22 C ATOM 340 CD ARG A 22 18.783 25.256 -7.877 1.00 13.21 C ATOM 341 NE ARG A 22 17.684 26.080 -8.370 1.00 21.42 N ATOM 342 CZ ARG A 22 16.404 25.737 -8.266 1.00 64.04 C ATOM 343 NH1 ARG A 22 16.066 24.593 -7.687 1.00 4.24 N ATOM 344 NH2 ARG A 22 15.460 26.541 -8.739 1.00 40.04 N ATOM 0 H ARG A 22 19.465 20.377 -7.378 1.00 33.03 H new ATOM 0 HA ARG A 22 19.892 21.911 -9.877 1.00 20.51 H new ATOM 0 HB2 ARG A 22 19.532 22.767 -7.051 1.00 44.03 H new ATOM 0 HB3 ARG A 22 20.882 23.510 -7.884 1.00 44.03 H new ATOM 0 HG2 ARG A 22 19.354 24.262 -9.693 1.00 22.22 H new ATOM 0 HG3 ARG A 22 18.003 23.515 -8.863 1.00 22.22 H new ATOM 0 HD2 ARG A 22 18.593 24.981 -6.840 1.00 13.21 H new ATOM 0 HD3 ARG A 22 19.705 25.837 -7.889 1.00 13.21 H new ATOM 0 HE ARG A 22 17.910 26.968 -8.819 1.00 21.42 H new ATOM 0 HH11 ARG A 22 16.789 23.974 -7.320 1.00 4.24 H new ATOM 0 HH12 ARG A 22 15.083 24.332 -7.608 1.00 4.24 H new ATOM 0 HH21 ARG A 22 15.716 27.423 -9.183 1.00 40.04 H new ATOM 0 HH22 ARG A 22 14.478 26.277 -8.659 1.00 40.04 H new ATOM 358 N PRO A 23 22.460 21.984 -9.529 1.00 10.33 N ATOM 359 CA PRO A 23 23.897 21.699 -9.561 1.00 21.31 C ATOM 360 C PRO A 23 24.599 22.114 -8.272 1.00 72.21 C ATOM 361 O PRO A 23 25.561 21.477 -7.845 1.00 3.41 O ATOM 362 CB PRO A 23 24.400 22.539 -10.737 1.00 14.30 C ATOM 363 CG PRO A 23 23.417 23.651 -10.857 1.00 44.54 C ATOM 364 CD PRO A 23 22.090 23.077 -10.445 1.00 23.01 C ATOM 0 HA PRO A 23 24.098 20.633 -9.664 1.00 21.31 H new ATOM 0 HB2 PRO A 23 25.405 22.918 -10.552 1.00 14.30 H new ATOM 0 HB3 PRO A 23 24.445 21.950 -11.653 1.00 14.30 H new ATOM 0 HG2 PRO A 23 23.695 24.489 -10.217 1.00 44.54 H new ATOM 0 HG3 PRO A 23 23.378 24.029 -11.879 1.00 44.54 H new ATOM 0 HD2 PRO A 23 21.466 23.822 -9.951 1.00 23.01 H new ATOM 0 HD3 PRO A 23 21.528 22.709 -11.303 1.00 23.01 H new ATOM 372 N GLY A 24 24.110 23.186 -7.655 1.00 64.40 N ATOM 373 CA GLY A 24 24.702 23.667 -6.421 1.00 71.33 C ATOM 374 C GLY A 24 23.702 23.723 -5.282 1.00 14.30 C ATOM 375 O GLY A 24 23.786 24.593 -4.416 1.00 55.11 O ATOM 0 H GLY A 24 23.314 23.730 -7.988 1.00 64.40 H new ATOM 0 HA2 GLY A 24 25.531 23.017 -6.141 1.00 71.33 H new ATOM 0 HA3 GLY A 24 25.118 24.661 -6.584 1.00 71.33 H new ATOM 379 N GLY A 25 22.753 22.793 -5.283 1.00 75.22 N ATOM 380 CA GLY A 25 21.746 22.759 -4.238 1.00 13.43 C ATOM 381 C GLY A 25 21.908 21.568 -3.315 1.00 25.55 C ATOM 382 O GLY A 25 22.861 20.798 -3.443 1.00 64.02 O ATOM 0 H GLY A 25 22.663 22.062 -5.989 1.00 75.22 H new ATOM 0 HA2 GLY A 25 21.802 23.678 -3.654 1.00 13.43 H new ATOM 0 HA3 GLY A 25 20.756 22.730 -4.693 1.00 13.43 H new ATOM 386 N LYS A 26 20.975 21.414 -2.382 1.00 21.43 N ATOM 387 CA LYS A 26 21.017 20.307 -1.433 1.00 52.10 C ATOM 388 C LYS A 26 19.707 19.527 -1.449 1.00 62.14 C ATOM 389 O LYS A 26 19.409 18.775 -0.521 1.00 21.43 O ATOM 390 CB LYS A 26 21.295 20.830 -0.021 1.00 40.20 C ATOM 391 CG LYS A 26 22.650 21.499 0.124 1.00 13.51 C ATOM 392 CD LYS A 26 22.753 22.275 1.426 1.00 14.22 C ATOM 393 CE LYS A 26 23.982 21.866 2.223 1.00 44.32 C ATOM 394 NZ LYS A 26 24.302 22.852 3.293 1.00 10.00 N ATOM 0 H LYS A 26 20.180 22.042 -2.262 1.00 21.43 H new ATOM 0 HA LYS A 26 21.822 19.636 -1.731 1.00 52.10 H new ATOM 0 HB2 LYS A 26 20.517 21.542 0.253 1.00 40.20 H new ATOM 0 HB3 LYS A 26 21.231 20.001 0.684 1.00 40.20 H new ATOM 0 HG2 LYS A 26 23.435 20.744 0.086 1.00 13.51 H new ATOM 0 HG3 LYS A 26 22.816 22.173 -0.716 1.00 13.51 H new ATOM 0 HD2 LYS A 26 22.796 23.343 1.212 1.00 14.22 H new ATOM 0 HD3 LYS A 26 21.857 22.105 2.024 1.00 14.22 H new ATOM 0 HE2 LYS A 26 23.815 20.886 2.670 1.00 44.32 H new ATOM 0 HE3 LYS A 26 24.835 21.769 1.551 1.00 44.32 H new ATOM 0 HZ1 LYS A 26 25.146 22.538 3.814 1.00 10.00 H new ATOM 0 HZ2 LYS A 26 24.486 23.782 2.865 1.00 10.00 H new ATOM 0 HZ3 LYS A 26 23.498 22.926 3.949 1.00 10.00 H new ATOM 408 N LYS A 27 18.927 19.710 -2.509 1.00 4.22 N ATOM 409 CA LYS A 27 17.649 19.022 -2.648 1.00 72.52 C ATOM 410 C LYS A 27 17.667 18.078 -3.846 1.00 74.31 C ATOM 411 O LYS A 27 18.114 18.446 -4.932 1.00 20.44 O ATOM 412 CB LYS A 27 16.514 20.036 -2.802 1.00 72.33 C ATOM 413 CG LYS A 27 15.524 20.020 -1.648 1.00 15.33 C ATOM 414 CD LYS A 27 16.125 20.621 -0.389 1.00 12.53 C ATOM 415 CE LYS A 27 16.102 19.633 0.766 1.00 30.32 C ATOM 416 NZ LYS A 27 14.888 19.799 1.613 1.00 32.25 N ATOM 0 H LYS A 27 19.158 20.330 -3.285 1.00 4.22 H new ATOM 0 HA LYS A 27 17.482 18.433 -1.746 1.00 72.52 H new ATOM 0 HB2 LYS A 27 16.940 21.035 -2.891 1.00 72.33 H new ATOM 0 HB3 LYS A 27 15.980 19.834 -3.731 1.00 72.33 H new ATOM 0 HG2 LYS A 27 14.630 20.577 -1.927 1.00 15.33 H new ATOM 0 HG3 LYS A 27 15.212 18.995 -1.450 1.00 15.33 H new ATOM 0 HD2 LYS A 27 17.152 20.928 -0.586 1.00 12.53 H new ATOM 0 HD3 LYS A 27 15.571 21.518 -0.113 1.00 12.53 H new ATOM 0 HE2 LYS A 27 16.136 18.616 0.375 1.00 30.32 H new ATOM 0 HE3 LYS A 27 16.994 19.769 1.378 1.00 30.32 H new ATOM 0 HZ1 LYS A 27 14.909 19.107 2.389 1.00 32.25 H new ATOM 0 HZ2 LYS A 27 14.868 20.761 2.007 1.00 32.25 H new ATOM 0 HZ3 LYS A 27 14.037 19.644 1.035 1.00 32.25 H new ATOM 430 N LYS A 28 17.178 16.859 -3.641 1.00 25.13 N ATOM 431 CA LYS A 28 17.134 15.863 -4.704 1.00 33.21 C ATOM 432 C LYS A 28 15.697 15.590 -5.136 1.00 21.22 C ATOM 433 O LYS A 28 14.749 15.985 -4.457 1.00 74.44 O ATOM 434 CB LYS A 28 17.795 14.563 -4.240 1.00 3.12 C ATOM 435 CG LYS A 28 19.310 14.641 -4.172 1.00 43.20 C ATOM 436 CD LYS A 28 19.840 14.068 -2.868 1.00 63.43 C ATOM 437 CE LYS A 28 20.421 15.154 -1.977 1.00 45.44 C ATOM 438 NZ LYS A 28 19.443 15.612 -0.952 1.00 54.25 N ATOM 0 H LYS A 28 16.806 16.538 -2.747 1.00 25.13 H new ATOM 0 HA LYS A 28 17.682 16.257 -5.560 1.00 33.21 H new ATOM 0 HB2 LYS A 28 17.409 14.300 -3.255 1.00 3.12 H new ATOM 0 HB3 LYS A 28 17.511 13.759 -4.919 1.00 3.12 H new ATOM 0 HG2 LYS A 28 19.741 14.096 -5.012 1.00 43.20 H new ATOM 0 HG3 LYS A 28 19.627 15.679 -4.269 1.00 43.20 H new ATOM 0 HD2 LYS A 28 19.035 13.556 -2.341 1.00 63.43 H new ATOM 0 HD3 LYS A 28 20.606 13.323 -3.082 1.00 63.43 H new ATOM 0 HE2 LYS A 28 21.316 14.777 -1.482 1.00 45.44 H new ATOM 0 HE3 LYS A 28 20.728 16.001 -2.590 1.00 45.44 H new ATOM 0 HZ1 LYS A 28 19.499 16.646 -0.857 1.00 54.25 H new ATOM 0 HZ2 LYS A 28 18.482 15.342 -1.244 1.00 54.25 H new ATOM 0 HZ3 LYS A 28 19.664 15.168 -0.038 1.00 54.25 H new ATOM 452 N TYR A 29 15.543 14.911 -6.268 1.00 40.13 N ATOM 453 CA TYR A 29 14.221 14.586 -6.790 1.00 60.12 C ATOM 454 C TYR A 29 13.493 13.616 -5.863 1.00 3.23 C ATOM 455 O TYR A 29 14.120 12.857 -5.124 1.00 45.54 O ATOM 456 CB TYR A 29 14.337 13.980 -8.190 1.00 51.44 C ATOM 457 CG TYR A 29 14.511 15.012 -9.282 1.00 72.11 C ATOM 458 CD1 TYR A 29 13.410 15.631 -9.861 1.00 31.32 C ATOM 459 CD2 TYR A 29 15.775 15.366 -9.737 1.00 74.55 C ATOM 460 CE1 TYR A 29 13.563 16.572 -10.860 1.00 21.33 C ATOM 461 CE2 TYR A 29 15.939 16.307 -10.733 1.00 24.43 C ATOM 462 CZ TYR A 29 14.830 16.907 -11.292 1.00 23.12 C ATOM 463 OH TYR A 29 14.987 17.845 -12.287 1.00 35.33 O ATOM 0 H TYR A 29 16.317 14.575 -6.841 1.00 40.13 H new ATOM 0 HA TYR A 29 13.644 15.509 -6.847 1.00 60.12 H new ATOM 0 HB2 TYR A 29 15.184 13.294 -8.211 1.00 51.44 H new ATOM 0 HB3 TYR A 29 13.444 13.390 -8.397 1.00 51.44 H new ATOM 0 HD1 TYR A 29 12.417 15.372 -9.524 1.00 31.32 H new ATOM 0 HD2 TYR A 29 16.645 14.896 -9.303 1.00 74.55 H new ATOM 0 HE1 TYR A 29 12.697 17.043 -11.300 1.00 21.33 H new ATOM 0 HE2 TYR A 29 16.929 16.572 -11.073 1.00 24.43 H new ATOM 0 HH TYR A 29 15.846 18.303 -12.172 1.00 35.33 H new ATOM 473 N ARG A 30 12.165 13.648 -5.911 1.00 63.04 N ATOM 474 CA ARG A 30 11.350 12.773 -5.076 1.00 11.34 C ATOM 475 C ARG A 30 10.122 12.285 -5.838 1.00 73.51 C ATOM 476 O ARG A 30 9.777 12.821 -6.892 1.00 13.11 O ATOM 477 CB ARG A 30 10.917 13.505 -3.804 1.00 22.34 C ATOM 478 CG ARG A 30 11.364 12.820 -2.524 1.00 32.43 C ATOM 479 CD ARG A 30 11.657 13.828 -1.425 1.00 42.02 C ATOM 480 NE ARG A 30 13.081 14.138 -1.331 1.00 11.02 N ATOM 481 CZ ARG A 30 13.600 14.939 -0.407 1.00 33.44 C ATOM 482 NH1 ARG A 30 12.816 15.507 0.498 1.00 75.53 N ATOM 483 NH2 ARG A 30 14.907 15.171 -0.387 1.00 45.02 N ATOM 0 H ARG A 30 11.631 14.270 -6.518 1.00 63.04 H new ATOM 0 HA ARG A 30 11.954 11.908 -4.801 1.00 11.34 H new ATOM 0 HB2 ARG A 30 11.319 14.518 -3.823 1.00 22.34 H new ATOM 0 HB3 ARG A 30 9.831 13.594 -3.798 1.00 22.34 H new ATOM 0 HG2 ARG A 30 10.589 12.131 -2.189 1.00 32.43 H new ATOM 0 HG3 ARG A 30 12.256 12.225 -2.721 1.00 32.43 H new ATOM 0 HD2 ARG A 30 11.099 14.744 -1.616 1.00 42.02 H new ATOM 0 HD3 ARG A 30 11.308 13.435 -0.470 1.00 42.02 H new ATOM 0 HE ARG A 30 13.712 13.716 -2.012 1.00 11.02 H new ATOM 0 HH11 ARG A 30 11.812 15.330 0.486 1.00 75.53 H new ATOM 0 HH12 ARG A 30 13.217 16.122 1.206 1.00 75.53 H new ATOM 0 HH21 ARG A 30 15.513 14.734 -1.081 1.00 45.02 H new ATOM 0 HH22 ARG A 30 15.305 15.786 0.323 1.00 45.02 H new ATOM 497 N LEU A 31 9.466 11.262 -5.299 1.00 2.33 N ATOM 498 CA LEU A 31 8.276 10.700 -5.928 1.00 14.03 C ATOM 499 C LEU A 31 7.309 11.802 -6.348 1.00 63.54 C ATOM 500 O LEU A 31 6.683 11.726 -7.405 1.00 70.22 O ATOM 501 CB LEU A 31 7.580 9.730 -4.973 1.00 43.45 C ATOM 502 CG LEU A 31 7.880 8.246 -5.185 1.00 64.30 C ATOM 503 CD1 LEU A 31 9.353 7.960 -4.942 1.00 34.40 C ATOM 504 CD2 LEU A 31 7.011 7.391 -4.274 1.00 63.22 C ATOM 0 H LEU A 31 9.738 10.806 -4.428 1.00 2.33 H new ATOM 0 HA LEU A 31 8.589 10.158 -6.821 1.00 14.03 H new ATOM 0 HB2 LEU A 31 7.858 9.994 -3.953 1.00 43.45 H new ATOM 0 HB3 LEU A 31 6.503 9.878 -5.058 1.00 43.45 H new ATOM 0 HG LEU A 31 7.647 7.992 -6.219 1.00 64.30 H new ATOM 0 HD11 LEU A 31 9.548 6.899 -5.097 1.00 34.40 H new ATOM 0 HD12 LEU A 31 9.957 8.545 -5.636 1.00 34.40 H new ATOM 0 HD13 LEU A 31 9.612 8.230 -3.918 1.00 34.40 H new ATOM 0 HD21 LEU A 31 7.238 6.338 -4.438 1.00 63.22 H new ATOM 0 HD22 LEU A 31 7.212 7.647 -3.234 1.00 63.22 H new ATOM 0 HD23 LEU A 31 5.960 7.575 -4.496 1.00 63.22 H new ATOM 516 N LYS A 32 7.192 12.829 -5.511 1.00 22.13 N ATOM 517 CA LYS A 32 6.304 13.950 -5.795 1.00 22.55 C ATOM 518 C LYS A 32 6.545 14.493 -7.200 1.00 61.13 C ATOM 519 O LYS A 32 5.601 14.791 -7.932 1.00 4.30 O ATOM 520 CB LYS A 32 6.508 15.062 -4.765 1.00 50.25 C ATOM 521 CG LYS A 32 5.592 14.951 -3.559 1.00 24.23 C ATOM 522 CD LYS A 32 4.348 15.807 -3.723 1.00 5.23 C ATOM 523 CE LYS A 32 4.574 17.222 -3.211 1.00 20.11 C ATOM 524 NZ LYS A 32 4.330 18.241 -4.270 1.00 33.00 N ATOM 0 H LYS A 32 7.701 12.907 -4.631 1.00 22.13 H new ATOM 0 HA LYS A 32 5.276 13.591 -5.735 1.00 22.55 H new ATOM 0 HB2 LYS A 32 7.544 15.046 -4.426 1.00 50.25 H new ATOM 0 HB3 LYS A 32 6.345 16.026 -5.247 1.00 50.25 H new ATOM 0 HG2 LYS A 32 5.302 13.910 -3.416 1.00 24.23 H new ATOM 0 HG3 LYS A 32 6.131 15.258 -2.662 1.00 24.23 H new ATOM 0 HD2 LYS A 32 4.064 15.840 -4.775 1.00 5.23 H new ATOM 0 HD3 LYS A 32 3.518 15.352 -3.183 1.00 5.23 H new ATOM 0 HE2 LYS A 32 3.913 17.412 -2.365 1.00 20.11 H new ATOM 0 HE3 LYS A 32 5.596 17.317 -2.845 1.00 20.11 H new ATOM 0 HZ1 LYS A 32 4.494 19.192 -3.882 1.00 33.00 H new ATOM 0 HZ2 LYS A 32 4.978 18.076 -5.067 1.00 33.00 H new ATOM 0 HZ3 LYS A 32 3.347 18.168 -4.602 1.00 33.00 H new ATOM 538 N HIS A 33 7.815 14.619 -7.571 1.00 30.21 N ATOM 539 CA HIS A 33 8.181 15.124 -8.890 1.00 2.22 C ATOM 540 C HIS A 33 7.762 14.143 -9.982 1.00 12.13 C ATOM 541 O HIS A 33 7.356 14.618 -11.043 1.00 64.21 O ATOM 542 CB HIS A 33 9.688 15.374 -8.965 1.00 64.53 C ATOM 543 CG HIS A 33 10.171 16.407 -7.993 1.00 12.34 C ATOM 544 ND1 HIS A 33 11.090 16.136 -7.002 1.00 32.30 N ATOM 545 CD2 HIS A 33 9.859 17.717 -7.866 1.00 53.52 C ATOM 546 CE1 HIS A 33 11.321 17.235 -6.307 1.00 55.14 C ATOM 547 NE2 HIS A 33 10.587 18.209 -6.811 1.00 53.41 N ATOM 0 H HIS A 33 8.608 14.378 -6.977 1.00 30.21 H new ATOM 0 HA HIS A 33 7.656 16.066 -9.049 1.00 2.22 H new ATOM 0 HB2 HIS A 33 10.213 14.437 -8.779 1.00 64.53 H new ATOM 0 HB3 HIS A 33 9.946 15.689 -9.976 1.00 64.53 H new ATOM 0 HD2 HIS A 33 9.166 18.273 -8.480 1.00 53.52 H new ATOM 0 HE1 HIS A 33 11.996 17.322 -5.468 1.00 55.14 H new ATOM 0 HE2 HIS A 33 10.564 19.171 -6.472 1.00 53.41 H new ATOM 555 N ILE A 34 7.847 12.836 -9.760 1.00 55.13 N ATOM 556 CA ILE A 34 7.458 11.862 -10.772 1.00 2.31 C ATOM 557 C ILE A 34 5.971 11.968 -11.093 1.00 2.24 C ATOM 558 O ILE A 34 5.567 11.870 -12.253 1.00 62.45 O ATOM 559 CB ILE A 34 7.772 10.424 -10.320 1.00 35.13 C ATOM 560 CG1 ILE A 34 9.261 10.282 -9.998 1.00 61.13 C ATOM 561 CG2 ILE A 34 7.360 9.429 -11.395 1.00 3.15 C ATOM 562 CD1 ILE A 34 9.655 8.886 -9.566 1.00 41.00 C ATOM 0 H ILE A 34 8.182 12.427 -8.888 1.00 55.13 H new ATOM 0 HA ILE A 34 8.038 12.088 -11.667 1.00 2.31 H new ATOM 0 HB ILE A 34 7.201 10.210 -9.416 1.00 35.13 H new ATOM 0 HG12 ILE A 34 9.843 10.559 -10.877 1.00 61.13 H new ATOM 0 HG13 ILE A 34 9.522 10.986 -9.208 1.00 61.13 H new ATOM 0 HG21 ILE A 34 7.588 8.417 -11.061 1.00 3.15 H new ATOM 0 HG22 ILE A 34 6.290 9.517 -11.581 1.00 3.15 H new ATOM 0 HG23 ILE A 34 7.907 9.639 -12.314 1.00 3.15 H new ATOM 0 HD11 ILE A 34 10.724 8.859 -9.354 1.00 41.00 H new ATOM 0 HD12 ILE A 34 9.100 8.613 -8.669 1.00 41.00 H new ATOM 0 HD13 ILE A 34 9.425 8.180 -10.364 1.00 41.00 H new ATOM 574 N VAL A 35 5.160 12.173 -10.060 1.00 34.40 N ATOM 575 CA VAL A 35 3.718 12.296 -10.232 1.00 53.41 C ATOM 576 C VAL A 35 3.370 13.492 -11.111 1.00 61.31 C ATOM 577 O VAL A 35 2.674 13.353 -12.117 1.00 3.43 O ATOM 578 CB VAL A 35 3.002 12.443 -8.877 1.00 62.13 C ATOM 579 CG1 VAL A 35 1.502 12.596 -9.079 1.00 1.11 C ATOM 580 CG2 VAL A 35 3.308 11.252 -7.980 1.00 11.35 C ATOM 0 H VAL A 35 5.478 12.257 -9.094 1.00 34.40 H new ATOM 0 HA VAL A 35 3.377 11.381 -10.717 1.00 53.41 H new ATOM 0 HB VAL A 35 3.372 13.343 -8.387 1.00 62.13 H new ATOM 0 HG11 VAL A 35 1.013 12.699 -8.110 1.00 1.11 H new ATOM 0 HG12 VAL A 35 1.305 13.483 -9.681 1.00 1.11 H new ATOM 0 HG13 VAL A 35 1.112 11.716 -9.591 1.00 1.11 H new ATOM 0 HG21 VAL A 35 2.794 11.373 -7.027 1.00 11.35 H new ATOM 0 HG22 VAL A 35 2.967 10.336 -8.463 1.00 11.35 H new ATOM 0 HG23 VAL A 35 4.383 11.193 -7.808 1.00 11.35 H new ATOM 590 N TRP A 36 3.857 14.665 -10.725 1.00 75.32 N ATOM 591 CA TRP A 36 3.598 15.887 -11.478 1.00 32.30 C ATOM 592 C TRP A 36 3.955 15.705 -12.950 1.00 71.41 C ATOM 593 O TRP A 36 3.228 16.155 -13.834 1.00 60.01 O ATOM 594 CB TRP A 36 4.391 17.052 -10.889 1.00 55.53 C ATOM 595 CG TRP A 36 4.028 18.380 -11.481 1.00 3.12 C ATOM 596 CD1 TRP A 36 2.973 19.174 -11.129 1.00 20.53 C ATOM 597 CD2 TRP A 36 4.715 19.067 -12.533 1.00 54.14 C ATOM 598 NE1 TRP A 36 2.965 20.312 -11.898 1.00 63.10 N ATOM 599 CE2 TRP A 36 4.023 20.272 -12.766 1.00 71.43 C ATOM 600 CE3 TRP A 36 5.850 18.782 -13.298 1.00 4.24 C ATOM 601 CZ2 TRP A 36 4.429 21.187 -13.733 1.00 71.24 C ATOM 602 CZ3 TRP A 36 6.250 19.693 -14.258 1.00 51.12 C ATOM 603 CH2 TRP A 36 5.542 20.883 -14.468 1.00 55.32 C ATOM 0 H TRP A 36 4.434 14.796 -9.894 1.00 75.32 H new ATOM 0 HA TRP A 36 2.533 16.109 -11.406 1.00 32.30 H new ATOM 0 HB2 TRP A 36 4.227 17.086 -9.812 1.00 55.53 H new ATOM 0 HB3 TRP A 36 5.455 16.872 -11.044 1.00 55.53 H new ATOM 0 HD1 TRP A 36 2.252 18.941 -10.360 1.00 20.53 H new ATOM 0 HE1 TRP A 36 2.281 21.066 -11.833 1.00 63.10 H new ATOM 0 HE3 TRP A 36 6.404 17.868 -13.142 1.00 4.24 H new ATOM 0 HZ2 TRP A 36 3.884 22.105 -13.897 1.00 71.24 H new ATOM 0 HZ3 TRP A 36 7.124 19.483 -14.857 1.00 51.12 H new ATOM 0 HH2 TRP A 36 5.881 21.574 -15.225 1.00 55.32 H new ATOM 614 N ALA A 37 5.078 15.041 -13.204 1.00 71.24 N ATOM 615 CA ALA A 37 5.529 14.798 -14.569 1.00 74.25 C ATOM 616 C ALA A 37 4.482 14.027 -15.364 1.00 44.03 C ATOM 617 O ALA A 37 3.981 14.510 -16.379 1.00 15.13 O ATOM 618 CB ALA A 37 6.850 14.043 -14.560 1.00 22.51 C ATOM 0 H ALA A 37 5.692 14.662 -12.483 1.00 71.24 H new ATOM 0 HA ALA A 37 5.677 15.763 -15.055 1.00 74.25 H new ATOM 0 HB1 ALA A 37 7.176 13.868 -15.585 1.00 22.51 H new ATOM 0 HB2 ALA A 37 7.602 14.632 -14.036 1.00 22.51 H new ATOM 0 HB3 ALA A 37 6.719 13.087 -14.052 1.00 22.51 H new ATOM 624 N ALA A 38 4.155 12.827 -14.896 1.00 3.05 N ATOM 625 CA ALA A 38 3.165 11.990 -15.564 1.00 40.22 C ATOM 626 C ALA A 38 1.813 12.691 -15.636 1.00 20.14 C ATOM 627 O ALA A 38 1.040 12.474 -16.568 1.00 31.05 O ATOM 628 CB ALA A 38 3.033 10.655 -14.846 1.00 4.13 C ATOM 0 H ALA A 38 4.561 12.412 -14.057 1.00 3.05 H new ATOM 0 HA ALA A 38 3.505 11.809 -16.584 1.00 40.22 H new ATOM 0 HB1 ALA A 38 2.291 10.040 -15.355 1.00 4.13 H new ATOM 0 HB2 ALA A 38 3.995 10.142 -14.852 1.00 4.13 H new ATOM 0 HB3 ALA A 38 2.719 10.825 -13.816 1.00 4.13 H new ATOM 634 N ASN A 39 1.533 13.532 -14.645 1.00 23.41 N ATOM 635 CA ASN A 39 0.272 14.263 -14.596 1.00 31.31 C ATOM 636 C ASN A 39 0.201 15.299 -15.714 1.00 61.22 C ATOM 637 O ASN A 39 -0.708 15.272 -16.545 1.00 73.15 O ATOM 638 CB ASN A 39 0.109 14.949 -13.238 1.00 32.44 C ATOM 639 CG ASN A 39 -1.028 14.359 -12.426 1.00 43.15 C ATOM 640 OD1 ASN A 39 -0.804 13.704 -11.409 1.00 33.52 O ATOM 641 ND2 ASN A 39 -2.257 14.592 -12.873 1.00 73.42 N ATOM 0 H ASN A 39 2.162 13.724 -13.866 1.00 23.41 H new ATOM 0 HA ASN A 39 -0.540 13.549 -14.734 1.00 31.31 H new ATOM 0 HB2 ASN A 39 1.038 14.860 -12.675 1.00 32.44 H new ATOM 0 HB3 ASN A 39 -0.071 16.013 -13.391 1.00 32.44 H new ATOM 0 HD21 ASN A 39 -3.062 14.222 -12.368 1.00 73.42 H new ATOM 0 HD22 ASN A 39 -2.396 15.141 -13.722 1.00 73.42 H new ATOM 648 N LYS A 40 1.166 16.213 -15.728 1.00 12.13 N ATOM 649 CA LYS A 40 1.216 17.258 -16.745 1.00 61.54 C ATOM 650 C LYS A 40 1.052 16.667 -18.141 1.00 53.10 C ATOM 651 O LYS A 40 0.488 17.302 -19.032 1.00 0.02 O ATOM 652 CB LYS A 40 2.538 18.023 -16.653 1.00 4.23 C ATOM 653 CG LYS A 40 2.565 19.059 -15.543 1.00 11.53 C ATOM 654 CD LYS A 40 1.795 20.311 -15.929 1.00 63.33 C ATOM 655 CE LYS A 40 0.740 20.658 -14.888 1.00 12.14 C ATOM 656 NZ LYS A 40 0.690 22.122 -14.618 1.00 60.13 N ATOM 0 H LYS A 40 1.924 16.251 -15.047 1.00 12.13 H new ATOM 0 HA LYS A 40 0.391 17.948 -16.564 1.00 61.54 H new ATOM 0 HB2 LYS A 40 3.349 17.312 -16.495 1.00 4.23 H new ATOM 0 HB3 LYS A 40 2.729 18.518 -17.605 1.00 4.23 H new ATOM 0 HG2 LYS A 40 2.137 18.633 -14.636 1.00 11.53 H new ATOM 0 HG3 LYS A 40 3.598 19.322 -15.315 1.00 11.53 H new ATOM 0 HD2 LYS A 40 2.487 21.146 -16.040 1.00 63.33 H new ATOM 0 HD3 LYS A 40 1.317 20.162 -16.897 1.00 63.33 H new ATOM 0 HE2 LYS A 40 -0.237 20.318 -15.233 1.00 12.14 H new ATOM 0 HE3 LYS A 40 0.954 20.125 -13.962 1.00 12.14 H new ATOM 0 HZ1 LYS A 40 -0.040 22.319 -13.904 1.00 60.13 H new ATOM 0 HZ2 LYS A 40 1.614 22.442 -14.265 1.00 60.13 H new ATOM 0 HZ3 LYS A 40 0.461 22.629 -15.496 1.00 60.13 H new ATOM 670 N LEU A 41 1.549 15.449 -18.324 1.00 11.11 N ATOM 671 CA LEU A 41 1.457 14.771 -19.614 1.00 43.34 C ATOM 672 C LEU A 41 0.002 14.508 -19.987 1.00 12.44 C ATOM 673 O LEU A 41 -0.512 15.072 -20.953 1.00 20.25 O ATOM 674 CB LEU A 41 2.232 13.453 -19.575 1.00 73.52 C ATOM 675 CG LEU A 41 3.754 13.571 -19.486 1.00 14.54 C ATOM 676 CD1 LEU A 41 4.381 12.209 -19.236 1.00 12.34 C ATOM 677 CD2 LEU A 41 4.315 14.193 -20.757 1.00 72.01 C ATOM 0 H LEU A 41 2.020 14.910 -17.597 1.00 11.11 H new ATOM 0 HA LEU A 41 1.895 15.421 -20.371 1.00 43.34 H new ATOM 0 HB2 LEU A 41 1.882 12.874 -18.720 1.00 73.52 H new ATOM 0 HB3 LEU A 41 1.984 12.882 -20.470 1.00 73.52 H new ATOM 0 HG LEU A 41 4.001 14.221 -18.647 1.00 14.54 H new ATOM 0 HD11 LEU A 41 5.464 12.313 -19.176 1.00 12.34 H new ATOM 0 HD12 LEU A 41 4.003 11.801 -18.299 1.00 12.34 H new ATOM 0 HD13 LEU A 41 4.126 11.535 -20.054 1.00 12.34 H new ATOM 0 HD21 LEU A 41 5.399 14.270 -20.677 1.00 72.01 H new ATOM 0 HD22 LEU A 41 4.058 13.568 -21.612 1.00 72.01 H new ATOM 0 HD23 LEU A 41 3.890 15.187 -20.894 1.00 72.01 H new ATOM 689 N ASP A 42 -0.656 13.650 -19.216 1.00 2.41 N ATOM 690 CA ASP A 42 -2.053 13.316 -19.464 1.00 63.43 C ATOM 691 C ASP A 42 -2.880 14.575 -19.705 1.00 14.04 C ATOM 692 O ASP A 42 -3.711 14.619 -20.613 1.00 33.14 O ATOM 693 CB ASP A 42 -2.629 12.531 -18.285 1.00 61.25 C ATOM 694 CG ASP A 42 -4.098 12.203 -18.469 1.00 62.11 C ATOM 695 OD1 ASP A 42 -4.945 13.034 -18.080 1.00 44.31 O ATOM 696 OD2 ASP A 42 -4.400 11.115 -19.002 1.00 3.14 O ATOM 0 H ASP A 42 -0.244 13.173 -18.414 1.00 2.41 H new ATOM 0 HA ASP A 42 -2.098 12.697 -20.360 1.00 63.43 H new ATOM 0 HB2 ASP A 42 -2.066 11.606 -18.159 1.00 61.25 H new ATOM 0 HB3 ASP A 42 -2.501 13.109 -17.370 1.00 61.25 H new ATOM 701 N ARG A 43 -2.646 15.596 -18.888 1.00 4.14 N ATOM 702 CA ARG A 43 -3.370 16.855 -19.012 1.00 51.43 C ATOM 703 C ARG A 43 -3.064 17.529 -20.345 1.00 21.04 C ATOM 704 O ARG A 43 -3.948 17.693 -21.188 1.00 55.12 O ATOM 705 CB ARG A 43 -3.006 17.793 -17.859 1.00 73.11 C ATOM 706 CG ARG A 43 -4.202 18.513 -17.258 1.00 2.24 C ATOM 707 CD ARG A 43 -3.779 19.485 -16.168 1.00 13.14 C ATOM 708 NE ARG A 43 -4.925 20.067 -15.478 1.00 65.31 N ATOM 709 CZ ARG A 43 -4.829 20.763 -14.351 1.00 53.04 C ATOM 710 NH1 ARG A 43 -3.644 20.964 -13.791 1.00 50.22 N ATOM 711 NH2 ARG A 43 -5.919 21.262 -13.782 1.00 24.10 N ATOM 0 H ARG A 43 -1.961 15.576 -18.133 1.00 4.14 H new ATOM 0 HA ARG A 43 -4.437 16.637 -18.971 1.00 51.43 H new ATOM 0 HB2 ARG A 43 -2.509 17.218 -17.078 1.00 73.11 H new ATOM 0 HB3 ARG A 43 -2.289 18.533 -18.216 1.00 73.11 H new ATOM 0 HG2 ARG A 43 -4.734 19.053 -18.041 1.00 2.24 H new ATOM 0 HG3 ARG A 43 -4.898 17.782 -16.845 1.00 2.24 H new ATOM 0 HD2 ARG A 43 -3.146 18.968 -15.447 1.00 13.14 H new ATOM 0 HD3 ARG A 43 -3.177 20.281 -16.606 1.00 13.14 H new ATOM 0 HE ARG A 43 -5.851 19.932 -15.884 1.00 65.31 H new ATOM 0 HH11 ARG A 43 -2.803 20.584 -14.226 1.00 50.22 H new ATOM 0 HH12 ARG A 43 -3.573 21.499 -12.925 1.00 50.22 H new ATOM 0 HH21 ARG A 43 -6.832 21.111 -14.210 1.00 24.10 H new ATOM 0 HH22 ARG A 43 -5.843 21.796 -12.916 1.00 24.10 H new ATOM 725 N PHE A 44 -1.808 17.920 -20.531 1.00 12.04 N ATOM 726 CA PHE A 44 -1.385 18.578 -21.762 1.00 75.31 C ATOM 727 C PHE A 44 -1.878 17.812 -22.986 1.00 64.31 C ATOM 728 O PHE A 44 -2.358 18.404 -23.951 1.00 61.03 O ATOM 729 CB PHE A 44 0.140 18.699 -21.803 1.00 44.21 C ATOM 730 CG PHE A 44 0.669 19.867 -21.021 1.00 11.32 C ATOM 731 CD1 PHE A 44 0.153 21.138 -21.214 1.00 5.00 C ATOM 732 CD2 PHE A 44 1.683 19.694 -20.092 1.00 3.25 C ATOM 733 CE1 PHE A 44 0.639 22.215 -20.497 1.00 61.12 C ATOM 734 CE2 PHE A 44 2.172 20.767 -19.371 1.00 11.00 C ATOM 735 CZ PHE A 44 1.649 22.029 -19.574 1.00 44.42 C ATOM 0 H PHE A 44 -1.064 17.793 -19.844 1.00 12.04 H new ATOM 0 HA PHE A 44 -1.823 19.576 -21.779 1.00 75.31 H new ATOM 0 HB2 PHE A 44 0.580 17.781 -21.413 1.00 44.21 H new ATOM 0 HB3 PHE A 44 0.462 18.791 -22.840 1.00 44.21 H new ATOM 0 HD1 PHE A 44 -0.638 21.289 -21.933 1.00 5.00 H new ATOM 0 HD2 PHE A 44 2.096 18.709 -19.930 1.00 3.25 H new ATOM 0 HE1 PHE A 44 0.229 23.201 -20.658 1.00 61.12 H new ATOM 0 HE2 PHE A 44 2.962 20.619 -18.650 1.00 11.00 H new ATOM 0 HZ PHE A 44 2.029 22.869 -19.012 1.00 44.42 H new ATOM 745 N GLY A 45 -1.755 16.488 -22.937 1.00 24.42 N ATOM 746 CA GLY A 45 -2.193 15.662 -24.047 1.00 70.40 C ATOM 747 C GLY A 45 -1.363 14.401 -24.193 1.00 51.45 C ATOM 748 O GLY A 45 -1.802 13.427 -24.805 1.00 3.41 O ATOM 0 H GLY A 45 -1.360 15.974 -22.149 1.00 24.42 H new ATOM 0 HA2 GLY A 45 -3.239 15.391 -23.904 1.00 70.40 H new ATOM 0 HA3 GLY A 45 -2.137 16.239 -24.970 1.00 70.40 H new ATOM 752 N LEU A 46 -0.159 14.420 -23.631 1.00 21.41 N ATOM 753 CA LEU A 46 0.736 13.270 -23.702 1.00 23.25 C ATOM 754 C LEU A 46 0.321 12.193 -22.705 1.00 24.44 C ATOM 755 O LEU A 46 -0.312 12.484 -21.691 1.00 62.31 O ATOM 756 CB LEU A 46 2.177 13.702 -23.432 1.00 43.42 C ATOM 757 CG LEU A 46 2.924 14.324 -24.612 1.00 13.03 C ATOM 758 CD1 LEU A 46 3.968 15.315 -24.121 1.00 5.31 C ATOM 759 CD2 LEU A 46 3.573 13.241 -25.463 1.00 50.45 C ATOM 0 H LEU A 46 0.220 15.218 -23.122 1.00 21.41 H new ATOM 0 HA LEU A 46 0.671 12.853 -24.707 1.00 23.25 H new ATOM 0 HB2 LEU A 46 2.172 14.420 -22.612 1.00 43.42 H new ATOM 0 HB3 LEU A 46 2.738 12.832 -23.091 1.00 43.42 H new ATOM 0 HG LEU A 46 2.205 14.862 -25.230 1.00 13.03 H new ATOM 0 HD11 LEU A 46 4.489 15.747 -24.975 1.00 5.31 H new ATOM 0 HD12 LEU A 46 3.479 16.108 -23.555 1.00 5.31 H new ATOM 0 HD13 LEU A 46 4.685 14.801 -23.481 1.00 5.31 H new ATOM 0 HD21 LEU A 46 4.100 13.702 -26.298 1.00 50.45 H new ATOM 0 HD22 LEU A 46 4.280 12.675 -24.855 1.00 50.45 H new ATOM 0 HD23 LEU A 46 2.804 12.569 -25.845 1.00 50.45 H new ATOM 771 N ALA A 47 0.682 10.949 -23.000 1.00 14.13 N ATOM 772 CA ALA A 47 0.351 9.830 -22.127 1.00 23.15 C ATOM 773 C ALA A 47 1.543 9.437 -21.261 1.00 63.04 C ATOM 774 O ALA A 47 2.619 10.022 -21.369 1.00 0.24 O ATOM 775 CB ALA A 47 -0.121 8.639 -22.950 1.00 53.33 C ATOM 0 H ALA A 47 1.204 10.691 -23.837 1.00 14.13 H new ATOM 0 HA ALA A 47 -0.457 10.144 -21.466 1.00 23.15 H new ATOM 0 HB1 ALA A 47 -0.365 7.811 -22.285 1.00 53.33 H new ATOM 0 HB2 ALA A 47 -1.007 8.919 -23.520 1.00 53.33 H new ATOM 0 HB3 ALA A 47 0.670 8.334 -23.635 1.00 53.33 H new ATOM 781 N GLU A 48 1.341 8.445 -20.400 1.00 75.32 N ATOM 782 CA GLU A 48 2.401 7.976 -19.514 1.00 41.22 C ATOM 783 C GLU A 48 3.154 6.805 -20.139 1.00 41.24 C ATOM 784 O GLU A 48 3.821 6.041 -19.442 1.00 74.20 O ATOM 785 CB GLU A 48 1.818 7.559 -18.162 1.00 24.31 C ATOM 786 CG GLU A 48 0.754 6.480 -18.265 1.00 61.30 C ATOM 787 CD GLU A 48 -0.590 6.932 -17.727 1.00 70.53 C ATOM 788 OE1 GLU A 48 -1.176 7.868 -18.308 1.00 44.54 O ATOM 789 OE2 GLU A 48 -1.054 6.350 -16.724 1.00 2.51 O ATOM 0 H GLU A 48 0.455 7.951 -20.297 1.00 75.32 H new ATOM 0 HA GLU A 48 3.102 8.796 -19.362 1.00 41.22 H new ATOM 0 HB2 GLU A 48 2.625 7.202 -17.522 1.00 24.31 H new ATOM 0 HB3 GLU A 48 1.389 8.435 -17.675 1.00 24.31 H new ATOM 0 HG2 GLU A 48 0.642 6.184 -19.308 1.00 61.30 H new ATOM 0 HG3 GLU A 48 1.083 5.597 -17.716 1.00 61.30 H new ATOM 796 N SER A 49 3.042 6.671 -21.456 1.00 42.23 N ATOM 797 CA SER A 49 3.708 5.591 -22.175 1.00 40.53 C ATOM 798 C SER A 49 5.151 5.966 -22.500 1.00 13.12 C ATOM 799 O SER A 49 5.931 5.132 -22.961 1.00 14.51 O ATOM 800 CB SER A 49 2.951 5.264 -23.463 1.00 62.23 C ATOM 801 OG SER A 49 1.741 4.580 -23.183 1.00 73.34 O ATOM 0 H SER A 49 2.496 7.297 -22.048 1.00 42.23 H new ATOM 0 HA SER A 49 3.715 4.710 -21.534 1.00 40.53 H new ATOM 0 HB2 SER A 49 2.735 6.184 -24.006 1.00 62.23 H new ATOM 0 HB3 SER A 49 3.577 4.651 -24.111 1.00 62.23 H new ATOM 0 HG SER A 49 1.274 4.384 -24.022 1.00 73.34 H new ATOM 807 N LEU A 50 5.498 7.225 -22.259 1.00 1.00 N ATOM 808 CA LEU A 50 6.847 7.712 -22.526 1.00 1.42 C ATOM 809 C LEU A 50 7.603 7.964 -21.226 1.00 71.44 C ATOM 810 O LEU A 50 8.427 8.875 -21.140 1.00 21.14 O ATOM 811 CB LEU A 50 6.792 8.997 -23.354 1.00 11.53 C ATOM 812 CG LEU A 50 5.964 8.932 -24.638 1.00 41.51 C ATOM 813 CD1 LEU A 50 5.906 10.299 -25.304 1.00 33.04 C ATOM 814 CD2 LEU A 50 6.540 7.897 -25.592 1.00 22.53 C ATOM 0 H LEU A 50 4.864 7.928 -21.879 1.00 1.00 H new ATOM 0 HA LEU A 50 7.378 6.945 -23.090 1.00 1.42 H new ATOM 0 HB2 LEU A 50 6.391 9.793 -22.727 1.00 11.53 H new ATOM 0 HB3 LEU A 50 7.811 9.281 -23.616 1.00 11.53 H new ATOM 0 HG LEU A 50 4.949 8.632 -24.379 1.00 41.51 H new ATOM 0 HD11 LEU A 50 5.313 10.234 -26.216 1.00 33.04 H new ATOM 0 HD12 LEU A 50 5.448 11.016 -24.623 1.00 33.04 H new ATOM 0 HD13 LEU A 50 6.916 10.627 -25.550 1.00 33.04 H new ATOM 0 HD21 LEU A 50 5.938 7.864 -26.500 1.00 22.53 H new ATOM 0 HD22 LEU A 50 7.565 8.167 -25.846 1.00 22.53 H new ATOM 0 HD23 LEU A 50 6.530 6.917 -25.115 1.00 22.53 H new ATOM 826 N LEU A 51 7.319 7.150 -20.216 1.00 74.43 N ATOM 827 CA LEU A 51 7.973 7.282 -18.918 1.00 13.31 C ATOM 828 C LEU A 51 8.586 5.955 -18.480 1.00 2.30 C ATOM 829 O LEU A 51 9.632 5.929 -17.833 1.00 60.15 O ATOM 830 CB LEU A 51 6.973 7.767 -17.867 1.00 53.32 C ATOM 831 CG LEU A 51 6.574 9.241 -17.951 1.00 75.15 C ATOM 832 CD1 LEU A 51 5.424 9.537 -17.001 1.00 21.52 C ATOM 833 CD2 LEU A 51 7.767 10.134 -17.642 1.00 11.40 C ATOM 0 H LEU A 51 6.640 6.391 -20.270 1.00 74.43 H new ATOM 0 HA LEU A 51 8.773 8.016 -19.015 1.00 13.31 H new ATOM 0 HB2 LEU A 51 6.070 7.162 -17.947 1.00 53.32 H new ATOM 0 HB3 LEU A 51 7.395 7.581 -16.879 1.00 53.32 H new ATOM 0 HG LEU A 51 6.242 9.451 -18.968 1.00 75.15 H new ATOM 0 HD11 LEU A 51 5.154 10.590 -17.074 1.00 21.52 H new ATOM 0 HD12 LEU A 51 4.564 8.922 -17.268 1.00 21.52 H new ATOM 0 HD13 LEU A 51 5.729 9.311 -15.979 1.00 21.52 H new ATOM 0 HD21 LEU A 51 7.465 11.179 -17.706 1.00 11.40 H new ATOM 0 HD22 LEU A 51 8.129 9.922 -16.636 1.00 11.40 H new ATOM 0 HD23 LEU A 51 8.562 9.941 -18.362 1.00 11.40 H new ATOM 845 N GLU A 52 7.928 4.857 -18.839 1.00 44.41 N ATOM 846 CA GLU A 52 8.410 3.528 -18.483 1.00 71.24 C ATOM 847 C GLU A 52 9.602 3.131 -19.349 1.00 1.34 C ATOM 848 O GLU A 52 10.623 2.668 -18.844 1.00 50.34 O ATOM 849 CB GLU A 52 7.289 2.498 -18.635 1.00 31.14 C ATOM 850 CG GLU A 52 5.926 3.011 -18.200 1.00 11.22 C ATOM 851 CD GLU A 52 4.979 1.893 -17.810 1.00 12.44 C ATOM 852 OE1 GLU A 52 5.312 0.717 -18.068 1.00 3.44 O ATOM 853 OE2 GLU A 52 3.906 2.194 -17.247 1.00 33.11 O ATOM 0 H GLU A 52 7.061 4.862 -19.376 1.00 44.41 H new ATOM 0 HA GLU A 52 8.732 3.553 -17.442 1.00 71.24 H new ATOM 0 HB2 GLU A 52 7.234 2.185 -19.678 1.00 31.14 H new ATOM 0 HB3 GLU A 52 7.538 1.613 -18.049 1.00 31.14 H new ATOM 0 HG2 GLU A 52 6.050 3.689 -17.355 1.00 11.22 H new ATOM 0 HG3 GLU A 52 5.484 3.590 -19.011 1.00 11.22 H new ATOM 860 N SER A 53 9.462 3.316 -20.658 1.00 4.44 N ATOM 861 CA SER A 53 10.525 2.975 -21.596 1.00 72.31 C ATOM 862 C SER A 53 11.384 4.195 -21.912 1.00 34.33 C ATOM 863 O SER A 53 10.868 5.274 -22.204 1.00 35.41 O ATOM 864 CB SER A 53 9.931 2.406 -22.887 1.00 53.11 C ATOM 865 OG SER A 53 10.019 3.345 -23.945 1.00 41.00 O ATOM 0 H SER A 53 8.623 3.700 -21.093 1.00 4.44 H new ATOM 0 HA SER A 53 11.158 2.219 -21.131 1.00 72.31 H new ATOM 0 HB2 SER A 53 10.458 1.493 -23.162 1.00 53.11 H new ATOM 0 HB3 SER A 53 8.888 2.135 -22.723 1.00 53.11 H new ATOM 0 HG SER A 53 9.635 2.958 -24.759 1.00 41.00 H new ATOM 871 N LYS A 54 12.700 4.015 -21.853 1.00 44.24 N ATOM 872 CA LYS A 54 13.633 5.099 -22.133 1.00 54.13 C ATOM 873 C LYS A 54 13.406 5.665 -23.531 1.00 24.13 C ATOM 874 O LYS A 54 13.527 6.870 -23.749 1.00 1.51 O ATOM 875 CB LYS A 54 15.075 4.605 -21.999 1.00 11.44 C ATOM 876 CG LYS A 54 15.507 3.678 -23.123 1.00 51.22 C ATOM 877 CD LYS A 54 16.871 3.068 -22.849 1.00 15.52 C ATOM 878 CE LYS A 54 16.750 1.726 -22.142 1.00 41.43 C ATOM 879 NZ LYS A 54 16.361 0.638 -23.081 1.00 64.34 N ATOM 0 H LYS A 54 13.144 3.128 -21.614 1.00 44.24 H new ATOM 0 HA LYS A 54 13.458 5.892 -21.406 1.00 54.13 H new ATOM 0 HB2 LYS A 54 15.744 5.465 -21.971 1.00 11.44 H new ATOM 0 HB3 LYS A 54 15.185 4.085 -21.048 1.00 11.44 H new ATOM 0 HG2 LYS A 54 14.770 2.884 -23.245 1.00 51.22 H new ATOM 0 HG3 LYS A 54 15.537 4.232 -24.061 1.00 51.22 H new ATOM 0 HD2 LYS A 54 17.408 2.938 -23.789 1.00 15.52 H new ATOM 0 HD3 LYS A 54 17.460 3.751 -22.237 1.00 15.52 H new ATOM 0 HE2 LYS A 54 17.701 1.477 -21.671 1.00 41.43 H new ATOM 0 HE3 LYS A 54 16.010 1.800 -21.346 1.00 41.43 H new ATOM 0 HZ1 LYS A 54 15.872 -0.115 -22.556 1.00 64.34 H new ATOM 0 HZ2 LYS A 54 15.726 1.020 -23.811 1.00 64.34 H new ATOM 0 HZ3 LYS A 54 17.213 0.248 -23.533 1.00 64.34 H new ATOM 893 N GLU A 55 13.074 4.788 -24.473 1.00 13.24 N ATOM 894 CA GLU A 55 12.829 5.202 -25.849 1.00 10.35 C ATOM 895 C GLU A 55 11.677 6.199 -25.921 1.00 45.53 C ATOM 896 O GLU A 55 11.707 7.145 -26.708 1.00 74.11 O ATOM 897 CB GLU A 55 12.519 3.986 -26.724 1.00 75.52 C ATOM 898 CG GLU A 55 13.604 3.675 -27.742 1.00 54.42 C ATOM 899 CD GLU A 55 14.269 2.334 -27.495 1.00 1.31 C ATOM 900 OE1 GLU A 55 14.870 2.160 -26.415 1.00 52.15 O ATOM 901 OE2 GLU A 55 14.188 1.459 -28.383 1.00 64.02 O ATOM 0 H GLU A 55 12.969 3.787 -24.308 1.00 13.24 H new ATOM 0 HA GLU A 55 13.731 5.688 -26.220 1.00 10.35 H new ATOM 0 HB2 GLU A 55 12.373 3.116 -26.084 1.00 75.52 H new ATOM 0 HB3 GLU A 55 11.579 4.157 -27.248 1.00 75.52 H new ATOM 0 HG2 GLU A 55 13.171 3.683 -28.742 1.00 54.42 H new ATOM 0 HG3 GLU A 55 14.359 4.461 -27.715 1.00 54.42 H new ATOM 908 N GLY A 56 10.660 5.980 -25.092 1.00 4.32 N ATOM 909 CA GLY A 56 9.511 6.867 -25.077 1.00 53.32 C ATOM 910 C GLY A 56 9.863 8.264 -24.604 1.00 63.13 C ATOM 911 O GLY A 56 9.465 9.254 -25.219 1.00 34.53 O ATOM 0 H GLY A 56 10.612 5.205 -24.431 1.00 4.32 H new ATOM 0 HA2 GLY A 56 9.086 6.922 -26.079 1.00 53.32 H new ATOM 0 HA3 GLY A 56 8.742 6.450 -24.427 1.00 53.32 H new ATOM 915 N CYS A 57 10.609 8.345 -23.507 1.00 21.31 N ATOM 916 CA CYS A 57 11.012 9.631 -22.950 1.00 74.31 C ATOM 917 C CYS A 57 11.663 10.506 -24.016 1.00 30.12 C ATOM 918 O CYS A 57 11.399 11.704 -24.094 1.00 5.43 O ATOM 919 CB CYS A 57 11.978 9.424 -21.783 1.00 42.21 C ATOM 920 SG CYS A 57 11.360 8.307 -20.503 1.00 74.45 S ATOM 0 H CYS A 57 10.947 7.535 -22.986 1.00 21.31 H new ATOM 0 HA CYS A 57 10.118 10.138 -22.587 1.00 74.31 H new ATOM 0 HB2 CYS A 57 12.919 9.032 -22.169 1.00 42.21 H new ATOM 0 HB3 CYS A 57 12.198 10.391 -21.331 1.00 42.21 H new ATOM 0 HG CYS A 57 10.064 8.237 -20.577 1.00 74.45 H new ATOM 926 N GLN A 58 12.517 9.897 -24.834 1.00 24.30 N ATOM 927 CA GLN A 58 13.207 10.621 -25.893 1.00 0.43 C ATOM 928 C GLN A 58 12.210 11.263 -26.853 1.00 34.14 C ATOM 929 O GLN A 58 12.546 12.197 -27.581 1.00 12.30 O ATOM 930 CB GLN A 58 14.138 9.680 -26.661 1.00 64.31 C ATOM 931 CG GLN A 58 15.270 10.396 -27.379 1.00 44.20 C ATOM 932 CD GLN A 58 16.117 9.457 -28.214 1.00 2.32 C ATOM 933 OE1 GLN A 58 16.240 9.627 -29.428 1.00 12.23 O ATOM 934 NE2 GLN A 58 16.709 8.459 -27.568 1.00 24.44 N ATOM 0 H GLN A 58 12.747 8.904 -24.783 1.00 24.30 H new ATOM 0 HA GLN A 58 13.800 11.411 -25.431 1.00 0.43 H new ATOM 0 HB2 GLN A 58 14.561 8.954 -25.966 1.00 64.31 H new ATOM 0 HB3 GLN A 58 13.553 9.120 -27.390 1.00 64.31 H new ATOM 0 HG2 GLN A 58 14.854 11.172 -28.021 1.00 44.20 H new ATOM 0 HG3 GLN A 58 15.903 10.895 -26.645 1.00 44.20 H new ATOM 0 HE21 GLN A 58 16.580 8.355 -26.562 1.00 24.44 H new ATOM 0 HE22 GLN A 58 17.293 7.796 -28.078 1.00 24.44 H new ATOM 943 N LYS A 59 10.982 10.755 -26.849 1.00 2.45 N ATOM 944 CA LYS A 59 9.935 11.279 -27.719 1.00 73.00 C ATOM 945 C LYS A 59 9.284 12.514 -27.103 1.00 34.44 C ATOM 946 O LYS A 59 8.575 13.257 -27.784 1.00 74.43 O ATOM 947 CB LYS A 59 8.875 10.206 -27.978 1.00 74.52 C ATOM 948 CG LYS A 59 8.472 10.089 -29.437 1.00 24.02 C ATOM 949 CD LYS A 59 7.032 9.623 -29.583 1.00 14.54 C ATOM 950 CE LYS A 59 6.476 9.955 -30.959 1.00 4.21 C ATOM 951 NZ LYS A 59 7.195 9.226 -32.040 1.00 72.22 N ATOM 0 H LYS A 59 10.687 9.981 -26.253 1.00 2.45 H new ATOM 0 HA LYS A 59 10.393 11.565 -28.666 1.00 73.00 H new ATOM 0 HB2 LYS A 59 9.254 9.243 -27.636 1.00 74.52 H new ATOM 0 HB3 LYS A 59 7.990 10.430 -27.382 1.00 74.52 H new ATOM 0 HG2 LYS A 59 8.594 11.055 -29.928 1.00 24.02 H new ATOM 0 HG3 LYS A 59 9.135 9.388 -29.943 1.00 24.02 H new ATOM 0 HD2 LYS A 59 6.978 8.547 -29.417 1.00 14.54 H new ATOM 0 HD3 LYS A 59 6.416 10.095 -28.817 1.00 14.54 H new ATOM 0 HE2 LYS A 59 5.416 9.702 -30.993 1.00 4.21 H new ATOM 0 HE3 LYS A 59 6.553 11.028 -31.132 1.00 4.21 H new ATOM 0 HZ1 LYS A 59 6.743 9.427 -32.955 1.00 72.22 H new ATOM 0 HZ2 LYS A 59 8.187 9.537 -32.068 1.00 72.22 H new ATOM 0 HZ3 LYS A 59 7.158 8.204 -31.853 1.00 72.22 H new ATOM 965 N ILE A 60 9.531 12.726 -25.816 1.00 43.42 N ATOM 966 CA ILE A 60 8.970 13.872 -25.110 1.00 4.53 C ATOM 967 C ILE A 60 9.887 15.086 -25.218 1.00 4.24 C ATOM 968 O ILE A 60 9.458 16.168 -25.622 1.00 24.01 O ATOM 969 CB ILE A 60 8.729 13.556 -23.622 1.00 31.35 C ATOM 970 CG1 ILE A 60 7.746 12.393 -23.479 1.00 30.21 C ATOM 971 CG2 ILE A 60 8.210 14.789 -22.896 1.00 33.44 C ATOM 972 CD1 ILE A 60 7.523 11.962 -22.046 1.00 53.43 C ATOM 0 H ILE A 60 10.116 12.120 -25.240 1.00 43.42 H new ATOM 0 HA ILE A 60 8.014 14.097 -25.584 1.00 4.53 H new ATOM 0 HB ILE A 60 9.676 13.264 -23.169 1.00 31.35 H new ATOM 0 HG12 ILE A 60 6.790 12.680 -23.916 1.00 30.21 H new ATOM 0 HG13 ILE A 60 8.116 11.543 -24.052 1.00 30.21 H new ATOM 0 HG21 ILE A 60 8.044 14.550 -21.846 1.00 33.44 H new ATOM 0 HG22 ILE A 60 8.942 15.592 -22.974 1.00 33.44 H new ATOM 0 HG23 ILE A 60 7.271 15.109 -23.348 1.00 33.44 H new ATOM 0 HD11 ILE A 60 6.815 11.134 -22.021 1.00 53.43 H new ATOM 0 HD12 ILE A 60 8.470 11.643 -21.610 1.00 53.43 H new ATOM 0 HD13 ILE A 60 7.123 12.798 -21.473 1.00 53.43 H new ATOM 984 N LEU A 61 11.151 14.900 -24.857 1.00 31.35 N ATOM 985 CA LEU A 61 12.131 15.980 -24.916 1.00 74.24 C ATOM 986 C LEU A 61 12.326 16.461 -26.349 1.00 51.14 C ATOM 987 O LEU A 61 12.650 17.626 -26.586 1.00 72.32 O ATOM 988 CB LEU A 61 13.468 15.513 -24.335 1.00 2.34 C ATOM 989 CG LEU A 61 13.470 15.171 -22.845 1.00 11.03 C ATOM 990 CD1 LEU A 61 14.825 14.622 -22.426 1.00 53.42 C ATOM 991 CD2 LEU A 61 13.109 16.395 -22.016 1.00 12.12 C ATOM 0 H LEU A 61 11.522 14.012 -24.520 1.00 31.35 H new ATOM 0 HA LEU A 61 11.754 16.813 -24.322 1.00 74.24 H new ATOM 0 HB2 LEU A 61 13.795 14.633 -24.890 1.00 2.34 H new ATOM 0 HB3 LEU A 61 14.209 16.293 -24.509 1.00 2.34 H new ATOM 0 HG LEU A 61 12.718 14.402 -22.667 1.00 11.03 H new ATOM 0 HD11 LEU A 61 14.808 14.384 -21.362 1.00 53.42 H new ATOM 0 HD12 LEU A 61 15.044 13.719 -22.996 1.00 53.42 H new ATOM 0 HD13 LEU A 61 15.595 15.369 -22.618 1.00 53.42 H new ATOM 0 HD21 LEU A 61 13.115 16.133 -20.958 1.00 12.12 H new ATOM 0 HD22 LEU A 61 13.837 17.186 -22.198 1.00 12.12 H new ATOM 0 HD23 LEU A 61 12.116 16.745 -22.297 1.00 12.12 H new ATOM 1003 N THR A 62 12.125 15.559 -27.304 1.00 25.40 N ATOM 1004 CA THR A 62 12.276 15.892 -28.715 1.00 72.04 C ATOM 1005 C THR A 62 11.171 16.832 -29.180 1.00 20.51 C ATOM 1006 O THR A 62 11.407 17.739 -29.979 1.00 75.00 O ATOM 1007 CB THR A 62 12.265 14.627 -29.594 1.00 1.35 C ATOM 1008 OG1 THR A 62 12.835 14.917 -30.876 1.00 72.23 O ATOM 1009 CG2 THR A 62 10.847 14.105 -29.772 1.00 21.13 C ATOM 0 H THR A 62 11.857 14.591 -27.126 1.00 25.40 H new ATOM 0 HA THR A 62 13.239 16.391 -28.821 1.00 72.04 H new ATOM 0 HB THR A 62 12.859 13.860 -29.097 1.00 1.35 H new ATOM 0 HG1 THR A 62 12.826 14.108 -31.429 1.00 72.23 H new ATOM 0 HG21 THR A 62 10.864 13.212 -30.396 1.00 21.13 H new ATOM 0 HG22 THR A 62 10.425 13.859 -28.798 1.00 21.13 H new ATOM 0 HG23 THR A 62 10.235 14.870 -30.250 1.00 21.13 H new ATOM 1017 N VAL A 63 9.960 16.610 -28.676 1.00 13.11 N ATOM 1018 CA VAL A 63 8.818 17.439 -29.039 1.00 24.14 C ATOM 1019 C VAL A 63 8.869 18.788 -28.330 1.00 54.24 C ATOM 1020 O VAL A 63 8.656 19.834 -28.944 1.00 73.42 O ATOM 1021 CB VAL A 63 7.488 16.742 -28.698 1.00 61.43 C ATOM 1022 CG1 VAL A 63 6.309 17.638 -29.048 1.00 20.03 C ATOM 1023 CG2 VAL A 63 7.386 15.407 -29.420 1.00 25.50 C ATOM 0 H VAL A 63 9.746 15.863 -28.015 1.00 13.11 H new ATOM 0 HA VAL A 63 8.872 17.597 -30.116 1.00 24.14 H new ATOM 0 HB VAL A 63 7.463 16.552 -27.625 1.00 61.43 H new ATOM 0 HG11 VAL A 63 5.378 17.128 -28.800 1.00 20.03 H new ATOM 0 HG12 VAL A 63 6.377 18.566 -28.481 1.00 20.03 H new ATOM 0 HG13 VAL A 63 6.327 17.862 -30.115 1.00 20.03 H new ATOM 0 HG21 VAL A 63 6.440 14.928 -29.168 1.00 25.50 H new ATOM 0 HG22 VAL A 63 7.434 15.571 -30.497 1.00 25.50 H new ATOM 0 HG23 VAL A 63 8.211 14.764 -29.114 1.00 25.50 H new ATOM 1033 N LEU A 64 9.154 18.756 -27.033 1.00 43.21 N ATOM 1034 CA LEU A 64 9.234 19.977 -26.237 1.00 21.12 C ATOM 1035 C LEU A 64 10.550 20.706 -26.490 1.00 25.45 C ATOM 1036 O LEU A 64 10.718 21.859 -26.093 1.00 14.33 O ATOM 1037 CB LEU A 64 9.098 19.650 -24.749 1.00 33.21 C ATOM 1038 CG LEU A 64 7.986 18.667 -24.377 1.00 40.53 C ATOM 1039 CD1 LEU A 64 8.286 18.002 -23.043 1.00 0.34 C ATOM 1040 CD2 LEU A 64 6.641 19.378 -24.330 1.00 54.42 C ATOM 0 H LEU A 64 9.334 17.899 -26.510 1.00 43.21 H new ATOM 0 HA LEU A 64 8.414 20.630 -26.536 1.00 21.12 H new ATOM 0 HB2 LEU A 64 10.047 19.244 -24.398 1.00 33.21 H new ATOM 0 HB3 LEU A 64 8.930 20.580 -24.207 1.00 33.21 H new ATOM 0 HG LEU A 64 7.939 17.893 -25.143 1.00 40.53 H new ATOM 0 HD11 LEU A 64 7.484 17.306 -22.795 1.00 0.34 H new ATOM 0 HD12 LEU A 64 9.229 17.460 -23.111 1.00 0.34 H new ATOM 0 HD13 LEU A 64 8.360 18.763 -22.266 1.00 0.34 H new ATOM 0 HD21 LEU A 64 5.861 18.664 -24.064 1.00 54.42 H new ATOM 0 HD22 LEU A 64 6.675 20.173 -23.585 1.00 54.42 H new ATOM 0 HD23 LEU A 64 6.422 19.807 -25.308 1.00 54.42 H new ATOM 1052 N ASP A 65 11.477 20.027 -27.156 1.00 51.32 N ATOM 1053 CA ASP A 65 12.778 20.612 -27.466 1.00 4.11 C ATOM 1054 C ASP A 65 12.615 21.948 -28.185 1.00 75.33 C ATOM 1055 O ASP A 65 13.026 22.999 -27.693 1.00 71.12 O ATOM 1056 CB ASP A 65 13.600 19.652 -28.328 1.00 64.20 C ATOM 1057 CG ASP A 65 14.541 20.380 -29.268 1.00 23.24 C ATOM 1058 OD1 ASP A 65 15.245 21.302 -28.807 1.00 42.11 O ATOM 1059 OD2 ASP A 65 14.572 20.026 -30.465 1.00 53.31 O ATOM 0 H ASP A 65 11.353 19.072 -27.492 1.00 51.32 H new ATOM 0 HA ASP A 65 13.304 20.786 -26.527 1.00 4.11 H new ATOM 0 HB2 ASP A 65 14.177 18.991 -27.681 1.00 64.20 H new ATOM 0 HB3 ASP A 65 12.926 19.022 -28.909 1.00 64.20 H new ATOM 1064 N PRO A 66 12.003 21.908 -29.377 1.00 30.30 N ATOM 1065 CA PRO A 66 11.772 23.106 -30.189 1.00 42.41 C ATOM 1066 C PRO A 66 10.728 24.032 -29.573 1.00 13.22 C ATOM 1067 O PRO A 66 10.479 25.126 -30.080 1.00 54.23 O ATOM 1068 CB PRO A 66 11.269 22.542 -31.520 1.00 11.13 C ATOM 1069 CG PRO A 66 10.672 21.223 -31.170 1.00 64.20 C ATOM 1070 CD PRO A 66 11.487 20.690 -30.025 1.00 65.24 C ATOM 0 HA PRO A 66 12.671 23.715 -30.282 1.00 42.41 H new ATOM 0 HB2 PRO A 66 10.531 23.202 -31.976 1.00 11.13 H new ATOM 0 HB3 PRO A 66 12.083 22.431 -32.236 1.00 11.13 H new ATOM 0 HG2 PRO A 66 9.625 21.331 -30.887 1.00 64.20 H new ATOM 0 HG3 PRO A 66 10.703 20.543 -32.021 1.00 64.20 H new ATOM 0 HD2 PRO A 66 10.879 20.098 -29.341 1.00 65.24 H new ATOM 0 HD3 PRO A 66 12.295 20.046 -30.372 1.00 65.24 H new ATOM 1078 N MET A 67 10.120 23.586 -28.479 1.00 13.21 N ATOM 1079 CA MET A 67 9.104 24.375 -27.794 1.00 44.10 C ATOM 1080 C MET A 67 9.678 25.034 -26.544 1.00 11.02 C ATOM 1081 O MET A 67 9.091 25.968 -25.997 1.00 2.11 O ATOM 1082 CB MET A 67 7.911 23.495 -27.418 1.00 23.45 C ATOM 1083 CG MET A 67 7.137 22.974 -28.620 1.00 55.40 C ATOM 1084 SD MET A 67 5.940 24.168 -29.246 1.00 3.32 S ATOM 1085 CE MET A 67 4.485 23.136 -29.407 1.00 2.13 C ATOM 0 H MET A 67 10.314 22.682 -28.048 1.00 13.21 H new ATOM 0 HA MET A 67 8.769 25.158 -28.475 1.00 44.10 H new ATOM 0 HB2 MET A 67 8.265 22.649 -26.830 1.00 23.45 H new ATOM 0 HB3 MET A 67 7.236 24.066 -26.781 1.00 23.45 H new ATOM 0 HG2 MET A 67 7.837 22.717 -29.415 1.00 55.40 H new ATOM 0 HG3 MET A 67 6.618 22.056 -28.343 1.00 55.40 H new ATOM 0 HE1 MET A 67 3.655 23.733 -29.785 1.00 2.13 H new ATOM 0 HE2 MET A 67 4.692 22.321 -30.101 1.00 2.13 H new ATOM 0 HE3 MET A 67 4.221 22.724 -28.433 1.00 2.13 H new ATOM 1095 N VAL A 68 10.828 24.542 -26.096 1.00 73.41 N ATOM 1096 CA VAL A 68 11.482 25.083 -24.911 1.00 3.21 C ATOM 1097 C VAL A 68 11.531 26.606 -24.958 1.00 1.20 C ATOM 1098 O VAL A 68 11.041 27.296 -24.063 1.00 14.03 O ATOM 1099 CB VAL A 68 12.915 24.538 -24.762 1.00 20.43 C ATOM 1100 CG1 VAL A 68 13.802 25.553 -24.057 1.00 10.14 C ATOM 1101 CG2 VAL A 68 12.905 23.214 -24.012 1.00 55.51 C ATOM 0 H VAL A 68 11.327 23.769 -26.536 1.00 73.41 H new ATOM 0 HA VAL A 68 10.891 24.768 -24.051 1.00 3.21 H new ATOM 0 HB VAL A 68 13.324 24.363 -25.757 1.00 20.43 H new ATOM 0 HG11 VAL A 68 14.810 25.150 -23.961 1.00 10.14 H new ATOM 0 HG12 VAL A 68 13.833 26.475 -24.638 1.00 10.14 H new ATOM 0 HG13 VAL A 68 13.399 25.762 -23.066 1.00 10.14 H new ATOM 0 HG21 VAL A 68 13.925 22.843 -23.915 1.00 55.51 H new ATOM 0 HG22 VAL A 68 12.477 23.361 -23.020 1.00 55.51 H new ATOM 0 HG23 VAL A 68 12.306 22.489 -24.562 1.00 55.51 H new ATOM 1111 N PRO A 69 12.136 27.145 -26.026 1.00 1.13 N ATOM 1112 CA PRO A 69 12.263 28.593 -26.217 1.00 50.31 C ATOM 1113 C PRO A 69 10.925 29.259 -26.517 1.00 63.44 C ATOM 1114 O PRO A 69 10.668 30.383 -26.086 1.00 65.40 O ATOM 1115 CB PRO A 69 13.201 28.712 -27.420 1.00 24.34 C ATOM 1116 CG PRO A 69 13.020 27.437 -28.169 1.00 72.33 C ATOM 1117 CD PRO A 69 12.742 26.384 -27.132 1.00 41.04 C ATOM 0 HA PRO A 69 12.632 29.090 -25.320 1.00 50.31 H new ATOM 0 HB2 PRO A 69 12.946 29.573 -28.037 1.00 24.34 H new ATOM 0 HB3 PRO A 69 14.236 28.842 -27.104 1.00 24.34 H new ATOM 0 HG2 PRO A 69 12.195 27.514 -28.878 1.00 72.33 H new ATOM 0 HG3 PRO A 69 13.913 27.192 -28.744 1.00 72.33 H new ATOM 0 HD2 PRO A 69 12.066 25.617 -27.510 1.00 41.04 H new ATOM 0 HD3 PRO A 69 13.655 25.878 -26.819 1.00 41.04 H new ATOM 1125 N THR A 70 10.072 28.556 -27.257 1.00 55.20 N ATOM 1126 CA THR A 70 8.760 29.079 -27.616 1.00 53.12 C ATOM 1127 C THR A 70 7.681 28.540 -26.683 1.00 1.14 C ATOM 1128 O THR A 70 6.546 28.312 -27.099 1.00 65.42 O ATOM 1129 CB THR A 70 8.391 28.724 -29.068 1.00 0.41 C ATOM 1130 OG1 THR A 70 9.572 28.686 -29.878 1.00 60.21 O ATOM 1131 CG2 THR A 70 7.411 29.737 -29.641 1.00 45.44 C ATOM 0 H THR A 70 10.267 27.623 -27.619 1.00 55.20 H new ATOM 0 HA THR A 70 8.814 30.163 -27.518 1.00 53.12 H new ATOM 0 HB THR A 70 7.917 27.742 -29.069 1.00 0.41 H new ATOM 0 HG1 THR A 70 9.329 28.458 -30.800 1.00 60.21 H new ATOM 0 HG21 THR A 70 7.165 29.465 -30.668 1.00 45.44 H new ATOM 0 HG22 THR A 70 6.502 29.744 -29.040 1.00 45.44 H new ATOM 0 HG23 THR A 70 7.863 30.729 -29.627 1.00 45.44 H new ATOM 1139 N GLY A 71 8.043 28.339 -25.419 1.00 14.33 N ATOM 1140 CA GLY A 71 7.093 27.829 -24.448 1.00 40.04 C ATOM 1141 C GLY A 71 7.212 28.519 -23.104 1.00 61.14 C ATOM 1142 O GLY A 71 8.264 29.063 -22.769 1.00 51.21 O ATOM 0 H GLY A 71 8.977 28.520 -25.051 1.00 14.33 H new ATOM 0 HA2 GLY A 71 6.081 27.959 -24.831 1.00 40.04 H new ATOM 0 HA3 GLY A 71 7.250 26.758 -24.318 1.00 40.04 H new ATOM 1146 N SER A 72 6.130 28.498 -22.332 1.00 45.35 N ATOM 1147 CA SER A 72 6.116 29.132 -21.019 1.00 61.14 C ATOM 1148 C SER A 72 6.910 28.309 -20.010 1.00 14.22 C ATOM 1149 O SER A 72 7.375 27.211 -20.317 1.00 21.01 O ATOM 1150 CB SER A 72 4.676 29.307 -20.529 1.00 12.31 C ATOM 1151 OG SER A 72 4.213 28.137 -19.878 1.00 21.04 O ATOM 0 H SER A 72 5.252 28.049 -22.593 1.00 45.35 H new ATOM 0 HA SER A 72 6.584 30.112 -21.111 1.00 61.14 H new ATOM 0 HB2 SER A 72 4.622 30.153 -19.844 1.00 12.31 H new ATOM 0 HB3 SER A 72 4.027 29.538 -21.373 1.00 12.31 H new ATOM 0 HG SER A 72 3.292 28.275 -19.573 1.00 21.04 H new ATOM 1157 N GLU A 73 7.063 28.848 -18.805 1.00 42.14 N ATOM 1158 CA GLU A 73 7.803 28.164 -17.750 1.00 12.55 C ATOM 1159 C GLU A 73 7.240 26.767 -17.508 1.00 1.24 C ATOM 1160 O GLU A 73 7.984 25.823 -17.250 1.00 63.42 O ATOM 1161 CB GLU A 73 7.756 28.976 -16.454 1.00 12.31 C ATOM 1162 CG GLU A 73 8.332 30.376 -16.591 1.00 31.44 C ATOM 1163 CD GLU A 73 9.082 30.823 -15.351 1.00 23.24 C ATOM 1164 OE1 GLU A 73 8.444 31.411 -14.453 1.00 23.53 O ATOM 1165 OE2 GLU A 73 10.305 30.584 -15.279 1.00 52.43 O ATOM 0 H GLU A 73 6.685 29.756 -18.535 1.00 42.14 H new ATOM 0 HA GLU A 73 8.840 28.068 -18.073 1.00 12.55 H new ATOM 0 HB2 GLU A 73 6.722 29.049 -16.118 1.00 12.31 H new ATOM 0 HB3 GLU A 73 8.305 28.441 -15.680 1.00 12.31 H new ATOM 0 HG2 GLU A 73 9.005 30.406 -17.448 1.00 31.44 H new ATOM 0 HG3 GLU A 73 7.524 31.079 -16.795 1.00 31.44 H new ATOM 1172 N ASN A 74 5.919 26.645 -17.595 1.00 74.34 N ATOM 1173 CA ASN A 74 5.255 25.364 -17.385 1.00 62.42 C ATOM 1174 C ASN A 74 5.789 24.309 -18.348 1.00 11.31 C ATOM 1175 O ASN A 74 5.690 23.109 -18.090 1.00 20.03 O ATOM 1176 CB ASN A 74 3.742 25.515 -17.563 1.00 54.33 C ATOM 1177 CG ASN A 74 3.002 25.523 -16.240 1.00 73.34 C ATOM 1178 OD1 ASN A 74 2.526 26.564 -15.788 1.00 30.41 O ATOM 1179 ND2 ASN A 74 2.902 24.356 -15.612 1.00 44.44 N ATOM 0 H ASN A 74 5.288 27.417 -17.809 1.00 74.34 H new ATOM 0 HA ASN A 74 5.464 25.038 -16.366 1.00 62.42 H new ATOM 0 HB2 ASN A 74 3.533 26.441 -18.099 1.00 54.33 H new ATOM 0 HB3 ASN A 74 3.368 24.698 -18.180 1.00 54.33 H new ATOM 0 HD21 ASN A 74 2.415 24.298 -14.718 1.00 44.44 H new ATOM 0 HD22 ASN A 74 3.312 23.518 -16.024 1.00 44.44 H new ATOM 1186 N LEU A 75 6.356 24.764 -19.461 1.00 44.22 N ATOM 1187 CA LEU A 75 6.907 23.861 -20.463 1.00 21.04 C ATOM 1188 C LEU A 75 8.396 23.630 -20.229 1.00 53.41 C ATOM 1189 O LEU A 75 8.964 22.642 -20.696 1.00 55.22 O ATOM 1190 CB LEU A 75 6.681 24.426 -21.867 1.00 53.41 C ATOM 1191 CG LEU A 75 6.960 23.472 -23.029 1.00 52.00 C ATOM 1192 CD1 LEU A 75 5.814 23.497 -24.027 1.00 64.35 C ATOM 1193 CD2 LEU A 75 8.273 23.831 -23.711 1.00 65.30 C ATOM 0 H LEU A 75 6.445 25.754 -19.691 1.00 44.22 H new ATOM 0 HA LEU A 75 6.392 22.904 -20.376 1.00 21.04 H new ATOM 0 HB2 LEU A 75 5.646 24.761 -21.939 1.00 53.41 H new ATOM 0 HB3 LEU A 75 7.311 25.307 -21.988 1.00 53.41 H new ATOM 0 HG LEU A 75 7.045 22.461 -22.631 1.00 52.00 H new ATOM 0 HD11 LEU A 75 6.030 22.812 -24.847 1.00 64.35 H new ATOM 0 HD12 LEU A 75 4.893 23.190 -23.531 1.00 64.35 H new ATOM 0 HD13 LEU A 75 5.695 24.507 -24.420 1.00 64.35 H new ATOM 0 HD21 LEU A 75 8.455 23.142 -24.535 1.00 65.30 H new ATOM 0 HD22 LEU A 75 8.217 24.849 -24.095 1.00 65.30 H new ATOM 0 HD23 LEU A 75 9.088 23.759 -22.991 1.00 65.30 H new ATOM 1205 N LYS A 76 9.025 24.547 -19.501 1.00 63.23 N ATOM 1206 CA LYS A 76 10.447 24.443 -19.200 1.00 74.41 C ATOM 1207 C LYS A 76 10.679 23.591 -17.956 1.00 40.52 C ATOM 1208 O LYS A 76 11.650 22.838 -17.880 1.00 64.23 O ATOM 1209 CB LYS A 76 11.050 25.835 -18.997 1.00 11.43 C ATOM 1210 CG LYS A 76 11.983 26.263 -20.118 1.00 70.20 C ATOM 1211 CD LYS A 76 11.456 27.488 -20.844 1.00 0.21 C ATOM 1212 CE LYS A 76 12.573 28.238 -21.555 1.00 33.20 C ATOM 1213 NZ LYS A 76 13.110 29.351 -20.724 1.00 71.30 N ATOM 0 H LYS A 76 8.571 25.372 -19.108 1.00 63.23 H new ATOM 0 HA LYS A 76 10.937 23.961 -20.046 1.00 74.41 H new ATOM 0 HB2 LYS A 76 10.243 26.562 -18.910 1.00 11.43 H new ATOM 0 HB3 LYS A 76 11.597 25.851 -18.054 1.00 11.43 H new ATOM 0 HG2 LYS A 76 12.970 26.478 -19.709 1.00 70.20 H new ATOM 0 HG3 LYS A 76 12.103 25.443 -20.826 1.00 70.20 H new ATOM 0 HD2 LYS A 76 10.700 27.186 -21.569 1.00 0.21 H new ATOM 0 HD3 LYS A 76 10.966 28.152 -20.132 1.00 0.21 H new ATOM 0 HE2 LYS A 76 13.378 27.545 -21.798 1.00 33.20 H new ATOM 0 HE3 LYS A 76 12.200 28.636 -22.498 1.00 33.20 H new ATOM 0 HZ1 LYS A 76 13.869 29.837 -21.243 1.00 71.30 H new ATOM 0 HZ2 LYS A 76 12.347 30.026 -20.513 1.00 71.30 H new ATOM 0 HZ3 LYS A 76 13.489 28.968 -19.835 1.00 71.30 H new ATOM 1227 N SER A 77 9.782 23.716 -16.983 1.00 53.00 N ATOM 1228 CA SER A 77 9.891 22.959 -15.741 1.00 1.14 C ATOM 1229 C SER A 77 9.791 21.460 -16.008 1.00 54.51 C ATOM 1230 O SER A 77 10.622 20.678 -15.543 1.00 3.32 O ATOM 1231 CB SER A 77 8.798 23.388 -14.760 1.00 43.12 C ATOM 1232 OG SER A 77 8.557 22.381 -13.793 1.00 63.40 O ATOM 0 H SER A 77 8.972 24.334 -17.031 1.00 53.00 H new ATOM 0 HA SER A 77 10.866 23.168 -15.301 1.00 1.14 H new ATOM 0 HB2 SER A 77 9.094 24.311 -14.262 1.00 43.12 H new ATOM 0 HB3 SER A 77 7.878 23.600 -15.305 1.00 43.12 H new ATOM 0 HG SER A 77 7.705 21.938 -13.987 1.00 63.40 H new ATOM 1238 N LEU A 78 8.768 21.066 -16.759 1.00 15.33 N ATOM 1239 CA LEU A 78 8.558 19.661 -17.089 1.00 54.32 C ATOM 1240 C LEU A 78 9.688 19.133 -17.967 1.00 1.35 C ATOM 1241 O LEU A 78 10.056 17.961 -17.886 1.00 11.51 O ATOM 1242 CB LEU A 78 7.216 19.479 -17.800 1.00 52.43 C ATOM 1243 CG LEU A 78 6.851 18.046 -18.188 1.00 34.12 C ATOM 1244 CD1 LEU A 78 6.966 17.121 -16.987 1.00 14.02 C ATOM 1245 CD2 LEU A 78 5.448 17.993 -18.773 1.00 73.23 C ATOM 0 H LEU A 78 8.071 21.700 -17.151 1.00 15.33 H new ATOM 0 HA LEU A 78 8.549 19.092 -16.159 1.00 54.32 H new ATOM 0 HB2 LEU A 78 6.430 19.871 -17.155 1.00 52.43 H new ATOM 0 HB3 LEU A 78 7.221 20.089 -18.703 1.00 52.43 H new ATOM 0 HG LEU A 78 7.553 17.706 -18.949 1.00 34.12 H new ATOM 0 HD11 LEU A 78 6.702 16.106 -17.283 1.00 14.02 H new ATOM 0 HD12 LEU A 78 7.990 17.136 -16.613 1.00 14.02 H new ATOM 0 HD13 LEU A 78 6.288 17.458 -16.202 1.00 14.02 H new ATOM 0 HD21 LEU A 78 5.205 16.965 -19.043 1.00 73.23 H new ATOM 0 HD22 LEU A 78 4.732 18.353 -18.034 1.00 73.23 H new ATOM 0 HD23 LEU A 78 5.400 18.623 -19.661 1.00 73.23 H new ATOM 1257 N PHE A 79 10.235 20.007 -18.806 1.00 34.54 N ATOM 1258 CA PHE A 79 11.324 19.629 -19.700 1.00 34.25 C ATOM 1259 C PHE A 79 12.547 19.176 -18.907 1.00 21.50 C ATOM 1260 O PHE A 79 13.153 18.150 -19.213 1.00 70.11 O ATOM 1261 CB PHE A 79 11.697 20.802 -20.608 1.00 11.23 C ATOM 1262 CG PHE A 79 12.655 20.431 -21.704 1.00 74.13 C ATOM 1263 CD1 PHE A 79 12.280 19.543 -22.699 1.00 62.31 C ATOM 1264 CD2 PHE A 79 13.931 20.970 -21.739 1.00 60.14 C ATOM 1265 CE1 PHE A 79 13.158 19.200 -23.709 1.00 52.32 C ATOM 1266 CE2 PHE A 79 14.814 20.632 -22.746 1.00 31.43 C ATOM 1267 CZ PHE A 79 14.428 19.744 -23.732 1.00 11.21 C ATOM 0 H PHE A 79 9.942 20.981 -18.886 1.00 34.54 H new ATOM 0 HA PHE A 79 10.983 18.796 -20.315 1.00 34.25 H new ATOM 0 HB2 PHE A 79 10.789 21.210 -21.053 1.00 11.23 H new ATOM 0 HB3 PHE A 79 12.139 21.593 -20.003 1.00 11.23 H new ATOM 0 HD1 PHE A 79 11.289 19.114 -22.685 1.00 62.31 H new ATOM 0 HD2 PHE A 79 14.239 21.663 -20.970 1.00 60.14 H new ATOM 0 HE1 PHE A 79 12.852 18.508 -24.479 1.00 52.32 H new ATOM 0 HE2 PHE A 79 15.805 21.061 -22.763 1.00 31.43 H new ATOM 0 HZ PHE A 79 15.117 19.476 -24.519 1.00 11.21 H new ATOM 1277 N ASN A 80 12.903 19.950 -17.887 1.00 62.31 N ATOM 1278 CA ASN A 80 14.053 19.630 -17.049 1.00 65.40 C ATOM 1279 C ASN A 80 13.795 18.370 -16.228 1.00 5.30 C ATOM 1280 O ASN A 80 14.729 17.701 -15.785 1.00 2.34 O ATOM 1281 CB ASN A 80 14.374 20.802 -16.119 1.00 13.15 C ATOM 1282 CG ASN A 80 14.928 21.999 -16.868 1.00 33.53 C ATOM 1283 OD1 ASN A 80 14.771 22.112 -18.084 1.00 63.12 O ATOM 1284 ND2 ASN A 80 15.581 22.900 -16.142 1.00 30.43 N ATOM 0 H ASN A 80 12.412 20.803 -17.621 1.00 62.31 H new ATOM 0 HA ASN A 80 14.907 19.448 -17.701 1.00 65.40 H new ATOM 0 HB2 ASN A 80 13.470 21.097 -15.585 1.00 13.15 H new ATOM 0 HB3 ASN A 80 15.096 20.480 -15.369 1.00 13.15 H new ATOM 0 HD21 ASN A 80 15.976 23.727 -16.590 1.00 30.43 H new ATOM 0 HD22 ASN A 80 15.687 22.765 -15.137 1.00 30.43 H new ATOM 1291 N THR A 81 12.520 18.051 -16.028 1.00 43.33 N ATOM 1292 CA THR A 81 12.138 16.874 -15.260 1.00 24.41 C ATOM 1293 C THR A 81 12.108 15.629 -16.140 1.00 33.13 C ATOM 1294 O THR A 81 12.467 14.536 -15.700 1.00 3.21 O ATOM 1295 CB THR A 81 10.757 17.055 -14.602 1.00 44.31 C ATOM 1296 OG1 THR A 81 10.712 18.299 -13.894 1.00 64.42 O ATOM 1297 CG2 THR A 81 10.458 15.910 -13.646 1.00 2.42 C ATOM 0 H THR A 81 11.734 18.593 -16.388 1.00 43.33 H new ATOM 0 HA THR A 81 12.890 16.748 -14.481 1.00 24.41 H new ATOM 0 HB THR A 81 10.002 17.057 -15.388 1.00 44.31 H new ATOM 0 HG1 THR A 81 10.702 19.040 -14.535 1.00 64.42 H new ATOM 0 HG21 THR A 81 9.478 16.060 -13.194 1.00 2.42 H new ATOM 0 HG22 THR A 81 10.464 14.968 -14.194 1.00 2.42 H new ATOM 0 HG23 THR A 81 11.217 15.881 -12.865 1.00 2.42 H new ATOM 1305 N VAL A 82 11.680 15.801 -17.387 1.00 41.22 N ATOM 1306 CA VAL A 82 11.606 14.692 -18.330 1.00 14.43 C ATOM 1307 C VAL A 82 12.999 14.192 -18.700 1.00 71.34 C ATOM 1308 O VAL A 82 13.186 13.011 -18.997 1.00 51.13 O ATOM 1309 CB VAL A 82 10.861 15.097 -19.616 1.00 64.24 C ATOM 1310 CG1 VAL A 82 10.872 13.955 -20.621 1.00 44.52 C ATOM 1311 CG2 VAL A 82 9.435 15.519 -19.292 1.00 2.15 C ATOM 0 H VAL A 82 11.379 16.698 -17.767 1.00 41.22 H new ATOM 0 HA VAL A 82 11.054 13.892 -17.836 1.00 14.43 H new ATOM 0 HB VAL A 82 11.376 15.947 -20.063 1.00 64.24 H new ATOM 0 HG11 VAL A 82 10.341 14.259 -21.523 1.00 44.52 H new ATOM 0 HG12 VAL A 82 11.902 13.703 -20.874 1.00 44.52 H new ATOM 0 HG13 VAL A 82 10.381 13.084 -20.187 1.00 44.52 H new ATOM 0 HG21 VAL A 82 8.922 15.802 -20.211 1.00 2.15 H new ATOM 0 HG22 VAL A 82 8.907 14.688 -18.823 1.00 2.15 H new ATOM 0 HG23 VAL A 82 9.453 16.369 -18.610 1.00 2.15 H new ATOM 1321 N CYS A 83 13.971 15.096 -18.680 1.00 51.34 N ATOM 1322 CA CYS A 83 15.347 14.747 -19.014 1.00 50.42 C ATOM 1323 C CYS A 83 15.968 13.882 -17.922 1.00 74.22 C ATOM 1324 O CYS A 83 16.911 13.130 -18.173 1.00 52.33 O ATOM 1325 CB CYS A 83 16.183 16.013 -19.214 1.00 23.31 C ATOM 1326 SG CYS A 83 16.885 16.684 -17.689 1.00 12.25 S ATOM 0 H CYS A 83 13.832 16.077 -18.436 1.00 51.34 H new ATOM 0 HA CYS A 83 15.336 14.177 -19.943 1.00 50.42 H new ATOM 0 HB2 CYS A 83 16.994 15.794 -19.909 1.00 23.31 H new ATOM 0 HB3 CYS A 83 15.561 16.776 -19.681 1.00 23.31 H new ATOM 0 HG CYS A 83 15.928 16.947 -16.849 1.00 12.25 H new ATOM 1332 N VAL A 84 15.435 13.993 -16.710 1.00 61.13 N ATOM 1333 CA VAL A 84 15.937 13.221 -15.580 1.00 44.31 C ATOM 1334 C VAL A 84 15.467 11.772 -15.652 1.00 53.31 C ATOM 1335 O VAL A 84 16.238 10.846 -15.395 1.00 42.30 O ATOM 1336 CB VAL A 84 15.484 13.830 -14.238 1.00 13.44 C ATOM 1337 CG1 VAL A 84 15.921 12.950 -13.077 1.00 13.24 C ATOM 1338 CG2 VAL A 84 16.029 15.241 -14.084 1.00 54.42 C ATOM 0 H VAL A 84 14.655 14.611 -16.485 1.00 61.13 H new ATOM 0 HA VAL A 84 17.025 13.250 -15.635 1.00 44.31 H new ATOM 0 HB VAL A 84 14.395 13.883 -14.231 1.00 13.44 H new ATOM 0 HG11 VAL A 84 15.592 13.396 -12.138 1.00 13.24 H new ATOM 0 HG12 VAL A 84 15.477 11.960 -13.183 1.00 13.24 H new ATOM 0 HG13 VAL A 84 17.007 12.862 -13.076 1.00 13.24 H new ATOM 0 HG21 VAL A 84 15.700 15.656 -13.131 1.00 54.42 H new ATOM 0 HG22 VAL A 84 17.118 15.215 -14.112 1.00 54.42 H new ATOM 0 HG23 VAL A 84 15.660 15.864 -14.898 1.00 54.42 H new ATOM 1348 N ILE A 85 14.200 11.584 -16.003 1.00 31.51 N ATOM 1349 CA ILE A 85 13.629 10.247 -16.110 1.00 75.11 C ATOM 1350 C ILE A 85 14.427 9.385 -17.083 1.00 25.11 C ATOM 1351 O ILE A 85 14.847 8.279 -16.745 1.00 15.33 O ATOM 1352 CB ILE A 85 12.161 10.298 -16.572 1.00 4.15 C ATOM 1353 CG1 ILE A 85 11.306 11.043 -15.545 1.00 61.11 C ATOM 1354 CG2 ILE A 85 11.626 8.890 -16.793 1.00 4.45 C ATOM 1355 CD1 ILE A 85 10.984 10.221 -14.317 1.00 42.14 C ATOM 0 H ILE A 85 13.549 12.340 -16.218 1.00 31.51 H new ATOM 0 HA ILE A 85 13.673 9.804 -15.115 1.00 75.11 H new ATOM 0 HB ILE A 85 12.112 10.837 -17.518 1.00 4.15 H new ATOM 0 HG12 ILE A 85 11.828 11.950 -15.239 1.00 61.11 H new ATOM 0 HG13 ILE A 85 10.375 11.355 -16.018 1.00 61.11 H new ATOM 0 HG21 ILE A 85 10.587 8.942 -17.119 1.00 4.45 H new ATOM 0 HG22 ILE A 85 12.222 8.390 -17.557 1.00 4.45 H new ATOM 0 HG23 ILE A 85 11.686 8.328 -15.861 1.00 4.45 H new ATOM 0 HD11 ILE A 85 10.376 10.812 -13.633 1.00 42.14 H new ATOM 0 HD12 ILE A 85 10.434 9.327 -14.611 1.00 42.14 H new ATOM 0 HD13 ILE A 85 11.910 9.930 -13.821 1.00 42.14 H new ATOM 1367 N TRP A 86 14.632 9.900 -18.290 1.00 63.03 N ATOM 1368 CA TRP A 86 15.381 9.178 -19.311 1.00 31.11 C ATOM 1369 C TRP A 86 16.767 8.797 -18.802 1.00 22.34 C ATOM 1370 O TRP A 86 17.288 7.730 -19.131 1.00 22.15 O ATOM 1371 CB TRP A 86 15.505 10.026 -20.578 1.00 5.43 C ATOM 1372 CG TRP A 86 16.357 9.394 -21.636 1.00 14.01 C ATOM 1373 CD1 TRP A 86 15.927 8.673 -22.713 1.00 10.53 C ATOM 1374 CD2 TRP A 86 17.787 9.425 -21.716 1.00 74.33 C ATOM 1375 NE1 TRP A 86 17.003 8.254 -23.458 1.00 21.24 N ATOM 1376 CE2 TRP A 86 18.155 8.702 -22.868 1.00 41.12 C ATOM 1377 CE3 TRP A 86 18.791 9.993 -20.927 1.00 15.04 C ATOM 1378 CZ2 TRP A 86 19.484 8.535 -23.248 1.00 62.51 C ATOM 1379 CZ3 TRP A 86 20.110 9.825 -21.306 1.00 70.42 C ATOM 1380 CH2 TRP A 86 20.446 9.102 -22.458 1.00 75.40 C ATOM 0 H TRP A 86 14.290 10.815 -18.585 1.00 63.03 H new ATOM 0 HA TRP A 86 14.837 8.264 -19.546 1.00 31.11 H new ATOM 0 HB2 TRP A 86 14.510 10.207 -20.984 1.00 5.43 H new ATOM 0 HB3 TRP A 86 15.924 10.997 -20.316 1.00 5.43 H new ATOM 0 HD1 TRP A 86 14.893 8.463 -22.945 1.00 10.53 H new ATOM 0 HE1 TRP A 86 16.952 7.699 -24.312 1.00 21.24 H new ATOM 0 HE3 TRP A 86 18.541 10.553 -20.038 1.00 15.04 H new ATOM 0 HZ2 TRP A 86 19.746 7.978 -24.135 1.00 62.51 H new ATOM 0 HZ3 TRP A 86 20.895 10.259 -20.704 1.00 70.42 H new ATOM 0 HH2 TRP A 86 21.486 8.990 -22.728 1.00 75.40 H new ATOM 1391 N CYS A 87 17.359 9.673 -17.999 1.00 12.23 N ATOM 1392 CA CYS A 87 18.686 9.428 -17.446 1.00 73.43 C ATOM 1393 C CYS A 87 18.665 8.238 -16.492 1.00 52.31 C ATOM 1394 O CYS A 87 19.702 7.633 -16.216 1.00 2.14 O ATOM 1395 CB CYS A 87 19.195 10.673 -16.718 1.00 74.02 C ATOM 1396 SG CYS A 87 19.972 11.895 -17.799 1.00 12.23 S ATOM 0 H CYS A 87 16.941 10.560 -17.716 1.00 12.23 H new ATOM 0 HA CYS A 87 19.361 9.198 -18.271 1.00 73.43 H new ATOM 0 HB2 CYS A 87 18.360 11.143 -16.198 1.00 74.02 H new ATOM 0 HB3 CYS A 87 19.914 10.368 -15.958 1.00 74.02 H new ATOM 0 HG CYS A 87 19.064 12.695 -18.272 1.00 12.23 H new ATOM 1402 N ILE A 88 17.480 7.910 -15.990 1.00 73.32 N ATOM 1403 CA ILE A 88 17.325 6.793 -15.065 1.00 12.13 C ATOM 1404 C ILE A 88 17.324 5.461 -15.808 1.00 24.02 C ATOM 1405 O ILE A 88 18.001 4.514 -15.409 1.00 71.24 O ATOM 1406 CB ILE A 88 16.025 6.914 -14.249 1.00 20.33 C ATOM 1407 CG1 ILE A 88 16.019 8.218 -13.449 1.00 31.21 C ATOM 1408 CG2 ILE A 88 15.868 5.717 -13.323 1.00 55.23 C ATOM 1409 CD1 ILE A 88 14.638 8.652 -13.011 1.00 53.55 C ATOM 0 H ILE A 88 16.613 8.401 -16.208 1.00 73.32 H new ATOM 0 HA ILE A 88 18.176 6.826 -14.384 1.00 12.13 H new ATOM 0 HB ILE A 88 15.181 6.929 -14.938 1.00 20.33 H new ATOM 0 HG12 ILE A 88 16.649 8.097 -12.568 1.00 31.21 H new ATOM 0 HG13 ILE A 88 16.464 9.008 -14.054 1.00 31.21 H new ATOM 0 HG21 ILE A 88 14.944 5.817 -12.753 1.00 55.23 H new ATOM 0 HG22 ILE A 88 15.832 4.802 -13.914 1.00 55.23 H new ATOM 0 HG23 ILE A 88 16.715 5.674 -12.638 1.00 55.23 H new ATOM 0 HD11 ILE A 88 14.710 9.583 -12.449 1.00 53.55 H new ATOM 0 HD12 ILE A 88 14.009 8.805 -13.888 1.00 53.55 H new ATOM 0 HD13 ILE A 88 14.197 7.881 -12.379 1.00 53.55 H new ATOM 1421 N HIS A 89 16.559 5.396 -16.894 1.00 42.12 N ATOM 1422 CA HIS A 89 16.470 4.181 -17.695 1.00 31.25 C ATOM 1423 C HIS A 89 17.659 4.069 -18.646 1.00 60.15 C ATOM 1424 O HIS A 89 18.094 2.942 -18.878 1.00 51.00 O ATOM 1425 CB HIS A 89 15.164 4.163 -18.493 1.00 53.14 C ATOM 1426 CG HIS A 89 13.946 4.383 -17.649 1.00 61.31 C ATOM 1427 ND1 HIS A 89 13.705 3.693 -16.479 1.00 34.34 N ATOM 1428 CD2 HIS A 89 12.897 5.223 -17.811 1.00 62.53 C ATOM 1429 CE1 HIS A 89 12.561 4.098 -15.959 1.00 32.02 C ATOM 1430 NE2 HIS A 89 12.050 5.026 -16.748 1.00 21.14 N ATOM 0 H HIS A 89 15.992 6.171 -17.239 1.00 42.12 H new ATOM 0 HA HIS A 89 16.485 3.328 -17.017 1.00 31.25 H new ATOM 0 HB2 HIS A 89 15.207 4.933 -19.263 1.00 53.14 H new ATOM 0 HB3 HIS A 89 15.073 3.205 -19.005 1.00 53.14 H new ATOM 0 HD2 HIS A 89 12.753 5.919 -18.625 1.00 62.53 H new ATOM 0 HE1 HIS A 89 12.118 3.733 -15.044 1.00 32.02 H new ATOM 0 HE2 HIS A 89 11.169 5.517 -16.593 1.00 21.14 H new ATOM 1438 N ALA A 90 18.179 5.170 -19.180 1.00 14.13 N ATOM 1439 CA ALA A 90 19.317 5.113 -20.090 1.00 23.41 C ATOM 1440 C ALA A 90 20.530 4.486 -19.413 1.00 14.02 C ATOM 1441 O ALA A 90 21.469 4.052 -20.081 1.00 70.44 O ATOM 1442 CB ALA A 90 19.654 6.505 -20.601 1.00 41.24 C ATOM 0 H ALA A 90 17.831 6.111 -18.998 1.00 14.13 H new ATOM 0 HA ALA A 90 19.043 4.485 -20.937 1.00 23.41 H new ATOM 0 HB1 ALA A 90 20.505 6.447 -21.279 1.00 41.24 H new ATOM 0 HB2 ALA A 90 18.795 6.916 -21.131 1.00 41.24 H new ATOM 0 HB3 ALA A 90 19.904 7.151 -19.759 1.00 41.24 H new ATOM 1448 N GLU A 91 20.506 4.444 -18.084 1.00 4.12 N ATOM 1449 CA GLU A 91 21.606 3.872 -17.318 1.00 34.43 C ATOM 1450 C GLU A 91 22.818 4.798 -17.332 1.00 52.42 C ATOM 1451 O GLU A 91 23.952 4.350 -17.495 1.00 74.14 O ATOM 1452 CB GLU A 91 21.991 2.502 -17.881 1.00 25.12 C ATOM 1453 CG GLU A 91 22.282 1.464 -16.811 1.00 74.42 C ATOM 1454 CD GLU A 91 21.031 1.009 -16.084 1.00 53.33 C ATOM 1455 OE1 GLU A 91 20.250 0.236 -16.676 1.00 21.14 O ATOM 1456 OE2 GLU A 91 20.836 1.426 -14.924 1.00 24.50 O ATOM 0 H GLU A 91 19.737 4.799 -17.516 1.00 4.12 H new ATOM 0 HA GLU A 91 21.273 3.753 -16.287 1.00 34.43 H new ATOM 0 HB2 GLU A 91 21.183 2.140 -18.516 1.00 25.12 H new ATOM 0 HB3 GLU A 91 22.870 2.613 -18.516 1.00 25.12 H new ATOM 0 HG2 GLU A 91 22.766 0.601 -17.269 1.00 74.42 H new ATOM 0 HG3 GLU A 91 22.986 1.879 -16.090 1.00 74.42 H new ATOM 1463 N GLU A 92 22.568 6.093 -17.161 1.00 62.43 N ATOM 1464 CA GLU A 92 23.638 7.083 -17.156 1.00 75.34 C ATOM 1465 C GLU A 92 23.743 7.764 -15.794 1.00 61.23 C ATOM 1466 O GLU A 92 22.732 8.049 -15.150 1.00 73.12 O ATOM 1467 CB GLU A 92 23.401 8.130 -18.245 1.00 35.21 C ATOM 1468 CG GLU A 92 23.494 7.573 -19.655 1.00 11.13 C ATOM 1469 CD GLU A 92 24.862 7.781 -20.276 1.00 43.21 C ATOM 1470 OE1 GLU A 92 25.865 7.716 -19.537 1.00 41.34 O ATOM 1471 OE2 GLU A 92 24.927 8.009 -21.502 1.00 1.42 O ATOM 0 H GLU A 92 21.634 6.480 -17.024 1.00 62.43 H new ATOM 0 HA GLU A 92 24.576 6.566 -17.358 1.00 75.34 H new ATOM 0 HB2 GLU A 92 22.415 8.573 -18.103 1.00 35.21 H new ATOM 0 HB3 GLU A 92 24.131 8.932 -18.131 1.00 35.21 H new ATOM 0 HG2 GLU A 92 23.266 6.507 -19.636 1.00 11.13 H new ATOM 0 HG3 GLU A 92 22.739 8.050 -20.280 1.00 11.13 H new ATOM 1478 N LYS A 93 24.971 8.022 -15.360 1.00 53.13 N ATOM 1479 CA LYS A 93 25.211 8.670 -14.076 1.00 25.31 C ATOM 1480 C LYS A 93 25.201 10.189 -14.223 1.00 21.42 C ATOM 1481 O LYS A 93 25.930 10.748 -15.042 1.00 14.14 O ATOM 1482 CB LYS A 93 26.548 8.212 -13.491 1.00 51.45 C ATOM 1483 CG LYS A 93 26.752 8.624 -12.044 1.00 64.34 C ATOM 1484 CD LYS A 93 28.153 9.163 -11.808 1.00 32.34 C ATOM 1485 CE LYS A 93 28.573 9.011 -10.355 1.00 62.42 C ATOM 1486 NZ LYS A 93 27.850 9.963 -9.466 1.00 33.40 N ATOM 0 H LYS A 93 25.818 7.792 -15.880 1.00 53.13 H new ATOM 0 HA LYS A 93 24.408 8.383 -13.397 1.00 25.31 H new ATOM 0 HB2 LYS A 93 26.614 7.126 -13.564 1.00 51.45 H new ATOM 0 HB3 LYS A 93 27.358 8.622 -14.094 1.00 51.45 H new ATOM 0 HG2 LYS A 93 26.019 9.384 -11.775 1.00 64.34 H new ATOM 0 HG3 LYS A 93 26.577 7.768 -11.393 1.00 64.34 H new ATOM 0 HD2 LYS A 93 28.859 8.635 -12.449 1.00 32.34 H new ATOM 0 HD3 LYS A 93 28.191 10.215 -12.090 1.00 32.34 H new ATOM 0 HE2 LYS A 93 28.381 7.990 -10.026 1.00 62.42 H new ATOM 0 HE3 LYS A 93 29.647 9.177 -10.268 1.00 62.42 H new ATOM 0 HZ1 LYS A 93 28.164 9.828 -8.484 1.00 33.40 H new ATOM 0 HZ2 LYS A 93 28.053 10.939 -9.763 1.00 33.40 H new ATOM 0 HZ3 LYS A 93 26.827 9.788 -9.529 1.00 33.40 H new ATOM 1500 N VAL A 94 24.371 10.851 -13.423 1.00 31.41 N ATOM 1501 CA VAL A 94 24.269 12.304 -13.462 1.00 40.15 C ATOM 1502 C VAL A 94 24.337 12.899 -12.060 1.00 74.03 C ATOM 1503 O VAL A 94 23.861 12.299 -11.096 1.00 73.13 O ATOM 1504 CB VAL A 94 22.960 12.757 -14.135 1.00 24.12 C ATOM 1505 CG1 VAL A 94 22.866 12.201 -15.548 1.00 22.12 C ATOM 1506 CG2 VAL A 94 21.759 12.331 -13.305 1.00 43.35 C ATOM 0 H VAL A 94 23.760 10.403 -12.740 1.00 31.41 H new ATOM 0 HA VAL A 94 25.115 12.664 -14.048 1.00 40.15 H new ATOM 0 HB VAL A 94 22.962 13.845 -14.198 1.00 24.12 H new ATOM 0 HG11 VAL A 94 21.935 12.531 -16.008 1.00 22.12 H new ATOM 0 HG12 VAL A 94 23.709 12.561 -16.137 1.00 22.12 H new ATOM 0 HG13 VAL A 94 22.887 11.112 -15.513 1.00 22.12 H new ATOM 0 HG21 VAL A 94 20.843 12.659 -13.796 1.00 43.35 H new ATOM 0 HG22 VAL A 94 21.750 11.245 -13.209 1.00 43.35 H new ATOM 0 HG23 VAL A 94 21.822 12.783 -12.315 1.00 43.35 H new ATOM 1516 N LYS A 95 24.934 14.081 -11.952 1.00 23.11 N ATOM 1517 CA LYS A 95 25.064 14.759 -10.668 1.00 53.10 C ATOM 1518 C LYS A 95 23.846 15.633 -10.388 1.00 63.24 C ATOM 1519 O LYS A 95 23.341 15.670 -9.265 1.00 35.54 O ATOM 1520 CB LYS A 95 26.334 15.613 -10.646 1.00 42.04 C ATOM 1521 CG LYS A 95 27.586 14.831 -10.289 1.00 12.42 C ATOM 1522 CD LYS A 95 28.829 15.702 -10.368 1.00 41.14 C ATOM 1523 CE LYS A 95 29.184 16.291 -9.011 1.00 63.10 C ATOM 1524 NZ LYS A 95 29.410 17.761 -9.087 1.00 45.53 N ATOM 0 H LYS A 95 25.336 14.590 -12.739 1.00 23.11 H new ATOM 0 HA LYS A 95 25.130 13.999 -9.889 1.00 53.10 H new ATOM 0 HB2 LYS A 95 26.470 16.073 -11.625 1.00 42.04 H new ATOM 0 HB3 LYS A 95 26.205 16.423 -9.928 1.00 42.04 H new ATOM 0 HG2 LYS A 95 27.488 14.426 -9.282 1.00 12.42 H new ATOM 0 HG3 LYS A 95 27.691 13.983 -10.965 1.00 12.42 H new ATOM 0 HD2 LYS A 95 29.666 15.111 -10.739 1.00 41.14 H new ATOM 0 HD3 LYS A 95 28.665 16.507 -11.084 1.00 41.14 H new ATOM 0 HE2 LYS A 95 28.381 16.083 -8.303 1.00 63.10 H new ATOM 0 HE3 LYS A 95 30.081 15.805 -8.627 1.00 63.10 H new ATOM 0 HZ1 LYS A 95 29.650 18.125 -8.143 1.00 45.53 H new ATOM 0 HZ2 LYS A 95 30.193 17.958 -9.743 1.00 45.53 H new ATOM 0 HZ3 LYS A 95 28.546 18.228 -9.429 1.00 45.53 H new ATOM 1538 N ASP A 96 23.378 16.335 -11.414 1.00 74.21 N ATOM 1539 CA ASP A 96 22.218 17.207 -11.279 1.00 71.02 C ATOM 1540 C ASP A 96 21.396 17.221 -12.564 1.00 32.30 C ATOM 1541 O ASP A 96 21.748 16.568 -13.547 1.00 21.42 O ATOM 1542 CB ASP A 96 22.659 18.628 -10.926 1.00 43.21 C ATOM 1543 CG ASP A 96 23.553 19.238 -11.988 1.00 64.42 C ATOM 1544 OD1 ASP A 96 23.027 19.634 -13.050 1.00 41.22 O ATOM 1545 OD2 ASP A 96 24.777 19.320 -11.757 1.00 34.22 O ATOM 0 H ASP A 96 23.785 16.317 -12.349 1.00 74.21 H new ATOM 0 HA ASP A 96 21.594 16.818 -10.474 1.00 71.02 H new ATOM 0 HB2 ASP A 96 21.778 19.256 -10.792 1.00 43.21 H new ATOM 0 HB3 ASP A 96 23.189 18.615 -9.973 1.00 43.21 H new ATOM 1550 N THR A 97 20.298 17.970 -12.550 1.00 42.11 N ATOM 1551 CA THR A 97 19.424 18.068 -13.713 1.00 21.22 C ATOM 1552 C THR A 97 20.148 18.707 -14.892 1.00 41.22 C ATOM 1553 O THR A 97 20.116 18.187 -16.007 1.00 41.30 O ATOM 1554 CB THR A 97 18.158 18.887 -13.397 1.00 33.03 C ATOM 1555 OG1 THR A 97 17.613 18.479 -12.137 1.00 3.34 O ATOM 1556 CG2 THR A 97 17.114 18.711 -14.489 1.00 31.30 C ATOM 0 H THR A 97 19.993 18.518 -11.746 1.00 42.11 H new ATOM 0 HA THR A 97 19.133 17.051 -13.977 1.00 21.22 H new ATOM 0 HB THR A 97 18.435 19.940 -13.348 1.00 33.03 H new ATOM 0 HG1 THR A 97 17.781 19.174 -11.467 1.00 3.34 H new ATOM 0 HG21 THR A 97 16.229 19.298 -14.244 1.00 31.30 H new ATOM 0 HG22 THR A 97 17.523 19.050 -15.441 1.00 31.30 H new ATOM 0 HG23 THR A 97 16.841 17.658 -14.565 1.00 31.30 H new ATOM 1564 N GLU A 98 20.802 19.836 -14.639 1.00 41.55 N ATOM 1565 CA GLU A 98 21.534 20.545 -15.681 1.00 43.23 C ATOM 1566 C GLU A 98 22.429 19.588 -16.464 1.00 5.41 C ATOM 1567 O GLU A 98 22.541 19.686 -17.685 1.00 1.32 O ATOM 1568 CB GLU A 98 22.378 21.666 -15.070 1.00 1.24 C ATOM 1569 CG GLU A 98 21.933 23.058 -15.483 1.00 22.05 C ATOM 1570 CD GLU A 98 23.082 23.917 -15.975 1.00 74.15 C ATOM 1571 OE1 GLU A 98 23.799 23.478 -16.898 1.00 60.44 O ATOM 1572 OE2 GLU A 98 23.263 25.029 -15.436 1.00 54.21 O ATOM 0 H GLU A 98 20.840 20.279 -13.721 1.00 41.55 H new ATOM 0 HA GLU A 98 20.808 20.980 -16.368 1.00 43.23 H new ATOM 0 HB2 GLU A 98 22.338 21.588 -13.984 1.00 1.24 H new ATOM 0 HB3 GLU A 98 23.419 21.525 -15.361 1.00 1.24 H new ATOM 0 HG2 GLU A 98 21.183 22.977 -16.269 1.00 22.05 H new ATOM 0 HG3 GLU A 98 21.455 23.549 -14.635 1.00 22.05 H new ATOM 1579 N GLY A 99 23.065 18.665 -15.751 1.00 60.53 N ATOM 1580 CA GLY A 99 23.942 17.704 -16.395 1.00 63.44 C ATOM 1581 C GLY A 99 23.177 16.573 -17.054 1.00 73.43 C ATOM 1582 O GLY A 99 23.584 16.066 -18.099 1.00 14.42 O ATOM 0 H GLY A 99 22.989 18.565 -14.739 1.00 60.53 H new ATOM 0 HA2 GLY A 99 24.547 18.214 -17.144 1.00 63.44 H new ATOM 0 HA3 GLY A 99 24.629 17.292 -15.656 1.00 63.44 H new ATOM 1586 N ALA A 100 22.068 16.174 -16.441 1.00 1.22 N ATOM 1587 CA ALA A 100 21.245 15.095 -16.976 1.00 52.44 C ATOM 1588 C ALA A 100 20.694 15.456 -18.351 1.00 13.05 C ATOM 1589 O ALA A 100 20.506 14.587 -19.203 1.00 15.03 O ATOM 1590 CB ALA A 100 20.108 14.774 -16.017 1.00 35.30 C ATOM 0 H ALA A 100 21.718 16.581 -15.574 1.00 1.22 H new ATOM 0 HA ALA A 100 21.873 14.211 -17.086 1.00 52.44 H new ATOM 0 HB1 ALA A 100 19.502 13.967 -16.429 1.00 35.30 H new ATOM 0 HB2 ALA A 100 20.519 14.465 -15.056 1.00 35.30 H new ATOM 0 HB3 ALA A 100 19.488 15.660 -15.879 1.00 35.30 H new ATOM 1596 N LYS A 101 20.435 16.741 -18.561 1.00 4.11 N ATOM 1597 CA LYS A 101 19.904 17.218 -19.833 1.00 32.00 C ATOM 1598 C LYS A 101 20.974 17.174 -20.919 1.00 15.20 C ATOM 1599 O LYS A 101 20.752 16.631 -22.001 1.00 44.10 O ATOM 1600 CB LYS A 101 19.371 18.644 -19.686 1.00 71.02 C ATOM 1601 CG LYS A 101 18.028 18.865 -20.360 1.00 71.30 C ATOM 1602 CD LYS A 101 17.990 20.187 -21.106 1.00 2.41 C ATOM 1603 CE LYS A 101 18.190 19.989 -22.602 1.00 45.23 C ATOM 1604 NZ LYS A 101 18.222 21.287 -23.333 1.00 50.11 N ATOM 0 H LYS A 101 20.584 17.473 -17.866 1.00 4.11 H new ATOM 0 HA LYS A 101 19.086 16.560 -20.125 1.00 32.00 H new ATOM 0 HB2 LYS A 101 19.279 18.881 -18.626 1.00 71.02 H new ATOM 0 HB3 LYS A 101 20.098 19.339 -20.106 1.00 71.02 H new ATOM 0 HG2 LYS A 101 17.830 18.049 -21.054 1.00 71.30 H new ATOM 0 HG3 LYS A 101 17.236 18.846 -19.611 1.00 71.30 H new ATOM 0 HD2 LYS A 101 17.034 20.679 -20.928 1.00 2.41 H new ATOM 0 HD3 LYS A 101 18.766 20.847 -20.718 1.00 2.41 H new ATOM 0 HE2 LYS A 101 19.122 19.451 -22.776 1.00 45.23 H new ATOM 0 HE3 LYS A 101 17.385 19.369 -22.997 1.00 45.23 H new ATOM 0 HZ1 LYS A 101 17.346 21.398 -23.882 1.00 50.11 H new ATOM 0 HZ2 LYS A 101 18.304 22.068 -22.651 1.00 50.11 H new ATOM 0 HZ3 LYS A 101 19.038 21.303 -23.977 1.00 50.11 H new ATOM 1618 N GLN A 102 22.137 17.747 -20.622 1.00 11.33 N ATOM 1619 CA GLN A 102 23.242 17.772 -21.573 1.00 20.54 C ATOM 1620 C GLN A 102 23.503 16.380 -22.139 1.00 55.31 C ATOM 1621 O GLN A 102 23.747 16.222 -23.336 1.00 14.32 O ATOM 1622 CB GLN A 102 24.507 18.310 -20.904 1.00 62.51 C ATOM 1623 CG GLN A 102 25.478 18.963 -21.874 1.00 34.24 C ATOM 1624 CD GLN A 102 26.050 20.262 -21.343 1.00 10.13 C ATOM 1625 OE1 GLN A 102 25.778 21.337 -21.878 1.00 10.12 O ATOM 1626 NE2 GLN A 102 26.847 20.170 -20.285 1.00 63.11 N ATOM 0 H GLN A 102 22.338 18.200 -19.730 1.00 11.33 H new ATOM 0 HA GLN A 102 22.967 18.433 -22.395 1.00 20.54 H new ATOM 0 HB2 GLN A 102 24.224 19.036 -20.142 1.00 62.51 H new ATOM 0 HB3 GLN A 102 25.013 17.492 -20.392 1.00 62.51 H new ATOM 0 HG2 GLN A 102 26.293 18.272 -22.086 1.00 34.24 H new ATOM 0 HG3 GLN A 102 24.968 19.154 -22.818 1.00 34.24 H new ATOM 0 HE21 GLN A 102 27.045 19.258 -19.874 1.00 63.11 H new ATOM 0 HE22 GLN A 102 27.261 21.011 -19.884 1.00 63.11 H new ATOM 1635 N ILE A 103 23.453 15.374 -21.272 1.00 44.13 N ATOM 1636 CA ILE A 103 23.684 13.997 -21.686 1.00 62.42 C ATOM 1637 C ILE A 103 22.665 13.559 -22.732 1.00 34.44 C ATOM 1638 O ILE A 103 22.988 12.809 -23.654 1.00 55.11 O ATOM 1639 CB ILE A 103 23.621 13.031 -20.488 1.00 72.51 C ATOM 1640 CG1 ILE A 103 24.747 13.336 -19.498 1.00 3.25 C ATOM 1641 CG2 ILE A 103 23.705 11.589 -20.966 1.00 13.11 C ATOM 1642 CD1 ILE A 103 24.719 12.464 -18.263 1.00 30.11 C ATOM 0 H ILE A 103 23.254 15.488 -20.278 1.00 44.13 H new ATOM 0 HA ILE A 103 24.684 13.961 -22.119 1.00 62.42 H new ATOM 0 HB ILE A 103 22.668 13.170 -19.978 1.00 72.51 H new ATOM 0 HG12 ILE A 103 25.706 13.209 -20.001 1.00 3.25 H new ATOM 0 HG13 ILE A 103 24.681 14.381 -19.196 1.00 3.25 H new ATOM 0 HG21 ILE A 103 23.659 10.918 -20.108 1.00 13.11 H new ATOM 0 HG22 ILE A 103 22.871 11.379 -21.636 1.00 13.11 H new ATOM 0 HG23 ILE A 103 24.645 11.436 -21.497 1.00 13.11 H new ATOM 0 HD11 ILE A 103 25.546 12.736 -17.607 1.00 30.11 H new ATOM 0 HD12 ILE A 103 23.775 12.608 -17.737 1.00 30.11 H new ATOM 0 HD13 ILE A 103 24.816 11.418 -18.554 1.00 30.11 H new ATOM 1654 N VAL A 104 21.433 14.033 -22.586 1.00 60.41 N ATOM 1655 CA VAL A 104 20.365 13.693 -23.520 1.00 54.43 C ATOM 1656 C VAL A 104 20.608 14.327 -24.884 1.00 24.41 C ATOM 1657 O VAL A 104 20.747 13.629 -25.890 1.00 64.45 O ATOM 1658 CB VAL A 104 18.991 14.146 -22.991 1.00 52.20 C ATOM 1659 CG1 VAL A 104 17.907 13.877 -24.023 1.00 31.23 C ATOM 1660 CG2 VAL A 104 18.671 13.452 -21.676 1.00 13.23 C ATOM 0 H VAL A 104 21.148 14.655 -21.829 1.00 60.41 H new ATOM 0 HA VAL A 104 20.366 12.608 -23.622 1.00 54.43 H new ATOM 0 HB VAL A 104 19.027 15.220 -22.809 1.00 52.20 H new ATOM 0 HG11 VAL A 104 16.943 14.203 -23.632 1.00 31.23 H new ATOM 0 HG12 VAL A 104 18.132 14.425 -24.938 1.00 31.23 H new ATOM 0 HG13 VAL A 104 17.868 12.809 -24.240 1.00 31.23 H new ATOM 0 HG21 VAL A 104 17.697 13.784 -21.317 1.00 13.23 H new ATOM 0 HG22 VAL A 104 18.653 12.373 -21.829 1.00 13.23 H new ATOM 0 HG23 VAL A 104 19.434 13.701 -20.938 1.00 13.23 H new ATOM 1670 N ARG A 105 20.658 15.655 -24.913 1.00 45.32 N ATOM 1671 CA ARG A 105 20.883 16.384 -26.155 1.00 21.12 C ATOM 1672 C ARG A 105 22.173 15.926 -26.829 1.00 14.23 C ATOM 1673 O ARG A 105 22.221 15.750 -28.047 1.00 45.22 O ATOM 1674 CB ARG A 105 20.942 17.889 -25.885 1.00 32.12 C ATOM 1675 CG ARG A 105 20.753 18.740 -27.130 1.00 41.01 C ATOM 1676 CD ARG A 105 21.566 20.023 -27.057 1.00 71.11 C ATOM 1677 NE ARG A 105 21.227 20.820 -25.882 1.00 63.01 N ATOM 1678 CZ ARG A 105 21.798 21.984 -25.593 1.00 1.25 C ATOM 1679 NH1 ARG A 105 22.732 22.484 -26.391 1.00 25.13 N ATOM 1680 NH2 ARG A 105 21.435 22.651 -24.505 1.00 22.41 N ATOM 0 H ARG A 105 20.546 16.248 -24.090 1.00 45.32 H new ATOM 0 HA ARG A 105 20.049 16.175 -26.825 1.00 21.12 H new ATOM 0 HB2 ARG A 105 20.173 18.149 -25.157 1.00 32.12 H new ATOM 0 HB3 ARG A 105 21.904 18.131 -25.433 1.00 32.12 H new ATOM 0 HG2 ARG A 105 21.050 18.170 -28.010 1.00 41.01 H new ATOM 0 HG3 ARG A 105 19.697 18.983 -27.249 1.00 41.01 H new ATOM 0 HD2 ARG A 105 22.628 19.778 -27.035 1.00 71.11 H new ATOM 0 HD3 ARG A 105 21.394 20.613 -27.957 1.00 71.11 H new ATOM 0 HE ARG A 105 20.512 20.463 -25.248 1.00 63.01 H new ATOM 0 HH11 ARG A 105 23.013 21.975 -27.229 1.00 25.13 H new ATOM 0 HH12 ARG A 105 23.169 23.378 -26.167 1.00 25.13 H new ATOM 0 HH21 ARG A 105 20.717 22.270 -23.889 1.00 22.41 H new ATOM 0 HH22 ARG A 105 21.874 23.545 -24.284 1.00 22.41 H new ATOM 1694 N ARG A 106 23.217 15.736 -26.028 1.00 20.23 N ATOM 1695 CA ARG A 106 24.507 15.300 -26.548 1.00 51.53 C ATOM 1696 C ARG A 106 24.349 14.068 -27.435 1.00 52.45 C ATOM 1697 O ARG A 106 24.875 14.020 -28.547 1.00 20.30 O ATOM 1698 CB ARG A 106 25.466 14.993 -25.396 1.00 53.00 C ATOM 1699 CG ARG A 106 26.877 14.653 -25.851 1.00 25.04 C ATOM 1700 CD ARG A 106 27.696 15.908 -26.112 1.00 24.11 C ATOM 1701 NE ARG A 106 28.247 16.467 -24.880 1.00 24.01 N ATOM 1702 CZ ARG A 106 29.277 17.304 -24.851 1.00 53.22 C ATOM 1703 NH1 ARG A 106 29.866 17.677 -25.978 1.00 10.05 N ATOM 1704 NH2 ARG A 106 29.722 17.770 -23.690 1.00 25.24 N ATOM 0 H ARG A 106 23.194 15.877 -25.018 1.00 20.23 H new ATOM 0 HA ARG A 106 24.920 16.109 -27.151 1.00 51.53 H new ATOM 0 HB2 ARG A 106 25.506 15.854 -24.729 1.00 53.00 H new ATOM 0 HB3 ARG A 106 25.069 14.159 -24.817 1.00 53.00 H new ATOM 0 HG2 ARG A 106 27.370 14.047 -25.090 1.00 25.04 H new ATOM 0 HG3 ARG A 106 26.833 14.051 -26.759 1.00 25.04 H new ATOM 0 HD2 ARG A 106 28.509 15.674 -26.799 1.00 24.11 H new ATOM 0 HD3 ARG A 106 27.070 16.655 -26.601 1.00 24.11 H new ATOM 0 HE ARG A 106 27.817 16.200 -23.994 1.00 24.01 H new ATOM 0 HH11 ARG A 106 29.528 17.321 -26.872 1.00 10.05 H new ATOM 0 HH12 ARG A 106 30.657 18.320 -25.951 1.00 10.05 H new ATOM 0 HH21 ARG A 106 29.272 17.485 -22.820 1.00 25.24 H new ATOM 0 HH22 ARG A 106 30.513 18.413 -23.668 1.00 25.24 H new ATOM 1718 N HIS A 107 23.623 13.075 -26.934 1.00 62.44 N ATOM 1719 CA HIS A 107 23.395 11.842 -27.680 1.00 51.12 C ATOM 1720 C HIS A 107 22.466 12.089 -28.866 1.00 13.51 C ATOM 1721 O HIS A 107 22.519 11.292 -29.802 1.00 30.35 O ATOM 1722 CB HIS A 107 22.798 10.770 -26.767 1.00 14.14 C ATOM 1723 CG HIS A 107 23.809 10.110 -25.879 1.00 40.30 C ATOM 1724 ND1 HIS A 107 25.093 9.820 -26.287 1.00 34.50 N ATOM 1725 CD2 HIS A 107 23.718 9.686 -24.598 1.00 42.05 C ATOM 1726 CE1 HIS A 107 25.748 9.244 -25.295 1.00 71.43 C ATOM 1727 NE2 HIS A 107 24.935 9.151 -24.257 1.00 14.21 N ATOM 0 H HIS A 107 23.182 13.099 -26.015 1.00 62.44 H new ATOM 0 HA HIS A 107 24.356 11.493 -28.058 1.00 51.12 H new ATOM 0 HB2 HIS A 107 22.023 11.222 -26.148 1.00 14.14 H new ATOM 0 HB3 HIS A 107 22.314 10.010 -27.380 1.00 14.14 H new ATOM 0 HD2 HIS A 107 22.849 9.756 -23.961 1.00 42.05 H new ATOM 0 HE1 HIS A 107 26.773 8.906 -25.327 1.00 71.43 H new ATOM 0 HE2 HIS A 107 25.173 8.748 -23.351 1.00 14.21 H new ATOM 1735 N LEU A 108 21.648 13.135 -28.853 1.00 53.41 N ATOM 1736 CA LEU A 108 20.744 13.413 -29.962 1.00 23.02 C ATOM 1737 C LEU A 108 21.476 14.120 -31.099 1.00 45.12 C ATOM 1738 O LEU A 108 21.348 13.744 -32.264 1.00 64.03 O ATOM 1739 CB LEU A 108 19.568 14.269 -29.486 1.00 10.42 C ATOM 1740 CG LEU A 108 18.686 13.654 -28.399 1.00 13.42 C ATOM 1741 CD1 LEU A 108 17.832 14.723 -27.737 1.00 71.12 C ATOM 1742 CD2 LEU A 108 17.811 12.554 -28.982 1.00 74.32 C ATOM 0 H LEU A 108 21.592 13.805 -28.086 1.00 53.41 H new ATOM 0 HA LEU A 108 20.365 12.462 -30.336 1.00 23.02 H new ATOM 0 HB2 LEU A 108 19.961 15.216 -29.115 1.00 10.42 H new ATOM 0 HB3 LEU A 108 18.941 14.500 -30.347 1.00 10.42 H new ATOM 0 HG LEU A 108 19.332 13.213 -27.640 1.00 13.42 H new ATOM 0 HD11 LEU A 108 17.211 14.267 -26.966 1.00 71.12 H new ATOM 0 HD12 LEU A 108 18.477 15.476 -27.285 1.00 71.12 H new ATOM 0 HD13 LEU A 108 17.194 15.194 -28.485 1.00 71.12 H new ATOM 0 HD21 LEU A 108 17.190 12.127 -28.194 1.00 74.32 H new ATOM 0 HD22 LEU A 108 17.173 12.971 -29.761 1.00 74.32 H new ATOM 0 HD23 LEU A 108 18.442 11.774 -29.408 1.00 74.32 H new ATOM 1754 N VAL A 109 22.245 15.147 -30.751 1.00 63.02 N ATOM 1755 CA VAL A 109 23.001 15.905 -31.740 1.00 2.13 C ATOM 1756 C VAL A 109 24.015 15.020 -32.454 1.00 34.11 C ATOM 1757 O VAL A 109 24.213 15.135 -33.663 1.00 14.05 O ATOM 1758 CB VAL A 109 23.738 17.094 -31.093 1.00 33.31 C ATOM 1759 CG1 VAL A 109 24.551 17.848 -32.135 1.00 43.05 C ATOM 1760 CG2 VAL A 109 22.750 18.020 -30.401 1.00 55.21 C ATOM 0 H VAL A 109 22.361 15.473 -29.791 1.00 63.02 H new ATOM 0 HA VAL A 109 22.281 16.284 -32.465 1.00 2.13 H new ATOM 0 HB VAL A 109 24.426 16.708 -30.340 1.00 33.31 H new ATOM 0 HG11 VAL A 109 25.065 18.684 -31.661 1.00 43.05 H new ATOM 0 HG12 VAL A 109 25.285 17.176 -32.580 1.00 43.05 H new ATOM 0 HG13 VAL A 109 23.886 18.225 -32.912 1.00 43.05 H new ATOM 0 HG21 VAL A 109 23.288 18.854 -29.950 1.00 55.21 H new ATOM 0 HG22 VAL A 109 22.036 18.401 -31.131 1.00 55.21 H new ATOM 0 HG23 VAL A 109 22.217 17.470 -29.626 1.00 55.21 H new ATOM 1770 N ALA A 110 24.656 14.134 -31.697 1.00 4.32 N ATOM 1771 CA ALA A 110 25.648 13.226 -32.258 1.00 13.30 C ATOM 1772 C ALA A 110 25.087 12.473 -33.459 1.00 74.52 C ATOM 1773 O ALA A 110 25.745 12.357 -34.492 1.00 21.20 O ATOM 1774 CB ALA A 110 26.128 12.248 -31.196 1.00 30.30 C ATOM 0 H ALA A 110 24.505 14.027 -30.694 1.00 4.32 H new ATOM 0 HA ALA A 110 26.496 13.820 -32.599 1.00 13.30 H new ATOM 0 HB1 ALA A 110 26.869 11.576 -31.629 1.00 30.30 H new ATOM 0 HB2 ALA A 110 26.577 12.799 -30.370 1.00 30.30 H new ATOM 0 HB3 ALA A 110 25.282 11.667 -30.827 1.00 30.30 H new ATOM 1780 N GLU A 111 23.868 11.963 -33.315 1.00 34.11 N ATOM 1781 CA GLU A 111 23.220 11.219 -34.389 1.00 51.33 C ATOM 1782 C GLU A 111 23.042 12.095 -35.626 1.00 44.12 C ATOM 1783 O GLU A 111 23.095 11.611 -36.757 1.00 63.23 O ATOM 1784 CB GLU A 111 21.862 10.689 -33.925 1.00 62.52 C ATOM 1785 CG GLU A 111 21.780 9.173 -33.889 1.00 33.21 C ATOM 1786 CD GLU A 111 20.596 8.670 -33.086 1.00 5.34 C ATOM 1787 OE1 GLU A 111 19.982 9.483 -32.363 1.00 61.41 O ATOM 1788 OE2 GLU A 111 20.283 7.465 -33.183 1.00 61.14 O ATOM 0 H GLU A 111 23.310 12.051 -32.466 1.00 34.11 H new ATOM 0 HA GLU A 111 23.860 10.376 -34.651 1.00 51.33 H new ATOM 0 HB2 GLU A 111 21.650 11.080 -32.930 1.00 62.52 H new ATOM 0 HB3 GLU A 111 21.086 11.071 -34.589 1.00 62.52 H new ATOM 0 HG2 GLU A 111 21.711 8.793 -34.908 1.00 33.21 H new ATOM 0 HG3 GLU A 111 22.700 8.773 -33.462 1.00 33.21 H new ATOM 1795 N THR A 112 22.828 13.388 -35.402 1.00 13.10 N ATOM 1796 CA THR A 112 22.640 14.331 -36.497 1.00 45.42 C ATOM 1797 C THR A 112 23.878 15.196 -36.697 1.00 15.45 C ATOM 1798 O THR A 112 23.790 16.321 -37.187 1.00 11.12 O ATOM 1799 CB THR A 112 21.425 15.246 -36.248 1.00 64.33 C ATOM 1800 OG1 THR A 112 20.430 14.544 -35.494 1.00 74.33 O ATOM 1801 CG2 THR A 112 20.828 15.723 -37.562 1.00 0.05 C ATOM 0 H THR A 112 22.781 13.805 -34.473 1.00 13.10 H new ATOM 0 HA THR A 112 22.464 13.740 -37.396 1.00 45.42 H new ATOM 0 HB THR A 112 21.763 16.115 -35.684 1.00 64.33 H new ATOM 0 HG1 THR A 112 19.662 15.132 -35.338 1.00 74.33 H new ATOM 0 HG21 THR A 112 19.972 16.367 -37.360 1.00 0.05 H new ATOM 0 HG22 THR A 112 21.579 16.282 -38.121 1.00 0.05 H new ATOM 0 HG23 THR A 112 20.505 14.863 -38.148 1.00 0.05 H new ATOM 1809 N GLY A 113 25.035 14.663 -36.316 1.00 54.15 N ATOM 1810 CA GLY A 113 26.277 15.400 -36.462 1.00 73.51 C ATOM 1811 C GLY A 113 27.367 14.575 -37.115 1.00 34.32 C ATOM 1812 O GLY A 113 28.555 14.844 -36.933 1.00 61.13 O ATOM 0 H GLY A 113 25.134 13.733 -35.909 1.00 54.15 H new ATOM 0 HA2 GLY A 113 26.097 16.295 -37.058 1.00 73.51 H new ATOM 0 HA3 GLY A 113 26.616 15.733 -35.481 1.00 73.51 H new ATOM 1816 N THR A 114 26.965 13.563 -37.879 1.00 4.51 N ATOM 1817 CA THR A 114 27.917 12.693 -38.560 1.00 43.22 C ATOM 1818 C THR A 114 27.738 12.759 -40.072 1.00 62.20 C ATOM 1819 O THR A 114 28.073 11.816 -40.787 1.00 2.24 O ATOM 1820 CB THR A 114 27.770 11.231 -38.100 1.00 22.50 C ATOM 1821 OG1 THR A 114 28.820 10.433 -38.657 1.00 1.32 O ATOM 1822 CG2 THR A 114 26.420 10.666 -38.518 1.00 52.05 C ATOM 0 H THR A 114 25.986 13.326 -38.042 1.00 4.51 H new ATOM 0 HA THR A 114 28.914 13.049 -38.299 1.00 43.22 H new ATOM 0 HB THR A 114 27.836 11.207 -37.012 1.00 22.50 H new ATOM 0 HG1 THR A 114 28.932 10.655 -39.605 1.00 1.32 H new ATOM 0 HG21 THR A 114 26.339 9.632 -38.182 1.00 52.05 H new ATOM 0 HG22 THR A 114 25.623 11.258 -38.068 1.00 52.05 H new ATOM 0 HG23 THR A 114 26.330 10.703 -39.604 1.00 52.05 H new ATOM 1830 N ALA A 115 27.209 13.880 -40.552 1.00 64.01 N ATOM 1831 CA ALA A 115 26.987 14.069 -41.980 1.00 10.33 C ATOM 1832 C ALA A 115 27.827 15.223 -42.518 1.00 51.10 C ATOM 1833 O ALA A 115 27.388 15.966 -43.396 1.00 74.24 O ATOM 1834 CB ALA A 115 25.511 14.314 -42.259 1.00 75.45 C ATOM 0 H ALA A 115 26.926 14.671 -39.973 1.00 64.01 H new ATOM 0 HA ALA A 115 27.295 13.158 -42.493 1.00 10.33 H new ATOM 0 HB1 ALA A 115 25.361 14.453 -43.330 1.00 75.45 H new ATOM 0 HB2 ALA A 115 24.929 13.457 -41.920 1.00 75.45 H new ATOM 0 HB3 ALA A 115 25.184 15.208 -41.728 1.00 75.45 H new ATOM 1840 N GLU A 116 29.036 15.368 -41.983 1.00 2.53 N ATOM 1841 CA GLU A 116 29.935 16.434 -42.409 1.00 40.11 C ATOM 1842 C GLU A 116 31.388 16.069 -42.116 1.00 3.32 C ATOM 1843 O GLU A 116 32.234 16.944 -41.928 1.00 72.43 O ATOM 1844 CB GLU A 116 29.576 17.746 -41.708 1.00 22.50 C ATOM 1845 CG GLU A 116 30.122 18.979 -42.407 1.00 43.53 C ATOM 1846 CD GLU A 116 30.805 19.937 -41.450 1.00 2.41 C ATOM 1847 OE1 GLU A 116 30.113 20.820 -40.901 1.00 53.11 O ATOM 1848 OE2 GLU A 116 32.031 19.805 -41.252 1.00 4.22 O ATOM 0 H GLU A 116 29.414 14.762 -41.255 1.00 2.53 H new ATOM 0 HA GLU A 116 29.820 16.563 -43.485 1.00 40.11 H new ATOM 0 HB2 GLU A 116 28.491 17.827 -41.641 1.00 22.50 H new ATOM 0 HB3 GLU A 116 29.957 17.719 -40.687 1.00 22.50 H new ATOM 0 HG2 GLU A 116 30.831 18.672 -43.176 1.00 43.53 H new ATOM 0 HG3 GLU A 116 29.307 19.496 -42.913 1.00 43.53 H new ATOM 1855 N LYS A 117 31.670 14.772 -42.078 1.00 21.14 N ATOM 1856 CA LYS A 117 33.020 14.289 -41.810 1.00 65.14 C ATOM 1857 C LYS A 117 33.324 13.041 -42.631 1.00 73.03 C ATOM 1858 O LYS A 117 33.693 12.002 -42.085 1.00 54.04 O ATOM 1859 CB LYS A 117 33.187 13.984 -40.318 1.00 4.34 C ATOM 1860 CG LYS A 117 33.148 15.222 -39.438 1.00 31.14 C ATOM 1861 CD LYS A 117 34.061 15.075 -38.232 1.00 41.42 C ATOM 1862 CE LYS A 117 33.294 15.244 -36.929 1.00 60.02 C ATOM 1863 NZ LYS A 117 33.988 14.585 -35.787 1.00 2.41 N ATOM 0 H LYS A 117 30.981 14.035 -42.230 1.00 21.14 H new ATOM 0 HA LYS A 117 33.723 15.071 -42.097 1.00 65.14 H new ATOM 0 HB2 LYS A 117 32.398 13.300 -40.005 1.00 4.34 H new ATOM 0 HB3 LYS A 117 34.135 13.469 -40.165 1.00 4.34 H new ATOM 0 HG2 LYS A 117 33.449 16.093 -40.020 1.00 31.14 H new ATOM 0 HG3 LYS A 117 32.126 15.400 -39.103 1.00 31.14 H new ATOM 0 HD2 LYS A 117 34.536 14.094 -38.251 1.00 41.42 H new ATOM 0 HD3 LYS A 117 34.858 15.816 -38.285 1.00 41.42 H new ATOM 0 HE2 LYS A 117 33.171 16.306 -36.715 1.00 60.02 H new ATOM 0 HE3 LYS A 117 32.295 14.823 -37.039 1.00 60.02 H new ATOM 0 HZ1 LYS A 117 33.434 14.723 -34.918 1.00 2.41 H new ATOM 0 HZ2 LYS A 117 34.083 13.567 -35.979 1.00 2.41 H new ATOM 0 HZ3 LYS A 117 34.932 15.004 -35.666 1.00 2.41 H new ATOM 1877 N MET A 118 33.168 13.150 -43.946 1.00 51.20 N ATOM 1878 CA MET A 118 33.430 12.031 -44.843 1.00 74.44 C ATOM 1879 C MET A 118 34.913 11.672 -44.848 1.00 40.34 C ATOM 1880 O MET A 118 35.785 12.535 -44.734 1.00 45.02 O ATOM 1881 CB MET A 118 32.971 12.368 -46.262 1.00 23.55 C ATOM 1882 CG MET A 118 33.813 13.440 -46.935 1.00 42.22 C ATOM 1883 SD MET A 118 32.986 14.184 -48.354 1.00 2.23 S ATOM 1884 CE MET A 118 34.113 13.741 -49.674 1.00 63.32 C ATOM 0 H MET A 118 32.861 14.003 -44.414 1.00 51.20 H new ATOM 0 HA MET A 118 32.867 11.170 -44.482 1.00 74.44 H new ATOM 0 HB2 MET A 118 32.998 11.463 -46.868 1.00 23.55 H new ATOM 0 HB3 MET A 118 31.933 12.700 -46.230 1.00 23.55 H new ATOM 0 HG2 MET A 118 34.052 14.218 -46.210 1.00 42.22 H new ATOM 0 HG3 MET A 118 34.759 13.004 -47.258 1.00 42.22 H new ATOM 0 HE1 MET A 118 33.737 14.132 -50.620 1.00 63.32 H new ATOM 0 HE2 MET A 118 35.096 14.166 -49.471 1.00 63.32 H new ATOM 0 HE3 MET A 118 34.192 12.656 -49.736 1.00 63.32 H new ATOM 1894 N PRO A 119 35.209 10.371 -44.981 1.00 61.55 N ATOM 1895 CA PRO A 119 36.586 9.871 -45.003 1.00 21.54 C ATOM 1896 C PRO A 119 37.327 10.270 -46.274 1.00 33.33 C ATOM 1897 O PRO A 119 36.744 10.309 -47.358 1.00 42.42 O ATOM 1898 CB PRO A 119 36.412 8.351 -44.940 1.00 0.23 C ATOM 1899 CG PRO A 119 35.058 8.101 -45.508 1.00 64.24 C ATOM 1900 CD PRO A 119 34.220 9.289 -45.120 1.00 35.34 C ATOM 0 HA PRO A 119 37.182 10.280 -44.187 1.00 21.54 H new ATOM 0 HB2 PRO A 119 37.183 7.840 -45.516 1.00 0.23 H new ATOM 0 HB3 PRO A 119 36.485 7.986 -43.915 1.00 0.23 H new ATOM 0 HG2 PRO A 119 35.103 7.993 -46.592 1.00 64.24 H new ATOM 0 HG3 PRO A 119 34.633 7.178 -45.113 1.00 64.24 H new ATOM 0 HD2 PRO A 119 33.474 9.521 -45.881 1.00 35.34 H new ATOM 0 HD3 PRO A 119 33.681 9.114 -44.189 1.00 35.34 H new ATOM 1908 N SER A 120 38.616 10.564 -46.134 1.00 12.15 N ATOM 1909 CA SER A 120 39.436 10.963 -47.272 1.00 14.23 C ATOM 1910 C SER A 120 40.186 9.766 -47.849 1.00 63.22 C ATOM 1911 O SER A 120 40.094 8.652 -47.332 1.00 42.04 O ATOM 1912 CB SER A 120 40.431 12.048 -46.856 1.00 65.45 C ATOM 1913 OG SER A 120 40.188 12.480 -45.527 1.00 24.43 O ATOM 0 H SER A 120 39.114 10.533 -45.245 1.00 12.15 H new ATOM 0 HA SER A 120 38.774 11.361 -48.041 1.00 14.23 H new ATOM 0 HB2 SER A 120 41.448 11.664 -46.937 1.00 65.45 H new ATOM 0 HB3 SER A 120 40.355 12.896 -47.537 1.00 65.45 H new ATOM 0 HG SER A 120 40.838 13.172 -45.284 1.00 24.43 H new ATOM 1919 N THR A 121 40.929 10.003 -48.925 1.00 20.22 N ATOM 1920 CA THR A 121 41.693 8.945 -49.575 1.00 55.30 C ATOM 1921 C THR A 121 43.002 8.682 -48.839 1.00 72.30 C ATOM 1922 O THR A 121 43.885 9.538 -48.799 1.00 71.24 O ATOM 1923 CB THR A 121 42.004 9.296 -51.042 1.00 12.42 C ATOM 1924 OG1 THR A 121 40.787 9.547 -51.754 1.00 1.42 O ATOM 1925 CG2 THR A 121 42.769 8.168 -51.718 1.00 41.22 C ATOM 0 H THR A 121 41.018 10.919 -49.365 1.00 20.22 H new ATOM 0 HA THR A 121 41.076 8.047 -49.547 1.00 55.30 H new ATOM 0 HB THR A 121 42.624 10.193 -51.054 1.00 12.42 H new ATOM 0 HG1 THR A 121 40.993 9.771 -52.685 1.00 1.42 H new ATOM 0 HG21 THR A 121 42.977 8.439 -52.753 1.00 41.22 H new ATOM 0 HG22 THR A 121 43.708 7.999 -51.191 1.00 41.22 H new ATOM 0 HG23 THR A 121 42.170 7.257 -51.695 1.00 41.22 H new ATOM 1933 N SER A 122 43.120 7.493 -48.257 1.00 32.21 N ATOM 1934 CA SER A 122 44.321 7.118 -47.519 1.00 30.33 C ATOM 1935 C SER A 122 44.449 5.601 -47.426 1.00 70.05 C ATOM 1936 O SER A 122 43.461 4.875 -47.539 1.00 54.24 O ATOM 1937 CB SER A 122 44.294 7.727 -46.117 1.00 71.21 C ATOM 1938 OG SER A 122 45.567 7.647 -45.501 1.00 30.04 O ATOM 0 H SER A 122 42.399 6.772 -48.282 1.00 32.21 H new ATOM 0 HA SER A 122 45.186 7.505 -48.058 1.00 30.33 H new ATOM 0 HB2 SER A 122 43.980 8.769 -46.176 1.00 71.21 H new ATOM 0 HB3 SER A 122 43.557 7.206 -45.505 1.00 71.21 H new ATOM 0 HG SER A 122 45.523 8.045 -44.606 1.00 30.04 H new ATOM 1944 N ARG A 123 45.674 5.128 -47.217 1.00 44.10 N ATOM 1945 CA ARG A 123 45.933 3.698 -47.108 1.00 43.31 C ATOM 1946 C ARG A 123 46.456 3.345 -45.719 1.00 34.41 C ATOM 1947 O ARG A 123 47.653 3.144 -45.512 1.00 1.23 O ATOM 1948 CB ARG A 123 46.941 3.259 -48.172 1.00 12.03 C ATOM 1949 CG ARG A 123 46.368 3.232 -49.579 1.00 13.24 C ATOM 1950 CD ARG A 123 47.264 2.454 -50.531 1.00 75.21 C ATOM 1951 NE ARG A 123 46.534 1.973 -51.701 1.00 62.43 N ATOM 1952 CZ ARG A 123 46.984 1.018 -52.507 1.00 3.34 C ATOM 1953 NH1 ARG A 123 48.156 0.446 -52.272 1.00 73.24 N ATOM 1954 NH2 ARG A 123 46.261 0.635 -53.552 1.00 72.54 N ATOM 0 H ARG A 123 46.502 5.715 -47.120 1.00 44.10 H new ATOM 0 HA ARG A 123 44.993 3.170 -47.268 1.00 43.31 H new ATOM 0 HB2 ARG A 123 47.797 3.934 -48.150 1.00 12.03 H new ATOM 0 HB3 ARG A 123 47.312 2.265 -47.921 1.00 12.03 H new ATOM 0 HG2 ARG A 123 45.376 2.780 -49.560 1.00 13.24 H new ATOM 0 HG3 ARG A 123 46.247 4.252 -49.943 1.00 13.24 H new ATOM 0 HD2 ARG A 123 48.088 3.090 -50.854 1.00 75.21 H new ATOM 0 HD3 ARG A 123 47.703 1.607 -50.004 1.00 75.21 H new ATOM 0 HE ARG A 123 45.629 2.394 -51.911 1.00 62.43 H new ATOM 0 HH11 ARG A 123 48.715 0.739 -51.471 1.00 73.24 H new ATOM 0 HH12 ARG A 123 48.499 -0.287 -52.893 1.00 73.24 H new ATOM 0 HH21 ARG A 123 45.359 1.074 -53.737 1.00 72.54 H new ATOM 0 HH22 ARG A 123 46.607 -0.098 -54.170 1.00 72.54 H new ATOM 1968 N PRO A 124 45.539 3.266 -44.743 1.00 32.15 N ATOM 1969 CA PRO A 124 45.885 2.936 -43.357 1.00 4.54 C ATOM 1970 C PRO A 124 46.321 1.484 -43.198 1.00 21.14 C ATOM 1971 O PRO A 124 46.326 0.716 -44.162 1.00 64.24 O ATOM 1972 CB PRO A 124 44.581 3.189 -42.597 1.00 24.45 C ATOM 1973 CG PRO A 124 43.508 3.018 -43.618 1.00 44.23 C ATOM 1974 CD PRO A 124 44.095 3.492 -44.918 1.00 11.45 C ATOM 0 HA PRO A 124 46.727 3.526 -42.995 1.00 4.54 H new ATOM 0 HB2 PRO A 124 44.460 2.485 -41.774 1.00 24.45 H new ATOM 0 HB3 PRO A 124 44.562 4.190 -42.166 1.00 24.45 H new ATOM 0 HG2 PRO A 124 43.197 1.975 -43.687 1.00 44.23 H new ATOM 0 HG3 PRO A 124 42.623 3.597 -43.355 1.00 44.23 H new ATOM 0 HD2 PRO A 124 43.700 2.931 -45.765 1.00 11.45 H new ATOM 0 HD3 PRO A 124 43.872 4.543 -45.100 1.00 11.45 H new ATOM 1982 N THR A 125 46.688 1.111 -41.976 1.00 20.12 N ATOM 1983 CA THR A 125 47.126 -0.249 -41.691 1.00 71.32 C ATOM 1984 C THR A 125 46.450 -0.794 -40.438 1.00 63.13 C ATOM 1985 O THR A 125 46.310 -0.088 -39.440 1.00 11.40 O ATOM 1986 CB THR A 125 48.654 -0.320 -41.508 1.00 2.13 C ATOM 1987 OG1 THR A 125 49.299 0.564 -42.431 1.00 52.24 O ATOM 1988 CG2 THR A 125 49.159 -1.739 -41.721 1.00 42.34 C ATOM 0 H THR A 125 46.690 1.733 -41.167 1.00 20.12 H new ATOM 0 HA THR A 125 46.841 -0.859 -42.548 1.00 71.32 H new ATOM 0 HB THR A 125 48.890 -0.016 -40.488 1.00 2.13 H new ATOM 0 HG1 THR A 125 50.270 0.514 -42.307 1.00 52.24 H new ATOM 0 HG21 THR A 125 50.240 -1.764 -41.587 1.00 42.34 H new ATOM 0 HG22 THR A 125 48.688 -2.405 -40.998 1.00 42.34 H new ATOM 0 HG23 THR A 125 48.911 -2.066 -42.731 1.00 42.34 H new ATOM 1996 N ALA A 126 46.033 -2.054 -40.497 1.00 24.10 N ATOM 1997 CA ALA A 126 45.373 -2.694 -39.365 1.00 41.03 C ATOM 1998 C ALA A 126 46.383 -3.085 -38.292 1.00 64.32 C ATOM 1999 O ALA A 126 47.532 -3.420 -38.578 1.00 12.14 O ATOM 2000 CB ALA A 126 44.594 -3.915 -39.829 1.00 20.35 C ATOM 0 H ALA A 126 46.140 -2.652 -41.316 1.00 24.10 H new ATOM 0 HA ALA A 126 44.677 -1.978 -38.929 1.00 41.03 H new ATOM 0 HB1 ALA A 126 44.107 -4.382 -38.973 1.00 20.35 H new ATOM 0 HB2 ALA A 126 43.840 -3.611 -40.555 1.00 20.35 H new ATOM 0 HB3 ALA A 126 45.277 -4.628 -40.292 1.00 20.35 H new ATOM 2006 N PRO A 127 45.947 -3.043 -37.023 1.00 23.23 N ATOM 2007 CA PRO A 127 46.797 -3.390 -35.881 1.00 12.35 C ATOM 2008 C PRO A 127 47.112 -4.880 -35.826 1.00 75.44 C ATOM 2009 O PRO A 127 46.597 -5.665 -36.623 1.00 1.54 O ATOM 2010 CB PRO A 127 45.953 -2.977 -34.673 1.00 55.43 C ATOM 2011 CG PRO A 127 44.545 -3.037 -35.155 1.00 53.31 C ATOM 2012 CD PRO A 127 44.589 -2.653 -36.608 1.00 24.43 C ATOM 0 HA PRO A 127 47.767 -2.896 -35.929 1.00 12.35 H new ATOM 0 HB2 PRO A 127 46.112 -3.650 -33.831 1.00 55.43 H new ATOM 0 HB3 PRO A 127 46.213 -1.974 -34.333 1.00 55.43 H new ATOM 0 HG2 PRO A 127 44.131 -4.037 -35.028 1.00 53.31 H new ATOM 0 HG3 PRO A 127 43.910 -2.355 -34.590 1.00 53.31 H new ATOM 0 HD2 PRO A 127 43.827 -3.176 -37.185 1.00 24.43 H new ATOM 0 HD3 PRO A 127 44.417 -1.586 -36.747 1.00 24.43 H new ATOM 2020 N SER A 128 47.962 -5.266 -34.879 1.00 71.35 N ATOM 2021 CA SER A 128 48.349 -6.663 -34.722 1.00 53.04 C ATOM 2022 C SER A 128 48.346 -7.065 -33.250 1.00 62.42 C ATOM 2023 O SER A 128 48.391 -6.214 -32.362 1.00 53.13 O ATOM 2024 CB SER A 128 49.736 -6.901 -35.323 1.00 24.24 C ATOM 2025 OG SER A 128 50.428 -5.678 -35.508 1.00 35.40 O ATOM 0 H SER A 128 48.396 -4.631 -34.209 1.00 71.35 H new ATOM 0 HA SER A 128 47.621 -7.277 -35.251 1.00 53.04 H new ATOM 0 HB2 SER A 128 50.313 -7.553 -34.667 1.00 24.24 H new ATOM 0 HB3 SER A 128 49.638 -7.415 -36.279 1.00 24.24 H new ATOM 0 HG SER A 128 51.312 -5.857 -35.891 1.00 35.40 H new ATOM 2031 N SER A 129 48.290 -8.370 -33.000 1.00 50.05 N ATOM 2032 CA SER A 129 48.276 -8.887 -31.636 1.00 24.25 C ATOM 2033 C SER A 129 48.495 -10.397 -31.626 1.00 43.23 C ATOM 2034 O SER A 129 48.228 -11.080 -32.613 1.00 4.45 O ATOM 2035 CB SER A 129 46.949 -8.547 -30.953 1.00 13.11 C ATOM 2036 OG SER A 129 47.138 -8.291 -29.573 1.00 40.14 O ATOM 0 H SER A 129 48.254 -9.088 -33.724 1.00 50.05 H new ATOM 0 HA SER A 129 49.090 -8.416 -31.086 1.00 24.25 H new ATOM 0 HB2 SER A 129 46.504 -7.674 -31.430 1.00 13.11 H new ATOM 0 HB3 SER A 129 46.249 -9.372 -31.081 1.00 13.11 H new ATOM 0 HG SER A 129 46.276 -8.075 -29.159 1.00 40.14 H new ATOM 2042 N GLU A 130 48.982 -10.910 -30.500 1.00 2.44 N ATOM 2043 CA GLU A 130 49.238 -12.338 -30.361 1.00 74.33 C ATOM 2044 C GLU A 130 48.978 -12.800 -28.930 1.00 43.02 C ATOM 2045 O GLU A 130 49.604 -12.319 -27.986 1.00 43.54 O ATOM 2046 CB GLU A 130 50.679 -12.662 -30.759 1.00 72.30 C ATOM 2047 CG GLU A 130 50.787 -13.678 -31.883 1.00 32.31 C ATOM 2048 CD GLU A 130 52.133 -14.377 -31.912 1.00 25.10 C ATOM 2049 OE1 GLU A 130 53.149 -13.720 -31.604 1.00 35.20 O ATOM 2050 OE2 GLU A 130 52.168 -15.581 -32.242 1.00 50.13 O ATOM 0 H GLU A 130 49.207 -10.358 -29.672 1.00 2.44 H new ATOM 0 HA GLU A 130 48.557 -12.869 -31.026 1.00 74.33 H new ATOM 0 HB2 GLU A 130 51.178 -11.742 -31.063 1.00 72.30 H new ATOM 0 HB3 GLU A 130 51.212 -13.040 -29.886 1.00 72.30 H new ATOM 0 HG2 GLU A 130 49.998 -14.422 -31.772 1.00 32.31 H new ATOM 0 HG3 GLU A 130 50.621 -13.178 -32.837 1.00 32.31 H new ATOM 2057 N LYS A 131 48.049 -13.738 -28.777 1.00 41.02 N ATOM 2058 CA LYS A 131 47.705 -14.267 -27.462 1.00 21.21 C ATOM 2059 C LYS A 131 48.274 -15.669 -27.275 1.00 51.03 C ATOM 2060 O LYS A 131 48.181 -16.512 -28.165 1.00 60.01 O ATOM 2061 CB LYS A 131 46.185 -14.294 -27.283 1.00 43.53 C ATOM 2062 CG LYS A 131 45.574 -12.921 -27.060 1.00 2.44 C ATOM 2063 CD LYS A 131 45.248 -12.237 -28.377 1.00 43.53 C ATOM 2064 CE LYS A 131 44.585 -10.886 -28.153 1.00 3.25 C ATOM 2065 NZ LYS A 131 43.279 -11.018 -27.451 1.00 43.31 N ATOM 0 H LYS A 131 47.521 -14.148 -29.547 1.00 41.02 H new ATOM 0 HA LYS A 131 48.142 -13.613 -26.708 1.00 21.21 H new ATOM 0 HB2 LYS A 131 45.732 -14.745 -28.166 1.00 43.53 H new ATOM 0 HB3 LYS A 131 45.939 -14.934 -26.436 1.00 43.53 H new ATOM 0 HG2 LYS A 131 44.666 -13.018 -26.464 1.00 2.44 H new ATOM 0 HG3 LYS A 131 46.266 -12.302 -26.489 1.00 2.44 H new ATOM 0 HD2 LYS A 131 46.162 -12.104 -28.955 1.00 43.53 H new ATOM 0 HD3 LYS A 131 44.588 -12.874 -28.966 1.00 43.53 H new ATOM 0 HE2 LYS A 131 45.248 -10.249 -27.569 1.00 3.25 H new ATOM 0 HE3 LYS A 131 44.433 -10.393 -29.113 1.00 3.25 H new ATOM 0 HZ1 LYS A 131 42.746 -10.130 -27.540 1.00 43.31 H new ATOM 0 HZ2 LYS A 131 42.733 -11.794 -27.877 1.00 43.31 H new ATOM 0 HZ3 LYS A 131 43.445 -11.223 -26.445 1.00 43.31 H new ATOM 2079 N GLY A 132 48.863 -15.912 -26.108 1.00 50.05 N ATOM 2080 CA GLY A 132 49.438 -17.214 -25.824 1.00 73.15 C ATOM 2081 C GLY A 132 49.331 -17.589 -24.358 1.00 3.15 C ATOM 2082 O GLY A 132 48.616 -16.940 -23.596 1.00 41.13 O ATOM 0 H GLY A 132 48.952 -15.231 -25.354 1.00 50.05 H new ATOM 0 HA2 GLY A 132 48.934 -17.969 -26.427 1.00 73.15 H new ATOM 0 HA3 GLY A 132 50.487 -17.217 -26.121 1.00 73.15 H new ATOM 2086 N GLY A 133 50.044 -18.639 -23.964 1.00 50.11 N ATOM 2087 CA GLY A 133 50.011 -19.081 -22.582 1.00 60.24 C ATOM 2088 C GLY A 133 50.914 -20.273 -22.333 1.00 73.34 C ATOM 2089 O GLY A 133 51.522 -20.804 -23.261 1.00 53.12 O ATOM 0 H GLY A 133 50.644 -19.192 -24.577 1.00 50.11 H new ATOM 0 HA2 GLY A 133 50.313 -18.259 -21.933 1.00 60.24 H new ATOM 0 HA3 GLY A 133 48.988 -19.341 -22.311 1.00 60.24 H new ATOM 2093 N ASN A 134 51.003 -20.694 -21.076 1.00 45.25 N ATOM 2094 CA ASN A 134 51.840 -21.829 -20.706 1.00 30.12 C ATOM 2095 C ASN A 134 51.045 -23.132 -20.758 1.00 5.52 C ATOM 2096 O ASN A 134 49.817 -23.124 -20.674 1.00 30.42 O ATOM 2097 CB ASN A 134 52.419 -21.628 -19.305 1.00 71.13 C ATOM 2098 CG ASN A 134 51.359 -21.242 -18.290 1.00 34.52 C ATOM 2099 OD1 ASN A 134 51.077 -19.949 -18.194 1.00 63.13 O flip ATOM 2100 ND2 ASN A 134 50.802 -22.098 -17.603 1.00 65.40 N flip ATOM 0 H ASN A 134 50.505 -20.266 -20.296 1.00 45.25 H new ATOM 0 HA ASN A 134 52.658 -21.894 -21.424 1.00 30.12 H new ATOM 0 HB2 ASN A 134 52.909 -22.546 -18.982 1.00 71.13 H new ATOM 0 HB3 ASN A 134 53.185 -20.853 -19.339 1.00 71.13 H new ATOM 0 HD21 ASN A 134 51.052 -23.081 -17.712 1.00 65.40 H new ATOM 0 HD22 ASN A 134 50.091 -21.824 -16.925 1.00 65.40 H new ATOM 2107 N TYR A 135 51.755 -24.245 -20.897 1.00 62.53 N ATOM 2108 CA TYR A 135 51.116 -25.555 -20.962 1.00 41.31 C ATOM 2109 C TYR A 135 51.491 -26.405 -19.751 1.00 11.52 C ATOM 2110 O TYR A 135 52.618 -26.886 -19.645 1.00 51.33 O ATOM 2111 CB TYR A 135 51.515 -26.277 -22.249 1.00 13.32 C ATOM 2112 CG TYR A 135 50.340 -26.835 -23.020 1.00 53.53 C ATOM 2113 CD1 TYR A 135 49.446 -27.714 -22.421 1.00 11.22 C ATOM 2114 CD2 TYR A 135 50.123 -26.482 -24.346 1.00 32.32 C ATOM 2115 CE1 TYR A 135 48.371 -28.226 -23.122 1.00 72.04 C ATOM 2116 CE2 TYR A 135 49.051 -26.988 -25.054 1.00 32.41 C ATOM 2117 CZ TYR A 135 48.178 -27.861 -24.438 1.00 35.34 C ATOM 2118 OH TYR A 135 47.108 -28.369 -25.138 1.00 12.23 O ATOM 0 H TYR A 135 52.772 -24.268 -20.967 1.00 62.53 H new ATOM 0 HA TYR A 135 50.036 -25.405 -20.957 1.00 41.31 H new ATOM 0 HB2 TYR A 135 52.063 -25.585 -22.889 1.00 13.32 H new ATOM 0 HB3 TYR A 135 52.197 -27.091 -22.003 1.00 13.32 H new ATOM 0 HD1 TYR A 135 49.594 -28.002 -21.391 1.00 11.22 H new ATOM 0 HD2 TYR A 135 50.805 -25.800 -24.832 1.00 32.32 H new ATOM 0 HE1 TYR A 135 47.685 -28.909 -22.642 1.00 72.04 H new ATOM 0 HE2 TYR A 135 48.897 -26.702 -26.084 1.00 32.41 H new ATOM 0 HH TYR A 135 47.115 -28.012 -26.051 1.00 12.23 H new TER 2128 TYR A 135