USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 796 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 117 CYS SG : rot -120:sc= -0.409 USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 99 ASN : amide:sc= 0.964 K(o=1.7,f=-6.3!) USER MOD Set 2.2: A 101 THR OG1 : rot 27:sc= 0.767 USER MOD Set 3.1: A 91 LYS NZ :NH3+ 168:sc= 0.788 (180deg=-0.0331) USER MOD Set 3.2: A 95 TYR OH : rot -5:sc= 1.83 USER MOD Set 4.1: A 40 GLN : amide:sc= 0.00116 X(o=-0.54,f=-0.19) USER MOD Set 4.2: A 50 GLN : amide:sc= -0.543 X(o=-0.54,f=-0.19) USER MOD Set 5.1: A 3 HIS : no HD1:sc= 0 X(o=0.32,f=0.3) USER MOD Set 5.2: A 5 SER OG : rot 52:sc= 0.325 USER MOD Single : A 4 ASN : amide:sc= -0.0989 K(o=-0.099,f=-1.2) USER MOD Single : A 8 SER OG : rot 180:sc= 0.0342 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc= -0.294 X(o=-0.29,f=0) USER MOD Single : A 15 GLN : amide:sc= -0.0589 K(o=-0.059,f=-1.1) USER MOD Single : A 32 GLN : amide:sc= -0.0809 X(o=-0.081,f=-0.081) USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 45 CYS SG : rot -2:sc= 0.0885 USER MOD Single : A 48 SER OG : rot -74:sc= 0.812 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.185 X(o=-0.18,f=0) USER MOD Single : A 57 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0276) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 GLN : amide:sc= 0.548 K(o=0.55,f=-6.4!) USER MOD Single : A 102 MET CE :methyl -169:sc= -0.0729 (180deg=-0.336) USER MOD Single : A 119 ASN : amide:sc= 0.838 K(o=0.84,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 134:sc= 0.65 USER MOD Single : A 129 ASN : amide:sc=-0.000765 X(o=-0.00077,f=0) USER MOD Single : A 134 THR OG1 : rot -65:sc= 0.88 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 113.648 -21.199 28.144 1.00 53.52 N ATOM 35 CA HIS A 3 112.376 -21.853 27.878 1.00 42.22 C ATOM 36 C HIS A 3 111.315 -21.372 28.873 1.00 64.31 C ATOM 37 O HIS A 3 111.583 -21.291 30.071 1.00 64.22 O ATOM 38 CB HIS A 3 112.557 -23.372 27.975 1.00 25.35 C ATOM 39 CG HIS A 3 111.274 -24.142 27.793 1.00 42.33 C ATOM 40 ND1 HIS A 3 110.529 -24.610 28.866 1.00 31.35 N ATOM 41 CD2 HIS A 3 110.576 -24.525 26.672 1.00 33.22 C ATOM 42 CE1 HIS A 3 109.461 -25.250 28.360 1.00 31.23 C ATOM 43 NE2 HIS A 3 109.428 -25.228 27.026 1.00 72.35 N ATOM 0 HA HIS A 3 112.040 -21.598 26.873 1.00 42.22 H new ATOM 0 HB2 HIS A 3 113.275 -23.694 27.220 1.00 25.35 H new ATOM 0 HB3 HIS A 3 112.985 -23.618 28.947 1.00 25.35 H new ATOM 0 HD2 HIS A 3 110.877 -24.310 25.657 1.00 33.22 H new ATOM 0 HE1 HIS A 3 108.709 -25.731 28.968 1.00 31.23 H new ATOM 0 HE2 HIS A 3 108.724 -25.633 26.409 1.00 72.35 H new ATOM 51 N ASN A 4 110.107 -21.081 28.375 1.00 53.02 N ATOM 52 CA ASN A 4 108.965 -20.707 29.194 1.00 51.42 C ATOM 53 C ASN A 4 107.680 -21.088 28.459 1.00 2.23 C ATOM 54 O ASN A 4 107.133 -20.289 27.699 1.00 72.32 O ATOM 55 CB ASN A 4 109.016 -19.207 29.526 1.00 32.30 C ATOM 56 CG ASN A 4 107.824 -18.743 30.365 1.00 24.12 C ATOM 57 OD1 ASN A 4 107.079 -19.551 30.916 1.00 34.31 O ATOM 58 ND2 ASN A 4 107.638 -17.426 30.467 1.00 62.24 N ATOM 0 H ASN A 4 109.900 -21.101 27.376 1.00 53.02 H new ATOM 0 HA ASN A 4 108.990 -21.244 30.142 1.00 51.42 H new ATOM 0 HB2 ASN A 4 109.939 -18.990 30.064 1.00 32.30 H new ATOM 0 HB3 ASN A 4 109.046 -18.635 28.598 1.00 32.30 H new ATOM 0 HD21 ASN A 4 106.859 -17.062 31.015 1.00 62.24 H new ATOM 0 HD22 ASN A 4 108.275 -16.783 29.997 1.00 62.24 H new ATOM 65 N SER A 5 107.187 -22.305 28.714 1.00 2.24 N ATOM 66 CA SER A 5 105.900 -22.774 28.223 1.00 74.33 C ATOM 67 C SER A 5 104.778 -22.147 29.057 1.00 53.34 C ATOM 68 O SER A 5 104.182 -22.813 29.901 1.00 24.03 O ATOM 69 CB SER A 5 105.870 -24.307 28.274 1.00 53.43 C ATOM 70 OG SER A 5 106.165 -24.764 29.579 1.00 54.51 O ATOM 0 H SER A 5 107.683 -22.997 29.276 1.00 2.24 H new ATOM 0 HA SER A 5 105.750 -22.471 27.187 1.00 74.33 H new ATOM 0 HB2 SER A 5 104.888 -24.668 27.969 1.00 53.43 H new ATOM 0 HB3 SER A 5 106.593 -24.715 27.567 1.00 53.43 H new ATOM 0 HG SER A 5 105.587 -24.307 30.224 1.00 54.51 H new ATOM 76 N ILE A 6 104.499 -20.861 28.820 1.00 64.33 N ATOM 77 CA ILE A 6 103.435 -20.123 29.490 1.00 14.11 C ATOM 78 C ILE A 6 102.061 -20.595 28.995 1.00 64.03 C ATOM 79 O ILE A 6 101.941 -21.090 27.875 1.00 71.43 O ATOM 80 CB ILE A 6 103.660 -18.610 29.289 1.00 11.45 C ATOM 81 CG1 ILE A 6 102.771 -17.788 30.241 1.00 52.33 C ATOM 82 CG2 ILE A 6 103.443 -18.190 27.827 1.00 51.14 C ATOM 83 CD1 ILE A 6 103.158 -16.308 30.280 1.00 62.25 C ATOM 0 H ILE A 6 105.018 -20.299 28.145 1.00 64.33 H new ATOM 0 HA ILE A 6 103.458 -20.319 30.562 1.00 14.11 H new ATOM 0 HB ILE A 6 104.701 -18.401 29.534 1.00 11.45 H new ATOM 0 HG12 ILE A 6 101.731 -17.879 29.929 1.00 52.33 H new ATOM 0 HG13 ILE A 6 102.840 -18.204 31.246 1.00 52.33 H new ATOM 0 HG21 ILE A 6 103.611 -17.118 27.728 1.00 51.14 H new ATOM 0 HG22 ILE A 6 104.142 -18.728 27.186 1.00 51.14 H new ATOM 0 HG23 ILE A 6 102.422 -18.426 27.528 1.00 51.14 H new ATOM 0 HD11 ILE A 6 102.498 -15.777 30.967 1.00 62.25 H new ATOM 0 HD12 ILE A 6 104.189 -16.210 30.619 1.00 62.25 H new ATOM 0 HD13 ILE A 6 103.062 -15.880 29.282 1.00 62.25 H new ATOM 95 N ARG A 7 101.030 -20.442 29.837 1.00 22.20 N ATOM 96 CA ARG A 7 99.636 -20.729 29.513 1.00 45.13 C ATOM 97 C ARG A 7 98.757 -19.548 29.934 1.00 65.32 C ATOM 98 O ARG A 7 99.188 -18.689 30.704 1.00 41.22 O ATOM 99 CB ARG A 7 99.165 -22.017 30.211 1.00 23.53 C ATOM 100 CG ARG A 7 99.911 -23.275 29.745 1.00 11.40 C ATOM 101 CD ARG A 7 101.045 -23.663 30.700 1.00 2.33 C ATOM 102 NE ARG A 7 101.788 -24.821 30.185 1.00 73.44 N ATOM 103 CZ ARG A 7 102.848 -25.385 30.788 1.00 53.15 C ATOM 104 NH1 ARG A 7 103.283 -24.934 31.974 1.00 41.02 N ATOM 105 NH2 ARG A 7 103.482 -26.405 30.193 1.00 3.43 N ATOM 0 H ARG A 7 101.153 -20.104 30.792 1.00 22.20 H new ATOM 0 HA ARG A 7 99.551 -20.877 28.436 1.00 45.13 H new ATOM 0 HB2 ARG A 7 99.295 -21.905 31.287 1.00 23.53 H new ATOM 0 HB3 ARG A 7 98.098 -22.149 30.030 1.00 23.53 H new ATOM 0 HG2 ARG A 7 99.207 -24.103 29.664 1.00 11.40 H new ATOM 0 HG3 ARG A 7 100.319 -23.105 28.749 1.00 11.40 H new ATOM 0 HD2 ARG A 7 101.722 -22.819 30.829 1.00 2.33 H new ATOM 0 HD3 ARG A 7 100.635 -23.896 31.683 1.00 2.33 H new ATOM 0 HE ARG A 7 101.476 -25.227 29.303 1.00 73.44 H new ATOM 0 HH11 ARG A 7 102.808 -24.154 32.429 1.00 41.02 H new ATOM 0 HH12 ARG A 7 104.089 -25.371 32.421 1.00 41.02 H new ATOM 0 HH21 ARG A 7 103.159 -26.748 29.288 1.00 3.43 H new ATOM 0 HH22 ARG A 7 104.287 -26.838 30.645 1.00 3.43 H new ATOM 119 N SER A 8 97.519 -19.519 29.427 1.00 11.01 N ATOM 120 CA SER A 8 96.511 -18.516 29.748 1.00 71.45 C ATOM 121 C SER A 8 95.119 -19.154 29.646 1.00 44.54 C ATOM 122 O SER A 8 95.001 -20.353 29.390 1.00 75.02 O ATOM 123 CB SER A 8 96.672 -17.316 28.803 1.00 53.45 C ATOM 124 OG SER A 8 95.837 -16.246 29.197 1.00 11.32 O ATOM 0 H SER A 8 97.186 -20.217 28.762 1.00 11.01 H new ATOM 0 HA SER A 8 96.636 -18.151 30.768 1.00 71.45 H new ATOM 0 HB2 SER A 8 97.712 -16.988 28.799 1.00 53.45 H new ATOM 0 HB3 SER A 8 96.428 -17.616 27.784 1.00 53.45 H new ATOM 0 HG SER A 8 95.958 -15.493 28.582 1.00 11.32 H new ATOM 130 N GLY A 9 94.067 -18.355 29.851 1.00 34.10 N ATOM 131 CA GLY A 9 92.687 -18.809 29.798 1.00 52.30 C ATOM 132 C GLY A 9 91.721 -17.630 29.886 1.00 34.41 C ATOM 133 O GLY A 9 92.132 -16.473 29.807 1.00 35.31 O ATOM 0 H GLY A 9 94.159 -17.361 30.061 1.00 34.10 H new ATOM 0 HA2 GLY A 9 92.516 -19.356 28.871 1.00 52.30 H new ATOM 0 HA3 GLY A 9 92.496 -19.502 30.617 1.00 52.30 H new ATOM 137 N HIS A 10 90.430 -17.938 30.049 1.00 34.11 N ATOM 138 CA HIS A 10 89.345 -16.970 30.149 1.00 55.11 C ATOM 139 C HIS A 10 88.161 -17.620 30.873 1.00 13.22 C ATOM 140 O HIS A 10 88.258 -18.766 31.313 1.00 23.44 O ATOM 141 CB HIS A 10 88.959 -16.476 28.747 1.00 15.32 C ATOM 142 CG HIS A 10 88.456 -17.574 27.845 1.00 21.00 C ATOM 143 ND1 HIS A 10 89.301 -18.311 27.030 1.00 70.04 N ATOM 144 CD2 HIS A 10 87.202 -18.095 27.634 1.00 23.31 C ATOM 145 CE1 HIS A 10 88.545 -19.220 26.391 1.00 51.14 C ATOM 146 NE2 HIS A 10 87.253 -19.140 26.717 1.00 31.35 N ATOM 0 H HIS A 10 90.106 -18.903 30.117 1.00 34.11 H new ATOM 0 HA HIS A 10 89.662 -16.101 30.726 1.00 55.11 H new ATOM 0 HB2 HIS A 10 88.189 -15.710 28.839 1.00 15.32 H new ATOM 0 HB3 HIS A 10 89.826 -16.004 28.284 1.00 15.32 H new ATOM 0 HD2 HIS A 10 86.301 -17.742 28.114 1.00 23.31 H new ATOM 0 HE1 HIS A 10 88.941 -19.939 25.689 1.00 51.14 H new ATOM 0 HE2 HIS A 10 86.482 -19.712 26.373 1.00 31.35 H new ATOM 154 N GLY A 11 87.042 -16.896 30.988 1.00 72.42 N ATOM 155 CA GLY A 11 85.829 -17.386 31.624 1.00 43.45 C ATOM 156 C GLY A 11 84.594 -16.669 31.085 1.00 64.14 C ATOM 157 O GLY A 11 84.673 -15.933 30.102 1.00 73.12 O ATOM 0 H GLY A 11 86.959 -15.942 30.635 1.00 72.42 H new ATOM 0 HA2 GLY A 11 85.734 -18.458 31.453 1.00 43.45 H new ATOM 0 HA3 GLY A 11 85.896 -17.240 32.702 1.00 43.45 H new ATOM 161 N GLY A 12 83.450 -16.896 31.741 1.00 12.13 N ATOM 162 CA GLY A 12 82.165 -16.325 31.371 1.00 51.20 C ATOM 163 C GLY A 12 81.174 -16.461 32.526 1.00 41.22 C ATOM 164 O GLY A 12 81.558 -16.830 33.636 1.00 70.13 O ATOM 0 H GLY A 12 83.399 -17.498 32.563 1.00 12.13 H new ATOM 0 HA2 GLY A 12 82.288 -15.274 31.110 1.00 51.20 H new ATOM 0 HA3 GLY A 12 81.776 -16.830 30.487 1.00 51.20 H new ATOM 168 N LEU A 13 79.900 -16.147 32.264 1.00 54.23 N ATOM 169 CA LEU A 13 78.845 -16.108 33.269 1.00 42.34 C ATOM 170 C LEU A 13 77.466 -16.198 32.608 1.00 2.02 C ATOM 171 O LEU A 13 77.364 -16.299 31.386 1.00 1.22 O ATOM 172 CB LEU A 13 79.008 -14.855 34.155 1.00 43.20 C ATOM 173 CG LEU A 13 79.242 -13.526 33.409 1.00 3.34 C ATOM 174 CD1 LEU A 13 78.101 -13.149 32.456 1.00 25.23 C ATOM 175 CD2 LEU A 13 79.415 -12.409 34.444 1.00 14.14 C ATOM 0 H LEU A 13 79.573 -15.909 31.328 1.00 54.23 H new ATOM 0 HA LEU A 13 78.930 -16.976 33.923 1.00 42.34 H new ATOM 0 HB2 LEU A 13 78.115 -14.751 34.771 1.00 43.20 H new ATOM 0 HB3 LEU A 13 79.845 -15.020 34.833 1.00 43.20 H new ATOM 0 HG LEU A 13 80.134 -13.654 32.796 1.00 3.34 H new ATOM 0 HD11 LEU A 13 78.334 -12.204 31.966 1.00 25.23 H new ATOM 0 HD12 LEU A 13 77.983 -13.928 31.703 1.00 25.23 H new ATOM 0 HD13 LEU A 13 77.174 -13.047 33.021 1.00 25.23 H new ATOM 0 HD21 LEU A 13 79.582 -11.461 33.932 1.00 14.14 H new ATOM 0 HD22 LEU A 13 78.516 -12.338 35.056 1.00 14.14 H new ATOM 0 HD23 LEU A 13 80.271 -12.633 35.081 1.00 14.14 H new ATOM 187 N ASN A 14 76.408 -16.158 33.426 1.00 51.20 N ATOM 188 CA ASN A 14 75.017 -16.131 32.996 1.00 12.23 C ATOM 189 C ASN A 14 74.224 -15.222 33.935 1.00 52.50 C ATOM 190 O ASN A 14 74.566 -15.107 35.112 1.00 64.21 O ATOM 191 CB ASN A 14 74.449 -17.555 32.961 1.00 61.14 C ATOM 192 CG ASN A 14 74.542 -18.265 34.313 1.00 43.12 C ATOM 193 OD1 ASN A 14 75.465 -19.043 34.542 1.00 24.12 O ATOM 194 ND2 ASN A 14 73.588 -18.008 35.210 1.00 65.10 N ATOM 0 H ASN A 14 76.507 -16.143 34.441 1.00 51.20 H new ATOM 0 HA ASN A 14 74.942 -15.729 31.986 1.00 12.23 H new ATOM 0 HB2 ASN A 14 73.406 -17.517 32.647 1.00 61.14 H new ATOM 0 HB3 ASN A 14 74.987 -18.137 32.213 1.00 61.14 H new ATOM 0 HD21 ASN A 14 73.610 -18.464 36.122 1.00 65.10 H new ATOM 0 HD22 ASN A 14 72.837 -17.356 34.983 1.00 65.10 H new ATOM 201 N GLN A 15 73.184 -14.565 33.404 1.00 75.13 N ATOM 202 CA GLN A 15 72.418 -13.541 34.105 1.00 10.20 C ATOM 203 C GLN A 15 70.939 -13.924 34.204 1.00 3.20 C ATOM 204 O GLN A 15 70.385 -13.925 35.302 1.00 40.33 O ATOM 205 CB GLN A 15 72.591 -12.185 33.404 1.00 41.31 C ATOM 206 CG GLN A 15 74.056 -11.735 33.293 1.00 72.15 C ATOM 207 CD GLN A 15 74.734 -11.587 34.654 1.00 52.31 C ATOM 208 OE1 GLN A 15 75.655 -12.331 34.979 1.00 4.50 O ATOM 209 NE2 GLN A 15 74.286 -10.617 35.453 1.00 70.52 N ATOM 0 H GLN A 15 72.850 -14.738 32.456 1.00 75.13 H new ATOM 0 HA GLN A 15 72.801 -13.460 35.122 1.00 10.20 H new ATOM 0 HB2 GLN A 15 72.161 -12.244 32.404 1.00 41.31 H new ATOM 0 HB3 GLN A 15 72.027 -11.428 33.949 1.00 41.31 H new ATOM 0 HG2 GLN A 15 74.609 -12.458 32.693 1.00 72.15 H new ATOM 0 HG3 GLN A 15 74.100 -10.783 32.765 1.00 72.15 H new ATOM 0 HE21 GLN A 15 73.518 -10.019 35.148 1.00 70.52 H new ATOM 0 HE22 GLN A 15 74.711 -10.474 36.369 1.00 70.52 H new ATOM 218 N LEU A 16 70.303 -14.224 33.061 1.00 32.04 N ATOM 219 CA LEU A 16 68.866 -14.462 32.934 1.00 44.01 C ATOM 220 C LEU A 16 68.060 -13.201 33.295 1.00 20.25 C ATOM 221 O LEU A 16 68.628 -12.159 33.620 1.00 33.01 O ATOM 222 CB LEU A 16 68.406 -15.708 33.720 1.00 61.33 C ATOM 223 CG LEU A 16 69.084 -17.050 33.379 1.00 3.25 C ATOM 224 CD1 LEU A 16 69.110 -17.337 31.872 1.00 24.43 C ATOM 225 CD2 LEU A 16 70.490 -17.209 33.969 1.00 2.21 C ATOM 0 H LEU A 16 70.796 -14.309 32.172 1.00 32.04 H new ATOM 0 HA LEU A 16 68.663 -14.682 31.886 1.00 44.01 H new ATOM 0 HB2 LEU A 16 68.559 -15.513 34.781 1.00 61.33 H new ATOM 0 HB3 LEU A 16 67.333 -15.825 33.569 1.00 61.33 H new ATOM 0 HG LEU A 16 68.450 -17.794 33.862 1.00 3.25 H new ATOM 0 HD11 LEU A 16 69.599 -18.294 31.692 1.00 24.43 H new ATOM 0 HD12 LEU A 16 68.089 -17.374 31.491 1.00 24.43 H new ATOM 0 HD13 LEU A 16 69.660 -16.547 31.361 1.00 24.43 H new ATOM 0 HD21 LEU A 16 70.897 -18.179 33.683 1.00 2.21 H new ATOM 0 HD22 LEU A 16 71.136 -16.418 33.588 1.00 2.21 H new ATOM 0 HD23 LEU A 16 70.438 -17.143 35.056 1.00 2.21 H new ATOM 375 N PRO A 27 48.564 -8.797 27.442 1.00 31.14 N ATOM 376 CA PRO A 27 47.487 -8.127 26.723 1.00 13.45 C ATOM 377 C PRO A 27 46.205 -8.972 26.801 1.00 62.32 C ATOM 378 O PRO A 27 46.053 -9.789 27.706 1.00 3.05 O ATOM 379 CB PRO A 27 48.031 -7.955 25.297 1.00 4.20 C ATOM 380 CG PRO A 27 48.919 -9.183 25.120 1.00 71.12 C ATOM 381 CD PRO A 27 49.546 -9.324 26.506 1.00 41.45 C ATOM 0 HA PRO A 27 47.207 -7.159 27.138 1.00 13.45 H new ATOM 0 HB2 PRO A 27 47.229 -7.927 24.559 1.00 4.20 H new ATOM 0 HB3 PRO A 27 48.596 -7.029 25.189 1.00 4.20 H new ATOM 0 HG2 PRO A 27 48.344 -10.066 24.841 1.00 71.12 H new ATOM 0 HG3 PRO A 27 49.671 -9.034 24.345 1.00 71.12 H new ATOM 0 HD2 PRO A 27 49.776 -10.366 26.727 1.00 41.45 H new ATOM 0 HD3 PRO A 27 50.483 -8.770 26.569 1.00 41.45 H new ATOM 389 N GLU A 28 45.280 -8.793 25.851 1.00 51.43 N ATOM 390 CA GLU A 28 44.009 -9.506 25.778 1.00 71.31 C ATOM 391 C GLU A 28 44.143 -11.037 25.805 1.00 12.12 C ATOM 392 O GLU A 28 43.187 -11.724 26.166 1.00 45.52 O ATOM 393 CB GLU A 28 43.259 -9.040 24.529 1.00 12.12 C ATOM 394 CG GLU A 28 42.832 -7.571 24.664 1.00 42.10 C ATOM 395 CD GLU A 28 41.687 -7.241 23.715 1.00 72.42 C ATOM 396 OE1 GLU A 28 41.983 -6.968 22.533 1.00 24.01 O ATOM 397 OE2 GLU A 28 40.530 -7.294 24.190 1.00 62.23 O ATOM 0 H GLU A 28 45.404 -8.126 25.090 1.00 51.43 H new ATOM 0 HA GLU A 28 43.446 -9.262 26.679 1.00 71.31 H new ATOM 0 HB2 GLU A 28 43.895 -9.159 23.652 1.00 12.12 H new ATOM 0 HB3 GLU A 28 42.380 -9.666 24.373 1.00 12.12 H new ATOM 0 HG2 GLU A 28 42.526 -7.371 25.691 1.00 42.10 H new ATOM 0 HG3 GLU A 28 43.682 -6.922 24.453 1.00 42.10 H new ATOM 404 N VAL A 29 45.327 -11.573 25.476 1.00 43.33 N ATOM 405 CA VAL A 29 45.665 -12.986 25.625 1.00 63.44 C ATOM 406 C VAL A 29 45.491 -13.486 27.068 1.00 73.14 C ATOM 407 O VAL A 29 45.445 -14.693 27.290 1.00 54.35 O ATOM 408 CB VAL A 29 47.100 -13.218 25.116 1.00 53.11 C ATOM 409 CG1 VAL A 29 48.144 -12.748 26.138 1.00 3.25 C ATOM 410 CG2 VAL A 29 47.354 -14.689 24.762 1.00 0.13 C ATOM 0 H VAL A 29 46.091 -11.018 25.090 1.00 43.33 H new ATOM 0 HA VAL A 29 44.968 -13.570 25.024 1.00 63.44 H new ATOM 0 HB VAL A 29 47.202 -12.623 24.208 1.00 53.11 H new ATOM 0 HG11 VAL A 29 49.145 -12.927 25.745 1.00 3.25 H new ATOM 0 HG12 VAL A 29 48.014 -11.682 26.327 1.00 3.25 H new ATOM 0 HG13 VAL A 29 48.016 -13.300 27.069 1.00 3.25 H new ATOM 0 HG21 VAL A 29 48.378 -14.806 24.408 1.00 0.13 H new ATOM 0 HG22 VAL A 29 47.203 -15.307 25.647 1.00 0.13 H new ATOM 0 HG23 VAL A 29 46.662 -15.000 23.980 1.00 0.13 H new ATOM 420 N VAL A 30 45.391 -12.577 28.049 1.00 0.14 N ATOM 421 CA VAL A 30 45.122 -12.894 29.444 1.00 44.15 C ATOM 422 C VAL A 30 43.894 -13.800 29.586 1.00 25.33 C ATOM 423 O VAL A 30 43.906 -14.692 30.429 1.00 75.34 O ATOM 424 CB VAL A 30 45.022 -11.600 30.273 1.00 2.21 C ATOM 425 CG1 VAL A 30 43.786 -10.759 29.927 1.00 55.35 C ATOM 426 CG2 VAL A 30 45.034 -11.906 31.777 1.00 1.35 C ATOM 0 H VAL A 30 45.499 -11.577 27.881 1.00 0.14 H new ATOM 0 HA VAL A 30 45.958 -13.467 29.846 1.00 44.15 H new ATOM 0 HB VAL A 30 45.901 -11.010 30.014 1.00 2.21 H new ATOM 0 HG11 VAL A 30 43.772 -9.861 30.545 1.00 55.35 H new ATOM 0 HG12 VAL A 30 43.822 -10.476 28.875 1.00 55.35 H new ATOM 0 HG13 VAL A 30 42.885 -11.342 30.115 1.00 55.35 H new ATOM 0 HG21 VAL A 30 44.962 -10.974 32.338 1.00 1.35 H new ATOM 0 HG22 VAL A 30 44.187 -12.545 32.025 1.00 1.35 H new ATOM 0 HG23 VAL A 30 45.962 -12.416 32.037 1.00 1.35 H new ATOM 436 N ARG A 31 42.866 -13.628 28.740 1.00 24.41 N ATOM 437 CA ARG A 31 41.735 -14.549 28.695 1.00 62.44 C ATOM 438 C ARG A 31 42.210 -15.982 28.430 1.00 32.02 C ATOM 439 O ARG A 31 41.791 -16.899 29.128 1.00 21.13 O ATOM 440 CB ARG A 31 40.712 -14.133 27.627 1.00 43.30 C ATOM 441 CG ARG A 31 39.742 -13.050 28.119 1.00 61.45 C ATOM 442 CD ARG A 31 40.209 -11.622 27.834 1.00 75.22 C ATOM 443 NE ARG A 31 40.118 -11.327 26.399 1.00 31.11 N ATOM 444 CZ ARG A 31 40.095 -10.100 25.857 1.00 21.41 C ATOM 445 NH1 ARG A 31 40.306 -9.003 26.597 1.00 72.04 N ATOM 446 NH2 ARG A 31 39.847 -9.966 24.549 1.00 43.12 N ATOM 0 H ARG A 31 42.801 -12.855 28.078 1.00 24.41 H new ATOM 0 HA ARG A 31 41.247 -14.511 29.669 1.00 62.44 H new ATOM 0 HB2 ARG A 31 41.241 -13.767 26.747 1.00 43.30 H new ATOM 0 HB3 ARG A 31 40.143 -15.009 27.315 1.00 43.30 H new ATOM 0 HG2 ARG A 31 38.771 -13.205 27.648 1.00 61.45 H new ATOM 0 HG3 ARG A 31 39.597 -13.167 29.193 1.00 61.45 H new ATOM 0 HD2 ARG A 31 39.599 -10.915 28.396 1.00 75.22 H new ATOM 0 HD3 ARG A 31 41.237 -11.495 28.173 1.00 75.22 H new ATOM 0 HE ARG A 31 40.068 -12.121 25.761 1.00 31.11 H new ATOM 0 HH11 ARG A 31 40.489 -9.090 27.597 1.00 72.04 H new ATOM 0 HH12 ARG A 31 40.283 -8.081 26.161 1.00 72.04 H new ATOM 0 HH21 ARG A 31 39.678 -10.792 23.975 1.00 43.12 H new ATOM 0 HH22 ARG A 31 39.827 -9.038 24.126 1.00 43.12 H new ATOM 460 N GLN A 32 43.084 -16.180 27.437 1.00 22.04 N ATOM 461 CA GLN A 32 43.614 -17.493 27.090 1.00 64.24 C ATOM 462 C GLN A 32 44.446 -18.068 28.238 1.00 74.32 C ATOM 463 O GLN A 32 44.319 -19.254 28.539 1.00 43.11 O ATOM 464 CB GLN A 32 44.429 -17.448 25.787 1.00 63.55 C ATOM 465 CG GLN A 32 43.686 -16.819 24.599 1.00 43.25 C ATOM 466 CD GLN A 32 42.291 -17.389 24.405 1.00 41.53 C ATOM 467 OE1 GLN A 32 41.299 -16.734 24.715 1.00 11.30 O ATOM 468 NE2 GLN A 32 42.210 -18.610 23.886 1.00 14.31 N ATOM 0 H GLN A 32 43.442 -15.426 26.851 1.00 22.04 H new ATOM 0 HA GLN A 32 42.765 -18.155 26.922 1.00 64.24 H new ATOM 0 HB2 GLN A 32 45.346 -16.887 25.965 1.00 63.55 H new ATOM 0 HB3 GLN A 32 44.723 -18.463 25.521 1.00 63.55 H new ATOM 0 HG2 GLN A 32 43.615 -15.742 24.750 1.00 43.25 H new ATOM 0 HG3 GLN A 32 44.267 -16.975 23.690 1.00 43.25 H new ATOM 0 HE21 GLN A 32 43.060 -19.118 23.643 1.00 14.31 H new ATOM 0 HE22 GLN A 32 41.298 -19.039 23.731 1.00 14.31 H new ATOM 477 N ARG A 33 45.275 -17.237 28.892 1.00 32.42 N ATOM 478 CA ARG A 33 46.039 -17.654 30.065 1.00 22.31 C ATOM 479 C ARG A 33 45.092 -18.186 31.149 1.00 31.32 C ATOM 480 O ARG A 33 45.268 -19.308 31.623 1.00 20.34 O ATOM 481 CB ARG A 33 46.896 -16.505 30.628 1.00 53.33 C ATOM 482 CG ARG A 33 47.960 -15.941 29.670 1.00 1.52 C ATOM 483 CD ARG A 33 48.839 -14.938 30.436 1.00 13.41 C ATOM 484 NE ARG A 33 49.737 -14.156 29.568 1.00 32.31 N ATOM 485 CZ ARG A 33 51.046 -14.399 29.369 1.00 61.13 C ATOM 486 NH1 ARG A 33 51.592 -15.573 29.716 1.00 10.42 N ATOM 487 NH2 ARG A 33 51.826 -13.454 28.825 1.00 31.33 N ATOM 0 H ARG A 33 45.429 -16.266 28.620 1.00 32.42 H new ATOM 0 HA ARG A 33 46.716 -18.449 29.753 1.00 22.31 H new ATOM 0 HB2 ARG A 33 46.233 -15.693 30.925 1.00 53.33 H new ATOM 0 HB3 ARG A 33 47.395 -16.856 31.531 1.00 53.33 H new ATOM 0 HG2 ARG A 33 48.572 -16.749 29.269 1.00 1.52 H new ATOM 0 HG3 ARG A 33 47.482 -15.452 28.821 1.00 1.52 H new ATOM 0 HD2 ARG A 33 48.196 -14.254 30.990 1.00 13.41 H new ATOM 0 HD3 ARG A 33 49.437 -15.478 31.170 1.00 13.41 H new ATOM 0 HE ARG A 33 49.331 -13.361 29.075 1.00 32.31 H new ATOM 0 HH11 ARG A 33 51.014 -16.299 30.138 1.00 10.42 H new ATOM 0 HH12 ARG A 33 52.586 -15.740 29.558 1.00 10.42 H new ATOM 0 HH21 ARG A 33 51.427 -12.553 28.563 1.00 31.33 H new ATOM 0 HH22 ARG A 33 52.818 -13.636 28.674 1.00 31.33 H new ATOM 501 N ILE A 34 44.086 -17.381 31.522 1.00 42.52 N ATOM 502 CA ILE A 34 43.074 -17.717 32.518 1.00 54.01 C ATOM 503 C ILE A 34 42.403 -19.043 32.163 1.00 65.14 C ATOM 504 O ILE A 34 42.350 -19.941 32.998 1.00 23.14 O ATOM 505 CB ILE A 34 42.053 -16.565 32.644 1.00 14.34 C ATOM 506 CG1 ILE A 34 42.721 -15.347 33.302 1.00 34.54 C ATOM 507 CG2 ILE A 34 40.833 -16.994 33.476 1.00 4.25 C ATOM 508 CD1 ILE A 34 41.933 -14.048 33.094 1.00 2.42 C ATOM 0 H ILE A 34 43.956 -16.451 31.123 1.00 42.52 H new ATOM 0 HA ILE A 34 43.549 -17.843 33.491 1.00 54.01 H new ATOM 0 HB ILE A 34 41.712 -16.303 31.643 1.00 14.34 H new ATOM 0 HG12 ILE A 34 42.830 -15.532 34.371 1.00 34.54 H new ATOM 0 HG13 ILE A 34 43.725 -15.226 32.895 1.00 34.54 H new ATOM 0 HG21 ILE A 34 40.131 -16.163 33.548 1.00 4.25 H new ATOM 0 HG22 ILE A 34 40.344 -17.841 32.995 1.00 4.25 H new ATOM 0 HG23 ILE A 34 41.158 -17.282 34.476 1.00 4.25 H new ATOM 0 HD11 ILE A 34 42.454 -13.224 33.581 1.00 2.42 H new ATOM 0 HD12 ILE A 34 41.846 -13.842 32.027 1.00 2.42 H new ATOM 0 HD13 ILE A 34 40.938 -14.153 33.526 1.00 2.42 H new ATOM 520 N VAL A 35 41.896 -19.157 30.930 1.00 52.32 N ATOM 521 CA VAL A 35 41.195 -20.337 30.445 1.00 10.23 C ATOM 522 C VAL A 35 42.073 -21.581 30.592 1.00 63.03 C ATOM 523 O VAL A 35 41.609 -22.575 31.141 1.00 55.30 O ATOM 524 CB VAL A 35 40.720 -20.106 28.997 1.00 32.35 C ATOM 525 CG1 VAL A 35 40.285 -21.404 28.304 1.00 14.15 C ATOM 526 CG2 VAL A 35 39.532 -19.134 28.987 1.00 41.20 C ATOM 0 H VAL A 35 41.966 -18.415 30.234 1.00 52.32 H new ATOM 0 HA VAL A 35 40.306 -20.512 31.052 1.00 10.23 H new ATOM 0 HB VAL A 35 41.569 -19.695 28.451 1.00 32.35 H new ATOM 0 HG11 VAL A 35 39.960 -21.182 27.287 1.00 14.15 H new ATOM 0 HG12 VAL A 35 41.124 -22.099 28.274 1.00 14.15 H new ATOM 0 HG13 VAL A 35 39.461 -21.854 28.858 1.00 14.15 H new ATOM 0 HG21 VAL A 35 39.201 -18.975 27.961 1.00 41.20 H new ATOM 0 HG22 VAL A 35 38.713 -19.554 29.571 1.00 41.20 H new ATOM 0 HG23 VAL A 35 39.837 -18.182 29.422 1.00 41.20 H new ATOM 536 N ASP A 36 43.326 -21.530 30.125 1.00 43.30 N ATOM 537 CA ASP A 36 44.229 -22.673 30.167 1.00 1.30 C ATOM 538 C ASP A 36 44.465 -23.142 31.606 1.00 25.41 C ATOM 539 O ASP A 36 44.203 -24.301 31.934 1.00 44.30 O ATOM 540 CB ASP A 36 45.546 -22.308 29.474 1.00 74.13 C ATOM 541 CG ASP A 36 46.546 -23.458 29.544 1.00 4.31 C ATOM 542 OD1 ASP A 36 46.413 -24.376 28.706 1.00 34.43 O ATOM 543 OD2 ASP A 36 47.414 -23.402 30.441 1.00 23.42 O ATOM 0 H ASP A 36 43.737 -20.694 29.709 1.00 43.30 H new ATOM 0 HA ASP A 36 43.771 -23.506 29.634 1.00 1.30 H new ATOM 0 HB2 ASP A 36 45.353 -22.054 28.432 1.00 74.13 H new ATOM 0 HB3 ASP A 36 45.974 -21.422 29.944 1.00 74.13 H new ATOM 548 N LEU A 37 44.954 -22.235 32.459 1.00 13.15 N ATOM 549 CA LEU A 37 45.299 -22.530 33.846 1.00 1.12 C ATOM 550 C LEU A 37 44.085 -23.018 34.644 1.00 32.42 C ATOM 551 O LEU A 37 44.200 -23.967 35.421 1.00 20.33 O ATOM 552 CB LEU A 37 45.951 -21.298 34.500 1.00 54.51 C ATOM 553 CG LEU A 37 47.437 -21.506 34.835 1.00 22.11 C ATOM 554 CD1 LEU A 37 48.308 -21.813 33.609 1.00 43.12 C ATOM 555 CD2 LEU A 37 47.973 -20.227 35.482 1.00 34.41 C ATOM 0 H LEU A 37 45.122 -21.263 32.198 1.00 13.15 H new ATOM 0 HA LEU A 37 46.021 -23.346 33.852 1.00 1.12 H new ATOM 0 HB2 LEU A 37 45.852 -20.444 33.830 1.00 54.51 H new ATOM 0 HB3 LEU A 37 45.410 -21.051 35.414 1.00 54.51 H new ATOM 0 HG LEU A 37 47.492 -22.368 35.499 1.00 22.11 H new ATOM 0 HD11 LEU A 37 49.343 -21.947 33.923 1.00 43.12 H new ATOM 0 HD12 LEU A 37 47.953 -22.725 33.129 1.00 43.12 H new ATOM 0 HD13 LEU A 37 48.247 -20.985 32.903 1.00 43.12 H new ATOM 0 HD21 LEU A 37 49.027 -20.357 35.726 1.00 34.41 H new ATOM 0 HD22 LEU A 37 47.862 -19.394 34.788 1.00 34.41 H new ATOM 0 HD23 LEU A 37 47.412 -20.018 36.393 1.00 34.41 H new ATOM 567 N ALA A 38 42.922 -22.385 34.449 1.00 73.54 N ATOM 568 CA ALA A 38 41.687 -22.787 35.104 1.00 11.33 C ATOM 569 C ALA A 38 41.225 -24.162 34.616 1.00 74.43 C ATOM 570 O ALA A 38 40.787 -24.979 35.423 1.00 31.05 O ATOM 571 CB ALA A 38 40.603 -21.736 34.853 1.00 70.01 C ATOM 0 H ALA A 38 42.818 -21.580 33.831 1.00 73.54 H new ATOM 0 HA ALA A 38 41.872 -22.861 36.176 1.00 11.33 H new ATOM 0 HB1 ALA A 38 39.680 -22.041 35.345 1.00 70.01 H new ATOM 0 HB2 ALA A 38 40.928 -20.776 35.253 1.00 70.01 H new ATOM 0 HB3 ALA A 38 40.429 -21.642 33.781 1.00 70.01 H new ATOM 577 N HIS A 39 41.312 -24.412 33.304 1.00 31.04 N ATOM 578 CA HIS A 39 40.841 -25.643 32.686 1.00 50.44 C ATOM 579 C HIS A 39 41.630 -26.851 33.188 1.00 3.12 C ATOM 580 O HIS A 39 41.025 -27.837 33.603 1.00 15.20 O ATOM 581 CB HIS A 39 40.895 -25.533 31.159 1.00 24.02 C ATOM 582 CG HIS A 39 40.435 -26.790 30.471 1.00 62.25 C ATOM 583 ND1 HIS A 39 41.318 -27.738 29.975 1.00 62.23 N ATOM 584 CD2 HIS A 39 39.182 -27.299 30.228 1.00 15.24 C ATOM 585 CE1 HIS A 39 40.582 -28.743 29.472 1.00 1.42 C ATOM 586 NE2 HIS A 39 39.269 -28.535 29.593 1.00 60.30 N ATOM 0 H HIS A 39 41.717 -23.753 32.639 1.00 31.04 H new ATOM 0 HA HIS A 39 39.801 -25.794 32.976 1.00 50.44 H new ATOM 0 HB2 HIS A 39 40.273 -24.698 30.836 1.00 24.02 H new ATOM 0 HB3 HIS A 39 41.916 -25.307 30.851 1.00 24.02 H new ATOM 0 HD2 HIS A 39 38.257 -26.808 30.493 1.00 15.24 H new ATOM 0 HE1 HIS A 39 41.008 -29.626 29.018 1.00 1.42 H new ATOM 0 HE2 HIS A 39 38.506 -29.141 29.290 1.00 60.30 H new ATOM 594 N GLN A 40 42.968 -26.779 33.164 1.00 61.23 N ATOM 595 CA GLN A 40 43.795 -27.845 33.719 1.00 25.10 C ATOM 596 C GLN A 40 43.616 -27.939 35.242 1.00 55.31 C ATOM 597 O GLN A 40 43.749 -29.025 35.803 1.00 4.42 O ATOM 598 CB GLN A 40 45.261 -27.693 33.278 1.00 34.23 C ATOM 599 CG GLN A 40 45.971 -26.556 34.014 1.00 33.13 C ATOM 600 CD GLN A 40 47.409 -26.319 33.555 1.00 21.23 C ATOM 601 OE1 GLN A 40 47.919 -27.006 32.675 1.00 34.14 O ATOM 602 NE2 GLN A 40 48.072 -25.341 34.177 1.00 64.04 N ATOM 0 H GLN A 40 43.492 -25.998 32.768 1.00 61.23 H new ATOM 0 HA GLN A 40 43.460 -28.801 33.316 1.00 25.10 H new ATOM 0 HB2 GLN A 40 45.792 -28.628 33.459 1.00 34.23 H new ATOM 0 HB3 GLN A 40 45.298 -27.508 32.205 1.00 34.23 H new ATOM 0 HG2 GLN A 40 45.401 -25.637 33.877 1.00 33.13 H new ATOM 0 HG3 GLN A 40 45.973 -26.774 35.082 1.00 33.13 H new ATOM 0 HE21 GLN A 40 47.610 -24.794 34.903 1.00 64.04 H new ATOM 0 HE22 GLN A 40 49.040 -25.141 33.926 1.00 64.04 H new ATOM 611 N GLY A 41 43.281 -26.820 35.902 1.00 31.14 N ATOM 612 CA GLY A 41 42.873 -26.793 37.299 1.00 62.31 C ATOM 613 C GLY A 41 44.081 -26.771 38.228 1.00 44.24 C ATOM 614 O GLY A 41 44.578 -27.830 38.607 1.00 3.24 O ATOM 0 H GLY A 41 43.289 -25.898 35.466 1.00 31.14 H new ATOM 0 HA2 GLY A 41 42.254 -25.915 37.483 1.00 62.31 H new ATOM 0 HA3 GLY A 41 42.259 -27.667 37.518 1.00 62.31 H new ATOM 618 N VAL A 42 44.538 -25.569 38.609 1.00 0.15 N ATOM 619 CA VAL A 42 45.656 -25.385 39.533 1.00 13.13 C ATOM 620 C VAL A 42 45.282 -24.365 40.614 1.00 64.30 C ATOM 621 O VAL A 42 44.561 -23.406 40.344 1.00 41.14 O ATOM 622 CB VAL A 42 46.929 -24.967 38.772 1.00 43.32 C ATOM 623 CG1 VAL A 42 48.145 -25.027 39.700 1.00 64.02 C ATOM 624 CG2 VAL A 42 47.195 -25.873 37.568 1.00 4.52 C ATOM 0 H VAL A 42 44.135 -24.692 38.279 1.00 0.15 H new ATOM 0 HA VAL A 42 45.870 -26.334 40.025 1.00 13.13 H new ATOM 0 HB VAL A 42 46.769 -23.948 38.419 1.00 43.32 H new ATOM 0 HG11 VAL A 42 49.038 -24.729 39.150 1.00 64.02 H new ATOM 0 HG12 VAL A 42 47.995 -24.350 40.541 1.00 64.02 H new ATOM 0 HG13 VAL A 42 48.270 -26.044 40.071 1.00 64.02 H new ATOM 0 HG21 VAL A 42 48.101 -25.545 37.059 1.00 4.52 H new ATOM 0 HG22 VAL A 42 47.322 -26.901 37.907 1.00 4.52 H new ATOM 0 HG23 VAL A 42 46.352 -25.820 36.879 1.00 4.52 H new ATOM 634 N ARG A 43 45.777 -24.581 41.841 1.00 60.43 N ATOM 635 CA ARG A 43 45.559 -23.698 42.982 1.00 51.44 C ATOM 636 C ARG A 43 46.356 -22.393 42.822 1.00 73.31 C ATOM 637 O ARG A 43 47.380 -22.393 42.137 1.00 24.34 O ATOM 638 CB ARG A 43 45.923 -24.436 44.281 1.00 45.13 C ATOM 639 CG ARG A 43 47.404 -24.835 44.381 1.00 44.24 C ATOM 640 CD ARG A 43 47.716 -25.465 45.744 1.00 2.23 C ATOM 641 NE ARG A 43 47.579 -24.493 46.839 1.00 72.34 N ATOM 642 CZ ARG A 43 47.887 -24.739 48.123 1.00 74.01 C ATOM 643 NH1 ARG A 43 48.402 -25.921 48.490 1.00 71.32 N ATOM 644 NH2 ARG A 43 47.676 -23.794 49.049 1.00 55.55 N ATOM 0 H ARG A 43 46.351 -25.393 42.066 1.00 60.43 H new ATOM 0 HA ARG A 43 44.505 -23.423 43.030 1.00 51.44 H new ATOM 0 HB2 ARG A 43 45.671 -23.801 45.130 1.00 45.13 H new ATOM 0 HB3 ARG A 43 45.310 -25.334 44.361 1.00 45.13 H new ATOM 0 HG2 ARG A 43 47.648 -25.540 43.587 1.00 44.24 H new ATOM 0 HG3 ARG A 43 48.031 -23.956 44.231 1.00 44.24 H new ATOM 0 HD2 ARG A 43 47.044 -26.306 45.918 1.00 2.23 H new ATOM 0 HD3 ARG A 43 48.730 -25.864 45.737 1.00 2.23 H new ATOM 0 HE ARG A 43 47.225 -23.565 46.607 1.00 72.34 H new ATOM 0 HH11 ARG A 43 48.564 -26.646 47.791 1.00 71.32 H new ATOM 0 HH12 ARG A 43 48.632 -26.096 49.468 1.00 71.32 H new ATOM 0 HH21 ARG A 43 47.283 -22.893 48.778 1.00 55.55 H new ATOM 0 HH22 ARG A 43 47.908 -23.976 50.025 1.00 55.55 H new ATOM 658 N PRO A 44 45.930 -21.282 43.456 1.00 42.23 N ATOM 659 CA PRO A 44 46.571 -19.975 43.329 1.00 72.42 C ATOM 660 C PRO A 44 47.852 -19.864 44.179 1.00 43.40 C ATOM 661 O PRO A 44 48.053 -18.884 44.893 1.00 1.45 O ATOM 662 CB PRO A 44 45.488 -18.969 43.738 1.00 32.22 C ATOM 663 CG PRO A 44 44.704 -19.743 44.793 1.00 20.03 C ATOM 664 CD PRO A 44 44.693 -21.156 44.211 1.00 54.43 C ATOM 0 HA PRO A 44 46.923 -19.788 42.314 1.00 72.42 H new ATOM 0 HB2 PRO A 44 45.917 -18.052 44.142 1.00 32.22 H new ATOM 0 HB3 PRO A 44 44.860 -18.682 42.894 1.00 32.22 H new ATOM 0 HG2 PRO A 44 45.189 -19.708 45.769 1.00 20.03 H new ATOM 0 HG3 PRO A 44 43.696 -19.348 44.923 1.00 20.03 H new ATOM 0 HD2 PRO A 44 44.639 -21.904 45.002 1.00 54.43 H new ATOM 0 HD3 PRO A 44 43.825 -21.308 43.569 1.00 54.43 H new ATOM 672 N CYS A 45 48.728 -20.870 44.078 1.00 11.55 N ATOM 673 CA CYS A 45 50.042 -20.949 44.703 1.00 5.25 C ATOM 674 C CYS A 45 51.007 -21.556 43.686 1.00 70.02 C ATOM 675 O CYS A 45 52.067 -21.002 43.413 1.00 53.40 O ATOM 676 CB CYS A 45 49.996 -21.794 45.980 1.00 42.00 C ATOM 677 SG CYS A 45 48.906 -21.046 47.222 1.00 50.42 S ATOM 0 H CYS A 45 48.520 -21.699 43.522 1.00 11.55 H new ATOM 0 HA CYS A 45 50.376 -19.953 44.994 1.00 5.25 H new ATOM 0 HB2 CYS A 45 49.646 -22.798 45.742 1.00 42.00 H new ATOM 0 HB3 CYS A 45 51.001 -21.896 46.389 1.00 42.00 H new ATOM 0 HG CYS A 45 48.433 -19.925 46.765 1.00 50.42 H new ATOM 683 N ASP A 46 50.607 -22.684 43.093 1.00 63.15 N ATOM 684 CA ASP A 46 51.306 -23.308 41.982 1.00 54.11 C ATOM 685 C ASP A 46 51.147 -22.483 40.701 1.00 21.13 C ATOM 686 O ASP A 46 52.075 -22.428 39.898 1.00 3.33 O ATOM 687 CB ASP A 46 50.830 -24.752 41.823 1.00 75.42 C ATOM 688 CG ASP A 46 51.343 -25.606 42.974 1.00 42.44 C ATOM 689 OD1 ASP A 46 52.513 -26.033 42.879 1.00 33.35 O ATOM 690 OD2 ASP A 46 50.569 -25.792 43.937 1.00 53.12 O ATOM 0 H ASP A 46 49.772 -23.193 43.382 1.00 63.15 H new ATOM 0 HA ASP A 46 52.375 -23.336 42.192 1.00 54.11 H new ATOM 0 HB2 ASP A 46 49.741 -24.782 41.796 1.00 75.42 H new ATOM 0 HB3 ASP A 46 51.184 -25.157 40.875 1.00 75.42 H new ATOM 695 N ILE A 47 50.017 -21.781 40.535 1.00 33.41 N ATOM 696 CA ILE A 47 49.903 -20.717 39.540 1.00 64.11 C ATOM 697 C ILE A 47 51.006 -19.679 39.752 1.00 31.23 C ATOM 698 O ILE A 47 51.629 -19.240 38.788 1.00 74.05 O ATOM 699 CB ILE A 47 48.499 -20.088 39.572 1.00 34.10 C ATOM 700 CG1 ILE A 47 47.490 -21.119 39.035 1.00 53.15 C ATOM 701 CG2 ILE A 47 48.484 -18.787 38.752 1.00 31.31 C ATOM 702 CD1 ILE A 47 46.031 -20.651 39.061 1.00 41.15 C ATOM 0 H ILE A 47 49.169 -21.935 41.081 1.00 33.41 H new ATOM 0 HA ILE A 47 50.037 -21.142 38.545 1.00 64.11 H new ATOM 0 HB ILE A 47 48.220 -19.825 40.592 1.00 34.10 H new ATOM 0 HG12 ILE A 47 47.759 -21.372 38.010 1.00 53.15 H new ATOM 0 HG13 ILE A 47 47.576 -22.033 39.622 1.00 53.15 H new ATOM 0 HG21 ILE A 47 47.486 -18.350 38.781 1.00 31.31 H new ATOM 0 HG22 ILE A 47 49.201 -18.083 39.174 1.00 31.31 H new ATOM 0 HG23 ILE A 47 48.755 -19.005 37.719 1.00 31.31 H new ATOM 0 HD11 ILE A 47 45.389 -21.438 38.666 1.00 41.15 H new ATOM 0 HD12 ILE A 47 45.739 -20.426 40.087 1.00 41.15 H new ATOM 0 HD13 ILE A 47 45.925 -19.755 38.449 1.00 41.15 H new ATOM 714 N SER A 48 51.262 -19.303 41.012 1.00 75.54 N ATOM 715 CA SER A 48 52.309 -18.353 41.355 1.00 31.22 C ATOM 716 C SER A 48 53.678 -18.816 40.842 1.00 72.41 C ATOM 717 O SER A 48 54.481 -17.985 40.422 1.00 12.44 O ATOM 718 CB SER A 48 52.325 -18.091 42.866 1.00 4.11 C ATOM 719 OG SER A 48 52.685 -16.755 43.118 1.00 15.30 O ATOM 0 H SER A 48 50.744 -19.654 41.818 1.00 75.54 H new ATOM 0 HA SER A 48 52.088 -17.410 40.856 1.00 31.22 H new ATOM 0 HB2 SER A 48 51.342 -18.298 43.290 1.00 4.11 H new ATOM 0 HB3 SER A 48 53.030 -18.765 43.353 1.00 4.11 H new ATOM 0 HG SER A 48 53.644 -16.638 42.952 1.00 15.30 H new ATOM 725 N ARG A 49 53.933 -20.133 40.840 1.00 72.21 N ATOM 726 CA ARG A 49 55.149 -20.707 40.278 1.00 53.14 C ATOM 727 C ARG A 49 55.138 -20.608 38.753 1.00 20.40 C ATOM 728 O ARG A 49 56.090 -20.098 38.170 1.00 62.45 O ATOM 729 CB ARG A 49 55.346 -22.160 40.731 1.00 71.12 C ATOM 730 CG ARG A 49 55.348 -22.260 42.259 1.00 63.55 C ATOM 731 CD ARG A 49 55.985 -23.566 42.747 1.00 10.44 C ATOM 732 NE ARG A 49 55.197 -24.750 42.363 1.00 3.40 N ATOM 733 CZ ARG A 49 55.688 -25.944 41.980 1.00 35.21 C ATOM 734 NH1 ARG A 49 57.004 -26.157 41.844 1.00 61.11 N ATOM 735 NH2 ARG A 49 54.838 -26.949 41.736 1.00 25.05 N ATOM 0 H ARG A 49 53.295 -20.826 41.231 1.00 72.21 H new ATOM 0 HA ARG A 49 55.993 -20.129 40.653 1.00 53.14 H new ATOM 0 HB2 ARG A 49 54.551 -22.784 40.323 1.00 71.12 H new ATOM 0 HB3 ARG A 49 56.287 -22.544 40.336 1.00 71.12 H new ATOM 0 HG2 ARG A 49 55.892 -21.413 42.677 1.00 63.55 H new ATOM 0 HG3 ARG A 49 54.324 -22.196 42.628 1.00 63.55 H new ATOM 0 HD2 ARG A 49 56.991 -23.653 42.336 1.00 10.44 H new ATOM 0 HD3 ARG A 49 56.086 -23.535 43.832 1.00 10.44 H new ATOM 0 HE ARG A 49 54.182 -24.656 42.390 1.00 3.40 H new ATOM 0 HH11 ARG A 49 57.665 -25.403 42.032 1.00 61.11 H new ATOM 0 HH12 ARG A 49 57.345 -27.073 41.552 1.00 61.11 H new ATOM 0 HH21 ARG A 49 53.834 -26.804 41.841 1.00 25.05 H new ATOM 0 HH22 ARG A 49 55.195 -27.859 41.445 1.00 25.05 H new ATOM 749 N GLN A 50 54.069 -21.089 38.106 1.00 1.43 N ATOM 750 CA GLN A 50 53.924 -21.047 36.655 1.00 14.03 C ATOM 751 C GLN A 50 54.116 -19.639 36.075 1.00 14.52 C ATOM 752 O GLN A 50 54.710 -19.503 35.007 1.00 44.44 O ATOM 753 CB GLN A 50 52.559 -21.611 36.254 1.00 74.45 C ATOM 754 CG GLN A 50 52.474 -23.111 36.548 1.00 60.43 C ATOM 755 CD GLN A 50 51.086 -23.641 36.213 1.00 15.12 C ATOM 756 OE1 GLN A 50 50.860 -24.203 35.145 1.00 12.32 O ATOM 757 NE2 GLN A 50 50.148 -23.447 37.140 1.00 3.33 N ATOM 0 H GLN A 50 53.277 -21.520 38.583 1.00 1.43 H new ATOM 0 HA GLN A 50 54.717 -21.665 36.234 1.00 14.03 H new ATOM 0 HB2 GLN A 50 51.772 -21.086 36.795 1.00 74.45 H new ATOM 0 HB3 GLN A 50 52.387 -21.435 35.192 1.00 74.45 H new ATOM 0 HG2 GLN A 50 53.224 -23.645 35.965 1.00 60.43 H new ATOM 0 HG3 GLN A 50 52.696 -23.295 37.599 1.00 60.43 H new ATOM 0 HE21 GLN A 50 50.384 -22.975 38.013 1.00 3.33 H new ATOM 0 HE22 GLN A 50 49.195 -23.771 36.977 1.00 3.33 H new ATOM 766 N LEU A 51 53.630 -18.602 36.769 1.00 23.24 N ATOM 767 CA LEU A 51 53.735 -17.210 36.339 1.00 22.32 C ATOM 768 C LEU A 51 55.002 -16.542 36.881 1.00 75.52 C ATOM 769 O LEU A 51 55.395 -15.501 36.363 1.00 55.02 O ATOM 770 CB LEU A 51 52.479 -16.433 36.766 1.00 53.21 C ATOM 771 CG LEU A 51 51.296 -16.537 35.785 1.00 72.32 C ATOM 772 CD1 LEU A 51 51.520 -15.679 34.531 1.00 12.24 C ATOM 773 CD2 LEU A 51 50.965 -17.978 35.378 1.00 61.14 C ATOM 0 H LEU A 51 53.145 -18.713 37.660 1.00 23.24 H new ATOM 0 HA LEU A 51 53.807 -17.197 35.251 1.00 22.32 H new ATOM 0 HB2 LEU A 51 52.157 -16.796 37.742 1.00 53.21 H new ATOM 0 HB3 LEU A 51 52.742 -15.382 36.888 1.00 53.21 H new ATOM 0 HG LEU A 51 50.436 -16.151 36.333 1.00 72.32 H new ATOM 0 HD11 LEU A 51 50.664 -15.779 33.864 1.00 12.24 H new ATOM 0 HD12 LEU A 51 51.634 -14.634 34.821 1.00 12.24 H new ATOM 0 HD13 LEU A 51 52.421 -16.014 34.017 1.00 12.24 H new ATOM 0 HD21 LEU A 51 50.122 -17.976 34.686 1.00 61.14 H new ATOM 0 HD22 LEU A 51 51.832 -18.427 34.893 1.00 61.14 H new ATOM 0 HD23 LEU A 51 50.705 -18.556 36.265 1.00 61.14 H new ATOM 785 N ARG A 52 55.649 -17.136 37.892 1.00 73.55 N ATOM 786 CA ARG A 52 56.818 -16.599 38.574 1.00 74.52 C ATOM 787 C ARG A 52 56.500 -15.252 39.227 1.00 22.12 C ATOM 788 O ARG A 52 57.034 -14.219 38.830 1.00 74.31 O ATOM 789 CB ARG A 52 58.057 -16.530 37.660 1.00 2.21 C ATOM 790 CG ARG A 52 58.459 -17.907 37.114 1.00 61.42 C ATOM 791 CD ARG A 52 57.906 -18.173 35.705 1.00 70.42 C ATOM 792 NE ARG A 52 57.562 -19.586 35.507 1.00 60.32 N ATOM 793 CZ ARG A 52 58.429 -20.603 35.389 1.00 61.45 C ATOM 794 NH1 ARG A 52 59.751 -20.384 35.411 1.00 34.55 N ATOM 795 NH2 ARG A 52 57.962 -21.850 35.243 1.00 75.43 N ATOM 0 H ARG A 52 55.356 -18.038 38.266 1.00 73.55 H new ATOM 0 HA ARG A 52 57.077 -17.297 39.370 1.00 74.52 H new ATOM 0 HB2 ARG A 52 57.853 -15.857 36.827 1.00 2.21 H new ATOM 0 HB3 ARG A 52 58.892 -16.105 38.216 1.00 2.21 H new ATOM 0 HG2 ARG A 52 59.546 -17.981 37.093 1.00 61.42 H new ATOM 0 HG3 ARG A 52 58.100 -18.681 37.792 1.00 61.42 H new ATOM 0 HD2 ARG A 52 57.021 -17.558 35.541 1.00 70.42 H new ATOM 0 HD3 ARG A 52 58.645 -17.872 34.963 1.00 70.42 H new ATOM 0 HE ARG A 52 56.570 -19.817 35.454 1.00 60.32 H new ATOM 0 HH11 ARG A 52 60.109 -19.435 35.519 1.00 34.55 H new ATOM 0 HH12 ARG A 52 60.399 -21.166 35.320 1.00 34.55 H new ATOM 0 HH21 ARG A 52 56.956 -22.019 35.222 1.00 75.43 H new ATOM 0 HH22 ARG A 52 58.612 -22.631 35.152 1.00 75.43 H new ATOM 809 N VAL A 53 55.623 -15.284 40.237 1.00 21.23 N ATOM 810 CA VAL A 53 55.193 -14.122 41.008 1.00 41.13 C ATOM 811 C VAL A 53 55.052 -14.497 42.488 1.00 31.34 C ATOM 812 O VAL A 53 55.255 -15.653 42.861 1.00 15.23 O ATOM 813 CB VAL A 53 53.883 -13.543 40.436 1.00 64.32 C ATOM 814 CG1 VAL A 53 54.052 -13.050 38.997 1.00 70.41 C ATOM 815 CG2 VAL A 53 52.729 -14.550 40.486 1.00 62.41 C ATOM 0 H VAL A 53 55.181 -16.150 40.547 1.00 21.23 H new ATOM 0 HA VAL A 53 55.951 -13.342 40.931 1.00 41.13 H new ATOM 0 HB VAL A 53 53.636 -12.696 41.076 1.00 64.32 H new ATOM 0 HG11 VAL A 53 53.104 -12.651 38.635 1.00 70.41 H new ATOM 0 HG12 VAL A 53 54.810 -12.268 38.967 1.00 70.41 H new ATOM 0 HG13 VAL A 53 54.362 -13.880 38.362 1.00 70.41 H new ATOM 0 HG21 VAL A 53 51.830 -14.094 40.072 1.00 62.41 H new ATOM 0 HG22 VAL A 53 52.990 -15.432 39.902 1.00 62.41 H new ATOM 0 HG23 VAL A 53 52.545 -14.841 41.520 1.00 62.41 H new ATOM 825 N SER A 54 54.711 -13.511 43.329 1.00 30.34 N ATOM 826 CA SER A 54 54.583 -13.668 44.773 1.00 35.14 C ATOM 827 C SER A 54 53.277 -14.387 45.136 1.00 42.14 C ATOM 828 O SER A 54 53.320 -15.526 45.595 1.00 10.41 O ATOM 829 CB SER A 54 54.697 -12.290 45.440 1.00 62.43 C ATOM 830 OG SER A 54 54.608 -12.403 46.845 1.00 71.10 O ATOM 0 H SER A 54 54.513 -12.562 43.011 1.00 30.34 H new ATOM 0 HA SER A 54 55.391 -14.297 45.147 1.00 35.14 H new ATOM 0 HB2 SER A 54 55.645 -11.827 45.167 1.00 62.43 H new ATOM 0 HB3 SER A 54 53.906 -11.637 45.073 1.00 62.43 H new ATOM 0 HG SER A 54 54.685 -11.514 47.250 1.00 71.10 H new ATOM 836 N HIS A 55 52.135 -13.711 44.945 1.00 14.01 N ATOM 837 CA HIS A 55 50.782 -14.212 45.187 1.00 5.43 C ATOM 838 C HIS A 55 49.762 -13.127 44.838 1.00 24.30 C ATOM 839 O HIS A 55 48.771 -13.409 44.172 1.00 55.42 O ATOM 840 CB HIS A 55 50.573 -14.675 46.639 1.00 11.11 C ATOM 841 CG HIS A 55 49.161 -15.148 46.893 1.00 45.05 C ATOM 842 ND1 HIS A 55 48.794 -16.484 46.817 1.00 54.10 N ATOM 843 CD2 HIS A 55 47.997 -14.470 47.169 1.00 23.22 C ATOM 844 CE1 HIS A 55 47.471 -16.548 47.048 1.00 64.44 C ATOM 845 NE2 HIS A 55 46.924 -15.350 47.265 1.00 40.15 N ATOM 0 H HIS A 55 52.134 -12.751 44.600 1.00 14.01 H new ATOM 0 HA HIS A 55 50.640 -15.084 44.548 1.00 5.43 H new ATOM 0 HB2 HIS A 55 51.270 -15.482 46.864 1.00 11.11 H new ATOM 0 HB3 HIS A 55 50.806 -13.854 47.317 1.00 11.11 H new ATOM 0 HD2 HIS A 55 47.926 -13.400 47.294 1.00 23.22 H new ATOM 0 HE1 HIS A 55 46.910 -17.471 47.057 1.00 64.44 H new ATOM 0 HE2 HIS A 55 45.946 -15.131 47.457 1.00 40.15 H new ATOM 853 N GLY A 56 49.988 -11.887 45.294 1.00 31.24 N ATOM 854 CA GLY A 56 49.097 -10.758 45.045 1.00 64.30 C ATOM 855 C GLY A 56 48.776 -10.573 43.559 1.00 20.13 C ATOM 856 O GLY A 56 47.669 -10.166 43.206 1.00 20.34 O ATOM 0 H GLY A 56 50.806 -11.643 45.852 1.00 31.24 H new ATOM 0 HA2 GLY A 56 48.169 -10.905 45.597 1.00 64.30 H new ATOM 0 HA3 GLY A 56 49.556 -9.847 45.429 1.00 64.30 H new ATOM 860 N CYS A 57 49.743 -10.892 42.692 1.00 13.30 N ATOM 861 CA CYS A 57 49.605 -10.819 41.249 1.00 34.13 C ATOM 862 C CYS A 57 48.675 -11.914 40.723 1.00 73.33 C ATOM 863 O CYS A 57 47.947 -11.674 39.766 1.00 2.11 O ATOM 864 CB CYS A 57 50.986 -10.942 40.596 1.00 22.14 C ATOM 865 SG CYS A 57 52.084 -9.621 41.178 1.00 1.25 S ATOM 0 H CYS A 57 50.663 -11.215 42.991 1.00 13.30 H new ATOM 0 HA CYS A 57 49.163 -9.856 40.994 1.00 34.13 H new ATOM 0 HB2 CYS A 57 51.420 -11.914 40.831 1.00 22.14 H new ATOM 0 HB3 CYS A 57 50.888 -10.890 39.512 1.00 22.14 H new ATOM 0 HG CYS A 57 53.249 -9.745 40.614 1.00 1.25 H new ATOM 871 N VAL A 58 48.702 -13.111 41.330 1.00 70.35 N ATOM 872 CA VAL A 58 47.949 -14.271 40.868 1.00 31.42 C ATOM 873 C VAL A 58 46.467 -13.946 40.708 1.00 12.25 C ATOM 874 O VAL A 58 45.909 -14.234 39.657 1.00 24.21 O ATOM 875 CB VAL A 58 48.163 -15.480 41.795 1.00 65.03 C ATOM 876 CG1 VAL A 58 47.240 -16.643 41.410 1.00 42.22 C ATOM 877 CG2 VAL A 58 49.619 -15.947 41.721 1.00 12.13 C ATOM 0 H VAL A 58 49.257 -13.295 42.166 1.00 70.35 H new ATOM 0 HA VAL A 58 48.331 -14.540 39.883 1.00 31.42 H new ATOM 0 HB VAL A 58 47.926 -15.167 42.812 1.00 65.03 H new ATOM 0 HG11 VAL A 58 47.414 -17.483 42.082 1.00 42.22 H new ATOM 0 HG12 VAL A 58 46.201 -16.324 41.489 1.00 42.22 H new ATOM 0 HG13 VAL A 58 47.449 -16.949 40.385 1.00 42.22 H new ATOM 0 HG21 VAL A 58 49.760 -16.803 42.381 1.00 12.13 H new ATOM 0 HG22 VAL A 58 49.857 -16.235 40.697 1.00 12.13 H new ATOM 0 HG23 VAL A 58 50.277 -15.136 42.033 1.00 12.13 H new ATOM 887 N SER A 59 45.840 -13.348 41.727 1.00 30.13 N ATOM 888 CA SER A 59 44.425 -12.990 41.695 1.00 44.33 C ATOM 889 C SER A 59 44.104 -12.078 40.506 1.00 3.14 C ATOM 890 O SER A 59 43.081 -12.253 39.848 1.00 31.45 O ATOM 891 CB SER A 59 44.035 -12.326 43.021 1.00 20.03 C ATOM 892 OG SER A 59 42.643 -12.087 43.062 1.00 11.40 O ATOM 0 H SER A 59 46.306 -13.099 42.600 1.00 30.13 H new ATOM 0 HA SER A 59 43.838 -13.899 41.566 1.00 44.33 H new ATOM 0 HB2 SER A 59 44.325 -12.966 43.854 1.00 20.03 H new ATOM 0 HB3 SER A 59 44.575 -11.386 43.137 1.00 20.03 H new ATOM 0 HG SER A 59 42.409 -11.664 43.915 1.00 11.40 H new ATOM 898 N LYS A 60 44.982 -11.104 40.237 1.00 25.32 N ATOM 899 CA LYS A 60 44.821 -10.144 39.155 1.00 42.13 C ATOM 900 C LYS A 60 44.953 -10.842 37.798 1.00 4.12 C ATOM 901 O LYS A 60 44.154 -10.597 36.898 1.00 2.21 O ATOM 902 CB LYS A 60 45.847 -9.012 39.305 1.00 43.45 C ATOM 903 CG LYS A 60 45.720 -8.312 40.664 1.00 13.32 C ATOM 904 CD LYS A 60 46.755 -7.186 40.790 1.00 71.20 C ATOM 905 CE LYS A 60 46.749 -6.566 42.192 1.00 31.33 C ATOM 906 NZ LYS A 60 45.465 -5.917 42.509 1.00 52.24 N ATOM 0 H LYS A 60 45.836 -10.965 40.778 1.00 25.32 H new ATOM 0 HA LYS A 60 43.823 -9.708 39.207 1.00 42.13 H new ATOM 0 HB2 LYS A 60 46.854 -9.416 39.195 1.00 43.45 H new ATOM 0 HB3 LYS A 60 45.707 -8.284 38.506 1.00 43.45 H new ATOM 0 HG2 LYS A 60 44.715 -7.904 40.777 1.00 13.32 H new ATOM 0 HG3 LYS A 60 45.862 -9.036 41.467 1.00 13.32 H new ATOM 0 HD2 LYS A 60 47.748 -7.578 40.569 1.00 71.20 H new ATOM 0 HD3 LYS A 60 46.545 -6.414 40.050 1.00 71.20 H new ATOM 0 HE2 LYS A 60 46.954 -7.341 42.931 1.00 31.33 H new ATOM 0 HE3 LYS A 60 47.553 -5.833 42.267 1.00 31.33 H new ATOM 0 HZ1 LYS A 60 45.530 -5.454 43.438 1.00 52.24 H new ATOM 0 HZ2 LYS A 60 45.247 -5.206 41.782 1.00 52.24 H new ATOM 0 HZ3 LYS A 60 44.710 -6.632 42.531 1.00 52.24 H new ATOM 920 N ILE A 61 45.948 -11.729 37.668 1.00 24.42 N ATOM 921 CA ILE A 61 46.197 -12.526 36.471 1.00 2.01 C ATOM 922 C ILE A 61 45.035 -13.495 36.221 1.00 0.53 C ATOM 923 O ILE A 61 44.681 -13.729 35.068 1.00 12.23 O ATOM 924 CB ILE A 61 47.556 -13.246 36.595 1.00 61.31 C ATOM 925 CG1 ILE A 61 48.698 -12.211 36.643 1.00 43.24 C ATOM 926 CG2 ILE A 61 47.775 -14.202 35.411 1.00 72.21 C ATOM 927 CD1 ILE A 61 50.006 -12.796 37.186 1.00 42.24 C ATOM 0 H ILE A 61 46.617 -11.913 38.415 1.00 24.42 H new ATOM 0 HA ILE A 61 46.253 -11.873 35.600 1.00 2.01 H new ATOM 0 HB ILE A 61 47.553 -13.827 37.517 1.00 61.31 H new ATOM 0 HG12 ILE A 61 48.869 -11.819 35.641 1.00 43.24 H new ATOM 0 HG13 ILE A 61 48.395 -11.370 37.267 1.00 43.24 H new ATOM 0 HG21 ILE A 61 48.739 -14.699 35.518 1.00 72.21 H new ATOM 0 HG22 ILE A 61 46.981 -14.949 35.395 1.00 72.21 H new ATOM 0 HG23 ILE A 61 47.760 -13.637 34.479 1.00 72.21 H new ATOM 0 HD11 ILE A 61 50.774 -12.022 37.197 1.00 42.24 H new ATOM 0 HD12 ILE A 61 49.847 -13.164 38.200 1.00 42.24 H new ATOM 0 HD13 ILE A 61 50.329 -13.619 36.548 1.00 42.24 H new ATOM 939 N LEU A 62 44.417 -14.016 37.292 1.00 62.41 N ATOM 940 CA LEU A 62 43.190 -14.811 37.251 1.00 70.12 C ATOM 941 C LEU A 62 42.037 -14.023 36.609 1.00 52.15 C ATOM 942 O LEU A 62 41.066 -14.623 36.153 1.00 12.01 O ATOM 943 CB LEU A 62 42.812 -15.273 38.674 1.00 11.05 C ATOM 944 CG LEU A 62 42.498 -16.771 38.832 1.00 1.43 C ATOM 945 CD1 LEU A 62 41.348 -17.236 37.933 1.00 41.14 C ATOM 946 CD2 LEU A 62 43.740 -17.648 38.617 1.00 62.13 C ATOM 0 H LEU A 62 44.773 -13.889 38.239 1.00 62.41 H new ATOM 0 HA LEU A 62 43.371 -15.690 36.633 1.00 70.12 H new ATOM 0 HB2 LEU A 62 43.631 -15.020 39.347 1.00 11.05 H new ATOM 0 HB3 LEU A 62 41.943 -14.703 39.002 1.00 11.05 H new ATOM 0 HG LEU A 62 42.172 -16.894 39.865 1.00 1.43 H new ATOM 0 HD11 LEU A 62 41.172 -18.301 38.088 1.00 41.14 H new ATOM 0 HD12 LEU A 62 40.444 -16.679 38.181 1.00 41.14 H new ATOM 0 HD13 LEU A 62 41.608 -17.059 36.889 1.00 41.14 H new ATOM 0 HD21 LEU A 62 43.470 -18.697 38.738 1.00 62.13 H new ATOM 0 HD22 LEU A 62 44.129 -17.487 37.612 1.00 62.13 H new ATOM 0 HD23 LEU A 62 44.504 -17.383 39.348 1.00 62.13 H new ATOM 958 N GLY A 63 42.154 -12.688 36.559 1.00 72.43 N ATOM 959 CA GLY A 63 41.244 -11.789 35.877 1.00 24.41 C ATOM 960 C GLY A 63 40.588 -10.865 36.891 1.00 70.23 C ATOM 961 O GLY A 63 40.218 -11.306 37.977 1.00 54.42 O ATOM 0 H GLY A 63 42.922 -12.196 37.016 1.00 72.43 H new ATOM 0 HA2 GLY A 63 41.784 -11.204 35.132 1.00 24.41 H new ATOM 0 HA3 GLY A 63 40.484 -12.360 35.344 1.00 24.41 H new ATOM 1314 N LYS A 87 -0.923 -0.767 5.678 1.00 14.24 N ATOM 1315 CA LYS A 87 -1.114 -1.232 4.311 1.00 11.12 C ATOM 1316 C LYS A 87 -2.197 -2.311 4.185 1.00 72.44 C ATOM 1317 O LYS A 87 -2.729 -2.511 3.095 1.00 21.43 O ATOM 1318 CB LYS A 87 0.234 -1.701 3.755 1.00 23.41 C ATOM 1319 CG LYS A 87 0.187 -1.887 2.232 1.00 71.03 C ATOM 1320 CD LYS A 87 1.598 -2.008 1.651 1.00 42.51 C ATOM 1321 CE LYS A 87 1.520 -2.158 0.128 1.00 13.12 C ATOM 1322 NZ LYS A 87 2.861 -2.186 -0.484 1.00 63.03 N ATOM 0 HA LYS A 87 -1.483 -0.398 3.715 1.00 11.12 H new ATOM 0 HB2 LYS A 87 1.005 -0.974 4.009 1.00 23.41 H new ATOM 0 HB3 LYS A 87 0.515 -2.642 4.228 1.00 23.41 H new ATOM 0 HG2 LYS A 87 -0.388 -2.780 1.989 1.00 71.03 H new ATOM 0 HG3 LYS A 87 -0.327 -1.042 1.774 1.00 71.03 H new ATOM 0 HD2 LYS A 87 2.185 -1.126 1.909 1.00 42.51 H new ATOM 0 HD3 LYS A 87 2.108 -2.868 2.085 1.00 42.51 H new ATOM 0 HE2 LYS A 87 0.987 -3.075 -0.121 1.00 13.12 H new ATOM 0 HE3 LYS A 87 0.946 -1.332 -0.291 1.00 13.12 H new ATOM 0 HZ1 LYS A 87 2.770 -2.288 -1.515 1.00 63.03 H new ATOM 0 HZ2 LYS A 87 3.360 -1.300 -0.267 1.00 63.03 H new ATOM 0 HZ3 LYS A 87 3.400 -2.989 -0.103 1.00 63.03 H new ATOM 1336 N VAL A 88 -2.555 -2.980 5.289 1.00 33.35 N ATOM 1337 CA VAL A 88 -3.709 -3.873 5.335 1.00 60.33 C ATOM 1338 C VAL A 88 -4.953 -3.195 4.751 1.00 20.51 C ATOM 1339 O VAL A 88 -5.635 -3.790 3.922 1.00 71.33 O ATOM 1340 CB VAL A 88 -3.969 -4.389 6.763 1.00 64.42 C ATOM 1341 CG1 VAL A 88 -2.793 -5.238 7.260 1.00 10.41 C ATOM 1342 CG2 VAL A 88 -4.288 -3.275 7.769 1.00 34.02 C ATOM 0 H VAL A 88 -2.050 -2.914 6.173 1.00 33.35 H new ATOM 0 HA VAL A 88 -3.480 -4.740 4.715 1.00 60.33 H new ATOM 0 HB VAL A 88 -4.862 -5.011 6.698 1.00 64.42 H new ATOM 0 HG11 VAL A 88 -3.000 -5.591 8.270 1.00 10.41 H new ATOM 0 HG12 VAL A 88 -2.656 -6.093 6.598 1.00 10.41 H new ATOM 0 HG13 VAL A 88 -1.885 -4.635 7.265 1.00 10.41 H new ATOM 0 HG21 VAL A 88 -4.460 -3.712 8.753 1.00 34.02 H new ATOM 0 HG22 VAL A 88 -3.449 -2.581 7.821 1.00 34.02 H new ATOM 0 HG23 VAL A 88 -5.182 -2.740 7.448 1.00 34.02 H new ATOM 1352 N VAL A 89 -5.216 -1.943 5.147 1.00 5.20 N ATOM 1353 CA VAL A 89 -6.370 -1.173 4.703 1.00 65.50 C ATOM 1354 C VAL A 89 -6.394 -1.064 3.175 1.00 52.44 C ATOM 1355 O VAL A 89 -7.462 -1.143 2.571 1.00 14.00 O ATOM 1356 CB VAL A 89 -6.371 0.210 5.379 1.00 13.42 C ATOM 1357 CG1 VAL A 89 -7.581 1.046 4.941 1.00 54.40 C ATOM 1358 CG2 VAL A 89 -6.408 0.067 6.908 1.00 52.42 C ATOM 0 H VAL A 89 -4.618 -1.433 5.797 1.00 5.20 H new ATOM 0 HA VAL A 89 -7.282 -1.691 5.001 1.00 65.50 H new ATOM 0 HB VAL A 89 -5.454 0.714 5.073 1.00 13.42 H new ATOM 0 HG11 VAL A 89 -7.551 2.016 5.437 1.00 54.40 H new ATOM 0 HG12 VAL A 89 -7.553 1.189 3.861 1.00 54.40 H new ATOM 0 HG13 VAL A 89 -8.500 0.527 5.214 1.00 54.40 H new ATOM 0 HG21 VAL A 89 -6.408 1.056 7.366 1.00 52.42 H new ATOM 0 HG22 VAL A 89 -7.311 -0.469 7.202 1.00 52.42 H new ATOM 0 HG23 VAL A 89 -5.532 -0.488 7.243 1.00 52.42 H new ATOM 1368 N GLU A 90 -5.220 -0.906 2.553 1.00 52.02 N ATOM 1369 CA GLU A 90 -5.093 -0.807 1.109 1.00 61.43 C ATOM 1370 C GLU A 90 -5.502 -2.128 0.450 1.00 52.21 C ATOM 1371 O GLU A 90 -6.386 -2.133 -0.404 1.00 2.25 O ATOM 1372 CB GLU A 90 -3.664 -0.404 0.718 1.00 40.12 C ATOM 1373 CG GLU A 90 -3.254 0.946 1.326 1.00 32.55 C ATOM 1374 CD GLU A 90 -1.774 1.242 1.098 1.00 13.11 C ATOM 1375 OE1 GLU A 90 -1.287 0.934 -0.011 1.00 63.24 O ATOM 1376 OE2 GLU A 90 -1.145 1.761 2.047 1.00 54.40 O ATOM 0 H GLU A 90 -4.330 -0.844 3.048 1.00 52.02 H new ATOM 0 HA GLU A 90 -5.765 -0.028 0.749 1.00 61.43 H new ATOM 0 HB2 GLU A 90 -2.968 -1.175 1.048 1.00 40.12 H new ATOM 0 HB3 GLU A 90 -3.588 -0.349 -0.368 1.00 40.12 H new ATOM 0 HG2 GLU A 90 -3.856 1.741 0.886 1.00 32.55 H new ATOM 0 HG3 GLU A 90 -3.464 0.942 2.396 1.00 32.55 H new ATOM 1383 N LYS A 91 -4.871 -3.244 0.845 1.00 21.10 N ATOM 1384 CA LYS A 91 -5.076 -4.533 0.185 1.00 12.43 C ATOM 1385 C LYS A 91 -6.365 -5.256 0.591 1.00 63.04 C ATOM 1386 O LYS A 91 -6.708 -6.262 -0.029 1.00 2.20 O ATOM 1387 CB LYS A 91 -3.808 -5.399 0.239 1.00 53.03 C ATOM 1388 CG LYS A 91 -3.296 -5.801 1.627 1.00 63.40 C ATOM 1389 CD LYS A 91 -4.229 -6.771 2.362 1.00 55.14 C ATOM 1390 CE LYS A 91 -3.458 -7.593 3.402 1.00 11.41 C ATOM 1391 NZ LYS A 91 -2.648 -8.650 2.769 1.00 23.34 N ATOM 0 H LYS A 91 -4.212 -3.275 1.623 1.00 21.10 H new ATOM 0 HA LYS A 91 -5.251 -4.317 -0.869 1.00 12.43 H new ATOM 0 HB2 LYS A 91 -3.996 -6.310 -0.329 1.00 53.03 H new ATOM 0 HB3 LYS A 91 -3.010 -4.862 -0.274 1.00 53.03 H new ATOM 0 HG2 LYS A 91 -2.313 -6.261 1.525 1.00 63.40 H new ATOM 0 HG3 LYS A 91 -3.166 -4.904 2.232 1.00 63.40 H new ATOM 0 HD2 LYS A 91 -5.026 -6.213 2.853 1.00 55.14 H new ATOM 0 HD3 LYS A 91 -4.703 -7.440 1.644 1.00 55.14 H new ATOM 0 HE2 LYS A 91 -2.810 -6.934 3.979 1.00 11.41 H new ATOM 0 HE3 LYS A 91 -4.160 -8.043 4.104 1.00 11.41 H new ATOM 0 HZ1 LYS A 91 -1.991 -9.050 3.469 1.00 23.34 H new ATOM 0 HZ2 LYS A 91 -3.274 -9.401 2.413 1.00 23.34 H new ATOM 0 HZ3 LYS A 91 -2.107 -8.246 1.978 1.00 23.34 H new ATOM 1405 N ILE A 92 -7.138 -4.720 1.547 1.00 34.14 N ATOM 1406 CA ILE A 92 -8.542 -5.085 1.676 1.00 40.44 C ATOM 1407 C ILE A 92 -9.278 -4.722 0.379 1.00 21.42 C ATOM 1408 O ILE A 92 -10.160 -5.460 -0.051 1.00 21.43 O ATOM 1409 CB ILE A 92 -9.140 -4.374 2.898 1.00 34.14 C ATOM 1410 CG1 ILE A 92 -8.503 -4.900 4.203 1.00 4.33 C ATOM 1411 CG2 ILE A 92 -10.671 -4.482 2.893 1.00 52.14 C ATOM 1412 CD1 ILE A 92 -9.280 -6.009 4.915 1.00 24.42 C ATOM 0 H ILE A 92 -6.811 -4.039 2.233 1.00 34.14 H new ATOM 0 HA ILE A 92 -8.649 -6.159 1.831 1.00 40.44 H new ATOM 0 HB ILE A 92 -8.902 -3.312 2.843 1.00 34.14 H new ATOM 0 HG12 ILE A 92 -7.503 -5.269 3.975 1.00 4.33 H new ATOM 0 HG13 ILE A 92 -8.385 -4.064 4.892 1.00 4.33 H new ATOM 0 HG21 ILE A 92 -11.075 -3.972 3.767 1.00 52.14 H new ATOM 0 HG22 ILE A 92 -11.065 -4.019 1.988 1.00 52.14 H new ATOM 0 HG23 ILE A 92 -10.962 -5.532 2.920 1.00 52.14 H new ATOM 0 HD11 ILE A 92 -8.746 -6.305 5.818 1.00 24.42 H new ATOM 0 HD12 ILE A 92 -10.272 -5.644 5.183 1.00 24.42 H new ATOM 0 HD13 ILE A 92 -9.376 -6.869 4.252 1.00 24.42 H new ATOM 1424 N GLY A 93 -8.897 -3.602 -0.253 1.00 2.05 N ATOM 1425 CA GLY A 93 -9.407 -3.185 -1.549 1.00 10.12 C ATOM 1426 C GLY A 93 -9.255 -4.285 -2.600 1.00 40.32 C ATOM 1427 O GLY A 93 -10.195 -4.547 -3.348 1.00 4.13 O ATOM 0 H GLY A 93 -8.212 -2.955 0.138 1.00 2.05 H new ATOM 0 HA2 GLY A 93 -10.459 -2.914 -1.456 1.00 10.12 H new ATOM 0 HA3 GLY A 93 -8.876 -2.292 -1.878 1.00 10.12 H new ATOM 1431 N ASP A 94 -8.088 -4.943 -2.647 1.00 11.30 N ATOM 1432 CA ASP A 94 -7.865 -6.062 -3.550 1.00 75.45 C ATOM 1433 C ASP A 94 -8.802 -7.217 -3.220 1.00 15.54 C ATOM 1434 O ASP A 94 -9.431 -7.767 -4.118 1.00 3.32 O ATOM 1435 CB ASP A 94 -6.407 -6.524 -3.521 1.00 41.24 C ATOM 1436 CG ASP A 94 -5.471 -5.485 -4.130 1.00 14.11 C ATOM 1437 OD1 ASP A 94 -5.476 -5.382 -5.377 1.00 33.02 O ATOM 1438 OD2 ASP A 94 -4.771 -4.813 -3.343 1.00 52.13 O ATOM 0 H ASP A 94 -7.284 -4.711 -2.063 1.00 11.30 H new ATOM 0 HA ASP A 94 -8.083 -5.718 -4.561 1.00 75.45 H new ATOM 0 HB2 ASP A 94 -6.109 -6.722 -2.491 1.00 41.24 H new ATOM 0 HB3 ASP A 94 -6.312 -7.463 -4.067 1.00 41.24 H new ATOM 1443 N TYR A 95 -8.919 -7.590 -1.943 1.00 32.23 N ATOM 1444 CA TYR A 95 -9.815 -8.665 -1.551 1.00 24.11 C ATOM 1445 C TYR A 95 -11.271 -8.383 -1.946 1.00 22.03 C ATOM 1446 O TYR A 95 -11.962 -9.300 -2.380 1.00 51.25 O ATOM 1447 CB TYR A 95 -9.672 -8.927 -0.054 1.00 50.31 C ATOM 1448 CG TYR A 95 -8.268 -9.181 0.466 1.00 33.31 C ATOM 1449 CD1 TYR A 95 -7.263 -9.747 -0.346 1.00 31.54 C ATOM 1450 CD2 TYR A 95 -8.030 -9.009 1.840 1.00 51.42 C ATOM 1451 CE1 TYR A 95 -6.057 -10.191 0.226 1.00 0.22 C ATOM 1452 CE2 TYR A 95 -6.826 -9.447 2.406 1.00 41.14 C ATOM 1453 CZ TYR A 95 -5.851 -10.062 1.610 1.00 3.24 C ATOM 1454 OH TYR A 95 -4.712 -10.527 2.193 1.00 15.41 O ATOM 0 H TYR A 95 -8.405 -7.163 -1.172 1.00 32.23 H new ATOM 0 HA TYR A 95 -9.529 -9.566 -2.094 1.00 24.11 H new ATOM 0 HB2 TYR A 95 -10.083 -8.071 0.481 1.00 50.31 H new ATOM 0 HB3 TYR A 95 -10.289 -9.788 0.201 1.00 50.31 H new ATOM 0 HD1 TYR A 95 -7.420 -9.840 -1.410 1.00 31.54 H new ATOM 0 HD2 TYR A 95 -8.777 -8.538 2.461 1.00 51.42 H new ATOM 0 HE1 TYR A 95 -5.292 -10.630 -0.397 1.00 0.22 H new ATOM 0 HE2 TYR A 95 -6.648 -9.310 3.462 1.00 41.14 H new ATOM 0 HH TYR A 95 -4.171 -10.997 1.525 1.00 15.41 H new ATOM 1464 N LYS A 96 -11.730 -7.128 -1.832 1.00 13.11 N ATOM 1465 CA LYS A 96 -13.052 -6.707 -2.282 1.00 34.01 C ATOM 1466 C LYS A 96 -13.194 -6.801 -3.803 1.00 53.22 C ATOM 1467 O LYS A 96 -14.134 -7.429 -4.279 1.00 25.31 O ATOM 1468 CB LYS A 96 -13.355 -5.282 -1.795 1.00 5.11 C ATOM 1469 CG LYS A 96 -13.642 -5.199 -0.289 1.00 14.25 C ATOM 1470 CD LYS A 96 -14.908 -5.946 0.168 1.00 0.10 C ATOM 1471 CE LYS A 96 -16.211 -5.505 -0.515 1.00 10.44 C ATOM 1472 NZ LYS A 96 -16.509 -4.082 -0.279 1.00 53.50 N ATOM 0 H LYS A 96 -11.182 -6.373 -1.419 1.00 13.11 H new ATOM 0 HA LYS A 96 -13.781 -7.390 -1.846 1.00 34.01 H new ATOM 0 HB2 LYS A 96 -12.508 -4.638 -2.032 1.00 5.11 H new ATOM 0 HB3 LYS A 96 -14.214 -4.894 -2.343 1.00 5.11 H new ATOM 0 HG2 LYS A 96 -12.785 -5.600 0.253 1.00 14.25 H new ATOM 0 HG3 LYS A 96 -13.735 -4.150 -0.008 1.00 14.25 H new ATOM 0 HD2 LYS A 96 -14.766 -7.012 -0.011 1.00 0.10 H new ATOM 0 HD3 LYS A 96 -15.019 -5.815 1.244 1.00 0.10 H new ATOM 0 HE2 LYS A 96 -16.136 -5.686 -1.587 1.00 10.44 H new ATOM 0 HE3 LYS A 96 -17.037 -6.113 -0.146 1.00 10.44 H new ATOM 0 HZ1 LYS A 96 -17.397 -3.829 -0.758 1.00 53.50 H new ATOM 0 HZ2 LYS A 96 -16.607 -3.913 0.742 1.00 53.50 H new ATOM 0 HZ3 LYS A 96 -15.734 -3.498 -0.654 1.00 53.50 H new ATOM 1486 N ARG A 97 -12.303 -6.174 -4.581 1.00 62.41 N ATOM 1487 CA ARG A 97 -12.410 -6.165 -6.027 1.00 50.20 C ATOM 1488 C ARG A 97 -12.291 -7.573 -6.626 1.00 60.12 C ATOM 1489 O ARG A 97 -12.912 -7.860 -7.647 1.00 5.32 O ATOM 1490 CB ARG A 97 -11.473 -5.103 -6.597 1.00 44.13 C ATOM 1491 CG ARG A 97 -10.098 -5.692 -6.809 1.00 0.52 C ATOM 1492 CD ARG A 97 -9.049 -4.622 -7.125 1.00 41.14 C ATOM 1493 NE ARG A 97 -7.692 -5.184 -7.138 1.00 10.40 N ATOM 1494 CZ ARG A 97 -7.152 -5.938 -8.108 1.00 33.32 C ATOM 1495 NH1 ARG A 97 -7.840 -6.240 -9.219 1.00 33.23 N ATOM 1496 NH2 ARG A 97 -5.903 -6.388 -7.949 1.00 12.51 N ATOM 0 H ARG A 97 -11.497 -5.665 -4.219 1.00 62.41 H new ATOM 0 HA ARG A 97 -13.413 -5.866 -6.333 1.00 50.20 H new ATOM 0 HB2 ARG A 97 -11.867 -4.727 -7.541 1.00 44.13 H new ATOM 0 HB3 ARG A 97 -11.414 -4.254 -5.916 1.00 44.13 H new ATOM 0 HG2 ARG A 97 -9.798 -6.239 -5.915 1.00 0.52 H new ATOM 0 HG3 ARG A 97 -10.136 -6.413 -7.626 1.00 0.52 H new ATOM 0 HD2 ARG A 97 -9.267 -4.173 -8.094 1.00 41.14 H new ATOM 0 HD3 ARG A 97 -9.106 -3.825 -6.384 1.00 41.14 H new ATOM 0 HE ARG A 97 -7.102 -4.981 -6.331 1.00 10.40 H new ATOM 0 HH11 ARG A 97 -8.792 -5.895 -9.339 1.00 33.23 H new ATOM 0 HH12 ARG A 97 -7.411 -6.815 -9.944 1.00 33.23 H new ATOM 0 HH21 ARG A 97 -5.381 -6.157 -7.104 1.00 12.51 H new ATOM 0 HH22 ARG A 97 -5.472 -6.963 -8.673 1.00 12.51 H new ATOM 1510 N GLN A 98 -11.527 -8.456 -5.970 1.00 54.22 N ATOM 1511 CA GLN A 98 -11.425 -9.866 -6.314 1.00 63.20 C ATOM 1512 C GLN A 98 -12.726 -10.594 -5.955 1.00 44.43 C ATOM 1513 O GLN A 98 -13.320 -11.250 -6.809 1.00 2.20 O ATOM 1514 CB GLN A 98 -10.226 -10.491 -5.591 1.00 71.21 C ATOM 1515 CG GLN A 98 -8.898 -10.001 -6.188 1.00 52.32 C ATOM 1516 CD GLN A 98 -7.698 -10.409 -5.335 1.00 44.44 C ATOM 1517 OE1 GLN A 98 -7.820 -11.221 -4.420 1.00 45.04 O ATOM 1518 NE2 GLN A 98 -6.527 -9.844 -5.635 1.00 2.50 N ATOM 0 H GLN A 98 -10.952 -8.196 -5.168 1.00 54.22 H new ATOM 0 HA GLN A 98 -11.269 -9.965 -7.388 1.00 63.20 H new ATOM 0 HB2 GLN A 98 -10.266 -10.239 -4.531 1.00 71.21 H new ATOM 0 HB3 GLN A 98 -10.281 -11.577 -5.663 1.00 71.21 H new ATOM 0 HG2 GLN A 98 -8.782 -10.406 -7.193 1.00 52.32 H new ATOM 0 HG3 GLN A 98 -8.922 -8.915 -6.283 1.00 52.32 H new ATOM 0 HE21 GLN A 98 -6.465 -9.174 -6.402 1.00 2.50 H new ATOM 0 HE22 GLN A 98 -5.693 -10.082 -5.098 1.00 2.50 H new ATOM 1527 N ASN A 99 -13.149 -10.492 -4.687 1.00 2.00 N ATOM 1528 CA ASN A 99 -14.295 -11.191 -4.118 1.00 41.35 C ATOM 1529 C ASN A 99 -15.224 -10.174 -3.440 1.00 14.11 C ATOM 1530 O ASN A 99 -15.110 -9.954 -2.235 1.00 62.12 O ATOM 1531 CB ASN A 99 -13.778 -12.259 -3.142 1.00 51.32 C ATOM 1532 CG ASN A 99 -14.874 -13.178 -2.609 1.00 35.43 C ATOM 1533 OD1 ASN A 99 -16.013 -12.768 -2.396 1.00 54.34 O ATOM 1534 ND2 ASN A 99 -14.520 -14.440 -2.375 1.00 24.30 N ATOM 0 H ASN A 99 -12.678 -9.894 -4.008 1.00 2.00 H new ATOM 0 HA ASN A 99 -14.877 -11.694 -4.890 1.00 41.35 H new ATOM 0 HB2 ASN A 99 -13.021 -12.862 -3.643 1.00 51.32 H new ATOM 0 HB3 ASN A 99 -13.288 -11.766 -2.302 1.00 51.32 H new ATOM 0 HD21 ASN A 99 -15.204 -15.102 -2.007 1.00 24.30 H new ATOM 0 HD22 ASN A 99 -13.565 -14.745 -2.564 1.00 24.30 H new ATOM 1541 N PRO A 100 -16.144 -9.541 -4.189 1.00 71.50 N ATOM 1542 CA PRO A 100 -17.041 -8.521 -3.660 1.00 43.21 C ATOM 1543 C PRO A 100 -18.141 -9.128 -2.789 1.00 21.35 C ATOM 1544 O PRO A 100 -18.594 -8.484 -1.844 1.00 5.15 O ATOM 1545 CB PRO A 100 -17.623 -7.815 -4.887 1.00 21.13 C ATOM 1546 CG PRO A 100 -17.596 -8.900 -5.961 1.00 15.44 C ATOM 1547 CD PRO A 100 -16.327 -9.683 -5.625 1.00 3.34 C ATOM 0 HA PRO A 100 -16.511 -7.826 -3.009 1.00 43.21 H new ATOM 0 HB2 PRO A 100 -18.636 -7.457 -4.702 1.00 21.13 H new ATOM 0 HB3 PRO A 100 -17.026 -6.949 -5.174 1.00 21.13 H new ATOM 0 HG2 PRO A 100 -18.483 -9.532 -5.919 1.00 15.44 H new ATOM 0 HG3 PRO A 100 -17.554 -8.475 -6.964 1.00 15.44 H new ATOM 0 HD2 PRO A 100 -16.429 -10.732 -5.905 1.00 3.34 H new ATOM 0 HD3 PRO A 100 -15.469 -9.290 -6.170 1.00 3.34 H new ATOM 1555 N THR A 101 -18.568 -10.356 -3.111 1.00 4.34 N ATOM 1556 CA THR A 101 -19.584 -11.091 -2.375 1.00 50.13 C ATOM 1557 C THR A 101 -19.208 -11.223 -0.896 1.00 43.10 C ATOM 1558 O THR A 101 -20.073 -11.060 -0.038 1.00 2.23 O ATOM 1559 CB THR A 101 -19.819 -12.458 -3.040 1.00 61.43 C ATOM 1560 OG1 THR A 101 -18.591 -13.059 -3.398 1.00 55.50 O ATOM 1561 CG2 THR A 101 -20.665 -12.312 -4.309 1.00 21.30 C ATOM 0 H THR A 101 -18.202 -10.871 -3.912 1.00 4.34 H new ATOM 0 HA THR A 101 -20.521 -10.535 -2.407 1.00 50.13 H new ATOM 0 HB THR A 101 -20.343 -13.081 -2.316 1.00 61.43 H new ATOM 0 HG1 THR A 101 -17.883 -12.737 -2.802 1.00 55.50 H new ATOM 0 HG21 THR A 101 -20.817 -13.293 -4.760 1.00 21.30 H new ATOM 0 HG22 THR A 101 -21.631 -11.877 -4.054 1.00 21.30 H new ATOM 0 HG23 THR A 101 -20.150 -11.663 -5.017 1.00 21.30 H new ATOM 1569 N MET A 102 -17.927 -11.477 -0.589 1.00 12.55 N ATOM 1570 CA MET A 102 -17.441 -11.412 0.777 1.00 40.31 C ATOM 1571 C MET A 102 -17.418 -9.959 1.244 1.00 14.34 C ATOM 1572 O MET A 102 -16.747 -9.113 0.654 1.00 62.24 O ATOM 1573 CB MET A 102 -16.059 -12.052 0.913 1.00 64.13 C ATOM 1574 CG MET A 102 -16.206 -13.561 1.087 1.00 12.34 C ATOM 1575 SD MET A 102 -14.643 -14.479 1.062 1.00 44.02 S ATOM 1576 CE MET A 102 -13.980 -14.030 2.688 1.00 21.21 C ATOM 0 H MET A 102 -17.217 -11.729 -1.276 1.00 12.55 H new ATOM 0 HA MET A 102 -18.120 -11.980 1.412 1.00 40.31 H new ATOM 0 HB2 MET A 102 -15.459 -11.835 0.030 1.00 64.13 H new ATOM 0 HB3 MET A 102 -15.533 -11.627 1.768 1.00 64.13 H new ATOM 0 HG2 MET A 102 -16.712 -13.757 2.032 1.00 12.34 H new ATOM 0 HG3 MET A 102 -16.850 -13.944 0.295 1.00 12.34 H new ATOM 0 HE1 MET A 102 -12.940 -14.349 2.758 1.00 21.21 H new ATOM 0 HE2 MET A 102 -14.038 -12.949 2.819 1.00 21.21 H new ATOM 0 HE3 MET A 102 -14.563 -14.521 3.467 1.00 21.21 H new ATOM 1586 N PHE A 103 -18.163 -9.696 2.318 1.00 2.13 N ATOM 1587 CA PHE A 103 -18.318 -8.374 2.909 1.00 33.13 C ATOM 1588 C PHE A 103 -17.223 -8.116 3.948 1.00 35.55 C ATOM 1589 O PHE A 103 -16.475 -9.024 4.296 1.00 13.22 O ATOM 1590 CB PHE A 103 -19.727 -8.272 3.501 1.00 5.01 C ATOM 1591 CG PHE A 103 -20.835 -8.566 2.502 1.00 11.14 C ATOM 1592 CD1 PHE A 103 -20.886 -7.862 1.283 1.00 50.31 C ATOM 1593 CD2 PHE A 103 -21.748 -9.612 2.738 1.00 73.21 C ATOM 1594 CE1 PHE A 103 -21.820 -8.222 0.297 1.00 25.55 C ATOM 1595 CE2 PHE A 103 -22.709 -9.943 1.766 1.00 41.43 C ATOM 1596 CZ PHE A 103 -22.740 -9.255 0.542 1.00 53.35 C ATOM 0 H PHE A 103 -18.688 -10.418 2.811 1.00 2.13 H new ATOM 0 HA PHE A 103 -18.205 -7.600 2.150 1.00 33.13 H new ATOM 0 HB2 PHE A 103 -19.811 -8.966 4.337 1.00 5.01 H new ATOM 0 HB3 PHE A 103 -19.870 -7.269 3.904 1.00 5.01 H new ATOM 0 HD1 PHE A 103 -20.205 -7.043 1.106 1.00 50.31 H new ATOM 0 HD2 PHE A 103 -21.710 -10.161 3.667 1.00 73.21 H new ATOM 0 HE1 PHE A 103 -21.831 -7.704 -0.651 1.00 25.55 H new ATOM 0 HE2 PHE A 103 -23.425 -10.728 1.961 1.00 41.43 H new ATOM 0 HZ PHE A 103 -23.469 -9.519 -0.209 1.00 53.35 H new ATOM 1606 N ALA A 104 -17.115 -6.866 4.421 1.00 21.31 N ATOM 1607 CA ALA A 104 -16.038 -6.368 5.278 1.00 24.15 C ATOM 1608 C ALA A 104 -15.630 -7.342 6.393 1.00 44.11 C ATOM 1609 O ALA A 104 -14.441 -7.554 6.624 1.00 71.53 O ATOM 1610 CB ALA A 104 -16.451 -5.010 5.858 1.00 1.11 C ATOM 0 H ALA A 104 -17.806 -6.147 4.206 1.00 21.31 H new ATOM 0 HA ALA A 104 -15.150 -6.261 4.655 1.00 24.15 H new ATOM 0 HB1 ALA A 104 -15.655 -4.630 6.498 1.00 1.11 H new ATOM 0 HB2 ALA A 104 -16.629 -4.306 5.045 1.00 1.11 H new ATOM 0 HB3 ALA A 104 -17.363 -5.127 6.444 1.00 1.11 H new ATOM 1616 N TRP A 105 -16.615 -7.935 7.077 1.00 52.22 N ATOM 1617 CA TRP A 105 -16.412 -8.845 8.194 1.00 25.44 C ATOM 1618 C TRP A 105 -15.854 -10.198 7.737 1.00 14.42 C ATOM 1619 O TRP A 105 -15.038 -10.783 8.443 1.00 51.23 O ATOM 1620 CB TRP A 105 -17.731 -8.984 8.970 1.00 44.43 C ATOM 1621 CG TRP A 105 -18.964 -9.178 8.142 1.00 0.21 C ATOM 1622 CD1 TRP A 105 -19.448 -10.368 7.734 1.00 60.54 C ATOM 1623 CD2 TRP A 105 -19.841 -8.173 7.550 1.00 43.44 C ATOM 1624 NE1 TRP A 105 -20.574 -10.184 6.958 1.00 2.22 N ATOM 1625 CE2 TRP A 105 -20.861 -8.841 6.812 1.00 0.01 C ATOM 1626 CE3 TRP A 105 -19.858 -6.761 7.534 1.00 34.13 C ATOM 1627 CZ2 TRP A 105 -21.856 -8.145 6.109 1.00 31.54 C ATOM 1628 CZ3 TRP A 105 -20.829 -6.053 6.801 1.00 40.51 C ATOM 1629 CH2 TRP A 105 -21.831 -6.742 6.094 1.00 52.40 C ATOM 0 H TRP A 105 -17.600 -7.787 6.857 1.00 52.22 H new ATOM 0 HA TRP A 105 -15.657 -8.431 8.862 1.00 25.44 H new ATOM 0 HB2 TRP A 105 -17.640 -9.828 9.653 1.00 44.43 H new ATOM 0 HB3 TRP A 105 -17.865 -8.092 9.582 1.00 44.43 H new ATOM 0 HD1 TRP A 105 -19.017 -11.327 7.979 1.00 60.54 H new ATOM 0 HE1 TRP A 105 -21.122 -10.940 6.547 1.00 2.22 H new ATOM 0 HE3 TRP A 105 -19.113 -6.215 8.094 1.00 34.13 H new ATOM 0 HZ2 TRP A 105 -22.632 -8.683 5.585 1.00 31.54 H new ATOM 0 HZ3 TRP A 105 -20.805 -4.973 6.781 1.00 40.51 H new ATOM 0 HH2 TRP A 105 -22.579 -6.193 5.541 1.00 52.40 H new ATOM 1640 N GLU A 106 -16.262 -10.683 6.557 1.00 33.15 N ATOM 1641 CA GLU A 106 -15.762 -11.919 5.971 1.00 34.31 C ATOM 1642 C GLU A 106 -14.310 -11.727 5.532 1.00 44.13 C ATOM 1643 O GLU A 106 -13.433 -12.510 5.891 1.00 74.40 O ATOM 1644 CB GLU A 106 -16.634 -12.311 4.769 1.00 34.21 C ATOM 1645 CG GLU A 106 -18.108 -12.459 5.157 1.00 43.20 C ATOM 1646 CD GLU A 106 -18.955 -12.868 3.961 1.00 0.52 C ATOM 1647 OE1 GLU A 106 -18.892 -14.061 3.596 1.00 51.25 O ATOM 1648 OE2 GLU A 106 -19.641 -11.969 3.428 1.00 63.11 O ATOM 0 H GLU A 106 -16.960 -10.215 5.979 1.00 33.15 H new ATOM 0 HA GLU A 106 -15.805 -12.717 6.712 1.00 34.31 H new ATOM 0 HB2 GLU A 106 -16.538 -11.556 3.989 1.00 34.21 H new ATOM 0 HB3 GLU A 106 -16.273 -13.250 4.349 1.00 34.21 H new ATOM 0 HG2 GLU A 106 -18.206 -13.204 5.947 1.00 43.20 H new ATOM 0 HG3 GLU A 106 -18.477 -11.516 5.561 1.00 43.20 H new ATOM 1655 N ILE A 107 -14.075 -10.665 4.754 1.00 62.00 N ATOM 1656 CA ILE A 107 -12.778 -10.274 4.224 1.00 60.05 C ATOM 1657 C ILE A 107 -11.730 -10.135 5.334 1.00 54.44 C ATOM 1658 O ILE A 107 -10.565 -10.451 5.098 1.00 3.34 O ATOM 1659 CB ILE A 107 -12.928 -8.964 3.433 1.00 50.23 C ATOM 1660 CG1 ILE A 107 -13.911 -9.067 2.255 1.00 71.22 C ATOM 1661 CG2 ILE A 107 -11.570 -8.490 2.917 1.00 43.25 C ATOM 1662 CD1 ILE A 107 -13.391 -9.879 1.070 1.00 53.50 C ATOM 0 H ILE A 107 -14.821 -10.031 4.468 1.00 62.00 H new ATOM 0 HA ILE A 107 -12.422 -11.058 3.556 1.00 60.05 H new ATOM 0 HB ILE A 107 -13.341 -8.239 4.135 1.00 50.23 H new ATOM 0 HG12 ILE A 107 -14.838 -9.517 2.609 1.00 71.22 H new ATOM 0 HG13 ILE A 107 -14.155 -8.062 1.912 1.00 71.22 H new ATOM 0 HG21 ILE A 107 -11.696 -7.562 2.360 1.00 43.25 H new ATOM 0 HG22 ILE A 107 -10.900 -8.319 3.760 1.00 43.25 H new ATOM 0 HG23 ILE A 107 -11.144 -9.251 2.263 1.00 43.25 H new ATOM 0 HD11 ILE A 107 -14.146 -9.901 0.284 1.00 53.50 H new ATOM 0 HD12 ILE A 107 -12.481 -9.419 0.685 1.00 53.50 H new ATOM 0 HD13 ILE A 107 -13.175 -10.897 1.394 1.00 53.50 H new ATOM 1674 N ARG A 108 -12.128 -9.670 6.527 1.00 5.25 N ATOM 1675 CA ARG A 108 -11.237 -9.511 7.674 1.00 44.32 C ATOM 1676 C ARG A 108 -10.409 -10.779 7.930 1.00 13.23 C ATOM 1677 O ARG A 108 -9.207 -10.692 8.174 1.00 13.44 O ATOM 1678 CB ARG A 108 -12.055 -9.086 8.907 1.00 52.13 C ATOM 1679 CG ARG A 108 -11.160 -8.520 10.017 1.00 4.43 C ATOM 1680 CD ARG A 108 -11.992 -7.931 11.166 1.00 34.04 C ATOM 1681 NE ARG A 108 -11.149 -7.197 12.125 1.00 54.22 N ATOM 1682 CZ ARG A 108 -10.529 -7.714 13.202 1.00 34.13 C ATOM 1683 NH1 ARG A 108 -10.668 -9.005 13.534 1.00 32.00 N ATOM 1684 NH2 ARG A 108 -9.740 -6.927 13.944 1.00 5.12 N ATOM 0 H ARG A 108 -13.090 -9.392 6.720 1.00 5.25 H new ATOM 0 HA ARG A 108 -10.516 -8.723 7.455 1.00 44.32 H new ATOM 0 HB2 ARG A 108 -12.790 -8.336 8.615 1.00 52.13 H new ATOM 0 HB3 ARG A 108 -12.609 -9.943 9.289 1.00 52.13 H new ATOM 0 HG2 ARG A 108 -10.513 -9.309 10.402 1.00 4.43 H new ATOM 0 HG3 ARG A 108 -10.510 -7.748 9.604 1.00 4.43 H new ATOM 0 HD2 ARG A 108 -12.751 -7.261 10.761 1.00 34.04 H new ATOM 0 HD3 ARG A 108 -12.519 -8.733 11.683 1.00 34.04 H new ATOM 0 HE ARG A 108 -11.023 -6.199 11.956 1.00 54.22 H new ATOM 0 HH11 ARG A 108 -11.253 -9.618 12.966 1.00 32.00 H new ATOM 0 HH12 ARG A 108 -10.189 -9.375 14.355 1.00 32.00 H new ATOM 0 HH21 ARG A 108 -9.614 -5.947 13.691 1.00 5.12 H new ATOM 0 HH22 ARG A 108 -9.265 -7.307 14.763 1.00 5.12 H new ATOM 1698 N ASP A 109 -11.041 -11.957 7.834 1.00 1.25 N ATOM 1699 CA ASP A 109 -10.394 -13.247 8.045 1.00 23.01 C ATOM 1700 C ASP A 109 -9.361 -13.602 6.967 1.00 73.04 C ATOM 1701 O ASP A 109 -8.470 -14.403 7.240 1.00 54.15 O ATOM 1702 CB ASP A 109 -11.453 -14.344 8.160 1.00 2.44 C ATOM 1703 CG ASP A 109 -12.391 -14.091 9.336 1.00 51.21 C ATOM 1704 OD1 ASP A 109 -13.391 -13.372 9.120 1.00 42.20 O ATOM 1705 OD2 ASP A 109 -12.082 -14.606 10.432 1.00 50.21 O ATOM 0 H ASP A 109 -12.032 -12.035 7.604 1.00 1.25 H new ATOM 0 HA ASP A 109 -9.835 -13.169 8.977 1.00 23.01 H new ATOM 0 HB2 ASP A 109 -12.030 -14.393 7.237 1.00 2.44 H new ATOM 0 HB3 ASP A 109 -10.965 -15.311 8.283 1.00 2.44 H new ATOM 1710 N ARG A 110 -9.452 -13.026 5.757 1.00 4.01 N ATOM 1711 CA ARG A 110 -8.512 -13.317 4.674 1.00 32.53 C ATOM 1712 C ARG A 110 -7.065 -12.980 5.055 1.00 64.55 C ATOM 1713 O ARG A 110 -6.136 -13.615 4.563 1.00 20.01 O ATOM 1714 CB ARG A 110 -8.931 -12.637 3.366 1.00 21.24 C ATOM 1715 CG ARG A 110 -8.065 -13.158 2.209 1.00 63.34 C ATOM 1716 CD ARG A 110 -8.689 -12.844 0.850 1.00 64.24 C ATOM 1717 NE ARG A 110 -7.754 -13.164 -0.235 1.00 12.04 N ATOM 1718 CZ ARG A 110 -7.926 -12.834 -1.525 1.00 31.33 C ATOM 1719 NH1 ARG A 110 -9.067 -12.274 -1.948 1.00 2.22 N ATOM 1720 NH2 ARG A 110 -6.939 -13.056 -2.402 1.00 15.33 N ATOM 0 H ARG A 110 -10.175 -12.351 5.508 1.00 4.01 H new ATOM 0 HA ARG A 110 -8.546 -14.393 4.505 1.00 32.53 H new ATOM 0 HB2 ARG A 110 -9.983 -12.836 3.163 1.00 21.24 H new ATOM 0 HB3 ARG A 110 -8.822 -11.556 3.456 1.00 21.24 H new ATOM 0 HG2 ARG A 110 -7.073 -12.710 2.266 1.00 63.34 H new ATOM 0 HG3 ARG A 110 -7.934 -14.235 2.309 1.00 63.34 H new ATOM 0 HD2 ARG A 110 -9.608 -13.416 0.725 1.00 64.24 H new ATOM 0 HD3 ARG A 110 -8.961 -11.789 0.804 1.00 64.24 H new ATOM 0 HE ARG A 110 -6.907 -13.677 0.010 1.00 12.04 H new ATOM 0 HH11 ARG A 110 -9.822 -12.092 -1.286 1.00 2.22 H new ATOM 0 HH12 ARG A 110 -9.181 -12.029 -2.932 1.00 2.22 H new ATOM 0 HH21 ARG A 110 -6.063 -13.474 -2.089 1.00 15.33 H new ATOM 0 HH22 ARG A 110 -7.063 -12.808 -3.383 1.00 15.33 H new ATOM 1734 N LEU A 111 -6.871 -12.002 5.943 1.00 65.04 N ATOM 1735 CA LEU A 111 -5.569 -11.624 6.468 1.00 30.51 C ATOM 1736 C LEU A 111 -5.001 -12.747 7.332 1.00 22.33 C ATOM 1737 O LEU A 111 -3.828 -13.087 7.203 1.00 72.43 O ATOM 1738 CB LEU A 111 -5.694 -10.300 7.233 1.00 63.12 C ATOM 1739 CG LEU A 111 -5.989 -9.146 6.260 1.00 71.34 C ATOM 1740 CD1 LEU A 111 -7.485 -8.896 6.039 1.00 41.34 C ATOM 1741 CD2 LEU A 111 -5.351 -7.830 6.714 1.00 43.14 C ATOM 0 H LEU A 111 -7.635 -11.442 6.321 1.00 65.04 H new ATOM 0 HA LEU A 111 -4.865 -11.470 5.650 1.00 30.51 H new ATOM 0 HB2 LEU A 111 -6.491 -10.374 7.973 1.00 63.12 H new ATOM 0 HB3 LEU A 111 -4.772 -10.099 7.778 1.00 63.12 H new ATOM 0 HG LEU A 111 -5.548 -9.473 5.318 1.00 71.34 H new ATOM 0 HD11 LEU A 111 -7.617 -8.068 5.342 1.00 41.34 H new ATOM 0 HD12 LEU A 111 -7.947 -9.794 5.628 1.00 41.34 H new ATOM 0 HD13 LEU A 111 -7.957 -8.648 6.990 1.00 41.34 H new ATOM 0 HD21 LEU A 111 -5.587 -7.045 5.996 1.00 43.14 H new ATOM 0 HD22 LEU A 111 -5.742 -7.555 7.694 1.00 43.14 H new ATOM 0 HD23 LEU A 111 -4.270 -7.952 6.776 1.00 43.14 H new ATOM 1753 N LEU A 112 -5.833 -13.356 8.180 1.00 40.30 N ATOM 1754 CA LEU A 112 -5.426 -14.485 9.003 1.00 32.11 C ATOM 1755 C LEU A 112 -5.130 -15.699 8.115 1.00 21.00 C ATOM 1756 O LEU A 112 -4.122 -16.374 8.318 1.00 1.12 O ATOM 1757 CB LEU A 112 -6.494 -14.791 10.063 1.00 63.21 C ATOM 1758 CG LEU A 112 -6.935 -13.554 10.869 1.00 15.34 C ATOM 1759 CD1 LEU A 112 -7.956 -13.974 11.929 1.00 70.44 C ATOM 1760 CD2 LEU A 112 -5.759 -12.847 11.554 1.00 31.51 C ATOM 0 H LEU A 112 -6.805 -13.077 8.312 1.00 40.30 H new ATOM 0 HA LEU A 112 -4.509 -14.233 9.536 1.00 32.11 H new ATOM 0 HB2 LEU A 112 -7.366 -15.225 9.574 1.00 63.21 H new ATOM 0 HB3 LEU A 112 -6.107 -15.543 10.750 1.00 63.21 H new ATOM 0 HG LEU A 112 -7.376 -12.849 10.164 1.00 15.34 H new ATOM 0 HD11 LEU A 112 -8.269 -13.100 12.500 1.00 70.44 H new ATOM 0 HD12 LEU A 112 -8.824 -14.419 11.442 1.00 70.44 H new ATOM 0 HD13 LEU A 112 -7.504 -14.703 12.601 1.00 70.44 H new ATOM 0 HD21 LEU A 112 -6.126 -11.983 12.108 1.00 31.51 H new ATOM 0 HD22 LEU A 112 -5.270 -13.537 12.241 1.00 31.51 H new ATOM 0 HD23 LEU A 112 -5.044 -12.518 10.800 1.00 31.51 H new ATOM 1772 N ALA A 113 -5.982 -15.949 7.110 1.00 75.14 N ATOM 1773 CA ALA A 113 -5.794 -17.014 6.130 1.00 21.54 C ATOM 1774 C ALA A 113 -4.477 -16.851 5.364 1.00 34.55 C ATOM 1775 O ALA A 113 -3.764 -17.831 5.160 1.00 44.12 O ATOM 1776 CB ALA A 113 -6.981 -17.051 5.164 1.00 71.52 C ATOM 0 H ALA A 113 -6.832 -15.406 6.958 1.00 75.14 H new ATOM 0 HA ALA A 113 -5.742 -17.962 6.666 1.00 21.54 H new ATOM 0 HB1 ALA A 113 -6.833 -17.848 4.436 1.00 71.52 H new ATOM 0 HB2 ALA A 113 -7.899 -17.235 5.722 1.00 71.52 H new ATOM 0 HB3 ALA A 113 -7.058 -16.096 4.645 1.00 71.52 H new ATOM 1782 N GLU A 114 -4.150 -15.618 4.950 1.00 54.40 N ATOM 1783 CA GLU A 114 -2.906 -15.301 4.264 1.00 20.13 C ATOM 1784 C GLU A 114 -1.713 -15.507 5.205 1.00 61.22 C ATOM 1785 O GLU A 114 -0.661 -15.973 4.773 1.00 21.13 O ATOM 1786 CB GLU A 114 -2.991 -13.864 3.727 1.00 64.42 C ATOM 1787 CG GLU A 114 -1.743 -13.442 2.941 1.00 30.45 C ATOM 1788 CD GLU A 114 -1.900 -12.035 2.373 1.00 64.13 C ATOM 1789 OE1 GLU A 114 -2.561 -11.912 1.317 1.00 43.01 O ATOM 1790 OE2 GLU A 114 -1.376 -11.096 3.010 1.00 30.42 O ATOM 0 H GLU A 114 -4.755 -14.809 5.088 1.00 54.40 H new ATOM 0 HA GLU A 114 -2.754 -15.972 3.418 1.00 20.13 H new ATOM 0 HB2 GLU A 114 -3.866 -13.774 3.084 1.00 64.42 H new ATOM 0 HB3 GLU A 114 -3.137 -13.178 4.562 1.00 64.42 H new ATOM 0 HG2 GLU A 114 -0.870 -13.479 3.592 1.00 30.45 H new ATOM 0 HG3 GLU A 114 -1.565 -14.147 2.129 1.00 30.45 H new ATOM 1797 N GLY A 115 -1.889 -15.169 6.488 1.00 5.43 N ATOM 1798 CA GLY A 115 -0.867 -15.273 7.519 1.00 42.23 C ATOM 1799 C GLY A 115 -0.203 -13.919 7.749 1.00 72.13 C ATOM 1800 O GLY A 115 1.013 -13.839 7.912 1.00 43.21 O ATOM 0 H GLY A 115 -2.775 -14.806 6.841 1.00 5.43 H new ATOM 0 HA2 GLY A 115 -1.313 -15.629 8.448 1.00 42.23 H new ATOM 0 HA3 GLY A 115 -0.117 -16.007 7.224 1.00 42.23 H new ATOM 1804 N VAL A 116 -1.015 -12.858 7.774 1.00 62.23 N ATOM 1805 CA VAL A 116 -0.594 -11.497 8.060 1.00 35.33 C ATOM 1806 C VAL A 116 -0.334 -11.356 9.562 1.00 32.43 C ATOM 1807 O VAL A 116 0.646 -10.730 9.962 1.00 31.05 O ATOM 1808 CB VAL A 116 -1.673 -10.516 7.563 1.00 33.51 C ATOM 1809 CG1 VAL A 116 -1.375 -9.076 8.002 1.00 33.24 C ATOM 1810 CG2 VAL A 116 -1.782 -10.553 6.033 1.00 63.23 C ATOM 0 H VAL A 116 -2.015 -12.933 7.589 1.00 62.23 H new ATOM 0 HA VAL A 116 0.334 -11.262 7.538 1.00 35.33 H new ATOM 0 HB VAL A 116 -2.616 -10.834 8.008 1.00 33.51 H new ATOM 0 HG11 VAL A 116 -2.158 -8.414 7.633 1.00 33.24 H new ATOM 0 HG12 VAL A 116 -1.342 -9.027 9.090 1.00 33.24 H new ATOM 0 HG13 VAL A 116 -0.413 -8.763 7.595 1.00 33.24 H new ATOM 0 HG21 VAL A 116 -2.550 -9.852 5.706 1.00 63.23 H new ATOM 0 HG22 VAL A 116 -0.825 -10.273 5.593 1.00 63.23 H new ATOM 0 HG23 VAL A 116 -2.049 -11.560 5.711 1.00 63.23 H new ATOM 1820 N CYS A 117 -1.222 -11.929 10.384 1.00 3.40 N ATOM 1821 CA CYS A 117 -1.185 -11.825 11.836 1.00 12.41 C ATOM 1822 C CYS A 117 -1.940 -12.998 12.475 1.00 53.01 C ATOM 1823 O CYS A 117 -2.404 -13.894 11.772 1.00 11.33 O ATOM 1824 CB CYS A 117 -1.715 -10.449 12.259 1.00 63.14 C ATOM 1825 SG CYS A 117 -3.358 -10.180 11.554 1.00 52.23 S ATOM 0 H CYS A 117 -2.003 -12.490 10.043 1.00 3.40 H new ATOM 0 HA CYS A 117 -0.160 -11.898 12.198 1.00 12.41 H new ATOM 0 HB2 CYS A 117 -1.761 -10.386 13.346 1.00 63.14 H new ATOM 0 HB3 CYS A 117 -1.033 -9.668 11.923 1.00 63.14 H new ATOM 0 HG CYS A 117 -3.336 -9.128 10.791 1.00 52.23 H new ATOM 1831 N ASP A 118 -1.995 -13.017 13.814 1.00 34.22 N ATOM 1832 CA ASP A 118 -2.229 -14.215 14.617 1.00 30.21 C ATOM 1833 C ASP A 118 -3.720 -14.435 14.918 1.00 51.33 C ATOM 1834 O ASP A 118 -4.415 -15.068 14.126 1.00 34.44 O ATOM 1835 CB ASP A 118 -1.331 -14.165 15.871 1.00 4.23 C ATOM 1836 CG ASP A 118 -1.452 -12.862 16.666 1.00 55.03 C ATOM 1837 OD1 ASP A 118 -0.887 -11.849 16.194 1.00 33.51 O ATOM 1838 OD2 ASP A 118 -2.141 -12.896 17.707 1.00 3.44 O ATOM 0 H ASP A 118 -1.874 -12.176 14.378 1.00 34.22 H new ATOM 0 HA ASP A 118 -1.945 -15.099 14.045 1.00 30.21 H new ATOM 0 HB2 ASP A 118 -1.585 -15.002 16.522 1.00 4.23 H new ATOM 0 HB3 ASP A 118 -0.293 -14.300 15.568 1.00 4.23 H new ATOM 1843 N ASN A 119 -4.211 -13.931 16.057 1.00 33.30 N ATOM 1844 CA ASN A 119 -5.615 -13.899 16.427 1.00 13.23 C ATOM 1845 C ASN A 119 -6.239 -12.789 15.591 1.00 64.53 C ATOM 1846 O ASN A 119 -7.079 -13.069 14.742 1.00 52.32 O ATOM 1847 CB ASN A 119 -5.767 -13.626 17.931 1.00 74.33 C ATOM 1848 CG ASN A 119 -5.219 -14.761 18.794 1.00 64.14 C ATOM 1849 OD1 ASN A 119 -5.972 -15.631 19.228 1.00 1.54 O ATOM 1850 ND2 ASN A 119 -3.912 -14.748 19.066 1.00 21.34 N ATOM 0 H ASN A 119 -3.608 -13.519 16.770 1.00 33.30 H new ATOM 0 HA ASN A 119 -6.109 -14.852 16.238 1.00 13.23 H new ATOM 0 HB2 ASN A 119 -5.248 -12.701 18.182 1.00 74.33 H new ATOM 0 HB3 ASN A 119 -6.821 -13.474 18.164 1.00 74.33 H new ATOM 0 HD21 ASN A 119 -3.506 -15.477 19.653 1.00 21.34 H new ATOM 0 HD22 ASN A 119 -3.320 -14.009 18.687 1.00 21.34 H new ATOM 1857 N ASP A 120 -5.734 -11.561 15.783 1.00 60.00 N ATOM 1858 CA ASP A 120 -5.630 -10.523 14.773 1.00 30.33 C ATOM 1859 C ASP A 120 -4.874 -9.333 15.358 1.00 64.55 C ATOM 1860 O ASP A 120 -4.760 -9.183 16.574 1.00 14.53 O ATOM 1861 CB ASP A 120 -6.976 -10.074 14.174 1.00 23.53 C ATOM 1862 CG ASP A 120 -7.840 -9.255 15.127 1.00 33.13 C ATOM 1863 OD1 ASP A 120 -7.514 -8.063 15.317 1.00 74.25 O ATOM 1864 OD2 ASP A 120 -8.866 -9.801 15.585 1.00 22.32 O ATOM 0 H ASP A 120 -5.374 -11.262 16.689 1.00 60.00 H new ATOM 0 HA ASP A 120 -5.083 -10.956 13.935 1.00 30.33 H new ATOM 0 HB2 ASP A 120 -6.784 -9.484 13.278 1.00 23.53 H new ATOM 0 HB3 ASP A 120 -7.535 -10.956 13.862 1.00 23.53 H new ATOM 1869 N THR A 121 -4.396 -8.473 14.458 1.00 1.23 N ATOM 1870 CA THR A 121 -3.995 -7.099 14.732 1.00 62.51 C ATOM 1871 C THR A 121 -4.616 -6.150 13.700 1.00 20.11 C ATOM 1872 O THR A 121 -4.368 -4.946 13.747 1.00 62.31 O ATOM 1873 CB THR A 121 -2.466 -6.985 14.728 1.00 72.01 C ATOM 1874 OG1 THR A 121 -1.950 -7.322 13.457 1.00 31.50 O ATOM 1875 CG2 THR A 121 -1.858 -7.905 15.787 1.00 43.42 C ATOM 0 H THR A 121 -4.274 -8.729 13.478 1.00 1.23 H new ATOM 0 HA THR A 121 -4.358 -6.814 15.720 1.00 62.51 H new ATOM 0 HB THR A 121 -2.202 -5.953 14.959 1.00 72.01 H new ATOM 0 HG1 THR A 121 -0.973 -7.243 13.469 1.00 31.50 H new ATOM 0 HG21 THR A 121 -0.772 -7.811 15.770 1.00 43.42 H new ATOM 0 HG22 THR A 121 -2.231 -7.623 16.772 1.00 43.42 H new ATOM 0 HG23 THR A 121 -2.136 -8.937 15.575 1.00 43.42 H new ATOM 1883 N VAL A 122 -5.409 -6.689 12.762 1.00 54.23 N ATOM 1884 CA VAL A 122 -6.024 -5.920 11.687 1.00 31.22 C ATOM 1885 C VAL A 122 -7.037 -4.923 12.279 1.00 1.10 C ATOM 1886 O VAL A 122 -7.625 -5.201 13.323 1.00 73.35 O ATOM 1887 CB VAL A 122 -6.662 -6.855 10.637 1.00 30.41 C ATOM 1888 CG1 VAL A 122 -5.768 -8.050 10.288 1.00 22.11 C ATOM 1889 CG2 VAL A 122 -8.020 -7.399 11.080 1.00 2.53 C ATOM 0 H VAL A 122 -5.639 -7.682 12.734 1.00 54.23 H new ATOM 0 HA VAL A 122 -5.258 -5.347 11.165 1.00 31.22 H new ATOM 0 HB VAL A 122 -6.790 -6.226 9.756 1.00 30.41 H new ATOM 0 HG11 VAL A 122 -6.267 -8.673 9.546 1.00 22.11 H new ATOM 0 HG12 VAL A 122 -4.822 -7.691 9.883 1.00 22.11 H new ATOM 0 HG13 VAL A 122 -5.579 -8.637 11.186 1.00 22.11 H new ATOM 0 HG21 VAL A 122 -8.422 -8.050 10.304 1.00 2.53 H new ATOM 0 HG22 VAL A 122 -7.901 -7.966 12.003 1.00 2.53 H new ATOM 0 HG23 VAL A 122 -8.707 -6.570 11.249 1.00 2.53 H new ATOM 1899 N PRO A 123 -7.247 -3.756 11.651 1.00 12.51 N ATOM 1900 CA PRO A 123 -8.062 -2.687 12.214 1.00 24.20 C ATOM 1901 C PRO A 123 -9.567 -2.973 12.127 1.00 42.33 C ATOM 1902 O PRO A 123 -10.001 -4.061 11.744 1.00 31.22 O ATOM 1903 CB PRO A 123 -7.655 -1.430 11.436 1.00 51.52 C ATOM 1904 CG PRO A 123 -7.253 -1.986 10.073 1.00 23.31 C ATOM 1905 CD PRO A 123 -6.574 -3.300 10.446 1.00 54.14 C ATOM 0 HA PRO A 123 -7.886 -2.574 13.284 1.00 24.20 H new ATOM 0 HB2 PRO A 123 -8.479 -0.721 11.356 1.00 51.52 H new ATOM 0 HB3 PRO A 123 -6.829 -0.907 11.918 1.00 51.52 H new ATOM 0 HG2 PRO A 123 -8.117 -2.144 9.427 1.00 23.31 H new ATOM 0 HG3 PRO A 123 -6.577 -1.315 9.543 1.00 23.31 H new ATOM 0 HD2 PRO A 123 -6.667 -4.032 9.643 1.00 54.14 H new ATOM 0 HD3 PRO A 123 -5.508 -3.155 10.623 1.00 54.14 H new ATOM 1913 N SER A 124 -10.353 -1.966 12.525 1.00 73.41 N ATOM 1914 CA SER A 124 -11.806 -1.980 12.578 1.00 22.44 C ATOM 1915 C SER A 124 -12.438 -2.373 11.243 1.00 75.22 C ATOM 1916 O SER A 124 -12.075 -1.837 10.196 1.00 51.01 O ATOM 1917 CB SER A 124 -12.293 -0.585 12.987 1.00 42.55 C ATOM 1918 OG SER A 124 -12.158 -0.419 14.381 1.00 4.55 O ATOM 0 H SER A 124 -9.964 -1.075 12.834 1.00 73.41 H new ATOM 0 HA SER A 124 -12.110 -2.731 13.307 1.00 22.44 H new ATOM 0 HB2 SER A 124 -11.717 0.179 12.464 1.00 42.55 H new ATOM 0 HB3 SER A 124 -13.335 -0.454 12.696 1.00 42.55 H new ATOM 0 HG SER A 124 -12.469 0.475 14.636 1.00 4.55 H new ATOM 1924 N VAL A 125 -13.435 -3.263 11.309 1.00 75.03 N ATOM 1925 CA VAL A 125 -14.280 -3.648 10.185 1.00 14.24 C ATOM 1926 C VAL A 125 -15.001 -2.434 9.586 1.00 23.52 C ATOM 1927 O VAL A 125 -15.216 -2.372 8.378 1.00 24.25 O ATOM 1928 CB VAL A 125 -15.252 -4.756 10.633 1.00 31.33 C ATOM 1929 CG1 VAL A 125 -16.295 -4.285 11.655 1.00 13.30 C ATOM 1930 CG2 VAL A 125 -15.963 -5.384 9.431 1.00 11.43 C ATOM 0 H VAL A 125 -13.679 -3.746 12.174 1.00 75.03 H new ATOM 0 HA VAL A 125 -13.658 -4.049 9.385 1.00 14.24 H new ATOM 0 HB VAL A 125 -14.631 -5.502 11.129 1.00 31.33 H new ATOM 0 HG11 VAL A 125 -16.944 -5.119 11.923 1.00 13.30 H new ATOM 0 HG12 VAL A 125 -15.789 -3.917 12.548 1.00 13.30 H new ATOM 0 HG13 VAL A 125 -16.894 -3.484 11.221 1.00 13.30 H new ATOM 0 HG21 VAL A 125 -16.643 -6.163 9.777 1.00 11.43 H new ATOM 0 HG22 VAL A 125 -16.529 -4.617 8.902 1.00 11.43 H new ATOM 0 HG23 VAL A 125 -15.224 -5.820 8.758 1.00 11.43 H new ATOM 1940 N SER A 126 -15.353 -1.451 10.423 1.00 22.21 N ATOM 1941 CA SER A 126 -15.963 -0.210 9.977 1.00 71.13 C ATOM 1942 C SER A 126 -14.965 0.671 9.216 1.00 44.01 C ATOM 1943 O SER A 126 -15.378 1.407 8.321 1.00 44.45 O ATOM 1944 CB SER A 126 -16.557 0.524 11.183 1.00 14.50 C ATOM 1945 OG SER A 126 -15.556 0.817 12.135 1.00 25.55 O ATOM 0 H SER A 126 -15.219 -1.502 11.433 1.00 22.21 H new ATOM 0 HA SER A 126 -16.764 -0.444 9.276 1.00 71.13 H new ATOM 0 HB2 SER A 126 -17.033 1.447 10.854 1.00 14.50 H new ATOM 0 HB3 SER A 126 -17.333 -0.089 11.641 1.00 14.50 H new ATOM 0 HG SER A 126 -15.956 1.287 12.896 1.00 25.55 H new ATOM 1951 N SER A 127 -13.668 0.617 9.563 1.00 71.32 N ATOM 1952 CA SER A 127 -12.666 1.508 8.989 1.00 25.13 C ATOM 1953 C SER A 127 -12.474 1.204 7.503 1.00 51.33 C ATOM 1954 O SER A 127 -12.545 2.116 6.685 1.00 53.20 O ATOM 1955 CB SER A 127 -11.347 1.441 9.768 1.00 64.42 C ATOM 1956 OG SER A 127 -10.422 2.375 9.246 1.00 24.21 O ATOM 0 H SER A 127 -13.294 -0.043 10.245 1.00 71.32 H new ATOM 0 HA SER A 127 -13.025 2.534 9.074 1.00 25.13 H new ATOM 0 HB2 SER A 127 -11.528 1.649 10.823 1.00 64.42 H new ATOM 0 HB3 SER A 127 -10.932 0.435 9.708 1.00 64.42 H new ATOM 0 HG SER A 127 -10.002 2.866 9.983 1.00 24.21 H new ATOM 1962 N ILE A 128 -12.271 -0.074 7.159 1.00 2.51 N ATOM 1963 CA ILE A 128 -12.192 -0.539 5.775 1.00 2.41 C ATOM 1964 C ILE A 128 -13.467 -0.219 4.982 1.00 11.04 C ATOM 1965 O ILE A 128 -13.388 0.071 3.789 1.00 3.32 O ATOM 1966 CB ILE A 128 -11.863 -2.041 5.699 1.00 40.33 C ATOM 1967 CG1 ILE A 128 -12.779 -2.891 6.600 1.00 63.44 C ATOM 1968 CG2 ILE A 128 -10.371 -2.264 5.980 1.00 55.04 C ATOM 1969 CD1 ILE A 128 -12.581 -4.402 6.483 1.00 14.14 C ATOM 0 H ILE A 128 -12.156 -0.820 7.845 1.00 2.51 H new ATOM 0 HA ILE A 128 -11.373 0.010 5.310 1.00 2.41 H new ATOM 0 HB ILE A 128 -12.066 -2.386 4.685 1.00 40.33 H new ATOM 0 HG12 ILE A 128 -12.616 -2.598 7.637 1.00 63.44 H new ATOM 0 HG13 ILE A 128 -13.816 -2.656 6.362 1.00 63.44 H new ATOM 0 HG21 ILE A 128 -10.146 -3.329 5.925 1.00 55.04 H new ATOM 0 HG22 ILE A 128 -9.777 -1.728 5.239 1.00 55.04 H new ATOM 0 HG23 ILE A 128 -10.129 -1.893 6.976 1.00 55.04 H new ATOM 0 HD11 ILE A 128 -13.271 -4.912 7.155 1.00 14.14 H new ATOM 0 HD12 ILE A 128 -12.775 -4.716 5.457 1.00 14.14 H new ATOM 0 HD13 ILE A 128 -11.556 -4.657 6.753 1.00 14.14 H new ATOM 1981 N ASN A 129 -14.637 -0.272 5.630 1.00 35.32 N ATOM 1982 CA ASN A 129 -15.905 0.007 4.974 1.00 63.14 C ATOM 1983 C ASN A 129 -15.994 1.483 4.581 1.00 21.23 C ATOM 1984 O ASN A 129 -16.258 1.791 3.421 1.00 1.22 O ATOM 1985 CB ASN A 129 -17.075 -0.427 5.864 1.00 51.00 C ATOM 1986 CG ASN A 129 -18.414 -0.192 5.168 1.00 72.03 C ATOM 1987 OD1 ASN A 129 -18.879 -1.041 4.411 1.00 62.51 O ATOM 1988 ND2 ASN A 129 -19.035 0.963 5.416 1.00 34.40 N ATOM 0 H ASN A 129 -14.724 -0.509 6.618 1.00 35.32 H new ATOM 0 HA ASN A 129 -15.965 -0.575 4.054 1.00 63.14 H new ATOM 0 HB2 ASN A 129 -16.973 -1.483 6.115 1.00 51.00 H new ATOM 0 HB3 ASN A 129 -17.047 0.128 6.802 1.00 51.00 H new ATOM 0 HD21 ASN A 129 -19.930 1.167 4.970 1.00 34.40 H new ATOM 0 HD22 ASN A 129 -18.615 1.642 6.051 1.00 34.40 H new ATOM 1995 N ARG A 130 -15.772 2.399 5.532 1.00 31.34 N ATOM 1996 CA ARG A 130 -15.919 3.834 5.291 1.00 54.15 C ATOM 1997 C ARG A 130 -14.924 4.407 4.273 1.00 71.50 C ATOM 1998 O ARG A 130 -15.158 5.510 3.789 1.00 31.05 O ATOM 1999 CB ARG A 130 -15.964 4.639 6.604 1.00 55.43 C ATOM 2000 CG ARG A 130 -14.707 4.551 7.478 1.00 63.04 C ATOM 2001 CD ARG A 130 -13.567 5.506 7.098 1.00 31.53 C ATOM 2002 NE ARG A 130 -12.301 5.024 7.665 1.00 72.34 N ATOM 2003 CZ ARG A 130 -11.153 5.716 7.739 1.00 11.13 C ATOM 2004 NH1 ARG A 130 -11.087 6.985 7.312 1.00 11.24 N ATOM 2005 NH2 ARG A 130 -10.063 5.119 8.238 1.00 61.35 N ATOM 0 H ARG A 130 -15.487 2.165 6.483 1.00 31.34 H new ATOM 0 HA ARG A 130 -16.892 3.949 4.813 1.00 54.15 H new ATOM 0 HB2 ARG A 130 -16.143 5.686 6.361 1.00 55.43 H new ATOM 0 HB3 ARG A 130 -16.817 4.297 7.190 1.00 55.43 H new ATOM 0 HG2 ARG A 130 -14.991 4.746 8.512 1.00 63.04 H new ATOM 0 HG3 ARG A 130 -14.329 3.529 7.438 1.00 63.04 H new ATOM 0 HD2 ARG A 130 -13.486 5.576 6.013 1.00 31.53 H new ATOM 0 HD3 ARG A 130 -13.783 6.509 7.467 1.00 31.53 H new ATOM 0 HE ARG A 130 -12.293 4.074 8.037 1.00 72.34 H new ATOM 0 HH11 ARG A 130 -11.916 7.437 6.925 1.00 11.24 H new ATOM 0 HH12 ARG A 130 -10.208 7.499 7.374 1.00 11.24 H new ATOM 0 HH21 ARG A 130 -10.112 4.151 8.556 1.00 61.35 H new ATOM 0 HH22 ARG A 130 -9.184 5.632 8.300 1.00 61.35 H new ATOM 2019 N ILE A 131 -13.847 3.690 3.909 1.00 43.11 N ATOM 2020 CA ILE A 131 -12.967 4.133 2.821 1.00 52.11 C ATOM 2021 C ILE A 131 -13.773 4.249 1.517 1.00 65.44 C ATOM 2022 O ILE A 131 -13.528 5.141 0.706 1.00 42.54 O ATOM 2023 CB ILE A 131 -11.768 3.184 2.598 1.00 62.22 C ATOM 2024 CG1 ILE A 131 -11.108 2.639 3.873 1.00 4.24 C ATOM 2025 CG2 ILE A 131 -10.697 3.867 1.732 1.00 15.34 C ATOM 2026 CD1 ILE A 131 -10.657 3.700 4.880 1.00 15.43 C ATOM 0 H ILE A 131 -13.569 2.812 4.348 1.00 43.11 H new ATOM 0 HA ILE A 131 -12.565 5.104 3.111 1.00 52.11 H new ATOM 0 HB ILE A 131 -12.199 2.320 2.093 1.00 62.22 H new ATOM 0 HG12 ILE A 131 -11.810 1.967 4.367 1.00 4.24 H new ATOM 0 HG13 ILE A 131 -10.242 2.041 3.587 1.00 4.24 H new ATOM 0 HG21 ILE A 131 -9.859 3.185 1.584 1.00 15.34 H new ATOM 0 HG22 ILE A 131 -11.125 4.131 0.765 1.00 15.34 H new ATOM 0 HG23 ILE A 131 -10.346 4.770 2.232 1.00 15.34 H new ATOM 0 HD11 ILE A 131 -10.204 3.213 5.744 1.00 15.43 H new ATOM 0 HD12 ILE A 131 -9.927 4.359 4.411 1.00 15.43 H new ATOM 0 HD13 ILE A 131 -11.518 4.284 5.203 1.00 15.43 H new ATOM 2038 N ILE A 132 -14.735 3.339 1.329 1.00 51.12 N ATOM 2039 CA ILE A 132 -15.526 3.192 0.119 1.00 1.53 C ATOM 2040 C ILE A 132 -16.364 4.444 -0.160 1.00 33.20 C ATOM 2041 O ILE A 132 -16.650 4.724 -1.321 1.00 73.11 O ATOM 2042 CB ILE A 132 -16.376 1.906 0.207 1.00 34.14 C ATOM 2043 CG1 ILE A 132 -15.444 0.692 0.407 1.00 75.31 C ATOM 2044 CG2 ILE A 132 -17.235 1.707 -1.052 1.00 63.40 C ATOM 2045 CD1 ILE A 132 -16.199 -0.626 0.592 1.00 4.25 C ATOM 0 H ILE A 132 -14.988 2.662 2.049 1.00 51.12 H new ATOM 0 HA ILE A 132 -14.858 3.089 -0.736 1.00 1.53 H new ATOM 0 HB ILE A 132 -17.053 2.001 1.056 1.00 34.14 H new ATOM 0 HG12 ILE A 132 -14.781 0.605 -0.454 1.00 75.31 H new ATOM 0 HG13 ILE A 132 -14.813 0.867 1.278 1.00 75.31 H new ATOM 0 HG21 ILE A 132 -17.819 0.792 -0.953 1.00 63.40 H new ATOM 0 HG22 ILE A 132 -17.908 2.556 -1.171 1.00 63.40 H new ATOM 0 HG23 ILE A 132 -16.588 1.632 -1.926 1.00 63.40 H new ATOM 0 HD11 ILE A 132 -15.485 -1.438 0.727 1.00 4.25 H new ATOM 0 HD12 ILE A 132 -16.841 -0.557 1.470 1.00 4.25 H new ATOM 0 HD13 ILE A 132 -16.809 -0.823 -0.289 1.00 4.25 H new ATOM 2057 N ARG A 133 -16.741 5.212 0.873 1.00 34.33 N ATOM 2058 CA ARG A 133 -17.590 6.388 0.719 1.00 62.15 C ATOM 2059 C ARG A 133 -16.996 7.402 -0.268 1.00 42.25 C ATOM 2060 O ARG A 133 -17.731 8.023 -1.032 1.00 41.12 O ATOM 2061 CB ARG A 133 -17.895 7.005 2.096 1.00 21.45 C ATOM 2062 CG ARG A 133 -16.811 7.970 2.597 1.00 45.13 C ATOM 2063 CD ARG A 133 -17.047 8.341 4.065 1.00 53.10 C ATOM 2064 NE ARG A 133 -18.300 9.092 4.243 1.00 14.15 N ATOM 2065 CZ ARG A 133 -18.835 9.406 5.434 1.00 24.42 C ATOM 2066 NH1 ARG A 133 -18.226 9.044 6.573 1.00 51.24 N ATOM 2067 NH2 ARG A 133 -19.989 10.086 5.490 1.00 14.34 N ATOM 0 H ARG A 133 -16.462 5.029 1.837 1.00 34.33 H new ATOM 0 HA ARG A 133 -18.537 6.074 0.280 1.00 62.15 H new ATOM 0 HB2 ARG A 133 -18.845 7.537 2.043 1.00 21.45 H new ATOM 0 HB3 ARG A 133 -18.019 6.203 2.824 1.00 21.45 H new ATOM 0 HG2 ARG A 133 -15.829 7.509 2.487 1.00 45.13 H new ATOM 0 HG3 ARG A 133 -16.810 8.872 1.985 1.00 45.13 H new ATOM 0 HD2 ARG A 133 -17.078 7.434 4.669 1.00 53.10 H new ATOM 0 HD3 ARG A 133 -16.210 8.938 4.428 1.00 53.10 H new ATOM 0 HE ARG A 133 -18.796 9.395 3.405 1.00 14.15 H new ATOM 0 HH11 ARG A 133 -17.348 8.525 6.539 1.00 51.24 H new ATOM 0 HH12 ARG A 133 -18.641 9.287 7.473 1.00 51.24 H new ATOM 0 HH21 ARG A 133 -20.459 10.364 4.629 1.00 14.34 H new ATOM 0 HH22 ARG A 133 -20.397 10.325 6.394 1.00 14.34 H new ATOM 2081 N THR A 134 -15.663 7.552 -0.272 1.00 62.12 N ATOM 2082 CA THR A 134 -14.966 8.458 -1.176 1.00 73.43 C ATOM 2083 C THR A 134 -15.142 8.038 -2.641 1.00 62.35 C ATOM 2084 O THR A 134 -15.130 8.892 -3.524 1.00 61.41 O ATOM 2085 CB THR A 134 -13.480 8.569 -0.803 1.00 63.21 C ATOM 2086 OG1 THR A 134 -12.815 7.330 -0.952 1.00 53.04 O ATOM 2087 CG2 THR A 134 -13.290 9.074 0.633 1.00 23.03 C ATOM 0 H THR A 134 -15.042 7.043 0.357 1.00 62.12 H new ATOM 0 HA THR A 134 -15.415 9.445 -1.066 1.00 73.43 H new ATOM 0 HB THR A 134 -13.043 9.293 -1.491 1.00 63.21 H new ATOM 0 HG1 THR A 134 -13.176 6.686 -0.308 1.00 53.04 H new ATOM 0 HG21 THR A 134 -12.225 9.139 0.858 1.00 23.03 H new ATOM 0 HG22 THR A 134 -13.743 10.060 0.735 1.00 23.03 H new ATOM 0 HG23 THR A 134 -13.766 8.382 1.328 1.00 23.03 H new