USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 878 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 78 HIS : no HD1:sc= -0.14 X(o=-0.95,f=-1.3) USER MOD Set 1.2: A 82 GLN : amide:sc= -0.807 X(o=-0.95,f=-1.3) USER MOD Set 2.1: A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 41 MET CE :methyl -111:sc= -0.293 (180deg=-1.76!) USER MOD Single : A 1 GLY N :NH3+ 147:sc= 0.0511 (180deg=0) USER MOD Single : A 2 SER OG : rot 21:sc= 0.0531 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.334 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 HIS : no HD1:sc= -0.0737 X(o=-0.074,f=-0.0063) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 21 MET CE :methyl 149:sc= -0.189 (180deg=-1.25) USER MOD Single : A 22 LYS NZ :NH3+ -129:sc=-0.00412 (180deg=-0.685) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 ASN : amide:sc= -0.282 X(o=-0.28,f=-0.47) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -105:sc= 1.22 USER MOD Single : A 57 CYS SG : rot 54:sc= -0.318 USER MOD Single : A 62 ASN : amide:sc= -0.384 K(o=-0.38,f=-2.3!) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 71 ASN : amide:sc= -1.88 X(o=-1.9,f=-2.3!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HE2:sc= -3.62 X(o=-3.6,f=-3.2!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 94 HIS : no HD1:sc= -0.41 X(o=-0.41,f=-0.41) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -107:sc= -1.29 (180deg=-4.89!) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.662 18.971 -14.610 1.00 0.00 N ATOM 2 CA GLY A 1 -0.402 17.890 -15.542 1.00 0.00 C ATOM 3 C GLY A 1 -0.816 16.539 -14.994 1.00 0.00 C ATOM 4 O GLY A 1 -0.948 16.367 -13.782 1.00 0.00 O ATOM 0 H1 GLY A 1 0.067 19.705 -14.718 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.598 19.381 -14.806 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.642 18.603 -13.637 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.937 18.080 -16.473 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.661 17.870 -15.783 1.00 0.00 H new ATOM 8 N SER A 2 -1.023 15.577 -15.887 1.00 0.00 N ATOM 9 CA SER A 2 -1.430 14.236 -15.486 1.00 0.00 C ATOM 10 C SER A 2 -0.786 13.182 -16.382 1.00 0.00 C ATOM 11 O SER A 2 -0.903 13.236 -17.606 1.00 0.00 O ATOM 12 CB SER A 2 -2.953 14.105 -15.540 1.00 0.00 C ATOM 13 OG SER A 2 -3.553 14.636 -14.371 1.00 0.00 O ATOM 0 H SER A 2 -0.915 15.702 -16.894 1.00 0.00 H new ATOM 0 HA SER A 2 -1.094 14.072 -14.462 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.335 14.627 -16.418 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.227 13.056 -15.649 1.00 0.00 H new ATOM 0 HG SER A 2 -2.931 15.256 -13.937 1.00 0.00 H new ATOM 19 N SER A 3 -0.105 12.223 -15.762 1.00 0.00 N ATOM 20 CA SER A 3 0.562 11.158 -16.501 1.00 0.00 C ATOM 21 C SER A 3 0.097 9.788 -16.019 1.00 0.00 C ATOM 22 O SER A 3 0.166 9.479 -14.830 1.00 0.00 O ATOM 23 CB SER A 3 2.080 11.276 -16.350 1.00 0.00 C ATOM 24 OG SER A 3 2.728 10.087 -16.766 1.00 0.00 O ATOM 0 H SER A 3 -0.001 12.162 -14.749 1.00 0.00 H new ATOM 0 HA SER A 3 0.300 11.262 -17.554 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.443 12.117 -16.940 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.330 11.485 -15.310 1.00 0.00 H new ATOM 0 HG SER A 3 3.697 10.189 -16.661 1.00 0.00 H new ATOM 30 N GLY A 4 -0.379 8.969 -16.952 1.00 0.00 N ATOM 31 CA GLY A 4 -0.849 7.641 -16.603 1.00 0.00 C ATOM 32 C GLY A 4 -0.318 6.573 -17.539 1.00 0.00 C ATOM 33 O GLY A 4 0.257 5.579 -17.095 1.00 0.00 O ATOM 0 H GLY A 4 -0.447 9.201 -17.943 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.546 7.408 -15.582 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.939 7.628 -16.623 1.00 0.00 H new ATOM 37 N SER A 5 -0.512 6.778 -18.838 1.00 0.00 N ATOM 38 CA SER A 5 -0.053 5.822 -19.839 1.00 0.00 C ATOM 39 C SER A 5 0.147 6.503 -21.189 1.00 0.00 C ATOM 40 O SER A 5 -0.613 7.396 -21.565 1.00 0.00 O ATOM 41 CB SER A 5 -1.055 4.674 -19.977 1.00 0.00 C ATOM 42 OG SER A 5 -1.330 4.083 -18.719 1.00 0.00 O ATOM 0 H SER A 5 -0.984 7.597 -19.222 1.00 0.00 H new ATOM 0 HA SER A 5 0.905 5.420 -19.509 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.980 5.046 -20.418 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.658 3.921 -20.657 1.00 0.00 H new ATOM 0 HG SER A 5 -1.974 3.353 -18.834 1.00 0.00 H new ATOM 48 N SER A 6 1.175 6.075 -21.915 1.00 0.00 N ATOM 49 CA SER A 6 1.479 6.645 -23.222 1.00 0.00 C ATOM 50 C SER A 6 0.614 6.010 -24.306 1.00 0.00 C ATOM 51 O SER A 6 0.792 4.843 -24.654 1.00 0.00 O ATOM 52 CB SER A 6 2.959 6.451 -23.556 1.00 0.00 C ATOM 53 OG SER A 6 3.252 6.912 -24.863 1.00 0.00 O ATOM 0 H SER A 6 1.812 5.335 -21.620 1.00 0.00 H new ATOM 0 HA SER A 6 1.260 7.712 -23.185 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.572 6.988 -22.832 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.218 5.396 -23.473 1.00 0.00 H new ATOM 0 HG SER A 6 4.204 6.778 -25.051 1.00 0.00 H new ATOM 59 N GLY A 7 -0.326 6.787 -24.837 1.00 0.00 N ATOM 60 CA GLY A 7 -1.205 6.284 -25.876 1.00 0.00 C ATOM 61 C GLY A 7 -2.670 6.423 -25.512 1.00 0.00 C ATOM 62 O GLY A 7 -3.033 7.243 -24.670 1.00 0.00 O ATOM 0 H GLY A 7 -0.494 7.756 -24.566 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.011 6.822 -26.804 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.978 5.234 -26.063 1.00 0.00 H new ATOM 66 N ASN A 8 -3.515 5.620 -26.151 1.00 0.00 N ATOM 67 CA ASN A 8 -4.950 5.658 -25.891 1.00 0.00 C ATOM 68 C ASN A 8 -5.428 4.344 -25.283 1.00 0.00 C ATOM 69 O ASN A 8 -6.037 4.328 -24.214 1.00 0.00 O ATOM 70 CB ASN A 8 -5.716 5.943 -27.185 1.00 0.00 C ATOM 71 CG ASN A 8 -5.759 7.421 -27.518 1.00 0.00 C ATOM 72 OD1 ASN A 8 -6.773 8.087 -27.307 1.00 0.00 O ATOM 73 ND2 ASN A 8 -4.656 7.943 -28.042 1.00 0.00 N ATOM 0 H ASN A 8 -3.231 4.936 -26.852 1.00 0.00 H new ATOM 0 HA ASN A 8 -5.144 6.459 -25.178 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -5.248 5.402 -28.007 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -6.734 5.565 -27.092 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -4.627 8.933 -28.287 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -3.838 7.354 -28.200 1.00 0.00 H new ATOM 80 N GLY A 9 -5.147 3.242 -25.971 1.00 0.00 N ATOM 81 CA GLY A 9 -5.556 1.938 -25.483 1.00 0.00 C ATOM 82 C GLY A 9 -4.752 1.493 -24.277 1.00 0.00 C ATOM 83 O GLY A 9 -5.316 1.067 -23.270 1.00 0.00 O ATOM 0 H GLY A 9 -4.643 3.229 -26.858 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -6.614 1.967 -25.221 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.445 1.204 -26.281 1.00 0.00 H new ATOM 87 N GLY A 10 -3.430 1.590 -24.380 1.00 0.00 N ATOM 88 CA GLY A 10 -2.569 1.188 -23.282 1.00 0.00 C ATOM 89 C GLY A 10 -2.887 -0.205 -22.776 1.00 0.00 C ATOM 90 O GLY A 10 -3.531 -0.363 -21.738 1.00 0.00 O ATOM 0 H GLY A 10 -2.940 1.939 -25.203 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -1.529 1.224 -23.607 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.672 1.901 -22.464 1.00 0.00 H new ATOM 94 N ILE A 11 -2.437 -1.216 -23.510 1.00 0.00 N ATOM 95 CA ILE A 11 -2.678 -2.603 -23.129 1.00 0.00 C ATOM 96 C ILE A 11 -2.160 -2.884 -21.723 1.00 0.00 C ATOM 97 O ILE A 11 -1.132 -2.357 -21.296 1.00 0.00 O ATOM 98 CB ILE A 11 -2.013 -3.581 -24.115 1.00 0.00 C ATOM 99 CG1 ILE A 11 -0.494 -3.397 -24.104 1.00 0.00 C ATOM 100 CG2 ILE A 11 -2.566 -3.378 -25.518 1.00 0.00 C ATOM 101 CD1 ILE A 11 0.253 -4.496 -24.826 1.00 0.00 C ATOM 0 H ILE A 11 -1.904 -1.102 -24.372 1.00 0.00 H new ATOM 0 HA ILE A 11 -3.757 -2.755 -23.153 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.239 -4.600 -23.800 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -0.249 -2.440 -24.564 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -0.149 -3.352 -23.071 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.086 -4.077 -26.203 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.642 -3.555 -25.514 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -2.367 -2.357 -25.843 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.324 -4.300 -24.778 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.038 -5.454 -24.353 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.064 -4.527 -25.869 1.00 0.00 H new ATOM 113 N PRO A 12 -2.885 -3.738 -20.985 1.00 0.00 N ATOM 114 CA PRO A 12 -2.516 -4.112 -19.617 1.00 0.00 C ATOM 115 C PRO A 12 -1.265 -4.982 -19.570 1.00 0.00 C ATOM 116 O PRO A 12 -0.931 -5.659 -20.543 1.00 0.00 O ATOM 117 CB PRO A 12 -3.733 -4.899 -19.124 1.00 0.00 C ATOM 118 CG PRO A 12 -4.365 -5.434 -20.362 1.00 0.00 C ATOM 119 CD PRO A 12 -4.120 -4.404 -21.430 1.00 0.00 C ATOM 0 HA PRO A 12 -2.278 -3.240 -19.007 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -3.438 -5.704 -18.451 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -4.422 -4.259 -18.573 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -3.930 -6.394 -20.639 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -5.433 -5.598 -20.216 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -3.998 -4.863 -22.411 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -4.950 -3.701 -21.508 1.00 0.00 H new ATOM 127 N HIS A 13 -0.575 -4.959 -18.434 1.00 0.00 N ATOM 128 CA HIS A 13 0.640 -5.747 -18.261 1.00 0.00 C ATOM 129 C HIS A 13 0.311 -7.232 -18.139 1.00 0.00 C ATOM 130 O HIS A 13 -0.766 -7.603 -17.672 1.00 0.00 O ATOM 131 CB HIS A 13 1.405 -5.278 -17.023 1.00 0.00 C ATOM 132 CG HIS A 13 1.963 -3.894 -17.152 1.00 0.00 C ATOM 133 ND1 HIS A 13 3.314 -3.621 -17.125 1.00 0.00 N ATOM 134 CD2 HIS A 13 1.343 -2.701 -17.311 1.00 0.00 C ATOM 135 CE1 HIS A 13 3.501 -2.321 -17.260 1.00 0.00 C ATOM 136 NE2 HIS A 13 2.321 -1.740 -17.375 1.00 0.00 N ATOM 0 H HIS A 13 -0.837 -4.403 -17.620 1.00 0.00 H new ATOM 0 HA HIS A 13 1.266 -5.603 -19.141 1.00 0.00 H new ATOM 0 HB2 HIS A 13 0.740 -5.314 -16.160 1.00 0.00 H new ATOM 0 HB3 HIS A 13 2.221 -5.973 -16.826 1.00 0.00 H new ATOM 0 HD2 HIS A 13 0.278 -2.536 -17.375 1.00 0.00 H new ATOM 0 HE1 HIS A 13 4.457 -1.818 -17.274 1.00 0.00 H new ATOM 0 HE2 HIS A 13 2.162 -0.739 -17.492 1.00 0.00 H new ATOM 145 N ASP A 14 1.246 -8.076 -18.562 1.00 0.00 N ATOM 146 CA ASP A 14 1.056 -9.521 -18.499 1.00 0.00 C ATOM 147 C ASP A 14 1.956 -10.142 -17.436 1.00 0.00 C ATOM 148 O ASP A 14 1.475 -10.709 -16.456 1.00 0.00 O ATOM 149 CB ASP A 14 1.343 -10.154 -19.862 1.00 0.00 C ATOM 150 CG ASP A 14 0.415 -9.641 -20.946 1.00 0.00 C ATOM 151 OD1 ASP A 14 0.295 -8.406 -21.088 1.00 0.00 O ATOM 152 OD2 ASP A 14 -0.192 -10.474 -21.651 1.00 0.00 O ATOM 0 H ASP A 14 2.142 -7.785 -18.952 1.00 0.00 H new ATOM 0 HA ASP A 14 0.018 -9.715 -18.228 1.00 0.00 H new ATOM 0 HB2 ASP A 14 2.375 -9.948 -20.145 1.00 0.00 H new ATOM 0 HB3 ASP A 14 1.243 -11.237 -19.785 1.00 0.00 H new ATOM 157 N ASN A 15 3.265 -10.031 -17.638 1.00 0.00 N ATOM 158 CA ASN A 15 4.233 -10.584 -16.698 1.00 0.00 C ATOM 159 C ASN A 15 3.932 -10.124 -15.274 1.00 0.00 C ATOM 160 O ASN A 15 3.923 -10.927 -14.340 1.00 0.00 O ATOM 161 CB ASN A 15 5.652 -10.167 -17.090 1.00 0.00 C ATOM 162 CG ASN A 15 6.091 -10.778 -18.407 1.00 0.00 C ATOM 163 OD1 ASN A 15 6.136 -12.000 -18.552 1.00 0.00 O ATOM 164 ND2 ASN A 15 6.417 -9.928 -19.374 1.00 0.00 N ATOM 0 H ASN A 15 3.680 -9.563 -18.444 1.00 0.00 H new ATOM 0 HA ASN A 15 4.157 -11.671 -16.735 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.702 -9.081 -17.162 1.00 0.00 H new ATOM 0 HB3 ASN A 15 6.346 -10.466 -16.304 1.00 0.00 H new ATOM 0 HD21 ASN A 15 6.720 -10.280 -20.282 1.00 0.00 H new ATOM 0 HD22 ASN A 15 6.365 -8.923 -19.209 1.00 0.00 H new ATOM 171 N LEU A 16 3.684 -8.829 -15.117 1.00 0.00 N ATOM 172 CA LEU A 16 3.381 -8.262 -13.807 1.00 0.00 C ATOM 173 C LEU A 16 1.876 -8.230 -13.562 1.00 0.00 C ATOM 174 O LEU A 16 1.090 -8.025 -14.487 1.00 0.00 O ATOM 175 CB LEU A 16 3.957 -6.849 -13.696 1.00 0.00 C ATOM 176 CG LEU A 16 5.414 -6.752 -13.243 1.00 0.00 C ATOM 177 CD1 LEU A 16 5.918 -5.322 -13.370 1.00 0.00 C ATOM 178 CD2 LEU A 16 5.562 -7.246 -11.812 1.00 0.00 C ATOM 0 H LEU A 16 3.687 -8.152 -15.880 1.00 0.00 H new ATOM 0 HA LEU A 16 3.840 -8.896 -13.049 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.867 -6.364 -14.668 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.342 -6.281 -12.998 1.00 0.00 H new ATOM 0 HG LEU A 16 6.019 -7.388 -13.890 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.957 -5.272 -13.043 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.849 -5.003 -14.410 1.00 0.00 H new ATOM 0 HD13 LEU A 16 5.310 -4.665 -12.748 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.606 -7.170 -11.507 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.945 -6.637 -11.151 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.241 -8.286 -11.751 1.00 0.00 H new ATOM 190 N VAL A 17 1.480 -8.434 -12.310 1.00 0.00 N ATOM 191 CA VAL A 17 0.070 -8.426 -11.942 1.00 0.00 C ATOM 192 C VAL A 17 -0.399 -7.018 -11.592 1.00 0.00 C ATOM 193 O VAL A 17 0.086 -6.409 -10.638 1.00 0.00 O ATOM 194 CB VAL A 17 -0.204 -9.358 -10.747 1.00 0.00 C ATOM 195 CG1 VAL A 17 -1.661 -9.262 -10.318 1.00 0.00 C ATOM 196 CG2 VAL A 17 0.164 -10.792 -11.095 1.00 0.00 C ATOM 0 H VAL A 17 2.117 -8.607 -11.533 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.485 -8.786 -12.808 1.00 0.00 H new ATOM 0 HB VAL A 17 0.418 -9.040 -9.910 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.836 -9.927 -9.473 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -1.887 -8.237 -10.026 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.305 -9.553 -11.148 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.036 -11.437 -10.239 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.430 -11.124 -11.946 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.223 -10.844 -11.349 1.00 0.00 H new ATOM 206 N LEU A 18 -1.346 -6.505 -12.370 1.00 0.00 N ATOM 207 CA LEU A 18 -1.882 -5.168 -12.143 1.00 0.00 C ATOM 208 C LEU A 18 -3.139 -5.224 -11.281 1.00 0.00 C ATOM 209 O LEU A 18 -3.959 -6.133 -11.420 1.00 0.00 O ATOM 210 CB LEU A 18 -2.195 -4.489 -13.478 1.00 0.00 C ATOM 211 CG LEU A 18 -2.669 -3.037 -13.397 1.00 0.00 C ATOM 212 CD1 LEU A 18 -1.498 -2.108 -13.119 1.00 0.00 C ATOM 213 CD2 LEU A 18 -3.377 -2.635 -14.683 1.00 0.00 C ATOM 0 H LEU A 18 -1.758 -6.995 -13.164 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.127 -4.586 -11.614 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.300 -4.524 -14.099 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.961 -5.072 -13.989 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.378 -2.952 -12.573 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.855 -1.079 -13.065 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -1.034 -2.381 -12.172 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.765 -2.196 -13.921 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.708 -1.599 -14.608 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -2.690 -2.737 -15.523 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.241 -3.281 -14.840 1.00 0.00 H new ATOM 225 N ILE A 19 -3.286 -4.247 -10.393 1.00 0.00 N ATOM 226 CA ILE A 19 -4.445 -4.184 -9.511 1.00 0.00 C ATOM 227 C ILE A 19 -5.258 -2.919 -9.762 1.00 0.00 C ATOM 228 O ILE A 19 -4.795 -1.809 -9.499 1.00 0.00 O ATOM 229 CB ILE A 19 -4.028 -4.228 -8.029 1.00 0.00 C ATOM 230 CG1 ILE A 19 -3.162 -5.459 -7.756 1.00 0.00 C ATOM 231 CG2 ILE A 19 -5.257 -4.229 -7.133 1.00 0.00 C ATOM 232 CD1 ILE A 19 -3.936 -6.758 -7.776 1.00 0.00 C ATOM 0 H ILE A 19 -2.617 -3.488 -10.265 1.00 0.00 H new ATOM 0 HA ILE A 19 -5.058 -5.057 -9.733 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.440 -3.338 -7.806 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.368 -5.507 -8.501 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.681 -5.347 -6.784 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.946 -4.260 -6.089 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.838 -3.324 -7.312 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.869 -5.103 -7.356 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.259 -7.588 -7.575 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -4.713 -6.730 -7.012 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.395 -6.893 -8.755 1.00 0.00 H new ATOM 244 N ARG A 20 -6.474 -3.094 -10.270 1.00 0.00 N ATOM 245 CA ARG A 20 -7.352 -1.967 -10.556 1.00 0.00 C ATOM 246 C ARG A 20 -8.599 -2.013 -9.678 1.00 0.00 C ATOM 247 O ARG A 20 -9.364 -2.976 -9.719 1.00 0.00 O ATOM 248 CB ARG A 20 -7.755 -1.968 -12.032 1.00 0.00 C ATOM 249 CG ARG A 20 -6.715 -1.344 -12.947 1.00 0.00 C ATOM 250 CD ARG A 20 -7.111 -1.471 -14.410 1.00 0.00 C ATOM 251 NE ARG A 20 -6.905 -2.825 -14.917 1.00 0.00 N ATOM 252 CZ ARG A 20 -7.538 -3.317 -15.976 1.00 0.00 C ATOM 253 NH1 ARG A 20 -8.412 -2.571 -16.636 1.00 0.00 N ATOM 254 NH2 ARG A 20 -7.297 -4.559 -16.376 1.00 0.00 N ATOM 0 H ARG A 20 -6.873 -4.006 -10.492 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.807 -1.049 -10.336 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.937 -2.995 -12.350 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.695 -1.428 -12.144 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.590 -0.291 -12.693 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.751 -1.827 -12.787 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -8.159 -1.196 -14.527 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -6.528 -0.768 -15.006 1.00 0.00 H new ATOM 0 HE ARG A 20 -6.239 -3.426 -14.431 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -8.600 -1.616 -16.331 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -8.896 -2.952 -17.449 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -6.625 -5.136 -15.870 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.783 -4.936 -17.189 1.00 0.00 H new ATOM 268 N MET A 21 -8.796 -0.966 -8.883 1.00 0.00 N ATOM 269 CA MET A 21 -9.950 -0.888 -7.995 1.00 0.00 C ATOM 270 C MET A 21 -10.344 0.564 -7.743 1.00 0.00 C ATOM 271 O MET A 21 -9.598 1.487 -8.071 1.00 0.00 O ATOM 272 CB MET A 21 -9.648 -1.585 -6.667 1.00 0.00 C ATOM 273 CG MET A 21 -8.513 -0.941 -5.888 1.00 0.00 C ATOM 274 SD MET A 21 -8.289 -1.672 -4.255 1.00 0.00 S ATOM 275 CE MET A 21 -6.641 -2.354 -4.412 1.00 0.00 C ATOM 0 H MET A 21 -8.172 -0.161 -8.836 1.00 0.00 H new ATOM 0 HA MET A 21 -10.785 -1.394 -8.480 1.00 0.00 H new ATOM 0 HB2 MET A 21 -10.548 -1.582 -6.052 1.00 0.00 H new ATOM 0 HB3 MET A 21 -9.398 -2.628 -6.862 1.00 0.00 H new ATOM 0 HG2 MET A 21 -7.587 -1.038 -6.455 1.00 0.00 H new ATOM 0 HG3 MET A 21 -8.711 0.126 -5.780 1.00 0.00 H new ATOM 0 HE1 MET A 21 -6.146 -2.336 -3.441 1.00 0.00 H new ATOM 0 HE2 MET A 21 -6.705 -3.382 -4.768 1.00 0.00 H new ATOM 0 HE3 MET A 21 -6.067 -1.759 -5.123 1.00 0.00 H new ATOM 285 N LYS A 22 -11.521 0.760 -7.158 1.00 0.00 N ATOM 286 CA LYS A 22 -12.014 2.100 -6.860 1.00 0.00 C ATOM 287 C LYS A 22 -12.173 2.299 -5.356 1.00 0.00 C ATOM 288 O LYS A 22 -12.380 1.351 -4.598 1.00 0.00 O ATOM 289 CB LYS A 22 -13.353 2.340 -7.561 1.00 0.00 C ATOM 290 CG LYS A 22 -13.304 2.111 -9.062 1.00 0.00 C ATOM 291 CD LYS A 22 -14.611 2.504 -9.729 1.00 0.00 C ATOM 292 CE LYS A 22 -14.599 3.962 -10.162 1.00 0.00 C ATOM 293 NZ LYS A 22 -15.121 4.862 -9.097 1.00 0.00 N ATOM 0 H LYS A 22 -12.151 0.008 -6.881 1.00 0.00 H new ATOM 0 HA LYS A 22 -11.283 2.820 -7.229 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -14.104 1.681 -7.126 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -13.676 3.363 -7.368 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -12.486 2.689 -9.493 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -13.093 1.061 -9.264 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -14.784 1.867 -10.596 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -15.438 2.335 -9.039 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -13.581 4.256 -10.419 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -15.202 4.078 -11.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -15.855 5.482 -9.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -15.529 4.291 -8.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -14.344 5.442 -8.721 1.00 0.00 H new ATOM 307 N PRO A 23 -12.074 3.561 -4.912 1.00 0.00 N ATOM 308 CA PRO A 23 -12.206 3.914 -3.495 1.00 0.00 C ATOM 309 C PRO A 23 -13.633 3.742 -2.985 1.00 0.00 C ATOM 310 O PRO A 23 -14.538 4.471 -3.388 1.00 0.00 O ATOM 311 CB PRO A 23 -11.799 5.389 -3.458 1.00 0.00 C ATOM 312 CG PRO A 23 -12.083 5.895 -4.830 1.00 0.00 C ATOM 313 CD PRO A 23 -11.828 4.740 -5.758 1.00 0.00 C ATOM 0 HA PRO A 23 -11.597 3.273 -2.857 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -12.368 5.938 -2.708 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -10.745 5.503 -3.204 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -13.113 6.242 -4.913 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -11.441 6.741 -5.075 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -12.495 4.762 -6.620 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -10.809 4.752 -6.144 1.00 0.00 H new ATOM 321 N ASP A 24 -13.825 2.774 -2.096 1.00 0.00 N ATOM 322 CA ASP A 24 -15.142 2.507 -1.529 1.00 0.00 C ATOM 323 C ASP A 24 -15.771 3.787 -0.989 1.00 0.00 C ATOM 324 O ASP A 24 -15.160 4.855 -1.031 1.00 0.00 O ATOM 325 CB ASP A 24 -15.039 1.465 -0.414 1.00 0.00 C ATOM 326 CG ASP A 24 -16.367 0.794 -0.124 1.00 0.00 C ATOM 327 OD1 ASP A 24 -16.760 -0.103 -0.898 1.00 0.00 O ATOM 328 OD2 ASP A 24 -17.015 1.167 0.877 1.00 0.00 O ATOM 0 H ASP A 24 -13.086 2.161 -1.752 1.00 0.00 H new ATOM 0 HA ASP A 24 -15.780 2.117 -2.322 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -14.307 0.708 -0.695 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -14.671 1.944 0.494 1.00 0.00 H new ATOM 333 N GLU A 25 -16.995 3.672 -0.484 1.00 0.00 N ATOM 334 CA GLU A 25 -17.707 4.822 0.062 1.00 0.00 C ATOM 335 C GLU A 25 -16.811 5.618 1.007 1.00 0.00 C ATOM 336 O GLU A 25 -16.629 6.823 0.839 1.00 0.00 O ATOM 337 CB GLU A 25 -18.967 4.366 0.800 1.00 0.00 C ATOM 338 CG GLU A 25 -19.657 5.479 1.571 1.00 0.00 C ATOM 339 CD GLU A 25 -20.989 5.047 2.153 1.00 0.00 C ATOM 340 OE1 GLU A 25 -20.989 4.410 3.227 1.00 0.00 O ATOM 341 OE2 GLU A 25 -22.031 5.346 1.534 1.00 0.00 O ATOM 0 H GLU A 25 -17.514 2.795 -0.441 1.00 0.00 H new ATOM 0 HA GLU A 25 -17.994 5.467 -0.768 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -19.668 3.946 0.079 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -18.703 3.566 1.492 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -19.005 5.816 2.377 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -19.813 6.331 0.910 1.00 0.00 H new ATOM 348 N ASN A 26 -16.254 4.934 2.001 1.00 0.00 N ATOM 349 CA ASN A 26 -15.377 5.576 2.974 1.00 0.00 C ATOM 350 C ASN A 26 -13.945 5.646 2.454 1.00 0.00 C ATOM 351 O ASN A 26 -12.990 5.632 3.229 1.00 0.00 O ATOM 352 CB ASN A 26 -15.413 4.818 4.303 1.00 0.00 C ATOM 353 CG ASN A 26 -16.607 5.201 5.155 1.00 0.00 C ATOM 354 OD1 ASN A 26 -17.616 4.497 5.182 1.00 0.00 O ATOM 355 ND2 ASN A 26 -16.496 6.323 5.858 1.00 0.00 N ATOM 0 H ASN A 26 -16.394 3.935 2.154 1.00 0.00 H new ATOM 0 HA ASN A 26 -15.736 6.593 3.134 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -15.439 3.746 4.106 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -14.496 5.018 4.857 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -17.267 6.632 6.451 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -15.640 6.875 5.805 1.00 0.00 H new ATOM 362 N GLY A 27 -13.804 5.722 1.134 1.00 0.00 N ATOM 363 CA GLY A 27 -12.485 5.793 0.532 1.00 0.00 C ATOM 364 C GLY A 27 -11.518 4.793 1.133 1.00 0.00 C ATOM 365 O GLY A 27 -10.398 5.146 1.501 1.00 0.00 O ATOM 0 H GLY A 27 -14.579 5.736 0.471 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.568 5.614 -0.540 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.086 6.800 0.657 1.00 0.00 H new ATOM 369 N ARG A 28 -11.952 3.541 1.235 1.00 0.00 N ATOM 370 CA ARG A 28 -11.118 2.486 1.798 1.00 0.00 C ATOM 371 C ARG A 28 -11.015 1.303 0.840 1.00 0.00 C ATOM 372 O ARG A 28 -12.003 0.617 0.575 1.00 0.00 O ATOM 373 CB ARG A 28 -11.685 2.021 3.141 1.00 0.00 C ATOM 374 CG ARG A 28 -13.055 1.371 3.031 1.00 0.00 C ATOM 375 CD ARG A 28 -13.872 1.577 4.297 1.00 0.00 C ATOM 376 NE ARG A 28 -13.376 0.766 5.406 1.00 0.00 N ATOM 377 CZ ARG A 28 -13.576 1.068 6.684 1.00 0.00 C ATOM 378 NH1 ARG A 28 -14.258 2.157 7.013 1.00 0.00 N ATOM 379 NH2 ARG A 28 -13.093 0.280 7.637 1.00 0.00 N ATOM 0 H ARG A 28 -12.877 3.232 0.935 1.00 0.00 H new ATOM 0 HA ARG A 28 -10.119 2.892 1.954 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -10.991 1.312 3.593 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.751 2.876 3.814 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -13.590 1.790 2.179 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -12.939 0.304 2.841 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -13.846 2.630 4.578 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -14.914 1.325 4.101 1.00 0.00 H new ATOM 0 HE ARG A 28 -12.847 -0.078 5.187 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -14.631 2.765 6.284 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -14.410 2.386 7.995 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -12.568 -0.558 7.388 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -13.247 0.513 8.618 1.00 0.00 H new ATOM 393 N PHE A 29 -9.814 1.071 0.322 1.00 0.00 N ATOM 394 CA PHE A 29 -9.582 -0.028 -0.608 1.00 0.00 C ATOM 395 C PHE A 29 -9.999 -1.360 0.008 1.00 0.00 C ATOM 396 O PHE A 29 -10.827 -2.082 -0.547 1.00 0.00 O ATOM 397 CB PHE A 29 -8.107 -0.080 -1.012 1.00 0.00 C ATOM 398 CG PHE A 29 -7.557 1.249 -1.444 1.00 0.00 C ATOM 399 CD1 PHE A 29 -7.776 1.721 -2.728 1.00 0.00 C ATOM 400 CD2 PHE A 29 -6.820 2.027 -0.565 1.00 0.00 C ATOM 401 CE1 PHE A 29 -7.271 2.944 -3.128 1.00 0.00 C ATOM 402 CE2 PHE A 29 -6.313 3.251 -0.959 1.00 0.00 C ATOM 403 CZ PHE A 29 -6.538 3.709 -2.243 1.00 0.00 C ATOM 0 H PHE A 29 -8.986 1.629 0.530 1.00 0.00 H new ATOM 0 HA PHE A 29 -10.189 0.147 -1.496 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -7.521 -0.451 -0.171 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.986 -0.796 -1.825 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -8.348 1.126 -3.425 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.640 1.673 0.439 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -7.450 3.301 -4.132 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -5.742 3.849 -0.264 1.00 0.00 H new ATOM 0 HZ PHE A 29 -6.141 4.664 -2.554 1.00 0.00 H new ATOM 413 N GLY A 30 -9.418 -1.680 1.161 1.00 0.00 N ATOM 414 CA GLY A 30 -9.741 -2.924 1.834 1.00 0.00 C ATOM 415 C GLY A 30 -8.562 -3.876 1.890 1.00 0.00 C ATOM 416 O GLY A 30 -8.700 -5.064 1.600 1.00 0.00 O ATOM 0 H GLY A 30 -8.730 -1.100 1.640 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.078 -2.708 2.848 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.571 -3.408 1.318 1.00 0.00 H new ATOM 420 N PHE A 31 -7.399 -3.353 2.263 1.00 0.00 N ATOM 421 CA PHE A 31 -6.190 -4.164 2.354 1.00 0.00 C ATOM 422 C PHE A 31 -5.102 -3.432 3.134 1.00 0.00 C ATOM 423 O PHE A 31 -5.060 -2.203 3.157 1.00 0.00 O ATOM 424 CB PHE A 31 -5.681 -4.516 0.954 1.00 0.00 C ATOM 425 CG PHE A 31 -4.897 -3.411 0.306 1.00 0.00 C ATOM 426 CD1 PHE A 31 -5.540 -2.416 -0.412 1.00 0.00 C ATOM 427 CD2 PHE A 31 -3.516 -3.368 0.415 1.00 0.00 C ATOM 428 CE1 PHE A 31 -4.821 -1.399 -1.010 1.00 0.00 C ATOM 429 CE2 PHE A 31 -2.791 -2.353 -0.181 1.00 0.00 C ATOM 430 CZ PHE A 31 -3.445 -1.366 -0.893 1.00 0.00 C ATOM 0 H PHE A 31 -7.268 -2.371 2.507 1.00 0.00 H new ATOM 0 HA PHE A 31 -6.437 -5.083 2.885 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -5.055 -5.406 1.017 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -6.531 -4.768 0.320 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -6.616 -2.435 -0.505 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -3.000 -4.136 0.972 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -5.334 -0.630 -1.569 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.715 -2.332 -0.090 1.00 0.00 H new ATOM 0 HZ PHE A 31 -2.881 -0.570 -1.357 1.00 0.00 H new ATOM 440 N ASN A 32 -4.223 -4.199 3.772 1.00 0.00 N ATOM 441 CA ASN A 32 -3.135 -3.624 4.554 1.00 0.00 C ATOM 442 C ASN A 32 -1.780 -4.013 3.970 1.00 0.00 C ATOM 443 O ASN A 32 -1.675 -4.968 3.199 1.00 0.00 O ATOM 444 CB ASN A 32 -3.226 -4.087 6.010 1.00 0.00 C ATOM 445 CG ASN A 32 -4.506 -3.629 6.683 1.00 0.00 C ATOM 446 OD1 ASN A 32 -4.977 -2.516 6.453 1.00 0.00 O ATOM 447 ND2 ASN A 32 -5.074 -4.489 7.520 1.00 0.00 N ATOM 0 H ASN A 32 -4.243 -5.219 3.763 1.00 0.00 H new ATOM 0 HA ASN A 32 -3.229 -2.539 4.517 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -3.168 -5.175 6.047 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -2.370 -3.703 6.565 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -5.937 -4.237 8.003 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -4.648 -5.402 7.680 1.00 0.00 H new ATOM 454 N VAL A 33 -0.745 -3.267 4.342 1.00 0.00 N ATOM 455 CA VAL A 33 0.604 -3.534 3.856 1.00 0.00 C ATOM 456 C VAL A 33 1.595 -3.626 5.010 1.00 0.00 C ATOM 457 O VAL A 33 1.337 -3.130 6.107 1.00 0.00 O ATOM 458 CB VAL A 33 1.074 -2.443 2.876 1.00 0.00 C ATOM 459 CG1 VAL A 33 0.218 -2.451 1.618 1.00 0.00 C ATOM 460 CG2 VAL A 33 1.042 -1.077 3.544 1.00 0.00 C ATOM 0 H VAL A 33 -0.814 -2.473 4.978 1.00 0.00 H new ATOM 0 HA VAL A 33 0.569 -4.490 3.334 1.00 0.00 H new ATOM 0 HB VAL A 33 2.103 -2.657 2.588 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.565 -1.674 0.937 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.297 -3.422 1.130 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.822 -2.263 1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.377 -0.318 2.837 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.024 -0.852 3.863 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.702 -1.081 4.412 1.00 0.00 H new ATOM 470 N LYS A 34 2.733 -4.264 4.757 1.00 0.00 N ATOM 471 CA LYS A 34 3.766 -4.421 5.773 1.00 0.00 C ATOM 472 C LYS A 34 5.155 -4.430 5.141 1.00 0.00 C ATOM 473 O LYS A 34 5.334 -4.907 4.022 1.00 0.00 O ATOM 474 CB LYS A 34 3.544 -5.714 6.561 1.00 0.00 C ATOM 475 CG LYS A 34 3.741 -6.972 5.733 1.00 0.00 C ATOM 476 CD LYS A 34 4.007 -8.182 6.611 1.00 0.00 C ATOM 477 CE LYS A 34 4.150 -9.451 5.785 1.00 0.00 C ATOM 478 NZ LYS A 34 5.519 -9.590 5.215 1.00 0.00 N ATOM 0 H LYS A 34 2.963 -4.681 3.855 1.00 0.00 H new ATOM 0 HA LYS A 34 3.702 -3.572 6.454 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.230 -5.736 7.408 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.533 -5.712 6.969 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.854 -7.151 5.125 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.575 -6.829 5.046 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.916 -8.020 7.190 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.192 -8.301 7.324 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.926 -10.317 6.408 1.00 0.00 H new ATOM 0 HE3 LYS A 34 3.419 -9.442 4.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 5.576 -10.467 4.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 5.723 -8.776 4.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 6.215 -9.624 5.987 1.00 0.00 H new ATOM 492 N GLY A 35 6.134 -3.900 5.867 1.00 0.00 N ATOM 493 CA GLY A 35 7.494 -3.858 5.361 1.00 0.00 C ATOM 494 C GLY A 35 7.784 -2.591 4.583 1.00 0.00 C ATOM 495 O GLY A 35 6.867 -1.881 4.174 1.00 0.00 O ATOM 0 H GLY A 35 6.010 -3.499 6.797 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.191 -3.936 6.195 1.00 0.00 H new ATOM 0 HA3 GLY A 35 7.667 -4.722 4.719 1.00 0.00 H new ATOM 499 N GLY A 36 9.067 -2.304 4.378 1.00 0.00 N ATOM 500 CA GLY A 36 9.453 -1.112 3.646 1.00 0.00 C ATOM 501 C GLY A 36 10.939 -0.831 3.738 1.00 0.00 C ATOM 502 O GLY A 36 11.637 -1.409 4.572 1.00 0.00 O ATOM 0 H GLY A 36 9.845 -2.876 4.706 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.172 -1.225 2.599 1.00 0.00 H new ATOM 0 HA3 GLY A 36 8.900 -0.256 4.034 1.00 0.00 H new ATOM 506 N TYR A 37 11.426 0.056 2.878 1.00 0.00 N ATOM 507 CA TYR A 37 12.841 0.410 2.863 1.00 0.00 C ATOM 508 C TYR A 37 13.374 0.585 4.282 1.00 0.00 C ATOM 509 O TYR A 37 14.490 0.170 4.593 1.00 0.00 O ATOM 510 CB TYR A 37 13.059 1.694 2.062 1.00 0.00 C ATOM 511 CG TYR A 37 14.454 2.261 2.195 1.00 0.00 C ATOM 512 CD1 TYR A 37 14.779 3.124 3.234 1.00 0.00 C ATOM 513 CD2 TYR A 37 15.448 1.934 1.280 1.00 0.00 C ATOM 514 CE1 TYR A 37 16.052 3.645 3.359 1.00 0.00 C ATOM 515 CE2 TYR A 37 16.724 2.449 1.398 1.00 0.00 C ATOM 516 CZ TYR A 37 17.022 3.304 2.439 1.00 0.00 C ATOM 517 OH TYR A 37 18.292 3.821 2.559 1.00 0.00 O ATOM 0 H TYR A 37 10.862 0.543 2.182 1.00 0.00 H new ATOM 0 HA TYR A 37 13.388 -0.404 2.387 1.00 0.00 H new ATOM 0 HB2 TYR A 37 12.856 1.495 1.010 1.00 0.00 H new ATOM 0 HB3 TYR A 37 12.338 2.443 2.390 1.00 0.00 H new ATOM 0 HD1 TYR A 37 14.023 3.392 3.957 1.00 0.00 H new ATOM 0 HD2 TYR A 37 15.219 1.266 0.463 1.00 0.00 H new ATOM 0 HE1 TYR A 37 16.287 4.316 4.172 1.00 0.00 H new ATOM 0 HE2 TYR A 37 17.485 2.184 0.679 1.00 0.00 H new ATOM 0 HH TYR A 37 18.854 3.481 1.832 1.00 0.00 H new ATOM 527 N ASP A 38 12.566 1.201 5.138 1.00 0.00 N ATOM 528 CA ASP A 38 12.954 1.430 6.525 1.00 0.00 C ATOM 529 C ASP A 38 13.508 0.155 7.152 1.00 0.00 C ATOM 530 O ASP A 38 14.489 0.193 7.895 1.00 0.00 O ATOM 531 CB ASP A 38 11.758 1.934 7.334 1.00 0.00 C ATOM 532 CG ASP A 38 11.866 1.584 8.806 1.00 0.00 C ATOM 533 OD1 ASP A 38 12.455 2.382 9.564 1.00 0.00 O ATOM 534 OD2 ASP A 38 11.361 0.512 9.198 1.00 0.00 O ATOM 0 H ASP A 38 11.639 1.551 4.896 1.00 0.00 H new ATOM 0 HA ASP A 38 13.737 2.188 6.538 1.00 0.00 H new ATOM 0 HB2 ASP A 38 11.679 3.016 7.225 1.00 0.00 H new ATOM 0 HB3 ASP A 38 10.842 1.506 6.928 1.00 0.00 H new ATOM 539 N GLN A 39 12.872 -0.972 6.849 1.00 0.00 N ATOM 540 CA GLN A 39 13.301 -2.258 7.385 1.00 0.00 C ATOM 541 C GLN A 39 13.982 -3.097 6.309 1.00 0.00 C ATOM 542 O GLN A 39 13.849 -4.321 6.283 1.00 0.00 O ATOM 543 CB GLN A 39 12.105 -3.019 7.960 1.00 0.00 C ATOM 544 CG GLN A 39 11.708 -2.565 9.356 1.00 0.00 C ATOM 545 CD GLN A 39 10.956 -3.632 10.126 1.00 0.00 C ATOM 546 OE1 GLN A 39 11.491 -4.705 10.406 1.00 0.00 O ATOM 547 NE2 GLN A 39 9.708 -3.343 10.473 1.00 0.00 N ATOM 0 H GLN A 39 12.058 -1.020 6.236 1.00 0.00 H new ATOM 0 HA GLN A 39 14.020 -2.069 8.182 1.00 0.00 H new ATOM 0 HB2 GLN A 39 11.253 -2.898 7.292 1.00 0.00 H new ATOM 0 HB3 GLN A 39 12.341 -4.083 7.986 1.00 0.00 H new ATOM 0 HG2 GLN A 39 12.603 -2.285 9.911 1.00 0.00 H new ATOM 0 HG3 GLN A 39 11.088 -1.672 9.281 1.00 0.00 H new ATOM 0 HE21 GLN A 39 9.304 -2.441 10.220 1.00 0.00 H new ATOM 0 HE22 GLN A 39 9.153 -4.023 10.993 1.00 0.00 H new ATOM 556 N LYS A 40 14.713 -2.431 5.421 1.00 0.00 N ATOM 557 CA LYS A 40 15.417 -3.114 4.342 1.00 0.00 C ATOM 558 C LYS A 40 14.623 -4.321 3.853 1.00 0.00 C ATOM 559 O LYS A 40 15.188 -5.383 3.594 1.00 0.00 O ATOM 560 CB LYS A 40 16.804 -3.558 4.811 1.00 0.00 C ATOM 561 CG LYS A 40 17.847 -2.455 4.755 1.00 0.00 C ATOM 562 CD LYS A 40 18.470 -2.347 3.373 1.00 0.00 C ATOM 563 CE LYS A 40 19.653 -3.292 3.220 1.00 0.00 C ATOM 564 NZ LYS A 40 20.402 -3.042 1.957 1.00 0.00 N ATOM 0 H LYS A 40 14.833 -1.418 5.428 1.00 0.00 H new ATOM 0 HA LYS A 40 15.527 -2.414 3.514 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.732 -3.926 5.834 1.00 0.00 H new ATOM 0 HB3 LYS A 40 17.137 -4.393 4.194 1.00 0.00 H new ATOM 0 HG2 LYS A 40 17.387 -1.504 5.023 1.00 0.00 H new ATOM 0 HG3 LYS A 40 18.626 -2.651 5.492 1.00 0.00 H new ATOM 0 HD2 LYS A 40 17.720 -2.575 2.616 1.00 0.00 H new ATOM 0 HD3 LYS A 40 18.797 -1.322 3.199 1.00 0.00 H new ATOM 0 HE2 LYS A 40 20.325 -3.174 4.070 1.00 0.00 H new ATOM 0 HE3 LYS A 40 19.299 -4.323 3.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 21.200 -3.705 1.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 19.768 -3.179 1.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 20.762 -2.066 1.954 1.00 0.00 H new ATOM 578 N MET A 41 13.311 -4.150 3.729 1.00 0.00 N ATOM 579 CA MET A 41 12.441 -5.226 3.269 1.00 0.00 C ATOM 580 C MET A 41 11.346 -4.687 2.353 1.00 0.00 C ATOM 581 O MET A 41 10.945 -3.526 2.444 1.00 0.00 O ATOM 582 CB MET A 41 11.813 -5.950 4.462 1.00 0.00 C ATOM 583 CG MET A 41 10.616 -5.223 5.052 1.00 0.00 C ATOM 584 SD MET A 41 9.652 -6.263 6.166 1.00 0.00 S ATOM 585 CE MET A 41 8.707 -7.231 4.992 1.00 0.00 C ATOM 0 H MET A 41 12.827 -3.277 3.940 1.00 0.00 H new ATOM 0 HA MET A 41 13.048 -5.933 2.703 1.00 0.00 H new ATOM 0 HB2 MET A 41 11.504 -6.948 4.150 1.00 0.00 H new ATOM 0 HB3 MET A 41 12.568 -6.078 5.237 1.00 0.00 H new ATOM 0 HG2 MET A 41 10.961 -4.341 5.592 1.00 0.00 H new ATOM 0 HG3 MET A 41 9.975 -4.871 4.244 1.00 0.00 H new ATOM 0 HE1 MET A 41 7.657 -6.945 5.047 1.00 0.00 H new ATOM 0 HE2 MET A 41 9.081 -7.048 3.985 1.00 0.00 H new ATOM 0 HE3 MET A 41 8.807 -8.290 5.229 1.00 0.00 H new ATOM 595 N PRO A 42 10.852 -5.546 1.450 1.00 0.00 N ATOM 596 CA PRO A 42 9.797 -5.177 0.501 1.00 0.00 C ATOM 597 C PRO A 42 8.450 -4.967 1.185 1.00 0.00 C ATOM 598 O PRO A 42 8.235 -5.422 2.309 1.00 0.00 O ATOM 599 CB PRO A 42 9.735 -6.378 -0.445 1.00 0.00 C ATOM 600 CG PRO A 42 10.249 -7.522 0.360 1.00 0.00 C ATOM 601 CD PRO A 42 11.283 -6.944 1.286 1.00 0.00 C ATOM 0 HA PRO A 42 10.011 -4.233 -0.000 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.716 -6.561 -0.787 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.345 -6.214 -1.334 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.444 -7.997 0.921 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.685 -8.287 -0.283 1.00 0.00 H new ATOM 0 HD2 PRO A 42 11.308 -7.471 2.240 1.00 0.00 H new ATOM 0 HD3 PRO A 42 12.284 -7.008 0.860 1.00 0.00 H new ATOM 609 N VAL A 43 7.544 -4.277 0.499 1.00 0.00 N ATOM 610 CA VAL A 43 6.217 -4.009 1.039 1.00 0.00 C ATOM 611 C VAL A 43 5.202 -5.028 0.535 1.00 0.00 C ATOM 612 O VAL A 43 4.680 -4.903 -0.573 1.00 0.00 O ATOM 613 CB VAL A 43 5.735 -2.594 0.668 1.00 0.00 C ATOM 614 CG1 VAL A 43 4.366 -2.320 1.270 1.00 0.00 C ATOM 615 CG2 VAL A 43 6.745 -1.551 1.124 1.00 0.00 C ATOM 0 H VAL A 43 7.705 -3.893 -0.432 1.00 0.00 H new ATOM 0 HA VAL A 43 6.296 -4.085 2.123 1.00 0.00 H new ATOM 0 HB VAL A 43 5.647 -2.532 -0.417 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.043 -1.316 0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.649 -3.048 0.890 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.423 -2.400 2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.389 -0.557 0.854 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.867 -1.611 2.205 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.704 -1.737 0.640 1.00 0.00 H new ATOM 625 N ILE A 44 4.926 -6.036 1.355 1.00 0.00 N ATOM 626 CA ILE A 44 3.972 -7.076 0.992 1.00 0.00 C ATOM 627 C ILE A 44 2.673 -6.928 1.777 1.00 0.00 C ATOM 628 O ILE A 44 2.681 -6.535 2.943 1.00 0.00 O ATOM 629 CB ILE A 44 4.551 -8.482 1.240 1.00 0.00 C ATOM 630 CG1 ILE A 44 5.750 -8.733 0.322 1.00 0.00 C ATOM 631 CG2 ILE A 44 3.480 -9.541 1.022 1.00 0.00 C ATOM 632 CD1 ILE A 44 7.072 -8.324 0.932 1.00 0.00 C ATOM 0 H ILE A 44 5.350 -6.155 2.275 1.00 0.00 H new ATOM 0 HA ILE A 44 3.766 -6.959 -0.072 1.00 0.00 H new ATOM 0 HB ILE A 44 4.890 -8.542 2.274 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.788 -9.792 0.068 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.605 -8.187 -0.610 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.904 -10.529 1.201 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.654 -9.370 1.712 1.00 0.00 H new ATOM 0 HG23 ILE A 44 3.114 -9.483 -0.003 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.877 -8.530 0.227 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.053 -7.258 1.160 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.240 -8.888 1.849 1.00 0.00 H new ATOM 644 N VAL A 45 1.557 -7.249 1.129 1.00 0.00 N ATOM 645 CA VAL A 45 0.249 -7.154 1.767 1.00 0.00 C ATOM 646 C VAL A 45 0.245 -7.858 3.120 1.00 0.00 C ATOM 647 O VAL A 45 0.784 -8.956 3.261 1.00 0.00 O ATOM 648 CB VAL A 45 -0.853 -7.764 0.880 1.00 0.00 C ATOM 649 CG1 VAL A 45 -2.192 -7.740 1.601 1.00 0.00 C ATOM 650 CG2 VAL A 45 -0.939 -7.024 -0.446 1.00 0.00 C ATOM 0 H VAL A 45 1.533 -7.577 0.163 1.00 0.00 H new ATOM 0 HA VAL A 45 0.043 -6.093 1.912 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.597 -8.803 0.674 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -2.959 -8.175 0.959 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -2.119 -8.318 2.522 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.459 -6.710 1.839 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.722 -7.468 -1.060 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.172 -5.975 -0.263 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.016 -7.098 -0.967 1.00 0.00 H new ATOM 660 N SER A 46 -0.367 -7.219 4.111 1.00 0.00 N ATOM 661 CA SER A 46 -0.438 -7.782 5.455 1.00 0.00 C ATOM 662 C SER A 46 -1.729 -8.573 5.644 1.00 0.00 C ATOM 663 O SER A 46 -1.701 -9.782 5.877 1.00 0.00 O ATOM 664 CB SER A 46 -0.350 -6.670 6.502 1.00 0.00 C ATOM 665 OG SER A 46 -0.103 -7.203 7.792 1.00 0.00 O ATOM 0 H SER A 46 -0.821 -6.311 4.009 1.00 0.00 H new ATOM 0 HA SER A 46 0.406 -8.460 5.584 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.446 -5.975 6.233 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.280 -6.101 6.512 1.00 0.00 H new ATOM 0 HG SER A 46 -0.049 -6.472 8.443 1.00 0.00 H new ATOM 671 N ARG A 47 -2.860 -7.882 5.542 1.00 0.00 N ATOM 672 CA ARG A 47 -4.161 -8.518 5.703 1.00 0.00 C ATOM 673 C ARG A 47 -5.193 -7.889 4.772 1.00 0.00 C ATOM 674 O ARG A 47 -5.082 -6.719 4.405 1.00 0.00 O ATOM 675 CB ARG A 47 -4.632 -8.405 7.154 1.00 0.00 C ATOM 676 CG ARG A 47 -5.905 -9.184 7.444 1.00 0.00 C ATOM 677 CD ARG A 47 -5.605 -10.638 7.774 1.00 0.00 C ATOM 678 NE ARG A 47 -5.259 -10.820 9.182 1.00 0.00 N ATOM 679 CZ ARG A 47 -5.359 -11.981 9.819 1.00 0.00 C ATOM 680 NH1 ARG A 47 -5.791 -13.058 9.177 1.00 0.00 N ATOM 681 NH2 ARG A 47 -5.026 -12.067 11.100 1.00 0.00 N ATOM 0 H ARG A 47 -2.901 -6.881 5.349 1.00 0.00 H new ATOM 0 HA ARG A 47 -4.057 -9.571 5.443 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.840 -8.761 7.813 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.797 -7.354 7.393 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.434 -8.722 8.278 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -6.568 -9.135 6.580 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.473 -11.251 7.532 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.783 -10.989 7.150 1.00 0.00 H new ATOM 0 HE ARG A 47 -4.922 -10.011 9.704 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -6.047 -12.996 8.192 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -5.867 -13.949 9.669 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -4.693 -11.241 11.597 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -5.103 -12.959 11.588 1.00 0.00 H new ATOM 695 N VAL A 48 -6.197 -8.673 4.392 1.00 0.00 N ATOM 696 CA VAL A 48 -7.249 -8.193 3.504 1.00 0.00 C ATOM 697 C VAL A 48 -8.626 -8.609 4.008 1.00 0.00 C ATOM 698 O VAL A 48 -8.869 -9.783 4.283 1.00 0.00 O ATOM 699 CB VAL A 48 -7.058 -8.722 2.070 1.00 0.00 C ATOM 700 CG1 VAL A 48 -8.124 -8.155 1.145 1.00 0.00 C ATOM 701 CG2 VAL A 48 -5.665 -8.387 1.560 1.00 0.00 C ATOM 0 H VAL A 48 -6.304 -9.644 4.686 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.182 -7.105 3.494 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.164 -9.807 2.085 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.973 -8.540 0.136 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -9.110 -8.451 1.502 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.054 -7.067 1.133 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.547 -8.768 0.546 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.528 -7.306 1.559 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.920 -8.847 2.209 1.00 0.00 H new ATOM 711 N ALA A 49 -9.525 -7.637 4.128 1.00 0.00 N ATOM 712 CA ALA A 49 -10.879 -7.902 4.597 1.00 0.00 C ATOM 713 C ALA A 49 -11.847 -8.047 3.427 1.00 0.00 C ATOM 714 O ALA A 49 -11.712 -7.391 2.394 1.00 0.00 O ATOM 715 CB ALA A 49 -11.340 -6.794 5.532 1.00 0.00 C ATOM 0 H ALA A 49 -9.339 -6.659 3.907 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.869 -8.844 5.145 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.353 -7.005 5.875 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.670 -6.740 6.390 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -11.327 -5.842 5.002 1.00 0.00 H new ATOM 721 N PRO A 50 -12.847 -8.926 3.590 1.00 0.00 N ATOM 722 CA PRO A 50 -13.856 -9.177 2.558 1.00 0.00 C ATOM 723 C PRO A 50 -14.798 -7.992 2.368 1.00 0.00 C ATOM 724 O PRO A 50 -14.728 -7.008 3.102 1.00 0.00 O ATOM 725 CB PRO A 50 -14.622 -10.387 3.098 1.00 0.00 C ATOM 726 CG PRO A 50 -14.437 -10.325 4.574 1.00 0.00 C ATOM 727 CD PRO A 50 -13.069 -9.742 4.796 1.00 0.00 C ATOM 0 HA PRO A 50 -13.406 -9.342 1.579 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.677 -10.340 2.829 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.230 -11.318 2.689 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.205 -9.706 5.038 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.515 -11.317 5.019 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -13.032 -9.138 5.703 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -12.313 -10.520 4.900 1.00 0.00 H new ATOM 735 N GLY A 51 -15.679 -8.095 1.377 1.00 0.00 N ATOM 736 CA GLY A 51 -16.622 -7.025 1.109 1.00 0.00 C ATOM 737 C GLY A 51 -15.935 -5.703 0.832 1.00 0.00 C ATOM 738 O GLY A 51 -16.382 -4.653 1.295 1.00 0.00 O ATOM 0 H GLY A 51 -15.756 -8.900 0.755 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -17.241 -7.296 0.253 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.291 -6.912 1.962 1.00 0.00 H new ATOM 742 N THR A 52 -14.843 -5.752 0.074 1.00 0.00 N ATOM 743 CA THR A 52 -14.091 -4.549 -0.261 1.00 0.00 C ATOM 744 C THR A 52 -13.735 -4.520 -1.743 1.00 0.00 C ATOM 745 O THR A 52 -13.597 -5.556 -2.394 1.00 0.00 O ATOM 746 CB THR A 52 -12.798 -4.446 0.569 1.00 0.00 C ATOM 747 OG1 THR A 52 -11.973 -5.593 0.336 1.00 0.00 O ATOM 748 CG2 THR A 52 -13.114 -4.334 2.052 1.00 0.00 C ATOM 0 H THR A 52 -14.460 -6.612 -0.319 1.00 0.00 H new ATOM 0 HA THR A 52 -14.732 -3.699 -0.027 1.00 0.00 H new ATOM 0 HB THR A 52 -12.265 -3.547 0.259 1.00 0.00 H new ATOM 0 HG1 THR A 52 -12.022 -6.193 1.109 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.185 -4.263 2.618 1.00 0.00 H new ATOM 0 HG22 THR A 52 -13.716 -3.443 2.229 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.668 -5.216 2.374 1.00 0.00 H new ATOM 756 N PRO A 53 -13.581 -3.305 -2.291 1.00 0.00 N ATOM 757 CA PRO A 53 -13.237 -3.112 -3.703 1.00 0.00 C ATOM 758 C PRO A 53 -11.808 -3.542 -4.015 1.00 0.00 C ATOM 759 O PRO A 53 -11.340 -3.400 -5.145 1.00 0.00 O ATOM 760 CB PRO A 53 -13.397 -1.603 -3.904 1.00 0.00 C ATOM 761 CG PRO A 53 -13.192 -1.017 -2.550 1.00 0.00 C ATOM 762 CD PRO A 53 -13.730 -2.027 -1.575 1.00 0.00 C ATOM 0 HA PRO A 53 -13.865 -3.713 -4.361 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.667 -1.219 -4.616 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -14.384 -1.358 -4.296 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.136 -0.821 -2.366 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.714 -0.065 -2.454 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -13.169 -2.022 -0.641 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.771 -1.827 -1.323 1.00 0.00 H new ATOM 770 N ALA A 54 -11.119 -4.068 -3.008 1.00 0.00 N ATOM 771 CA ALA A 54 -9.744 -4.521 -3.176 1.00 0.00 C ATOM 772 C ALA A 54 -9.676 -6.040 -3.290 1.00 0.00 C ATOM 773 O ALA A 54 -8.693 -6.592 -3.785 1.00 0.00 O ATOM 774 CB ALA A 54 -8.883 -4.037 -2.018 1.00 0.00 C ATOM 0 H ALA A 54 -11.491 -4.191 -2.066 1.00 0.00 H new ATOM 0 HA ALA A 54 -9.359 -4.096 -4.103 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.859 -4.383 -2.157 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.897 -2.948 -1.985 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.276 -4.434 -1.082 1.00 0.00 H new ATOM 780 N ASP A 55 -10.726 -6.710 -2.828 1.00 0.00 N ATOM 781 CA ASP A 55 -10.786 -8.166 -2.878 1.00 0.00 C ATOM 782 C ASP A 55 -11.600 -8.636 -4.080 1.00 0.00 C ATOM 783 O ASP A 55 -11.138 -9.456 -4.874 1.00 0.00 O ATOM 784 CB ASP A 55 -11.394 -8.718 -1.587 1.00 0.00 C ATOM 785 CG ASP A 55 -10.861 -10.094 -1.238 1.00 0.00 C ATOM 786 OD1 ASP A 55 -9.832 -10.170 -0.534 1.00 0.00 O ATOM 787 OD2 ASP A 55 -11.472 -11.094 -1.669 1.00 0.00 O ATOM 0 H ASP A 55 -11.547 -6.268 -2.415 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.769 -8.543 -2.981 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -11.183 -8.031 -0.767 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -12.478 -8.767 -1.691 1.00 0.00 H new ATOM 792 N LEU A 56 -12.814 -8.112 -4.206 1.00 0.00 N ATOM 793 CA LEU A 56 -13.694 -8.478 -5.310 1.00 0.00 C ATOM 794 C LEU A 56 -13.041 -8.165 -6.653 1.00 0.00 C ATOM 795 O LEU A 56 -13.259 -8.870 -7.639 1.00 0.00 O ATOM 796 CB LEU A 56 -15.027 -7.736 -5.193 1.00 0.00 C ATOM 797 CG LEU A 56 -15.794 -7.936 -3.886 1.00 0.00 C ATOM 798 CD1 LEU A 56 -16.619 -6.702 -3.557 1.00 0.00 C ATOM 799 CD2 LEU A 56 -16.684 -9.168 -3.972 1.00 0.00 C ATOM 0 H LEU A 56 -13.211 -7.432 -3.557 1.00 0.00 H new ATOM 0 HA LEU A 56 -13.877 -9.551 -5.257 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.839 -6.670 -5.321 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.667 -8.048 -6.018 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.072 -8.090 -3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.158 -6.863 -2.623 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -15.959 -5.841 -3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.332 -6.516 -4.360 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.222 -9.294 -3.033 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.399 -9.045 -4.786 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -16.069 -10.048 -4.159 1.00 0.00 H new ATOM 811 N CYS A 57 -12.239 -7.107 -6.683 1.00 0.00 N ATOM 812 CA CYS A 57 -11.553 -6.702 -7.905 1.00 0.00 C ATOM 813 C CYS A 57 -10.763 -7.865 -8.496 1.00 0.00 C ATOM 814 O CYS A 57 -10.422 -8.818 -7.795 1.00 0.00 O ATOM 815 CB CYS A 57 -10.618 -5.525 -7.623 1.00 0.00 C ATOM 816 SG CYS A 57 -9.194 -5.945 -6.591 1.00 0.00 S ATOM 0 H CYS A 57 -12.048 -6.514 -5.875 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.306 -6.393 -8.630 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -10.260 -5.124 -8.571 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -11.186 -4.733 -7.135 1.00 0.00 H new ATOM 0 HG CYS A 57 -8.554 -6.945 -7.121 1.00 0.00 H new ATOM 822 N VAL A 58 -10.476 -7.781 -9.791 1.00 0.00 N ATOM 823 CA VAL A 58 -9.727 -8.827 -10.477 1.00 0.00 C ATOM 824 C VAL A 58 -8.445 -8.272 -11.090 1.00 0.00 C ATOM 825 O VAL A 58 -8.462 -7.321 -11.871 1.00 0.00 O ATOM 826 CB VAL A 58 -10.569 -9.486 -11.585 1.00 0.00 C ATOM 827 CG1 VAL A 58 -9.676 -10.249 -12.552 1.00 0.00 C ATOM 828 CG2 VAL A 58 -11.620 -10.403 -10.980 1.00 0.00 C ATOM 0 H VAL A 58 -10.751 -7.000 -10.386 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.474 -9.578 -9.729 1.00 0.00 H new ATOM 0 HB VAL A 58 -11.081 -8.702 -12.143 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -10.289 -10.708 -13.328 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -8.965 -9.562 -13.010 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.134 -11.025 -12.012 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -12.206 -10.860 -11.777 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.130 -11.183 -10.396 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.278 -9.824 -10.332 1.00 0.00 H new ATOM 838 N PRO A 59 -7.305 -8.880 -10.728 1.00 0.00 N ATOM 839 CA PRO A 59 -7.273 -10.013 -9.798 1.00 0.00 C ATOM 840 C PRO A 59 -7.621 -9.602 -8.371 1.00 0.00 C ATOM 841 O PRO A 59 -7.767 -8.416 -8.075 1.00 0.00 O ATOM 842 CB PRO A 59 -5.822 -10.495 -9.876 1.00 0.00 C ATOM 843 CG PRO A 59 -5.047 -9.296 -10.301 1.00 0.00 C ATOM 844 CD PRO A 59 -5.961 -8.509 -11.199 1.00 0.00 C ATOM 0 HA PRO A 59 -8.005 -10.776 -10.061 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -5.477 -10.868 -8.912 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -5.714 -11.310 -10.591 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.742 -8.703 -9.439 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -4.137 -9.586 -10.827 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -5.786 -7.437 -11.110 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -5.816 -8.770 -12.247 1.00 0.00 H new ATOM 852 N ARG A 60 -7.753 -10.589 -7.491 1.00 0.00 N ATOM 853 CA ARG A 60 -8.085 -10.329 -6.096 1.00 0.00 C ATOM 854 C ARG A 60 -6.827 -10.034 -5.284 1.00 0.00 C ATOM 855 O ARG A 60 -5.926 -10.868 -5.189 1.00 0.00 O ATOM 856 CB ARG A 60 -8.824 -11.526 -5.494 1.00 0.00 C ATOM 857 CG ARG A 60 -8.978 -11.450 -3.984 1.00 0.00 C ATOM 858 CD ARG A 60 -9.203 -12.826 -3.377 1.00 0.00 C ATOM 859 NE ARG A 60 -8.982 -12.830 -1.933 1.00 0.00 N ATOM 860 CZ ARG A 60 -8.656 -13.917 -1.242 1.00 0.00 C ATOM 861 NH1 ARG A 60 -8.512 -15.081 -1.861 1.00 0.00 N ATOM 862 NH2 ARG A 60 -8.472 -13.840 0.069 1.00 0.00 N ATOM 0 H ARG A 60 -7.635 -11.576 -7.720 1.00 0.00 H new ATOM 0 HA ARG A 60 -8.734 -9.454 -6.060 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -9.812 -11.598 -5.948 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.288 -12.440 -5.751 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.086 -11.000 -3.548 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -9.817 -10.800 -3.735 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.221 -13.154 -3.589 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -8.532 -13.544 -3.848 1.00 0.00 H new ATOM 0 HE ARG A 60 -9.084 -11.950 -1.427 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -8.652 -15.143 -2.870 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -8.262 -15.914 -1.329 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.581 -12.946 0.548 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -8.222 -14.675 0.599 1.00 0.00 H new ATOM 876 N LEU A 61 -6.773 -8.842 -4.700 1.00 0.00 N ATOM 877 CA LEU A 61 -5.625 -8.435 -3.896 1.00 0.00 C ATOM 878 C LEU A 61 -5.581 -9.207 -2.581 1.00 0.00 C ATOM 879 O LEU A 61 -6.170 -8.790 -1.585 1.00 0.00 O ATOM 880 CB LEU A 61 -5.680 -6.932 -3.617 1.00 0.00 C ATOM 881 CG LEU A 61 -4.444 -6.328 -2.949 1.00 0.00 C ATOM 882 CD1 LEU A 61 -3.216 -6.521 -3.826 1.00 0.00 C ATOM 883 CD2 LEU A 61 -4.665 -4.852 -2.655 1.00 0.00 C ATOM 0 H LEU A 61 -7.510 -8.140 -4.768 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.719 -8.660 -4.459 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.848 -6.413 -4.561 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.545 -6.731 -2.985 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.275 -6.845 -2.004 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.346 -6.085 -3.335 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.047 -7.586 -3.986 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.374 -6.031 -4.786 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.775 -4.439 -2.180 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.859 -4.321 -3.587 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.519 -4.738 -1.988 1.00 0.00 H new ATOM 895 N ASN A 62 -4.876 -10.334 -2.586 1.00 0.00 N ATOM 896 CA ASN A 62 -4.754 -11.164 -1.393 1.00 0.00 C ATOM 897 C ASN A 62 -3.345 -11.078 -0.813 1.00 0.00 C ATOM 898 O ASN A 62 -2.434 -10.546 -1.447 1.00 0.00 O ATOM 899 CB ASN A 62 -5.095 -12.619 -1.720 1.00 0.00 C ATOM 900 CG ASN A 62 -4.314 -13.142 -2.910 1.00 0.00 C ATOM 901 OD1 ASN A 62 -3.098 -12.968 -2.994 1.00 0.00 O ATOM 902 ND2 ASN A 62 -5.012 -13.786 -3.838 1.00 0.00 N ATOM 0 H ASN A 62 -4.381 -10.693 -3.402 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.458 -10.792 -0.649 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -4.887 -13.242 -0.850 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.162 -12.702 -1.924 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -4.541 -14.160 -4.662 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.019 -13.907 -3.727 1.00 0.00 H new ATOM 909 N GLU A 63 -3.174 -11.607 0.394 1.00 0.00 N ATOM 910 CA GLU A 63 -1.876 -11.590 1.059 1.00 0.00 C ATOM 911 C GLU A 63 -0.791 -12.157 0.148 1.00 0.00 C ATOM 912 O GLU A 63 -1.055 -13.025 -0.684 1.00 0.00 O ATOM 913 CB GLU A 63 -1.934 -12.390 2.361 1.00 0.00 C ATOM 914 CG GLU A 63 -2.720 -11.702 3.464 1.00 0.00 C ATOM 915 CD GLU A 63 -3.077 -12.641 4.600 1.00 0.00 C ATOM 916 OE1 GLU A 63 -2.220 -13.467 4.978 1.00 0.00 O ATOM 917 OE2 GLU A 63 -4.214 -12.551 5.110 1.00 0.00 O ATOM 0 H GLU A 63 -3.918 -12.053 0.932 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.628 -10.554 1.289 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.382 -13.363 2.160 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -0.918 -12.573 2.711 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.136 -10.869 3.856 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.634 -11.281 3.045 1.00 0.00 H new ATOM 924 N GLY A 64 0.431 -11.660 0.311 1.00 0.00 N ATOM 925 CA GLY A 64 1.537 -12.128 -0.503 1.00 0.00 C ATOM 926 C GLY A 64 1.927 -11.133 -1.578 1.00 0.00 C ATOM 927 O GLY A 64 3.112 -10.878 -1.797 1.00 0.00 O ATOM 0 H GLY A 64 0.675 -10.941 0.993 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.398 -12.323 0.137 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.265 -13.075 -0.970 1.00 0.00 H new ATOM 931 N ASP A 65 0.930 -10.571 -2.252 1.00 0.00 N ATOM 932 CA ASP A 65 1.174 -9.599 -3.311 1.00 0.00 C ATOM 933 C ASP A 65 2.233 -8.586 -2.885 1.00 0.00 C ATOM 934 O ASP A 65 1.970 -7.709 -2.063 1.00 0.00 O ATOM 935 CB ASP A 65 -0.122 -8.876 -3.679 1.00 0.00 C ATOM 936 CG ASP A 65 -0.994 -9.691 -4.614 1.00 0.00 C ATOM 937 OD1 ASP A 65 -0.437 -10.376 -5.497 1.00 0.00 O ATOM 938 OD2 ASP A 65 -2.233 -9.643 -4.463 1.00 0.00 O ATOM 0 H ASP A 65 -0.056 -10.772 -2.084 1.00 0.00 H new ATOM 0 HA ASP A 65 1.541 -10.136 -4.185 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -0.680 -8.651 -2.770 1.00 0.00 H new ATOM 0 HB3 ASP A 65 0.118 -7.923 -4.150 1.00 0.00 H new ATOM 943 N GLN A 66 3.429 -8.715 -3.450 1.00 0.00 N ATOM 944 CA GLN A 66 4.527 -7.812 -3.127 1.00 0.00 C ATOM 945 C GLN A 66 4.474 -6.559 -3.995 1.00 0.00 C ATOM 946 O GLN A 66 4.641 -6.627 -5.212 1.00 0.00 O ATOM 947 CB GLN A 66 5.870 -8.520 -3.314 1.00 0.00 C ATOM 948 CG GLN A 66 7.069 -7.648 -2.980 1.00 0.00 C ATOM 949 CD GLN A 66 8.368 -8.208 -3.525 1.00 0.00 C ATOM 950 OE1 GLN A 66 8.612 -9.414 -3.462 1.00 0.00 O ATOM 951 NE2 GLN A 66 9.211 -7.334 -4.064 1.00 0.00 N ATOM 0 H GLN A 66 3.662 -9.436 -4.133 1.00 0.00 H new ATOM 0 HA GLN A 66 4.424 -7.514 -2.084 1.00 0.00 H new ATOM 0 HB2 GLN A 66 5.892 -9.410 -2.686 1.00 0.00 H new ATOM 0 HB3 GLN A 66 5.953 -8.857 -4.347 1.00 0.00 H new ATOM 0 HG2 GLN A 66 6.911 -6.648 -3.385 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.148 -7.545 -1.898 1.00 0.00 H new ATOM 0 HE21 GLN A 66 8.968 -6.344 -4.095 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.101 -7.653 -4.447 1.00 0.00 H new ATOM 960 N VAL A 67 4.241 -5.414 -3.360 1.00 0.00 N ATOM 961 CA VAL A 67 4.167 -4.145 -4.073 1.00 0.00 C ATOM 962 C VAL A 67 5.534 -3.736 -4.610 1.00 0.00 C ATOM 963 O VAL A 67 6.514 -3.683 -3.867 1.00 0.00 O ATOM 964 CB VAL A 67 3.626 -3.023 -3.168 1.00 0.00 C ATOM 965 CG1 VAL A 67 3.471 -1.730 -3.954 1.00 0.00 C ATOM 966 CG2 VAL A 67 2.304 -3.436 -2.539 1.00 0.00 C ATOM 0 H VAL A 67 4.100 -5.340 -2.352 1.00 0.00 H new ATOM 0 HA VAL A 67 3.481 -4.290 -4.907 1.00 0.00 H new ATOM 0 HB VAL A 67 4.344 -2.849 -2.367 1.00 0.00 H new ATOM 0 HG11 VAL A 67 3.088 -0.949 -3.298 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.440 -1.427 -4.351 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.774 -1.886 -4.778 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.937 -2.631 -1.903 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.575 -3.639 -3.324 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.451 -4.334 -1.939 1.00 0.00 H new ATOM 976 N VAL A 68 5.592 -3.446 -5.906 1.00 0.00 N ATOM 977 CA VAL A 68 6.839 -3.039 -6.543 1.00 0.00 C ATOM 978 C VAL A 68 6.848 -1.542 -6.827 1.00 0.00 C ATOM 979 O VAL A 68 7.823 -0.849 -6.531 1.00 0.00 O ATOM 980 CB VAL A 68 7.070 -3.802 -7.861 1.00 0.00 C ATOM 981 CG1 VAL A 68 8.432 -3.457 -8.446 1.00 0.00 C ATOM 982 CG2 VAL A 68 6.941 -5.301 -7.639 1.00 0.00 C ATOM 0 H VAL A 68 4.790 -3.485 -6.535 1.00 0.00 H new ATOM 0 HA VAL A 68 7.643 -3.278 -5.847 1.00 0.00 H new ATOM 0 HB VAL A 68 6.306 -3.497 -8.576 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.578 -4.005 -9.377 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.482 -2.386 -8.644 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.213 -3.732 -7.737 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.107 -5.824 -8.581 1.00 0.00 H new ATOM 0 HG22 VAL A 68 7.682 -5.626 -6.908 1.00 0.00 H new ATOM 0 HG23 VAL A 68 5.942 -5.529 -7.269 1.00 0.00 H new ATOM 992 N LEU A 69 5.757 -1.047 -7.401 1.00 0.00 N ATOM 993 CA LEU A 69 5.638 0.370 -7.725 1.00 0.00 C ATOM 994 C LEU A 69 4.183 0.824 -7.659 1.00 0.00 C ATOM 995 O LEU A 69 3.270 0.059 -7.973 1.00 0.00 O ATOM 996 CB LEU A 69 6.208 0.645 -9.117 1.00 0.00 C ATOM 997 CG LEU A 69 7.643 0.174 -9.361 1.00 0.00 C ATOM 998 CD1 LEU A 69 7.912 0.031 -10.850 1.00 0.00 C ATOM 999 CD2 LEU A 69 8.635 1.139 -8.727 1.00 0.00 C ATOM 0 H LEU A 69 4.942 -1.606 -7.652 1.00 0.00 H new ATOM 0 HA LEU A 69 6.209 0.935 -6.988 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.561 0.169 -9.853 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.163 1.719 -9.300 1.00 0.00 H new ATOM 0 HG LEU A 69 7.769 -0.803 -8.895 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.938 -0.305 -11.004 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.223 -0.699 -11.276 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.768 0.994 -11.340 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.651 0.789 -8.910 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.508 2.130 -9.163 1.00 0.00 H new ATOM 0 HD23 LEU A 69 8.457 1.190 -7.653 1.00 0.00 H new ATOM 1011 N ILE A 70 3.976 2.071 -7.252 1.00 0.00 N ATOM 1012 CA ILE A 70 2.632 2.627 -7.150 1.00 0.00 C ATOM 1013 C ILE A 70 2.312 3.516 -8.346 1.00 0.00 C ATOM 1014 O ILE A 70 2.948 4.549 -8.552 1.00 0.00 O ATOM 1015 CB ILE A 70 2.458 3.444 -5.856 1.00 0.00 C ATOM 1016 CG1 ILE A 70 2.921 2.630 -4.646 1.00 0.00 C ATOM 1017 CG2 ILE A 70 1.007 3.871 -5.690 1.00 0.00 C ATOM 1018 CD1 ILE A 70 1.917 1.592 -4.196 1.00 0.00 C ATOM 0 H ILE A 70 4.721 2.716 -6.988 1.00 0.00 H new ATOM 0 HA ILE A 70 1.942 1.783 -7.133 1.00 0.00 H new ATOM 0 HB ILE A 70 3.075 4.340 -5.925 1.00 0.00 H new ATOM 0 HG12 ILE A 70 3.860 2.133 -4.890 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.125 3.309 -3.818 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.900 4.447 -4.771 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.709 4.485 -6.540 1.00 0.00 H new ATOM 0 HG23 ILE A 70 0.371 2.987 -5.640 1.00 0.00 H new ATOM 0 HD11 ILE A 70 2.312 1.053 -3.335 1.00 0.00 H new ATOM 0 HD12 ILE A 70 0.984 2.084 -3.920 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.730 0.890 -5.009 1.00 0.00 H new ATOM 1030 N ASN A 71 1.320 3.108 -9.131 1.00 0.00 N ATOM 1031 CA ASN A 71 0.914 3.869 -10.308 1.00 0.00 C ATOM 1032 C ASN A 71 2.113 4.168 -11.203 1.00 0.00 C ATOM 1033 O ASN A 71 2.222 5.254 -11.770 1.00 0.00 O ATOM 1034 CB ASN A 71 0.239 5.176 -9.887 1.00 0.00 C ATOM 1035 CG ASN A 71 -0.886 4.952 -8.895 1.00 0.00 C ATOM 1036 OD1 ASN A 71 -1.222 3.814 -8.567 1.00 0.00 O ATOM 1037 ND2 ASN A 71 -1.473 6.040 -8.411 1.00 0.00 N ATOM 0 H ASN A 71 0.783 2.255 -8.974 1.00 0.00 H new ATOM 0 HA ASN A 71 0.203 3.266 -10.873 1.00 0.00 H new ATOM 0 HB2 ASN A 71 0.982 5.840 -9.446 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -0.154 5.680 -10.770 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.235 5.952 -7.739 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.162 6.964 -8.711 1.00 0.00 H new ATOM 1044 N GLY A 72 3.011 3.195 -11.325 1.00 0.00 N ATOM 1045 CA GLY A 72 4.190 3.373 -12.152 1.00 0.00 C ATOM 1046 C GLY A 72 5.166 4.373 -11.564 1.00 0.00 C ATOM 1047 O GLY A 72 5.739 5.190 -12.285 1.00 0.00 O ATOM 0 H GLY A 72 2.943 2.287 -10.866 1.00 0.00 H new ATOM 0 HA2 GLY A 72 4.690 2.413 -12.277 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.887 3.707 -13.144 1.00 0.00 H new ATOM 1051 N ARG A 73 5.354 4.311 -10.250 1.00 0.00 N ATOM 1052 CA ARG A 73 6.265 5.220 -9.565 1.00 0.00 C ATOM 1053 C ARG A 73 7.204 4.453 -8.638 1.00 0.00 C ATOM 1054 O ARG A 73 6.819 3.446 -8.043 1.00 0.00 O ATOM 1055 CB ARG A 73 5.476 6.258 -8.764 1.00 0.00 C ATOM 1056 CG ARG A 73 6.254 7.535 -8.491 1.00 0.00 C ATOM 1057 CD ARG A 73 5.431 8.525 -7.681 1.00 0.00 C ATOM 1058 NE ARG A 73 4.633 9.401 -8.535 1.00 0.00 N ATOM 1059 CZ ARG A 73 5.108 10.502 -9.107 1.00 0.00 C ATOM 1060 NH1 ARG A 73 6.371 10.859 -8.918 1.00 0.00 N ATOM 1061 NH2 ARG A 73 4.319 11.247 -9.871 1.00 0.00 N ATOM 0 H ARG A 73 4.888 3.641 -9.639 1.00 0.00 H new ATOM 0 HA ARG A 73 6.864 5.731 -10.319 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.564 6.507 -9.307 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.172 5.818 -7.814 1.00 0.00 H new ATOM 0 HG2 ARG A 73 7.171 7.296 -7.953 1.00 0.00 H new ATOM 0 HG3 ARG A 73 6.549 7.992 -9.436 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.773 7.981 -7.004 1.00 0.00 H new ATOM 0 HD3 ARG A 73 6.095 9.129 -7.063 1.00 0.00 H new ATOM 0 HE ARG A 73 3.657 9.154 -8.701 1.00 0.00 H new ATOM 0 HH11 ARG A 73 6.980 10.288 -8.332 1.00 0.00 H new ATOM 0 HH12 ARG A 73 6.733 11.705 -9.358 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.347 10.974 -10.019 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.684 12.092 -10.310 1.00 0.00 H new ATOM 1075 N ASP A 74 8.436 4.935 -8.522 1.00 0.00 N ATOM 1076 CA ASP A 74 9.430 4.295 -7.668 1.00 0.00 C ATOM 1077 C ASP A 74 9.077 4.475 -6.195 1.00 0.00 C ATOM 1078 O ASP A 74 9.108 5.588 -5.671 1.00 0.00 O ATOM 1079 CB ASP A 74 10.820 4.872 -7.947 1.00 0.00 C ATOM 1080 CG ASP A 74 11.922 4.073 -7.279 1.00 0.00 C ATOM 1081 OD1 ASP A 74 11.814 2.830 -7.240 1.00 0.00 O ATOM 1082 OD2 ASP A 74 12.893 4.692 -6.796 1.00 0.00 O ATOM 0 H ASP A 74 8.771 5.767 -9.008 1.00 0.00 H new ATOM 0 HA ASP A 74 9.436 3.229 -7.894 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.992 4.894 -9.023 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.859 5.903 -7.597 1.00 0.00 H new ATOM 1087 N ILE A 75 8.741 3.372 -5.534 1.00 0.00 N ATOM 1088 CA ILE A 75 8.382 3.408 -4.122 1.00 0.00 C ATOM 1089 C ILE A 75 9.309 2.522 -3.296 1.00 0.00 C ATOM 1090 O ILE A 75 9.592 2.814 -2.135 1.00 0.00 O ATOM 1091 CB ILE A 75 6.927 2.957 -3.899 1.00 0.00 C ATOM 1092 CG1 ILE A 75 6.751 1.498 -4.325 1.00 0.00 C ATOM 1093 CG2 ILE A 75 5.970 3.857 -4.667 1.00 0.00 C ATOM 1094 CD1 ILE A 75 7.012 0.508 -3.211 1.00 0.00 C ATOM 0 H ILE A 75 8.710 2.443 -5.954 1.00 0.00 H new ATOM 0 HA ILE A 75 8.487 4.443 -3.797 1.00 0.00 H new ATOM 0 HB ILE A 75 6.697 3.036 -2.837 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.736 1.356 -4.696 1.00 0.00 H new ATOM 0 HG13 ILE A 75 7.426 1.286 -5.154 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.945 3.526 -4.499 1.00 0.00 H new ATOM 0 HG22 ILE A 75 6.080 4.885 -4.321 1.00 0.00 H new ATOM 0 HG23 ILE A 75 6.198 3.806 -5.732 1.00 0.00 H new ATOM 0 HD11 ILE A 75 6.869 -0.506 -3.584 1.00 0.00 H new ATOM 0 HD12 ILE A 75 8.036 0.622 -2.855 1.00 0.00 H new ATOM 0 HD13 ILE A 75 6.320 0.693 -2.390 1.00 0.00 H new ATOM 1106 N ALA A 76 9.780 1.439 -3.905 1.00 0.00 N ATOM 1107 CA ALA A 76 10.679 0.512 -3.228 1.00 0.00 C ATOM 1108 C ALA A 76 11.866 1.247 -2.615 1.00 0.00 C ATOM 1109 O ALA A 76 12.564 0.708 -1.757 1.00 0.00 O ATOM 1110 CB ALA A 76 11.161 -0.558 -4.197 1.00 0.00 C ATOM 0 H ALA A 76 9.554 1.182 -4.866 1.00 0.00 H new ATOM 0 HA ALA A 76 10.126 0.033 -2.420 1.00 0.00 H new ATOM 0 HB1 ALA A 76 11.831 -1.243 -3.678 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.305 -1.111 -4.584 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.692 -0.087 -5.024 1.00 0.00 H new ATOM 1116 N GLU A 77 12.087 2.480 -3.061 1.00 0.00 N ATOM 1117 CA GLU A 77 13.191 3.287 -2.555 1.00 0.00 C ATOM 1118 C GLU A 77 12.702 4.284 -1.509 1.00 0.00 C ATOM 1119 O GLU A 77 13.356 5.293 -1.243 1.00 0.00 O ATOM 1120 CB GLU A 77 13.876 4.031 -3.704 1.00 0.00 C ATOM 1121 CG GLU A 77 15.014 3.251 -4.341 1.00 0.00 C ATOM 1122 CD GLU A 77 16.124 2.932 -3.359 1.00 0.00 C ATOM 1123 OE1 GLU A 77 16.849 3.867 -2.959 1.00 0.00 O ATOM 1124 OE2 GLU A 77 16.268 1.747 -2.991 1.00 0.00 O ATOM 0 H GLU A 77 11.517 2.941 -3.770 1.00 0.00 H new ATOM 0 HA GLU A 77 13.911 2.617 -2.084 1.00 0.00 H new ATOM 0 HB2 GLU A 77 13.134 4.264 -4.468 1.00 0.00 H new ATOM 0 HB3 GLU A 77 14.261 4.981 -3.333 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.624 2.322 -4.757 1.00 0.00 H new ATOM 0 HG3 GLU A 77 15.423 3.826 -5.172 1.00 0.00 H new ATOM 1131 N HIS A 78 11.546 3.996 -0.920 1.00 0.00 N ATOM 1132 CA HIS A 78 10.968 4.867 0.097 1.00 0.00 C ATOM 1133 C HIS A 78 10.604 4.073 1.349 1.00 0.00 C ATOM 1134 O HIS A 78 10.475 2.849 1.306 1.00 0.00 O ATOM 1135 CB HIS A 78 9.727 5.573 -0.451 1.00 0.00 C ATOM 1136 CG HIS A 78 10.020 6.499 -1.591 1.00 0.00 C ATOM 1137 ND1 HIS A 78 9.131 6.731 -2.620 1.00 0.00 N ATOM 1138 CD2 HIS A 78 11.110 7.254 -1.860 1.00 0.00 C ATOM 1139 CE1 HIS A 78 9.663 7.587 -3.473 1.00 0.00 C ATOM 1140 NE2 HIS A 78 10.864 7.921 -3.035 1.00 0.00 N ATOM 0 H HIS A 78 10.991 3.166 -1.129 1.00 0.00 H new ATOM 0 HA HIS A 78 11.714 5.615 0.366 1.00 0.00 H new ATOM 0 HB2 HIS A 78 9.007 4.823 -0.779 1.00 0.00 H new ATOM 0 HB3 HIS A 78 9.255 6.138 0.353 1.00 0.00 H new ATOM 0 HD2 HIS A 78 12.007 7.320 -1.262 1.00 0.00 H new ATOM 0 HE1 HIS A 78 9.196 7.952 -4.376 1.00 0.00 H new ATOM 0 HE2 HIS A 78 11.504 8.569 -3.495 1.00 0.00 H new ATOM 1149 N THR A 79 10.441 4.779 2.464 1.00 0.00 N ATOM 1150 CA THR A 79 10.095 4.141 3.728 1.00 0.00 C ATOM 1151 C THR A 79 8.617 3.770 3.770 1.00 0.00 C ATOM 1152 O THR A 79 7.780 4.442 3.166 1.00 0.00 O ATOM 1153 CB THR A 79 10.417 5.054 4.925 1.00 0.00 C ATOM 1154 OG1 THR A 79 9.653 6.262 4.839 1.00 0.00 O ATOM 1155 CG2 THR A 79 11.901 5.389 4.966 1.00 0.00 C ATOM 0 H THR A 79 10.543 5.792 2.517 1.00 0.00 H new ATOM 0 HA THR A 79 10.697 3.235 3.799 1.00 0.00 H new ATOM 0 HB THR A 79 10.155 4.523 5.840 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.862 6.837 5.605 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.105 6.035 5.820 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.479 4.470 5.060 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.184 5.903 4.047 1.00 0.00 H new ATOM 1163 N HIS A 80 8.301 2.696 4.487 1.00 0.00 N ATOM 1164 CA HIS A 80 6.922 2.237 4.609 1.00 0.00 C ATOM 1165 C HIS A 80 5.957 3.418 4.640 1.00 0.00 C ATOM 1166 O HIS A 80 5.082 3.540 3.782 1.00 0.00 O ATOM 1167 CB HIS A 80 6.753 1.392 5.872 1.00 0.00 C ATOM 1168 CG HIS A 80 5.383 0.806 6.022 1.00 0.00 C ATOM 1169 ND1 HIS A 80 5.053 -0.092 7.016 1.00 0.00 N ATOM 1170 CD2 HIS A 80 4.255 0.995 5.299 1.00 0.00 C ATOM 1171 CE1 HIS A 80 3.782 -0.431 6.895 1.00 0.00 C ATOM 1172 NE2 HIS A 80 3.275 0.216 5.861 1.00 0.00 N ATOM 0 H HIS A 80 8.981 2.128 4.992 1.00 0.00 H new ATOM 0 HA HIS A 80 6.691 1.624 3.738 1.00 0.00 H new ATOM 0 HB2 HIS A 80 7.485 0.585 5.860 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.973 2.008 6.744 1.00 0.00 H new ATOM 0 HD1 HIS A 80 5.691 -0.440 7.732 1.00 0.00 H new ATOM 0 HD2 HIS A 80 4.146 1.639 4.439 1.00 0.00 H new ATOM 0 HE1 HIS A 80 3.248 -1.120 7.533 1.00 0.00 H new ATOM 1181 N ASP A 81 6.121 4.284 5.633 1.00 0.00 N ATOM 1182 CA ASP A 81 5.264 5.455 5.776 1.00 0.00 C ATOM 1183 C ASP A 81 4.963 6.077 4.416 1.00 0.00 C ATOM 1184 O ASP A 81 3.806 6.156 4.002 1.00 0.00 O ATOM 1185 CB ASP A 81 5.926 6.490 6.688 1.00 0.00 C ATOM 1186 CG ASP A 81 4.916 7.396 7.364 1.00 0.00 C ATOM 1187 OD1 ASP A 81 3.783 6.936 7.621 1.00 0.00 O ATOM 1188 OD2 ASP A 81 5.258 8.566 7.636 1.00 0.00 O ATOM 0 H ASP A 81 6.840 4.197 6.351 1.00 0.00 H new ATOM 0 HA ASP A 81 4.324 5.134 6.225 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.515 5.976 7.448 1.00 0.00 H new ATOM 0 HB3 ASP A 81 6.619 7.095 6.103 1.00 0.00 H new ATOM 1193 N GLN A 82 6.011 6.518 3.727 1.00 0.00 N ATOM 1194 CA GLN A 82 5.857 7.134 2.414 1.00 0.00 C ATOM 1195 C GLN A 82 4.830 6.380 1.576 1.00 0.00 C ATOM 1196 O GLN A 82 3.888 6.973 1.049 1.00 0.00 O ATOM 1197 CB GLN A 82 7.201 7.170 1.684 1.00 0.00 C ATOM 1198 CG GLN A 82 8.041 8.392 2.017 1.00 0.00 C ATOM 1199 CD GLN A 82 9.143 8.636 1.004 1.00 0.00 C ATOM 1200 OE1 GLN A 82 10.287 8.227 1.204 1.00 0.00 O ATOM 1201 NE2 GLN A 82 8.803 9.305 -0.091 1.00 0.00 N ATOM 0 H GLN A 82 6.975 6.460 4.056 1.00 0.00 H new ATOM 0 HA GLN A 82 5.502 8.154 2.558 1.00 0.00 H new ATOM 0 HB2 GLN A 82 7.766 6.272 1.935 1.00 0.00 H new ATOM 0 HB3 GLN A 82 7.022 7.144 0.609 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.396 9.269 2.065 1.00 0.00 H new ATOM 0 HG3 GLN A 82 8.483 8.266 3.006 1.00 0.00 H new ATOM 0 HE21 GLN A 82 7.843 9.625 -0.215 1.00 0.00 H new ATOM 0 HE22 GLN A 82 9.502 9.499 -0.808 1.00 0.00 H new ATOM 1210 N VAL A 83 5.017 5.070 1.456 1.00 0.00 N ATOM 1211 CA VAL A 83 4.106 4.235 0.682 1.00 0.00 C ATOM 1212 C VAL A 83 2.666 4.413 1.149 1.00 0.00 C ATOM 1213 O VAL A 83 1.769 4.672 0.347 1.00 0.00 O ATOM 1214 CB VAL A 83 4.487 2.746 0.784 1.00 0.00 C ATOM 1215 CG1 VAL A 83 3.433 1.878 0.113 1.00 0.00 C ATOM 1216 CG2 VAL A 83 5.858 2.503 0.172 1.00 0.00 C ATOM 0 H VAL A 83 5.791 4.563 1.885 1.00 0.00 H new ATOM 0 HA VAL A 83 4.190 4.554 -0.357 1.00 0.00 H new ATOM 0 HB VAL A 83 4.532 2.472 1.838 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.719 0.829 0.195 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.471 2.031 0.602 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.353 2.151 -0.939 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.110 1.446 0.253 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.844 2.793 -0.879 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.603 3.096 0.702 1.00 0.00 H new ATOM 1226 N VAL A 84 2.451 4.274 2.454 1.00 0.00 N ATOM 1227 CA VAL A 84 1.120 4.422 3.029 1.00 0.00 C ATOM 1228 C VAL A 84 0.530 5.790 2.706 1.00 0.00 C ATOM 1229 O VAL A 84 -0.643 5.903 2.347 1.00 0.00 O ATOM 1230 CB VAL A 84 1.145 4.234 4.558 1.00 0.00 C ATOM 1231 CG1 VAL A 84 -0.245 4.432 5.143 1.00 0.00 C ATOM 1232 CG2 VAL A 84 1.692 2.860 4.916 1.00 0.00 C ATOM 0 H VAL A 84 3.182 4.059 3.132 1.00 0.00 H new ATOM 0 HA VAL A 84 0.496 3.647 2.585 1.00 0.00 H new ATOM 0 HB VAL A 84 1.805 4.987 4.989 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.208 4.295 6.224 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.595 5.439 4.916 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.930 3.704 4.709 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.703 2.744 6.000 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.059 2.090 4.475 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.707 2.760 4.530 1.00 0.00 H new ATOM 1242 N LEU A 85 1.350 6.827 2.834 1.00 0.00 N ATOM 1243 CA LEU A 85 0.910 8.189 2.555 1.00 0.00 C ATOM 1244 C LEU A 85 0.571 8.360 1.078 1.00 0.00 C ATOM 1245 O LEU A 85 -0.425 8.995 0.729 1.00 0.00 O ATOM 1246 CB LEU A 85 1.995 9.189 2.960 1.00 0.00 C ATOM 1247 CG LEU A 85 2.150 9.441 4.460 1.00 0.00 C ATOM 1248 CD1 LEU A 85 3.503 10.068 4.759 1.00 0.00 C ATOM 1249 CD2 LEU A 85 1.024 10.328 4.971 1.00 0.00 C ATOM 0 H LEU A 85 2.323 6.751 3.129 1.00 0.00 H new ATOM 0 HA LEU A 85 0.010 8.381 3.140 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.950 8.836 2.571 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.784 10.141 2.472 1.00 0.00 H new ATOM 0 HG LEU A 85 2.094 8.483 4.978 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.595 10.240 5.831 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.296 9.397 4.430 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.589 11.017 4.230 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.151 10.497 6.040 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.048 11.284 4.448 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.066 9.840 4.792 1.00 0.00 H new ATOM 1261 N PHE A 86 1.403 7.788 0.215 1.00 0.00 N ATOM 1262 CA PHE A 86 1.190 7.875 -1.225 1.00 0.00 C ATOM 1263 C PHE A 86 -0.143 7.246 -1.617 1.00 0.00 C ATOM 1264 O PHE A 86 -1.010 7.908 -2.189 1.00 0.00 O ATOM 1265 CB PHE A 86 2.332 7.185 -1.974 1.00 0.00 C ATOM 1266 CG PHE A 86 2.431 7.586 -3.418 1.00 0.00 C ATOM 1267 CD1 PHE A 86 2.388 8.921 -3.784 1.00 0.00 C ATOM 1268 CD2 PHE A 86 2.567 6.627 -4.409 1.00 0.00 C ATOM 1269 CE1 PHE A 86 2.479 9.294 -5.112 1.00 0.00 C ATOM 1270 CE2 PHE A 86 2.659 6.993 -5.738 1.00 0.00 C ATOM 1271 CZ PHE A 86 2.614 8.328 -6.091 1.00 0.00 C ATOM 0 H PHE A 86 2.231 7.259 0.487 1.00 0.00 H new ATOM 0 HA PHE A 86 1.169 8.929 -1.500 1.00 0.00 H new ATOM 0 HB2 PHE A 86 3.274 7.415 -1.476 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.195 6.105 -1.914 1.00 0.00 H new ATOM 0 HD1 PHE A 86 2.282 9.680 -3.023 1.00 0.00 H new ATOM 0 HD2 PHE A 86 2.601 5.582 -4.139 1.00 0.00 H new ATOM 0 HE1 PHE A 86 2.445 10.339 -5.384 1.00 0.00 H new ATOM 0 HE2 PHE A 86 2.766 6.236 -6.501 1.00 0.00 H new ATOM 0 HZ PHE A 86 2.684 8.616 -7.130 1.00 0.00 H new ATOM 1281 N ILE A 87 -0.300 5.964 -1.306 1.00 0.00 N ATOM 1282 CA ILE A 87 -1.528 5.245 -1.625 1.00 0.00 C ATOM 1283 C ILE A 87 -2.757 6.090 -1.309 1.00 0.00 C ATOM 1284 O ILE A 87 -3.508 6.474 -2.206 1.00 0.00 O ATOM 1285 CB ILE A 87 -1.619 3.917 -0.851 1.00 0.00 C ATOM 1286 CG1 ILE A 87 -0.425 3.022 -1.188 1.00 0.00 C ATOM 1287 CG2 ILE A 87 -2.926 3.207 -1.171 1.00 0.00 C ATOM 1288 CD1 ILE A 87 -0.233 1.879 -0.216 1.00 0.00 C ATOM 0 H ILE A 87 0.408 5.401 -0.833 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.501 5.032 -2.694 1.00 0.00 H new ATOM 0 HB ILE A 87 -1.597 4.134 0.217 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.557 2.617 -2.191 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.480 3.629 -1.206 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -2.976 2.270 -0.617 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -3.765 3.842 -0.886 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.975 2.999 -2.240 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.631 1.287 -0.517 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -0.069 2.277 0.786 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.122 1.249 -0.215 1.00 0.00 H new ATOM 1300 N LYS A 88 -2.956 6.379 -0.027 1.00 0.00 N ATOM 1301 CA LYS A 88 -4.093 7.182 0.409 1.00 0.00 C ATOM 1302 C LYS A 88 -4.158 8.496 -0.362 1.00 0.00 C ATOM 1303 O LYS A 88 -5.197 8.848 -0.920 1.00 0.00 O ATOM 1304 CB LYS A 88 -3.998 7.463 1.910 1.00 0.00 C ATOM 1305 CG LYS A 88 -4.242 6.238 2.775 1.00 0.00 C ATOM 1306 CD LYS A 88 -4.264 6.593 4.252 1.00 0.00 C ATOM 1307 CE LYS A 88 -3.890 5.400 5.118 1.00 0.00 C ATOM 1308 NZ LYS A 88 -4.948 4.352 5.106 1.00 0.00 N ATOM 0 H LYS A 88 -2.345 6.069 0.728 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.004 6.618 0.208 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -3.010 7.865 2.134 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.722 8.234 2.173 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -5.190 5.778 2.496 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.462 5.499 2.589 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -3.570 7.412 4.441 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -5.258 6.947 4.527 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -2.952 4.973 4.763 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -3.721 5.733 6.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -4.655 3.556 5.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -5.837 4.752 5.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -5.092 4.015 4.133 1.00 0.00 H new ATOM 1322 N ALA A 89 -3.042 9.217 -0.389 1.00 0.00 N ATOM 1323 CA ALA A 89 -2.973 10.491 -1.095 1.00 0.00 C ATOM 1324 C ALA A 89 -3.842 10.472 -2.348 1.00 0.00 C ATOM 1325 O ALA A 89 -4.719 11.319 -2.519 1.00 0.00 O ATOM 1326 CB ALA A 89 -1.531 10.816 -1.455 1.00 0.00 C ATOM 0 H ALA A 89 -2.174 8.941 0.070 1.00 0.00 H new ATOM 0 HA ALA A 89 -3.355 11.267 -0.432 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -1.494 11.770 -1.982 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -0.934 10.880 -0.545 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -1.130 10.031 -2.097 1.00 0.00 H new ATOM 1332 N SER A 90 -3.591 9.503 -3.222 1.00 0.00 N ATOM 1333 CA SER A 90 -4.348 9.377 -4.462 1.00 0.00 C ATOM 1334 C SER A 90 -5.803 9.787 -4.254 1.00 0.00 C ATOM 1335 O SER A 90 -6.316 10.667 -4.945 1.00 0.00 O ATOM 1336 CB SER A 90 -4.281 7.940 -4.982 1.00 0.00 C ATOM 1337 OG SER A 90 -4.687 7.869 -6.338 1.00 0.00 O ATOM 0 H SER A 90 -2.869 8.794 -3.095 1.00 0.00 H new ATOM 0 HA SER A 90 -3.902 10.044 -5.200 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.264 7.561 -4.883 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.920 7.300 -4.374 1.00 0.00 H new ATOM 0 HG SER A 90 -4.634 6.941 -6.647 1.00 0.00 H new ATOM 1343 N CYS A 91 -6.462 9.142 -3.298 1.00 0.00 N ATOM 1344 CA CYS A 91 -7.858 9.437 -2.998 1.00 0.00 C ATOM 1345 C CYS A 91 -8.108 10.942 -2.998 1.00 0.00 C ATOM 1346 O CYS A 91 -9.021 11.429 -3.663 1.00 0.00 O ATOM 1347 CB CYS A 91 -8.248 8.843 -1.644 1.00 0.00 C ATOM 1348 SG CYS A 91 -10.032 8.741 -1.368 1.00 0.00 S ATOM 0 H CYS A 91 -6.052 8.411 -2.717 1.00 0.00 H new ATOM 0 HA CYS A 91 -8.474 8.985 -3.775 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -7.821 7.844 -1.561 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -7.803 9.446 -0.853 1.00 0.00 H new ATOM 0 HG CYS A 91 -10.261 8.224 -0.197 1.00 0.00 H new ATOM 1354 N GLU A 92 -7.290 11.672 -2.246 1.00 0.00 N ATOM 1355 CA GLU A 92 -7.425 13.121 -2.157 1.00 0.00 C ATOM 1356 C GLU A 92 -7.077 13.782 -3.488 1.00 0.00 C ATOM 1357 O GLU A 92 -7.783 14.678 -3.951 1.00 0.00 O ATOM 1358 CB GLU A 92 -6.523 13.673 -1.051 1.00 0.00 C ATOM 1359 CG GLU A 92 -7.102 13.508 0.344 1.00 0.00 C ATOM 1360 CD GLU A 92 -8.226 14.485 0.629 1.00 0.00 C ATOM 1361 OE1 GLU A 92 -9.109 14.643 -0.239 1.00 0.00 O ATOM 1362 OE2 GLU A 92 -8.222 15.092 1.720 1.00 0.00 O ATOM 0 H GLU A 92 -6.528 11.284 -1.690 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.463 13.349 -1.917 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.557 13.170 -1.096 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -6.340 14.731 -1.237 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -7.473 12.490 0.461 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.310 13.646 1.080 1.00 0.00 H new ATOM 1369 N ARG A 93 -5.985 13.333 -4.098 1.00 0.00 N ATOM 1370 CA ARG A 93 -5.542 13.881 -5.374 1.00 0.00 C ATOM 1371 C ARG A 93 -6.705 13.974 -6.358 1.00 0.00 C ATOM 1372 O ARG A 93 -6.894 14.998 -7.016 1.00 0.00 O ATOM 1373 CB ARG A 93 -4.428 13.016 -5.966 1.00 0.00 C ATOM 1374 CG ARG A 93 -3.134 13.060 -5.169 1.00 0.00 C ATOM 1375 CD ARG A 93 -1.922 12.844 -6.061 1.00 0.00 C ATOM 1376 NE ARG A 93 -0.740 12.457 -5.296 1.00 0.00 N ATOM 1377 CZ ARG A 93 -0.052 13.298 -4.532 1.00 0.00 C ATOM 1378 NH1 ARG A 93 -0.425 14.566 -4.433 1.00 0.00 N ATOM 1379 NH2 ARG A 93 1.013 12.871 -3.865 1.00 0.00 N ATOM 0 H ARG A 93 -5.391 12.591 -3.729 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.157 14.885 -5.196 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -4.774 11.984 -6.025 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.228 13.344 -6.986 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -3.049 14.023 -4.665 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -3.157 12.295 -4.393 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -2.147 12.071 -6.796 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -1.712 13.759 -6.614 1.00 0.00 H new ATOM 0 HE ARG A 93 -0.426 11.488 -5.351 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -1.243 14.899 -4.944 1.00 0.00 H new ATOM 0 HH12 ARG A 93 0.105 15.209 -3.845 1.00 0.00 H new ATOM 0 HH21 ARG A 93 1.304 11.896 -3.939 1.00 0.00 H new ATOM 0 HH22 ARG A 93 1.541 13.518 -3.279 1.00 0.00 H new ATOM 1393 N HIS A 94 -7.480 12.899 -6.454 1.00 0.00 N ATOM 1394 CA HIS A 94 -8.624 12.860 -7.358 1.00 0.00 C ATOM 1395 C HIS A 94 -9.450 11.597 -7.134 1.00 0.00 C ATOM 1396 O HIS A 94 -9.020 10.677 -6.439 1.00 0.00 O ATOM 1397 CB HIS A 94 -8.155 12.926 -8.812 1.00 0.00 C ATOM 1398 CG HIS A 94 -9.215 13.392 -9.762 1.00 0.00 C ATOM 1399 ND1 HIS A 94 -9.747 12.588 -10.748 1.00 0.00 N ATOM 1400 CD2 HIS A 94 -9.842 14.586 -9.873 1.00 0.00 C ATOM 1401 CE1 HIS A 94 -10.655 13.269 -11.425 1.00 0.00 C ATOM 1402 NE2 HIS A 94 -10.732 14.484 -10.914 1.00 0.00 N ATOM 0 H HIS A 94 -7.337 12.043 -5.917 1.00 0.00 H new ATOM 0 HA HIS A 94 -9.252 13.726 -7.148 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -7.298 13.597 -8.879 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.811 11.938 -9.120 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -9.674 15.457 -9.257 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -11.236 12.895 -12.255 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -11.352 15.226 -11.239 1.00 0.00 H new ATOM 1411 N SER A 95 -10.639 11.559 -7.729 1.00 0.00 N ATOM 1412 CA SER A 95 -11.527 10.411 -7.591 1.00 0.00 C ATOM 1413 C SER A 95 -11.670 9.672 -8.918 1.00 0.00 C ATOM 1414 O SER A 95 -12.503 10.026 -9.751 1.00 0.00 O ATOM 1415 CB SER A 95 -12.902 10.860 -7.093 1.00 0.00 C ATOM 1416 OG SER A 95 -13.838 9.798 -7.153 1.00 0.00 O ATOM 0 H SER A 95 -11.009 12.310 -8.311 1.00 0.00 H new ATOM 0 HA SER A 95 -11.089 9.730 -6.861 1.00 0.00 H new ATOM 0 HB2 SER A 95 -12.821 11.220 -6.067 1.00 0.00 H new ATOM 0 HB3 SER A 95 -13.256 11.695 -7.697 1.00 0.00 H new ATOM 0 HG SER A 95 -14.708 10.110 -6.828 1.00 0.00 H new ATOM 1422 N GLY A 96 -10.849 8.643 -9.107 1.00 0.00 N ATOM 1423 CA GLY A 96 -10.899 7.870 -10.334 1.00 0.00 C ATOM 1424 C GLY A 96 -10.612 6.400 -10.105 1.00 0.00 C ATOM 1425 O GLY A 96 -11.530 5.583 -10.046 1.00 0.00 O ATOM 0 H GLY A 96 -10.150 8.331 -8.432 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -11.884 7.978 -10.788 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -10.175 8.272 -11.043 1.00 0.00 H new ATOM 1429 N GLU A 97 -9.332 6.062 -9.977 1.00 0.00 N ATOM 1430 CA GLU A 97 -8.927 4.678 -9.756 1.00 0.00 C ATOM 1431 C GLU A 97 -7.467 4.602 -9.319 1.00 0.00 C ATOM 1432 O GLU A 97 -6.720 5.575 -9.437 1.00 0.00 O ATOM 1433 CB GLU A 97 -9.133 3.854 -11.028 1.00 0.00 C ATOM 1434 CG GLU A 97 -8.112 4.145 -12.115 1.00 0.00 C ATOM 1435 CD GLU A 97 -8.259 5.539 -12.695 1.00 0.00 C ATOM 1436 OE1 GLU A 97 -9.396 5.920 -13.044 1.00 0.00 O ATOM 1437 OE2 GLU A 97 -7.236 6.248 -12.799 1.00 0.00 O ATOM 0 H GLU A 97 -8.559 6.726 -10.022 1.00 0.00 H new ATOM 0 HA GLU A 97 -9.549 4.267 -8.961 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -9.090 2.795 -10.775 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.132 4.048 -11.418 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -7.108 4.030 -11.706 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -8.217 3.410 -12.913 1.00 0.00 H new ATOM 1444 N LEU A 98 -7.067 3.441 -8.813 1.00 0.00 N ATOM 1445 CA LEU A 98 -5.697 3.237 -8.356 1.00 0.00 C ATOM 1446 C LEU A 98 -5.026 2.110 -9.135 1.00 0.00 C ATOM 1447 O LEU A 98 -5.545 0.997 -9.208 1.00 0.00 O ATOM 1448 CB LEU A 98 -5.679 2.918 -6.860 1.00 0.00 C ATOM 1449 CG LEU A 98 -4.309 2.958 -6.182 1.00 0.00 C ATOM 1450 CD1 LEU A 98 -3.846 4.395 -5.998 1.00 0.00 C ATOM 1451 CD2 LEU A 98 -4.355 2.235 -4.844 1.00 0.00 C ATOM 0 H LEU A 98 -7.672 2.626 -8.709 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.141 4.158 -8.532 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.335 3.624 -6.350 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.105 1.925 -6.715 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.592 2.447 -6.824 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -2.869 4.403 -5.514 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -3.773 4.881 -6.971 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -4.563 4.932 -5.377 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.371 2.273 -4.376 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.085 2.718 -4.195 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.641 1.195 -5.002 1.00 0.00 H new ATOM 1463 N MET A 99 -3.867 2.407 -9.715 1.00 0.00 N ATOM 1464 CA MET A 99 -3.123 1.418 -10.486 1.00 0.00 C ATOM 1465 C MET A 99 -1.871 0.974 -9.736 1.00 0.00 C ATOM 1466 O MET A 99 -0.874 1.696 -9.690 1.00 0.00 O ATOM 1467 CB MET A 99 -2.738 1.989 -11.852 1.00 0.00 C ATOM 1468 CG MET A 99 -2.433 0.924 -12.892 1.00 0.00 C ATOM 1469 SD MET A 99 -2.373 1.586 -14.568 1.00 0.00 S ATOM 1470 CE MET A 99 -3.846 0.851 -15.275 1.00 0.00 C ATOM 0 H MET A 99 -3.423 3.324 -9.665 1.00 0.00 H new ATOM 0 HA MET A 99 -3.765 0.549 -10.632 1.00 0.00 H new ATOM 0 HB2 MET A 99 -3.550 2.618 -12.216 1.00 0.00 H new ATOM 0 HB3 MET A 99 -1.865 2.631 -11.735 1.00 0.00 H new ATOM 0 HG2 MET A 99 -1.478 0.455 -12.657 1.00 0.00 H new ATOM 0 HG3 MET A 99 -3.192 0.144 -12.841 1.00 0.00 H new ATOM 0 HE1 MET A 99 -3.561 0.060 -15.968 1.00 0.00 H new ATOM 0 HE2 MET A 99 -4.461 0.432 -14.479 1.00 0.00 H new ATOM 0 HE3 MET A 99 -4.413 1.614 -15.808 1.00 0.00 H new ATOM 1480 N LEU A 100 -1.929 -0.217 -9.150 1.00 0.00 N ATOM 1481 CA LEU A 100 -0.800 -0.757 -8.402 1.00 0.00 C ATOM 1482 C LEU A 100 -0.056 -1.807 -9.221 1.00 0.00 C ATOM 1483 O LEU A 100 -0.634 -2.451 -10.097 1.00 0.00 O ATOM 1484 CB LEU A 100 -1.281 -1.369 -7.085 1.00 0.00 C ATOM 1485 CG LEU A 100 -2.200 -0.493 -6.234 1.00 0.00 C ATOM 1486 CD1 LEU A 100 -2.943 -1.336 -5.209 1.00 0.00 C ATOM 1487 CD2 LEU A 100 -1.403 0.606 -5.546 1.00 0.00 C ATOM 0 H LEU A 100 -2.746 -0.827 -9.179 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.114 0.062 -8.186 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.804 -2.299 -7.309 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.407 -1.631 -6.489 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.934 -0.026 -6.890 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.592 -0.695 -4.613 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.545 -2.086 -5.722 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.225 -1.832 -4.557 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.074 1.220 -4.945 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.646 0.158 -4.902 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.918 1.229 -6.298 1.00 0.00 H new ATOM 1499 N LEU A 101 1.230 -1.975 -8.931 1.00 0.00 N ATOM 1500 CA LEU A 101 2.054 -2.948 -9.639 1.00 0.00 C ATOM 1501 C LEU A 101 2.684 -3.939 -8.666 1.00 0.00 C ATOM 1502 O LEU A 101 3.680 -3.634 -8.010 1.00 0.00 O ATOM 1503 CB LEU A 101 3.146 -2.236 -10.438 1.00 0.00 C ATOM 1504 CG LEU A 101 3.759 -3.029 -11.593 1.00 0.00 C ATOM 1505 CD1 LEU A 101 2.693 -3.394 -12.614 1.00 0.00 C ATOM 1506 CD2 LEU A 101 4.880 -2.236 -12.249 1.00 0.00 C ATOM 0 H LEU A 101 1.724 -1.450 -8.210 1.00 0.00 H new ATOM 0 HA LEU A 101 1.412 -3.500 -10.325 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.730 -1.311 -10.839 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.945 -1.955 -9.752 1.00 0.00 H new ATOM 0 HG LEU A 101 4.180 -3.951 -11.193 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.147 -3.958 -13.429 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.925 -4.002 -12.136 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.242 -2.484 -13.010 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.304 -2.816 -13.069 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.483 -1.297 -12.636 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.656 -2.026 -11.513 1.00 0.00 H new ATOM 1518 N VAL A 102 2.098 -5.129 -8.579 1.00 0.00 N ATOM 1519 CA VAL A 102 2.603 -6.167 -7.688 1.00 0.00 C ATOM 1520 C VAL A 102 3.244 -7.304 -8.477 1.00 0.00 C ATOM 1521 O VAL A 102 2.764 -7.678 -9.547 1.00 0.00 O ATOM 1522 CB VAL A 102 1.482 -6.740 -6.801 1.00 0.00 C ATOM 1523 CG1 VAL A 102 0.764 -5.623 -6.059 1.00 0.00 C ATOM 1524 CG2 VAL A 102 0.504 -7.552 -7.637 1.00 0.00 C ATOM 0 H VAL A 102 1.273 -5.398 -9.115 1.00 0.00 H new ATOM 0 HA VAL A 102 3.355 -5.700 -7.052 1.00 0.00 H new ATOM 0 HB VAL A 102 1.931 -7.404 -6.062 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.025 -6.047 -5.438 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.475 -5.089 -5.429 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.326 -4.931 -6.778 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.281 -7.949 -6.994 1.00 0.00 H new ATOM 0 HG22 VAL A 102 0.060 -6.913 -8.400 1.00 0.00 H new ATOM 0 HG23 VAL A 102 1.032 -8.376 -8.116 1.00 0.00 H new ATOM 1534 N ARG A 103 4.330 -7.850 -7.941 1.00 0.00 N ATOM 1535 CA ARG A 103 5.037 -8.944 -8.595 1.00 0.00 C ATOM 1536 C ARG A 103 4.456 -10.293 -8.179 1.00 0.00 C ATOM 1537 O ARG A 103 4.164 -10.536 -7.008 1.00 0.00 O ATOM 1538 CB ARG A 103 6.528 -8.893 -8.254 1.00 0.00 C ATOM 1539 CG ARG A 103 7.424 -9.430 -9.358 1.00 0.00 C ATOM 1540 CD ARG A 103 7.587 -10.939 -9.258 1.00 0.00 C ATOM 1541 NE ARG A 103 8.089 -11.518 -10.501 1.00 0.00 N ATOM 1542 CZ ARG A 103 8.649 -12.720 -10.577 1.00 0.00 C ATOM 1543 NH1 ARG A 103 8.778 -13.466 -9.489 1.00 0.00 N ATOM 1544 NH2 ARG A 103 9.082 -13.179 -11.745 1.00 0.00 N ATOM 0 H ARG A 103 4.740 -7.553 -7.055 1.00 0.00 H new ATOM 0 HA ARG A 103 4.913 -8.830 -9.672 1.00 0.00 H new ATOM 0 HB2 ARG A 103 6.808 -7.862 -8.040 1.00 0.00 H new ATOM 0 HB3 ARG A 103 6.704 -9.466 -7.344 1.00 0.00 H new ATOM 0 HG2 ARG A 103 7.001 -9.172 -10.329 1.00 0.00 H new ATOM 0 HG3 ARG A 103 8.402 -8.952 -9.299 1.00 0.00 H new ATOM 0 HD2 ARG A 103 8.272 -11.177 -8.444 1.00 0.00 H new ATOM 0 HD3 ARG A 103 6.627 -11.392 -9.009 1.00 0.00 H new ATOM 0 HE ARG A 103 8.005 -10.970 -11.357 1.00 0.00 H new ATOM 0 HH11 ARG A 103 8.447 -13.118 -8.589 1.00 0.00 H new ATOM 0 HH12 ARG A 103 9.209 -14.389 -9.551 1.00 0.00 H new ATOM 0 HH21 ARG A 103 8.985 -12.608 -12.585 1.00 0.00 H new ATOM 0 HH22 ARG A 103 9.512 -14.102 -11.802 1.00 0.00 H new ATOM 1558 N PRO A 104 4.283 -11.190 -9.161 1.00 0.00 N ATOM 1559 CA PRO A 104 3.735 -12.529 -8.921 1.00 0.00 C ATOM 1560 C PRO A 104 4.699 -13.419 -8.144 1.00 0.00 C ATOM 1561 O PRO A 104 5.900 -13.430 -8.409 1.00 0.00 O ATOM 1562 CB PRO A 104 3.519 -13.081 -10.333 1.00 0.00 C ATOM 1563 CG PRO A 104 4.493 -12.340 -11.183 1.00 0.00 C ATOM 1564 CD PRO A 104 4.609 -10.968 -10.579 1.00 0.00 C ATOM 0 HA PRO A 104 2.828 -12.496 -8.317 1.00 0.00 H new ATOM 0 HB2 PRO A 104 3.699 -14.155 -10.370 1.00 0.00 H new ATOM 0 HB3 PRO A 104 2.495 -12.917 -10.670 1.00 0.00 H new ATOM 0 HG2 PRO A 104 5.460 -12.843 -11.198 1.00 0.00 H new ATOM 0 HG3 PRO A 104 4.147 -12.284 -12.215 1.00 0.00 H new ATOM 0 HD2 PRO A 104 5.612 -10.559 -10.701 1.00 0.00 H new ATOM 0 HD3 PRO A 104 3.919 -10.265 -11.044 1.00 0.00 H new ATOM 1572 N ASN A 105 4.163 -14.165 -7.183 1.00 0.00 N ATOM 1573 CA ASN A 105 4.976 -15.059 -6.366 1.00 0.00 C ATOM 1574 C ASN A 105 4.558 -16.512 -6.568 1.00 0.00 C ATOM 1575 O ASN A 105 3.609 -16.987 -5.946 1.00 0.00 O ATOM 1576 CB ASN A 105 4.857 -14.683 -4.888 1.00 0.00 C ATOM 1577 CG ASN A 105 5.897 -15.375 -4.029 1.00 0.00 C ATOM 1578 OD1 ASN A 105 7.099 -15.249 -4.267 1.00 0.00 O ATOM 1579 ND2 ASN A 105 5.439 -16.112 -3.024 1.00 0.00 N ATOM 0 H ASN A 105 3.170 -14.168 -6.951 1.00 0.00 H new ATOM 0 HA ASN A 105 6.015 -14.952 -6.679 1.00 0.00 H new ATOM 0 HB2 ASN A 105 4.962 -13.603 -4.781 1.00 0.00 H new ATOM 0 HB3 ASN A 105 3.861 -14.944 -4.529 1.00 0.00 H new ATOM 0 HD21 ASN A 105 6.092 -16.602 -2.412 1.00 0.00 H new ATOM 0 HD22 ASN A 105 4.435 -16.188 -2.864 1.00 0.00 H new ATOM 1586 N ALA A 106 5.274 -17.212 -7.442 1.00 0.00 N ATOM 1587 CA ALA A 106 4.979 -18.611 -7.725 1.00 0.00 C ATOM 1588 C ALA A 106 5.631 -19.528 -6.696 1.00 0.00 C ATOM 1589 O ALA A 106 5.878 -20.704 -6.965 1.00 0.00 O ATOM 1590 CB ALA A 106 5.442 -18.975 -9.128 1.00 0.00 C ATOM 0 H ALA A 106 6.063 -16.833 -7.966 1.00 0.00 H new ATOM 0 HA ALA A 106 3.899 -18.749 -7.664 1.00 0.00 H new ATOM 0 HB1 ALA A 106 5.215 -20.023 -9.326 1.00 0.00 H new ATOM 0 HB2 ALA A 106 4.926 -18.349 -9.855 1.00 0.00 H new ATOM 0 HB3 ALA A 106 6.517 -18.815 -9.209 1.00 0.00 H new ATOM 1596 N VAL A 107 5.909 -18.982 -5.516 1.00 0.00 N ATOM 1597 CA VAL A 107 6.532 -19.752 -4.445 1.00 0.00 C ATOM 1598 C VAL A 107 5.549 -20.010 -3.309 1.00 0.00 C ATOM 1599 O VAL A 107 5.153 -19.088 -2.595 1.00 0.00 O ATOM 1600 CB VAL A 107 7.771 -19.030 -3.883 1.00 0.00 C ATOM 1601 CG1 VAL A 107 8.377 -19.823 -2.736 1.00 0.00 C ATOM 1602 CG2 VAL A 107 8.797 -18.798 -4.982 1.00 0.00 C ATOM 0 H VAL A 107 5.713 -18.010 -5.277 1.00 0.00 H new ATOM 0 HA VAL A 107 6.840 -20.704 -4.878 1.00 0.00 H new ATOM 0 HB VAL A 107 7.460 -18.059 -3.497 1.00 0.00 H new ATOM 0 HG11 VAL A 107 9.251 -19.297 -2.352 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.640 -19.932 -1.940 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.674 -20.809 -3.093 1.00 0.00 H new ATOM 0 HG21 VAL A 107 9.666 -18.287 -4.567 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.105 -19.756 -5.400 1.00 0.00 H new ATOM 0 HG23 VAL A 107 8.356 -18.184 -5.768 1.00 0.00 H new ATOM 1612 N TYR A 108 5.159 -21.269 -3.147 1.00 0.00 N ATOM 1613 CA TYR A 108 4.219 -21.649 -2.099 1.00 0.00 C ATOM 1614 C TYR A 108 4.759 -22.819 -1.282 1.00 0.00 C ATOM 1615 O TYR A 108 5.809 -23.380 -1.598 1.00 0.00 O ATOM 1616 CB TYR A 108 2.866 -22.019 -2.707 1.00 0.00 C ATOM 1617 CG TYR A 108 2.975 -22.821 -3.985 1.00 0.00 C ATOM 1618 CD1 TYR A 108 3.273 -24.178 -3.953 1.00 0.00 C ATOM 1619 CD2 TYR A 108 2.778 -22.222 -5.223 1.00 0.00 C ATOM 1620 CE1 TYR A 108 3.375 -24.914 -5.118 1.00 0.00 C ATOM 1621 CE2 TYR A 108 2.876 -22.951 -6.393 1.00 0.00 C ATOM 1622 CZ TYR A 108 3.175 -24.296 -6.335 1.00 0.00 C ATOM 1623 OH TYR A 108 3.274 -25.026 -7.497 1.00 0.00 O ATOM 0 H TYR A 108 5.479 -22.044 -3.728 1.00 0.00 H new ATOM 0 HA TYR A 108 4.089 -20.794 -1.435 1.00 0.00 H new ATOM 0 HB2 TYR A 108 2.293 -22.591 -1.977 1.00 0.00 H new ATOM 0 HB3 TYR A 108 2.305 -21.106 -2.908 1.00 0.00 H new ATOM 0 HD1 TYR A 108 3.427 -24.665 -3.002 1.00 0.00 H new ATOM 0 HD2 TYR A 108 2.544 -21.169 -5.272 1.00 0.00 H new ATOM 0 HE1 TYR A 108 3.610 -25.967 -5.076 1.00 0.00 H new ATOM 0 HE2 TYR A 108 2.719 -22.470 -7.347 1.00 0.00 H new ATOM 0 HH TYR A 108 3.104 -24.442 -8.266 1.00 0.00 H new ATOM 1633 N ASP A 109 4.033 -23.182 -0.230 1.00 0.00 N ATOM 1634 CA ASP A 109 4.437 -24.286 0.633 1.00 0.00 C ATOM 1635 C ASP A 109 3.247 -24.818 1.426 1.00 0.00 C ATOM 1636 O ASP A 109 2.275 -24.101 1.664 1.00 0.00 O ATOM 1637 CB ASP A 109 5.543 -23.837 1.588 1.00 0.00 C ATOM 1638 CG ASP A 109 5.639 -24.718 2.819 1.00 0.00 C ATOM 1639 OD1 ASP A 109 4.845 -24.509 3.760 1.00 0.00 O ATOM 1640 OD2 ASP A 109 6.507 -25.615 2.841 1.00 0.00 O ATOM 0 H ASP A 109 3.162 -22.728 0.046 1.00 0.00 H new ATOM 0 HA ASP A 109 4.818 -25.088 0.001 1.00 0.00 H new ATOM 0 HB2 ASP A 109 6.498 -23.846 1.063 1.00 0.00 H new ATOM 0 HB3 ASP A 109 5.358 -22.808 1.895 1.00 0.00 H new ATOM 1645 N VAL A 110 3.331 -26.081 1.833 1.00 0.00 N ATOM 1646 CA VAL A 110 2.262 -26.710 2.600 1.00 0.00 C ATOM 1647 C VAL A 110 2.746 -27.116 3.987 1.00 0.00 C ATOM 1648 O VAL A 110 3.456 -28.110 4.143 1.00 0.00 O ATOM 1649 CB VAL A 110 1.709 -27.952 1.877 1.00 0.00 C ATOM 1650 CG1 VAL A 110 0.624 -28.617 2.712 1.00 0.00 C ATOM 1651 CG2 VAL A 110 1.179 -27.576 0.502 1.00 0.00 C ATOM 0 H VAL A 110 4.128 -26.689 1.644 1.00 0.00 H new ATOM 0 HA VAL A 110 1.466 -25.972 2.698 1.00 0.00 H new ATOM 0 HB VAL A 110 2.522 -28.666 1.745 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.245 -29.493 2.185 1.00 0.00 H new ATOM 0 HG12 VAL A 110 1.040 -28.923 3.672 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.191 -27.912 2.878 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.792 -28.466 0.005 1.00 0.00 H new ATOM 0 HG22 VAL A 110 0.379 -26.843 0.608 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.985 -27.149 -0.095 1.00 0.00 H new ATOM 1661 N VAL A 111 2.358 -26.340 4.995 1.00 0.00 N ATOM 1662 CA VAL A 111 2.751 -26.620 6.370 1.00 0.00 C ATOM 1663 C VAL A 111 1.561 -27.093 7.197 1.00 0.00 C ATOM 1664 O VAL A 111 0.427 -26.677 6.964 1.00 0.00 O ATOM 1665 CB VAL A 111 3.367 -25.378 7.042 1.00 0.00 C ATOM 1666 CG1 VAL A 111 2.357 -24.241 7.090 1.00 0.00 C ATOM 1667 CG2 VAL A 111 3.865 -25.719 8.438 1.00 0.00 C ATOM 0 H VAL A 111 1.772 -25.513 4.884 1.00 0.00 H new ATOM 0 HA VAL A 111 3.499 -27.411 6.330 1.00 0.00 H new ATOM 0 HB VAL A 111 4.220 -25.050 6.447 1.00 0.00 H new ATOM 0 HG11 VAL A 111 2.810 -23.372 7.568 1.00 0.00 H new ATOM 0 HG12 VAL A 111 2.054 -23.981 6.076 1.00 0.00 H new ATOM 0 HG13 VAL A 111 1.483 -24.555 7.661 1.00 0.00 H new ATOM 0 HG21 VAL A 111 4.297 -24.830 8.897 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.032 -26.073 9.045 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.624 -26.499 8.373 1.00 0.00 H new ATOM 1677 N GLU A 112 1.828 -27.966 8.163 1.00 0.00 N ATOM 1678 CA GLU A 112 0.777 -28.497 9.024 1.00 0.00 C ATOM 1679 C GLU A 112 1.337 -28.886 10.389 1.00 0.00 C ATOM 1680 O GLU A 112 2.503 -29.262 10.508 1.00 0.00 O ATOM 1681 CB GLU A 112 0.113 -29.709 8.368 1.00 0.00 C ATOM 1682 CG GLU A 112 0.970 -30.964 8.399 1.00 0.00 C ATOM 1683 CD GLU A 112 0.961 -31.643 9.755 1.00 0.00 C ATOM 1684 OE1 GLU A 112 -0.047 -31.505 10.480 1.00 0.00 O ATOM 1685 OE2 GLU A 112 1.960 -32.312 10.091 1.00 0.00 O ATOM 0 H GLU A 112 2.762 -28.320 8.369 1.00 0.00 H new ATOM 0 HA GLU A 112 0.030 -27.716 9.166 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -0.832 -29.912 8.872 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -0.124 -29.466 7.332 1.00 0.00 H new ATOM 0 HG2 GLU A 112 0.611 -31.663 7.644 1.00 0.00 H new ATOM 0 HG3 GLU A 112 1.995 -30.706 8.133 1.00 0.00 H new ATOM 1692 N GLU A 113 0.497 -28.793 11.415 1.00 0.00 N ATOM 1693 CA GLU A 113 0.909 -29.135 12.772 1.00 0.00 C ATOM 1694 C GLU A 113 -0.282 -29.108 13.725 1.00 0.00 C ATOM 1695 O GLU A 113 -0.792 -28.041 14.069 1.00 0.00 O ATOM 1696 CB GLU A 113 1.989 -28.166 13.260 1.00 0.00 C ATOM 1697 CG GLU A 113 2.690 -28.625 14.528 1.00 0.00 C ATOM 1698 CD GLU A 113 3.407 -27.494 15.239 1.00 0.00 C ATOM 1699 OE1 GLU A 113 2.769 -26.449 15.488 1.00 0.00 O ATOM 1700 OE2 GLU A 113 4.606 -27.654 15.547 1.00 0.00 O ATOM 0 H GLU A 113 -0.472 -28.484 11.333 1.00 0.00 H new ATOM 0 HA GLU A 113 1.317 -30.146 12.757 1.00 0.00 H new ATOM 0 HB2 GLU A 113 2.731 -28.035 12.472 1.00 0.00 H new ATOM 0 HB3 GLU A 113 1.537 -27.190 13.438 1.00 0.00 H new ATOM 0 HG2 GLU A 113 1.958 -29.068 15.203 1.00 0.00 H new ATOM 0 HG3 GLU A 113 3.408 -29.406 14.279 1.00 0.00 H new ATOM 1707 N SER A 114 -0.721 -30.289 14.148 1.00 0.00 N ATOM 1708 CA SER A 114 -1.855 -30.402 15.058 1.00 0.00 C ATOM 1709 C SER A 114 -1.478 -31.207 16.298 1.00 0.00 C ATOM 1710 O SER A 114 -0.450 -31.883 16.324 1.00 0.00 O ATOM 1711 CB SER A 114 -3.040 -31.061 14.350 1.00 0.00 C ATOM 1712 OG SER A 114 -2.711 -32.367 13.911 1.00 0.00 O ATOM 0 H SER A 114 -0.309 -31.181 13.875 1.00 0.00 H new ATOM 0 HA SER A 114 -2.140 -29.397 15.371 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.893 -31.106 15.027 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.342 -30.453 13.497 1.00 0.00 H new ATOM 0 HG SER A 114 -3.486 -32.767 13.463 1.00 0.00 H new ATOM 1718 N GLY A 115 -2.318 -31.128 17.325 1.00 0.00 N ATOM 1719 CA GLY A 115 -2.057 -31.853 18.555 1.00 0.00 C ATOM 1720 C GLY A 115 -3.314 -32.083 19.370 1.00 0.00 C ATOM 1721 O GLY A 115 -4.219 -31.250 19.405 1.00 0.00 O ATOM 0 H GLY A 115 -3.175 -30.575 17.327 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -1.601 -32.814 18.317 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -1.336 -31.298 19.154 1.00 0.00 H new ATOM 1725 N PRO A 116 -3.382 -33.241 20.045 1.00 0.00 N ATOM 1726 CA PRO A 116 -4.533 -33.606 20.875 1.00 0.00 C ATOM 1727 C PRO A 116 -4.634 -32.753 22.135 1.00 0.00 C ATOM 1728 O PRO A 116 -3.770 -31.917 22.400 1.00 0.00 O ATOM 1729 CB PRO A 116 -4.258 -35.067 21.240 1.00 0.00 C ATOM 1730 CG PRO A 116 -2.778 -35.208 21.150 1.00 0.00 C ATOM 1731 CD PRO A 116 -2.340 -34.281 20.050 1.00 0.00 C ATOM 0 HA PRO A 116 -5.477 -33.453 20.352 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -4.617 -35.299 22.243 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -4.763 -35.748 20.555 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -2.303 -34.944 22.095 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -2.497 -36.237 20.928 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -1.354 -33.861 20.248 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -2.281 -34.795 19.091 1.00 0.00 H new ATOM 1739 N SER A 117 -5.693 -32.969 22.908 1.00 0.00 N ATOM 1740 CA SER A 117 -5.908 -32.217 24.139 1.00 0.00 C ATOM 1741 C SER A 117 -5.876 -33.141 25.353 1.00 0.00 C ATOM 1742 O SER A 117 -6.469 -34.220 25.342 1.00 0.00 O ATOM 1743 CB SER A 117 -7.246 -31.477 24.082 1.00 0.00 C ATOM 1744 OG SER A 117 -7.278 -30.564 22.999 1.00 0.00 O ATOM 0 H SER A 117 -6.416 -33.659 22.704 1.00 0.00 H new ATOM 0 HA SER A 117 -5.102 -31.490 24.237 1.00 0.00 H new ATOM 0 HB2 SER A 117 -8.059 -32.196 23.980 1.00 0.00 H new ATOM 0 HB3 SER A 117 -7.410 -30.942 25.018 1.00 0.00 H new ATOM 0 HG SER A 117 -8.144 -30.105 22.983 1.00 0.00 H new ATOM 1750 N SER A 118 -5.179 -32.709 26.399 1.00 0.00 N ATOM 1751 CA SER A 118 -5.065 -33.498 27.620 1.00 0.00 C ATOM 1752 C SER A 118 -6.048 -33.006 28.678 1.00 0.00 C ATOM 1753 O SER A 118 -6.820 -33.785 29.235 1.00 0.00 O ATOM 1754 CB SER A 118 -3.637 -33.432 28.164 1.00 0.00 C ATOM 1755 OG SER A 118 -2.789 -34.339 27.482 1.00 0.00 O ATOM 0 H SER A 118 -4.685 -31.817 26.425 1.00 0.00 H new ATOM 0 HA SER A 118 -5.306 -34.533 27.378 1.00 0.00 H new ATOM 0 HB2 SER A 118 -3.251 -32.418 28.058 1.00 0.00 H new ATOM 0 HB3 SER A 118 -3.639 -33.662 29.229 1.00 0.00 H new ATOM 0 HG SER A 118 -1.882 -34.276 27.847 1.00 0.00 H new ATOM 1761 N GLY A 119 -6.013 -31.705 28.950 1.00 0.00 N ATOM 1762 CA GLY A 119 -6.904 -31.130 29.941 1.00 0.00 C ATOM 1763 C GLY A 119 -7.523 -29.826 29.476 1.00 0.00 C ATOM 1764 O GLY A 119 -7.988 -29.722 28.341 1.00 0.00 O ATOM 0 H GLY A 119 -5.384 -31.039 28.502 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -7.696 -31.843 30.171 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -6.352 -30.958 30.865 1.00 0.00 H new TER 1768 GLY A 119