USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=20 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 14 ASN : amide:sc= 0.541 K(o=1.1,f=0.1) USER MOD Set 1.2: A 15 GLN : amide:sc= 0.598 K(o=1.1,f=0.1) USER MOD Single : A 3 HIS : no HE2:sc= 0.542 K(o=0.54,f=-1.8!) USER MOD Single : A 4 ASN : amide:sc= -0.341 K(o=-0.34,f=-2.7!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.0087) USER MOD Single : A 32 GLN : amide:sc= -0.0861 X(o=-0.086,f=-0.086) USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 40 GLN : amide:sc= 0.551 K(o=0.55,f=0) USER MOD Single : A 45 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -63:sc= 0.374 USER MOD Single : A 50 GLN : amide:sc= 0.565 K(o=0.57,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0.297 USER MOD Single : A 55 HIS : no HD1:sc= -0.0713 X(o=-0.071,f=-0.41) USER MOD Single : A 57 CYS SG : rot 170:sc= 0 USER MOD Single : A 59 SER OG : rot 72:sc= 0.421 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 158:sc= 0.982 (180deg=-0.0111!) USER MOD Single : A 91 LYS NZ :NH3+ 172:sc= 1.23 (180deg=1.21) USER MOD Single : A 95 TYR OH : rot 18:sc= 1.02 USER MOD Single : A 96 LYS NZ :NH3+ -135:sc= 1.14 (180deg=-0.147) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 99 ASN : amide:sc= -0.853 K(o=-0.85,f=-2.4!) USER MOD Single : A 101 THR OG1 : rot 59:sc= 0.13 USER MOD Single : A 102 MET CE :methyl 178:sc= -0.445 (180deg=-0.467) USER MOD Single : A 117 CYS SG : rot -130:sc= 0.0546 USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.306 USER MOD Single : A 124 SER OG : rot 180:sc= 0.0906 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 THR OG1 : rot 1:sc= 0.989 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 10.446 -74.057 64.771 1.00 32.44 N ATOM 35 CA HIS A 3 10.880 -73.198 63.678 1.00 24.55 C ATOM 36 C HIS A 3 12.373 -73.426 63.417 1.00 62.21 C ATOM 37 O HIS A 3 12.979 -74.322 64.001 1.00 44.42 O ATOM 38 CB HIS A 3 10.579 -71.729 64.018 1.00 52.01 C ATOM 39 CG HIS A 3 11.446 -71.173 65.120 1.00 71.14 C ATOM 40 ND1 HIS A 3 12.586 -70.424 64.863 1.00 64.42 N ATOM 41 CD2 HIS A 3 11.379 -71.271 66.489 1.00 23.13 C ATOM 42 CE1 HIS A 3 13.137 -70.116 66.049 1.00 71.52 C ATOM 43 NE2 HIS A 3 12.446 -70.603 67.081 1.00 5.31 N ATOM 0 HA HIS A 3 10.334 -73.444 62.767 1.00 24.55 H new ATOM 0 HB2 HIS A 3 10.712 -71.123 63.122 1.00 52.01 H new ATOM 0 HB3 HIS A 3 9.533 -71.640 64.310 1.00 52.01 H new ATOM 0 HD1 HIS A 3 12.940 -70.157 63.944 1.00 64.42 H new ATOM 0 HD2 HIS A 3 10.605 -71.794 67.031 1.00 23.13 H new ATOM 0 HE1 HIS A 3 14.042 -69.536 66.155 1.00 71.52 H new ATOM 51 N ASN A 4 12.960 -72.588 62.554 1.00 52.33 N ATOM 52 CA ASN A 4 14.388 -72.548 62.273 1.00 70.30 C ATOM 53 C ASN A 4 14.835 -71.082 62.218 1.00 13.22 C ATOM 54 O ASN A 4 14.003 -70.174 62.260 1.00 23.24 O ATOM 55 CB ASN A 4 14.651 -73.281 60.948 1.00 3.31 C ATOM 56 CG ASN A 4 16.138 -73.450 60.632 1.00 1.40 C ATOM 57 OD1 ASN A 4 16.959 -73.595 61.535 1.00 13.43 O ATOM 58 ND2 ASN A 4 16.494 -73.419 59.346 1.00 71.12 N ATOM 0 H ASN A 4 12.431 -71.900 62.018 1.00 52.33 H new ATOM 0 HA ASN A 4 14.962 -73.048 63.053 1.00 70.30 H new ATOM 0 HB2 ASN A 4 14.181 -74.264 60.986 1.00 3.31 H new ATOM 0 HB3 ASN A 4 14.175 -72.731 60.136 1.00 3.31 H new ATOM 0 HD21 ASN A 4 17.475 -73.517 59.086 1.00 71.12 H new ATOM 0 HD22 ASN A 4 15.785 -73.297 58.623 1.00 71.12 H new ATOM 65 N SER A 5 16.148 -70.852 62.126 1.00 32.52 N ATOM 66 CA SER A 5 16.746 -69.537 61.956 1.00 32.32 C ATOM 67 C SER A 5 18.119 -69.696 61.301 1.00 63.30 C ATOM 68 O SER A 5 18.711 -70.774 61.355 1.00 75.21 O ATOM 69 CB SER A 5 16.844 -68.825 63.312 1.00 0.03 C ATOM 70 OG SER A 5 17.561 -69.610 64.242 1.00 24.13 O ATOM 0 H SER A 5 16.839 -71.601 62.170 1.00 32.52 H new ATOM 0 HA SER A 5 16.123 -68.921 61.308 1.00 32.32 H new ATOM 0 HB2 SER A 5 17.337 -67.861 63.187 1.00 0.03 H new ATOM 0 HB3 SER A 5 15.844 -68.623 63.695 1.00 0.03 H new ATOM 0 HG SER A 5 17.613 -69.137 65.098 1.00 24.13 H new ATOM 76 N ILE A 6 18.619 -68.621 60.680 1.00 75.51 N ATOM 77 CA ILE A 6 19.901 -68.600 59.988 1.00 14.12 C ATOM 78 C ILE A 6 20.457 -67.174 60.008 1.00 3.13 C ATOM 79 O ILE A 6 19.698 -66.214 60.139 1.00 1.31 O ATOM 80 CB ILE A 6 19.738 -69.163 58.560 1.00 52.15 C ATOM 81 CG1 ILE A 6 21.108 -69.383 57.891 1.00 73.53 C ATOM 82 CG2 ILE A 6 18.840 -68.266 57.693 1.00 54.31 C ATOM 83 CD1 ILE A 6 21.015 -70.261 56.640 1.00 54.04 C ATOM 0 H ILE A 6 18.129 -67.727 60.647 1.00 75.51 H new ATOM 0 HA ILE A 6 20.623 -69.241 60.495 1.00 14.12 H new ATOM 0 HB ILE A 6 19.244 -70.131 58.648 1.00 52.15 H new ATOM 0 HG12 ILE A 6 21.537 -68.418 57.622 1.00 73.53 H new ATOM 0 HG13 ILE A 6 21.788 -69.846 58.606 1.00 73.53 H new ATOM 0 HG21 ILE A 6 18.750 -68.696 56.696 1.00 54.31 H new ATOM 0 HG22 ILE A 6 17.852 -68.193 58.147 1.00 54.31 H new ATOM 0 HG23 ILE A 6 19.280 -67.272 57.621 1.00 54.31 H new ATOM 0 HD11 ILE A 6 22.008 -70.384 56.207 1.00 54.04 H new ATOM 0 HD12 ILE A 6 20.613 -71.237 56.910 1.00 54.04 H new ATOM 0 HD13 ILE A 6 20.358 -69.787 55.911 1.00 54.04 H new ATOM 95 N ARG A 7 21.785 -67.049 59.898 1.00 12.32 N ATOM 96 CA ARG A 7 22.506 -65.785 59.857 1.00 73.11 C ATOM 97 C ARG A 7 23.418 -65.778 58.629 1.00 14.14 C ATOM 98 O ARG A 7 23.918 -66.827 58.224 1.00 44.35 O ATOM 99 CB ARG A 7 23.330 -65.614 61.139 1.00 64.42 C ATOM 100 CG ARG A 7 22.441 -65.558 62.389 1.00 42.12 C ATOM 101 CD ARG A 7 23.300 -65.313 63.632 1.00 34.30 C ATOM 102 NE ARG A 7 22.479 -65.277 64.850 1.00 45.21 N ATOM 103 CZ ARG A 7 22.963 -65.089 66.089 1.00 62.51 C ATOM 104 NH1 ARG A 7 24.276 -64.916 66.290 1.00 73.54 N ATOM 105 NH2 ARG A 7 22.123 -65.074 67.133 1.00 35.32 N ATOM 0 H ARG A 7 22.403 -67.858 59.833 1.00 12.32 H new ATOM 0 HA ARG A 7 21.802 -64.955 59.789 1.00 73.11 H new ATOM 0 HB2 ARG A 7 24.034 -66.441 61.231 1.00 64.42 H new ATOM 0 HB3 ARG A 7 23.920 -64.700 61.072 1.00 64.42 H new ATOM 0 HG2 ARG A 7 21.703 -64.763 62.285 1.00 42.12 H new ATOM 0 HG3 ARG A 7 21.890 -66.493 62.496 1.00 42.12 H new ATOM 0 HD2 ARG A 7 24.050 -66.099 63.719 1.00 34.30 H new ATOM 0 HD3 ARG A 7 23.837 -64.371 63.525 1.00 34.30 H new ATOM 0 HE ARG A 7 21.472 -65.403 64.748 1.00 45.21 H new ATOM 0 HH11 ARG A 7 24.919 -64.926 65.498 1.00 73.54 H new ATOM 0 HH12 ARG A 7 24.633 -64.774 67.235 1.00 73.54 H new ATOM 0 HH21 ARG A 7 21.122 -65.205 66.984 1.00 35.32 H new ATOM 0 HH22 ARG A 7 22.484 -64.932 68.076 1.00 35.32 H new ATOM 119 N SER A 8 23.630 -64.595 58.044 1.00 51.41 N ATOM 120 CA SER A 8 24.457 -64.398 56.862 1.00 51.52 C ATOM 121 C SER A 8 24.818 -62.916 56.733 1.00 4.24 C ATOM 122 O SER A 8 24.271 -62.075 57.447 1.00 63.20 O ATOM 123 CB SER A 8 23.721 -64.911 55.616 1.00 31.43 C ATOM 124 OG SER A 8 22.475 -64.259 55.474 1.00 2.02 O ATOM 0 H SER A 8 23.218 -63.729 58.393 1.00 51.41 H new ATOM 0 HA SER A 8 25.382 -64.966 56.958 1.00 51.52 H new ATOM 0 HB2 SER A 8 24.331 -64.739 54.729 1.00 31.43 H new ATOM 0 HB3 SER A 8 23.568 -65.987 55.694 1.00 31.43 H new ATOM 0 HG SER A 8 22.019 -64.596 54.675 1.00 2.02 H new ATOM 130 N GLY A 9 25.748 -62.597 55.825 1.00 53.41 N ATOM 131 CA GLY A 9 26.197 -61.237 55.577 1.00 35.11 C ATOM 132 C GLY A 9 27.177 -61.203 54.406 1.00 61.51 C ATOM 133 O GLY A 9 27.570 -62.249 53.892 1.00 54.03 O ATOM 0 H GLY A 9 26.211 -63.291 55.238 1.00 53.41 H new ATOM 0 HA2 GLY A 9 25.340 -60.599 55.361 1.00 35.11 H new ATOM 0 HA3 GLY A 9 26.675 -60.837 56.471 1.00 35.11 H new ATOM 137 N HIS A 10 27.563 -59.991 53.987 1.00 72.20 N ATOM 138 CA HIS A 10 28.483 -59.754 52.882 1.00 2.22 C ATOM 139 C HIS A 10 29.016 -58.320 52.958 1.00 71.44 C ATOM 140 O HIS A 10 28.510 -57.509 53.732 1.00 71.25 O ATOM 141 CB HIS A 10 27.775 -60.004 51.540 1.00 14.22 C ATOM 142 CG HIS A 10 26.615 -59.073 51.293 1.00 31.21 C ATOM 143 ND1 HIS A 10 25.335 -59.335 51.760 1.00 22.53 N ATOM 144 CD2 HIS A 10 26.526 -57.862 50.648 1.00 52.10 C ATOM 145 CE1 HIS A 10 24.556 -58.307 51.382 1.00 41.24 C ATOM 146 NE2 HIS A 10 25.224 -57.374 50.699 1.00 34.32 N ATOM 0 H HIS A 10 27.232 -59.130 54.423 1.00 72.20 H new ATOM 0 HA HIS A 10 29.323 -60.444 52.955 1.00 2.22 H new ATOM 0 HB2 HIS A 10 28.497 -59.895 50.731 1.00 14.22 H new ATOM 0 HB3 HIS A 10 27.418 -61.033 51.512 1.00 14.22 H new ATOM 0 HD2 HIS A 10 27.353 -57.359 50.168 1.00 52.10 H new ATOM 0 HE1 HIS A 10 23.502 -58.242 51.607 1.00 41.24 H new ATOM 0 HE2 HIS A 10 24.863 -56.505 50.306 1.00 34.32 H new ATOM 154 N GLY A 11 30.026 -58.008 52.139 1.00 15.25 N ATOM 155 CA GLY A 11 30.600 -56.675 52.048 1.00 52.03 C ATOM 156 C GLY A 11 31.718 -56.638 51.006 1.00 51.23 C ATOM 157 O GLY A 11 32.082 -57.669 50.442 1.00 24.31 O ATOM 0 H GLY A 11 30.467 -58.686 51.517 1.00 15.25 H new ATOM 0 HA2 GLY A 11 29.824 -55.957 51.782 1.00 52.03 H new ATOM 0 HA3 GLY A 11 30.992 -56.375 53.020 1.00 52.03 H new ATOM 161 N GLY A 12 32.259 -55.440 50.758 1.00 71.44 N ATOM 162 CA GLY A 12 33.345 -55.226 49.815 1.00 31.24 C ATOM 163 C GLY A 12 33.685 -53.739 49.722 1.00 53.34 C ATOM 164 O GLY A 12 32.925 -52.898 50.201 1.00 61.31 O ATOM 0 H GLY A 12 31.945 -54.585 51.217 1.00 71.44 H new ATOM 0 HA2 GLY A 12 34.224 -55.788 50.130 1.00 31.24 H new ATOM 0 HA3 GLY A 12 33.061 -55.603 48.832 1.00 31.24 H new ATOM 168 N LEU A 13 34.832 -53.422 49.110 1.00 30.43 N ATOM 169 CA LEU A 13 35.320 -52.060 48.939 1.00 53.52 C ATOM 170 C LEU A 13 36.339 -52.038 47.800 1.00 73.52 C ATOM 171 O LEU A 13 37.227 -52.887 47.757 1.00 4.24 O ATOM 172 CB LEU A 13 35.926 -51.559 50.261 1.00 2.53 C ATOM 173 CG LEU A 13 36.464 -50.117 50.183 1.00 35.51 C ATOM 174 CD1 LEU A 13 36.215 -49.394 51.512 1.00 71.05 C ATOM 175 CD2 LEU A 13 37.973 -50.086 49.897 1.00 53.14 C ATOM 0 H LEU A 13 35.456 -54.125 48.713 1.00 30.43 H new ATOM 0 HA LEU A 13 34.502 -51.389 48.678 1.00 53.52 H new ATOM 0 HB2 LEU A 13 35.168 -51.614 51.043 1.00 2.53 H new ATOM 0 HB3 LEU A 13 36.737 -52.225 50.556 1.00 2.53 H new ATOM 0 HG LEU A 13 35.938 -49.621 49.367 1.00 35.51 H new ATOM 0 HD11 LEU A 13 36.598 -48.375 51.449 1.00 71.05 H new ATOM 0 HD12 LEU A 13 35.145 -49.367 51.717 1.00 71.05 H new ATOM 0 HD13 LEU A 13 36.725 -49.925 52.316 1.00 71.05 H new ATOM 0 HD21 LEU A 13 38.313 -49.052 49.850 1.00 53.14 H new ATOM 0 HD22 LEU A 13 38.505 -50.607 50.693 1.00 53.14 H new ATOM 0 HD23 LEU A 13 38.173 -50.578 48.945 1.00 53.14 H new ATOM 187 N ASN A 14 36.209 -51.060 46.894 1.00 61.03 N ATOM 188 CA ASN A 14 37.146 -50.810 45.810 1.00 13.51 C ATOM 189 C ASN A 14 38.042 -49.626 46.180 1.00 11.23 C ATOM 190 O ASN A 14 39.240 -49.800 46.390 1.00 72.00 O ATOM 191 CB ASN A 14 36.371 -50.552 44.509 1.00 5.41 C ATOM 192 CG ASN A 14 37.299 -50.131 43.372 1.00 65.12 C ATOM 193 OD1 ASN A 14 37.198 -49.017 42.861 1.00 2.15 O ATOM 194 ND2 ASN A 14 38.217 -51.016 42.983 1.00 54.30 N ATOM 0 H ASN A 14 35.425 -50.407 46.902 1.00 61.03 H new ATOM 0 HA ASN A 14 37.783 -51.680 45.652 1.00 13.51 H new ATOM 0 HB2 ASN A 14 35.831 -51.454 44.222 1.00 5.41 H new ATOM 0 HB3 ASN A 14 35.626 -49.774 44.677 1.00 5.41 H new ATOM 0 HD21 ASN A 14 38.869 -50.779 42.235 1.00 54.30 H new ATOM 0 HD22 ASN A 14 38.267 -51.930 43.433 1.00 54.30 H new ATOM 201 N GLN A 15 37.454 -48.424 46.240 1.00 31.35 N ATOM 202 CA GLN A 15 38.132 -47.162 46.508 1.00 63.45 C ATOM 203 C GLN A 15 37.197 -46.267 47.323 1.00 62.44 C ATOM 204 O GLN A 15 35.984 -46.474 47.327 1.00 1.34 O ATOM 205 CB GLN A 15 38.493 -46.471 45.186 1.00 55.11 C ATOM 206 CG GLN A 15 39.644 -47.156 44.442 1.00 33.24 C ATOM 207 CD GLN A 15 39.887 -46.492 43.089 1.00 54.12 C ATOM 208 OE1 GLN A 15 40.811 -45.697 42.938 1.00 33.13 O ATOM 209 NE2 GLN A 15 39.052 -46.821 42.102 1.00 41.55 N ATOM 0 H GLN A 15 36.451 -48.306 46.096 1.00 31.35 H new ATOM 0 HA GLN A 15 39.049 -47.347 47.067 1.00 63.45 H new ATOM 0 HB2 GLN A 15 37.614 -46.451 44.542 1.00 55.11 H new ATOM 0 HB3 GLN A 15 38.765 -45.435 45.387 1.00 55.11 H new ATOM 0 HG2 GLN A 15 40.552 -47.108 45.044 1.00 33.24 H new ATOM 0 HG3 GLN A 15 39.413 -48.211 44.298 1.00 33.24 H new ATOM 0 HE21 GLN A 15 38.298 -47.486 42.272 1.00 41.55 H new ATOM 0 HE22 GLN A 15 39.168 -46.407 41.177 1.00 41.55 H new ATOM 218 N LEU A 16 37.764 -45.254 47.990 1.00 25.12 N ATOM 219 CA LEU A 16 37.018 -44.276 48.771 1.00 32.23 C ATOM 220 C LEU A 16 36.492 -43.180 47.836 1.00 62.32 C ATOM 221 O LEU A 16 36.843 -42.009 47.975 1.00 2.12 O ATOM 222 CB LEU A 16 37.904 -43.701 49.891 1.00 31.12 C ATOM 223 CG LEU A 16 38.247 -44.649 51.057 1.00 75.15 C ATOM 224 CD1 LEU A 16 36.998 -45.093 51.829 1.00 35.44 C ATOM 225 CD2 LEU A 16 39.073 -45.872 50.641 1.00 71.12 C ATOM 0 H LEU A 16 38.771 -45.094 47.998 1.00 25.12 H new ATOM 0 HA LEU A 16 36.164 -44.754 49.251 1.00 32.23 H new ATOM 0 HB2 LEU A 16 38.838 -43.359 49.445 1.00 31.12 H new ATOM 0 HB3 LEU A 16 37.406 -42.823 50.302 1.00 31.12 H new ATOM 0 HG LEU A 16 38.876 -44.053 51.719 1.00 75.15 H new ATOM 0 HD11 LEU A 16 37.290 -45.760 52.641 1.00 35.44 H new ATOM 0 HD12 LEU A 16 36.495 -44.218 52.241 1.00 35.44 H new ATOM 0 HD13 LEU A 16 36.321 -45.617 51.155 1.00 35.44 H new ATOM 0 HD21 LEU A 16 39.274 -46.490 51.516 1.00 71.12 H new ATOM 0 HD22 LEU A 16 38.517 -46.454 49.906 1.00 71.12 H new ATOM 0 HD23 LEU A 16 40.016 -45.543 50.205 1.00 71.12 H new ATOM 375 N PRO A 27 39.055 -27.073 36.999 1.00 11.34 N ATOM 376 CA PRO A 27 38.409 -26.761 35.731 1.00 62.02 C ATOM 377 C PRO A 27 36.905 -27.071 35.821 1.00 23.54 C ATOM 378 O PRO A 27 36.366 -27.275 36.909 1.00 4.42 O ATOM 379 CB PRO A 27 39.142 -27.640 34.710 1.00 12.44 C ATOM 380 CG PRO A 27 39.440 -28.902 35.513 1.00 55.33 C ATOM 381 CD PRO A 27 39.738 -28.354 36.912 1.00 51.14 C ATOM 0 HA PRO A 27 38.469 -25.709 35.451 1.00 62.02 H new ATOM 0 HB2 PRO A 27 38.523 -27.851 33.838 1.00 12.44 H new ATOM 0 HB3 PRO A 27 40.054 -27.166 34.347 1.00 12.44 H new ATOM 0 HG2 PRO A 27 38.592 -29.587 35.519 1.00 55.33 H new ATOM 0 HG3 PRO A 27 40.289 -29.450 35.104 1.00 55.33 H new ATOM 0 HD2 PRO A 27 39.382 -29.038 37.682 1.00 51.14 H new ATOM 0 HD3 PRO A 27 40.811 -28.234 37.063 1.00 51.14 H new ATOM 389 N GLU A 28 36.231 -27.127 34.665 1.00 44.23 N ATOM 390 CA GLU A 28 34.801 -27.398 34.530 1.00 71.30 C ATOM 391 C GLU A 28 34.364 -28.702 35.210 1.00 33.01 C ATOM 392 O GLU A 28 33.187 -28.867 35.526 1.00 72.30 O ATOM 393 CB GLU A 28 34.429 -27.436 33.043 1.00 74.55 C ATOM 394 CG GLU A 28 34.743 -26.107 32.349 1.00 62.14 C ATOM 395 CD GLU A 28 34.192 -26.077 30.928 1.00 14.01 C ATOM 396 OE1 GLU A 28 32.968 -25.854 30.799 1.00 0.50 O ATOM 397 OE2 GLU A 28 35.002 -26.281 29.999 1.00 31.54 O ATOM 0 H GLU A 28 36.688 -26.978 33.765 1.00 44.23 H new ATOM 0 HA GLU A 28 34.273 -26.591 35.038 1.00 71.30 H new ATOM 0 HB2 GLU A 28 34.974 -28.242 32.551 1.00 74.55 H new ATOM 0 HB3 GLU A 28 33.367 -27.660 32.939 1.00 74.55 H new ATOM 0 HG2 GLU A 28 34.316 -25.285 32.924 1.00 62.14 H new ATOM 0 HG3 GLU A 28 35.822 -25.953 32.326 1.00 62.14 H new ATOM 404 N VAL A 29 35.304 -29.628 35.440 1.00 14.02 N ATOM 405 CA VAL A 29 35.068 -30.891 36.124 1.00 52.25 C ATOM 406 C VAL A 29 34.436 -30.697 37.510 1.00 21.20 C ATOM 407 O VAL A 29 33.747 -31.594 37.986 1.00 54.24 O ATOM 408 CB VAL A 29 36.390 -31.679 36.191 1.00 3.31 C ATOM 409 CG1 VAL A 29 37.293 -31.185 37.329 1.00 20.31 C ATOM 410 CG2 VAL A 29 36.140 -33.183 36.344 1.00 43.44 C ATOM 0 H VAL A 29 36.273 -29.509 35.145 1.00 14.02 H new ATOM 0 HA VAL A 29 34.340 -31.468 35.554 1.00 52.25 H new ATOM 0 HB VAL A 29 36.903 -31.504 35.245 1.00 3.31 H new ATOM 0 HG11 VAL A 29 38.214 -31.767 37.341 1.00 20.31 H new ATOM 0 HG12 VAL A 29 37.531 -30.133 37.174 1.00 20.31 H new ATOM 0 HG13 VAL A 29 36.776 -31.304 38.281 1.00 20.31 H new ATOM 0 HG21 VAL A 29 37.094 -33.708 36.388 1.00 43.44 H new ATOM 0 HG22 VAL A 29 35.582 -33.368 37.262 1.00 43.44 H new ATOM 0 HG23 VAL A 29 35.566 -33.545 35.491 1.00 43.44 H new ATOM 420 N VAL A 30 34.661 -29.544 38.160 1.00 21.25 N ATOM 421 CA VAL A 30 34.078 -29.220 39.458 1.00 43.41 C ATOM 422 C VAL A 30 32.552 -29.319 39.394 1.00 23.34 C ATOM 423 O VAL A 30 31.971 -30.087 40.160 1.00 44.03 O ATOM 424 CB VAL A 30 34.562 -27.841 39.929 1.00 4.31 C ATOM 425 CG1 VAL A 30 33.823 -27.366 41.190 1.00 1.11 C ATOM 426 CG2 VAL A 30 36.064 -27.888 40.235 1.00 3.54 C ATOM 0 H VAL A 30 35.261 -28.807 37.789 1.00 21.25 H new ATOM 0 HA VAL A 30 34.413 -29.946 40.199 1.00 43.41 H new ATOM 0 HB VAL A 30 34.354 -27.139 39.121 1.00 4.31 H new ATOM 0 HG11 VAL A 30 34.199 -26.387 41.485 1.00 1.11 H new ATOM 0 HG12 VAL A 30 32.755 -27.297 40.982 1.00 1.11 H new ATOM 0 HG13 VAL A 30 33.989 -28.077 41.999 1.00 1.11 H new ATOM 0 HG21 VAL A 30 36.398 -26.906 40.568 1.00 3.54 H new ATOM 0 HG22 VAL A 30 36.253 -28.621 41.019 1.00 3.54 H new ATOM 0 HG23 VAL A 30 36.610 -28.171 39.335 1.00 3.54 H new ATOM 436 N ARG A 31 31.916 -28.583 38.469 1.00 62.23 N ATOM 437 CA ARG A 31 30.483 -28.672 38.210 1.00 12.13 C ATOM 438 C ARG A 31 30.052 -30.136 38.112 1.00 13.32 C ATOM 439 O ARG A 31 29.176 -30.574 38.854 1.00 2.12 O ATOM 440 CB ARG A 31 30.144 -27.923 36.910 1.00 22.01 C ATOM 441 CG ARG A 31 28.696 -28.111 36.429 1.00 61.54 C ATOM 442 CD ARG A 31 27.685 -27.482 37.394 1.00 61.34 C ATOM 443 NE ARG A 31 26.297 -27.666 36.947 1.00 2.54 N ATOM 444 CZ ARG A 31 25.701 -27.019 35.931 1.00 15.40 C ATOM 445 NH1 ARG A 31 26.377 -26.141 35.174 1.00 14.22 N ATOM 446 NH2 ARG A 31 24.408 -27.252 35.673 1.00 3.33 N ATOM 0 H ARG A 31 32.394 -27.904 37.877 1.00 62.23 H new ATOM 0 HA ARG A 31 29.941 -28.210 39.036 1.00 12.13 H new ATOM 0 HB2 ARG A 31 30.330 -26.859 37.059 1.00 22.01 H new ATOM 0 HB3 ARG A 31 30.821 -28.258 36.125 1.00 22.01 H new ATOM 0 HG2 ARG A 31 28.581 -27.664 35.441 1.00 61.54 H new ATOM 0 HG3 ARG A 31 28.484 -29.175 36.324 1.00 61.54 H new ATOM 0 HD2 ARG A 31 27.807 -27.924 38.383 1.00 61.34 H new ATOM 0 HD3 ARG A 31 27.894 -26.417 37.492 1.00 61.34 H new ATOM 0 HE ARG A 31 25.734 -28.348 37.455 1.00 2.54 H new ATOM 0 HH11 ARG A 31 27.361 -25.955 35.365 1.00 14.22 H new ATOM 0 HH12 ARG A 31 25.906 -25.660 34.407 1.00 14.22 H new ATOM 0 HH21 ARG A 31 23.885 -27.915 36.245 1.00 3.33 H new ATOM 0 HH22 ARG A 31 23.946 -26.766 34.904 1.00 3.33 H new ATOM 460 N GLN A 32 30.677 -30.881 37.195 1.00 41.22 N ATOM 461 CA GLN A 32 30.328 -32.261 36.888 1.00 15.32 C ATOM 462 C GLN A 32 30.381 -33.149 38.133 1.00 41.24 C ATOM 463 O GLN A 32 29.462 -33.927 38.367 1.00 74.43 O ATOM 464 CB GLN A 32 31.242 -32.816 35.783 1.00 41.14 C ATOM 465 CG GLN A 32 31.230 -32.000 34.480 1.00 1.24 C ATOM 466 CD GLN A 32 29.830 -31.664 33.998 1.00 22.22 C ATOM 467 OE1 GLN A 32 29.415 -30.508 34.029 1.00 3.44 O ATOM 468 NE2 GLN A 32 29.093 -32.675 33.549 1.00 44.13 N ATOM 0 H GLN A 32 31.455 -30.529 36.637 1.00 41.22 H new ATOM 0 HA GLN A 32 29.300 -32.269 36.526 1.00 15.32 H new ATOM 0 HB2 GLN A 32 32.263 -32.859 36.161 1.00 41.14 H new ATOM 0 HB3 GLN A 32 30.941 -33.839 35.559 1.00 41.14 H new ATOM 0 HG2 GLN A 32 31.786 -31.075 34.633 1.00 1.24 H new ATOM 0 HG3 GLN A 32 31.750 -32.560 33.703 1.00 1.24 H new ATOM 0 HE21 GLN A 32 29.476 -33.620 33.540 1.00 44.13 H new ATOM 0 HE22 GLN A 32 28.145 -32.505 33.213 1.00 44.13 H new ATOM 477 N ARG A 33 31.448 -33.029 38.929 1.00 34.32 N ATOM 478 CA ARG A 33 31.660 -33.823 40.130 1.00 34.25 C ATOM 479 C ARG A 33 30.602 -33.529 41.193 1.00 24.43 C ATOM 480 O ARG A 33 30.079 -34.461 41.798 1.00 53.21 O ATOM 481 CB ARG A 33 33.067 -33.569 40.677 1.00 43.42 C ATOM 482 CG ARG A 33 34.111 -34.307 39.828 1.00 73.31 C ATOM 483 CD ARG A 33 35.529 -33.825 40.150 1.00 33.35 C ATOM 484 NE ARG A 33 35.814 -33.853 41.588 1.00 74.43 N ATOM 485 CZ ARG A 33 36.056 -34.947 42.327 1.00 70.23 C ATOM 486 NH1 ARG A 33 36.082 -36.168 41.779 1.00 53.02 N ATOM 487 NH2 ARG A 33 36.284 -34.811 43.638 1.00 54.21 N ATOM 0 H ARG A 33 32.199 -32.363 38.748 1.00 34.32 H new ATOM 0 HA ARG A 33 31.565 -34.876 39.865 1.00 34.25 H new ATOM 0 HB2 ARG A 33 33.277 -32.499 40.675 1.00 43.42 H new ATOM 0 HB3 ARG A 33 33.128 -33.904 41.712 1.00 43.42 H new ATOM 0 HG2 ARG A 33 34.039 -35.379 40.009 1.00 73.31 H new ATOM 0 HG3 ARG A 33 33.902 -34.148 38.770 1.00 73.31 H new ATOM 0 HD2 ARG A 33 36.251 -34.452 39.627 1.00 33.35 H new ATOM 0 HD3 ARG A 33 35.659 -32.809 39.776 1.00 33.35 H new ATOM 0 HE ARG A 33 35.830 -32.956 42.073 1.00 74.43 H new ATOM 0 HH11 ARG A 33 35.916 -36.282 40.779 1.00 53.02 H new ATOM 0 HH12 ARG A 33 36.268 -36.984 42.361 1.00 53.02 H new ATOM 0 HH21 ARG A 33 36.273 -33.884 44.064 1.00 54.21 H new ATOM 0 HH22 ARG A 33 36.469 -35.634 44.211 1.00 54.21 H new ATOM 501 N ILE A 34 30.287 -32.252 41.434 1.00 10.22 N ATOM 502 CA ILE A 34 29.279 -31.875 42.417 1.00 63.01 C ATOM 503 C ILE A 34 27.886 -32.322 41.965 1.00 32.43 C ATOM 504 O ILE A 34 27.116 -32.820 42.784 1.00 64.24 O ATOM 505 CB ILE A 34 29.362 -30.371 42.726 1.00 42.51 C ATOM 506 CG1 ILE A 34 30.728 -29.980 43.327 1.00 24.54 C ATOM 507 CG2 ILE A 34 28.229 -29.936 43.665 1.00 31.41 C ATOM 508 CD1 ILE A 34 31.077 -30.677 44.649 1.00 24.12 C ATOM 0 H ILE A 34 30.721 -31.462 40.956 1.00 10.22 H new ATOM 0 HA ILE A 34 29.479 -32.396 43.353 1.00 63.01 H new ATOM 0 HB ILE A 34 29.252 -29.848 41.776 1.00 42.51 H new ATOM 0 HG12 ILE A 34 31.507 -30.205 42.598 1.00 24.54 H new ATOM 0 HG13 ILE A 34 30.743 -28.902 43.487 1.00 24.54 H new ATOM 0 HG21 ILE A 34 28.313 -28.868 43.866 1.00 31.41 H new ATOM 0 HG22 ILE A 34 27.267 -30.142 43.195 1.00 31.41 H new ATOM 0 HG23 ILE A 34 28.301 -30.488 44.602 1.00 31.41 H new ATOM 0 HD11 ILE A 34 32.054 -30.338 44.992 1.00 24.12 H new ATOM 0 HD12 ILE A 34 30.324 -30.433 45.399 1.00 24.12 H new ATOM 0 HD13 ILE A 34 31.100 -31.756 44.496 1.00 24.12 H new ATOM 520 N VAL A 35 27.565 -32.179 40.673 1.00 70.21 N ATOM 521 CA VAL A 35 26.322 -32.683 40.098 1.00 3.41 C ATOM 522 C VAL A 35 26.225 -34.202 40.299 1.00 22.00 C ATOM 523 O VAL A 35 25.208 -34.687 40.784 1.00 1.41 O ATOM 524 CB VAL A 35 26.222 -32.277 38.615 1.00 23.14 C ATOM 525 CG1 VAL A 35 25.080 -33.002 37.890 1.00 22.41 C ATOM 526 CG2 VAL A 35 25.977 -30.767 38.493 1.00 3.13 C ATOM 0 H VAL A 35 28.167 -31.707 39.998 1.00 70.21 H new ATOM 0 HA VAL A 35 25.471 -32.236 40.612 1.00 3.41 H new ATOM 0 HB VAL A 35 27.168 -32.557 38.152 1.00 23.14 H new ATOM 0 HG11 VAL A 35 25.050 -32.683 36.848 1.00 22.41 H new ATOM 0 HG12 VAL A 35 25.246 -34.078 37.935 1.00 22.41 H new ATOM 0 HG13 VAL A 35 24.132 -32.760 38.371 1.00 22.41 H new ATOM 0 HG21 VAL A 35 25.908 -30.493 37.440 1.00 3.13 H new ATOM 0 HG22 VAL A 35 25.046 -30.508 38.997 1.00 3.13 H new ATOM 0 HG23 VAL A 35 26.803 -30.226 38.955 1.00 3.13 H new ATOM 536 N ASP A 36 27.281 -34.942 39.940 1.00 61.03 N ATOM 537 CA ASP A 36 27.344 -36.395 40.056 1.00 53.25 C ATOM 538 C ASP A 36 27.140 -36.841 41.504 1.00 52.13 C ATOM 539 O ASP A 36 26.327 -37.722 41.778 1.00 14.22 O ATOM 540 CB ASP A 36 28.694 -36.885 39.521 1.00 2.41 C ATOM 541 CG ASP A 36 28.818 -38.401 39.624 1.00 15.22 C ATOM 542 OD1 ASP A 36 28.213 -39.080 38.768 1.00 54.31 O ATOM 543 OD2 ASP A 36 29.513 -38.852 40.561 1.00 21.42 O ATOM 0 H ASP A 36 28.132 -34.534 39.553 1.00 61.03 H new ATOM 0 HA ASP A 36 26.540 -36.834 39.464 1.00 53.25 H new ATOM 0 HB2 ASP A 36 28.807 -36.579 38.481 1.00 2.41 H new ATOM 0 HB3 ASP A 36 29.502 -36.414 40.081 1.00 2.41 H new ATOM 548 N LEU A 37 27.875 -36.216 42.429 1.00 71.14 N ATOM 549 CA LEU A 37 27.761 -36.460 43.860 1.00 2.14 C ATOM 550 C LEU A 37 26.316 -36.247 44.307 1.00 53.24 C ATOM 551 O LEU A 37 25.711 -37.163 44.858 1.00 35.34 O ATOM 552 CB LEU A 37 28.734 -35.532 44.608 1.00 33.41 C ATOM 553 CG LEU A 37 28.787 -35.769 46.128 1.00 23.13 C ATOM 554 CD1 LEU A 37 29.639 -36.997 46.467 1.00 73.40 C ATOM 555 CD2 LEU A 37 29.394 -34.540 46.816 1.00 63.33 C ATOM 0 H LEU A 37 28.577 -35.514 42.194 1.00 71.14 H new ATOM 0 HA LEU A 37 28.028 -37.491 44.091 1.00 2.14 H new ATOM 0 HB2 LEU A 37 29.734 -35.664 44.196 1.00 33.41 H new ATOM 0 HB3 LEU A 37 28.447 -34.497 44.422 1.00 33.41 H new ATOM 0 HG LEU A 37 27.770 -35.940 46.480 1.00 23.13 H new ATOM 0 HD11 LEU A 37 29.658 -37.140 47.547 1.00 73.40 H new ATOM 0 HD12 LEU A 37 29.210 -37.880 45.992 1.00 73.40 H new ATOM 0 HD13 LEU A 37 30.655 -36.847 46.103 1.00 73.40 H new ATOM 0 HD21 LEU A 37 29.432 -34.707 47.892 1.00 63.33 H new ATOM 0 HD22 LEU A 37 30.403 -34.373 46.439 1.00 63.33 H new ATOM 0 HD23 LEU A 37 28.779 -33.665 46.606 1.00 63.33 H new ATOM 567 N ALA A 38 25.764 -35.058 44.045 1.00 72.11 N ATOM 568 CA ALA A 38 24.399 -34.688 44.391 1.00 75.53 C ATOM 569 C ALA A 38 23.371 -35.683 43.845 1.00 12.13 C ATOM 570 O ALA A 38 22.393 -35.982 44.526 1.00 1.13 O ATOM 571 CB ALA A 38 24.107 -33.275 43.880 1.00 25.53 C ATOM 0 H ALA A 38 26.273 -34.310 43.574 1.00 72.11 H new ATOM 0 HA ALA A 38 24.311 -34.711 45.477 1.00 75.53 H new ATOM 0 HB1 ALA A 38 23.085 -32.998 44.139 1.00 25.53 H new ATOM 0 HB2 ALA A 38 24.801 -32.571 44.339 1.00 25.53 H new ATOM 0 HB3 ALA A 38 24.227 -33.248 42.797 1.00 25.53 H new ATOM 577 N HIS A 39 23.600 -36.188 42.624 1.00 33.44 N ATOM 578 CA HIS A 39 22.687 -37.067 41.906 1.00 63.13 C ATOM 579 C HIS A 39 22.386 -38.364 42.664 1.00 3.40 C ATOM 580 O HIS A 39 21.290 -38.899 42.504 1.00 53.12 O ATOM 581 CB HIS A 39 23.231 -37.360 40.501 1.00 43.33 C ATOM 582 CG HIS A 39 22.277 -38.142 39.636 1.00 74.51 C ATOM 583 ND1 HIS A 39 22.401 -39.509 39.435 1.00 22.51 N ATOM 584 CD2 HIS A 39 21.166 -37.769 38.917 1.00 33.22 C ATOM 585 CE1 HIS A 39 21.389 -39.887 38.636 1.00 41.23 C ATOM 586 NE2 HIS A 39 20.601 -38.870 38.280 1.00 30.42 N ATOM 0 H HIS A 39 24.452 -35.986 42.100 1.00 33.44 H new ATOM 0 HA HIS A 39 21.736 -36.541 41.818 1.00 63.13 H new ATOM 0 HB2 HIS A 39 23.466 -36.417 40.008 1.00 43.33 H new ATOM 0 HB3 HIS A 39 24.165 -37.915 40.590 1.00 43.33 H new ATOM 0 HD2 HIS A 39 20.784 -36.761 38.855 1.00 33.22 H new ATOM 0 HE1 HIS A 39 21.230 -40.906 38.316 1.00 41.23 H new ATOM 0 HE2 HIS A 39 19.776 -38.894 37.680 1.00 30.42 H new ATOM 594 N GLN A 40 23.314 -38.871 43.495 1.00 21.34 N ATOM 595 CA GLN A 40 23.031 -40.065 44.292 1.00 71.23 C ATOM 596 C GLN A 40 21.906 -39.820 45.312 1.00 52.43 C ATOM 597 O GLN A 40 21.266 -40.772 45.752 1.00 51.03 O ATOM 598 CB GLN A 40 24.313 -40.617 44.932 1.00 15.31 C ATOM 599 CG GLN A 40 24.669 -39.948 46.263 1.00 52.40 C ATOM 600 CD GLN A 40 26.106 -40.247 46.676 1.00 63.23 C ATOM 601 OE1 GLN A 40 26.364 -41.206 47.399 1.00 61.23 O ATOM 602 NE2 GLN A 40 27.044 -39.417 46.220 1.00 40.43 N ATOM 0 H GLN A 40 24.246 -38.478 43.627 1.00 21.34 H new ATOM 0 HA GLN A 40 22.658 -40.838 43.620 1.00 71.23 H new ATOM 0 HB2 GLN A 40 24.197 -41.689 45.093 1.00 15.31 H new ATOM 0 HB3 GLN A 40 25.142 -40.487 44.236 1.00 15.31 H new ATOM 0 HG2 GLN A 40 24.532 -38.870 46.177 1.00 52.40 H new ATOM 0 HG3 GLN A 40 23.987 -40.295 47.039 1.00 52.40 H new ATOM 0 HE21 GLN A 40 26.784 -38.633 45.622 1.00 40.43 H new ATOM 0 HE22 GLN A 40 28.022 -39.566 46.469 1.00 40.43 H new ATOM 611 N GLY A 41 21.661 -38.548 45.665 1.00 52.21 N ATOM 612 CA GLY A 41 20.559 -38.100 46.504 1.00 65.41 C ATOM 613 C GLY A 41 21.104 -37.441 47.765 1.00 0.13 C ATOM 614 O GLY A 41 20.995 -38.011 48.849 1.00 22.20 O ATOM 0 H GLY A 41 22.255 -37.779 45.356 1.00 52.21 H new ATOM 0 HA2 GLY A 41 19.935 -37.395 45.955 1.00 65.41 H new ATOM 0 HA3 GLY A 41 19.925 -38.946 46.770 1.00 65.41 H new ATOM 618 N VAL A 42 21.696 -36.247 47.614 1.00 45.14 N ATOM 619 CA VAL A 42 22.373 -35.533 48.691 1.00 24.21 C ATOM 620 C VAL A 42 21.782 -34.125 48.837 1.00 55.35 C ATOM 621 O VAL A 42 21.706 -33.379 47.861 1.00 35.14 O ATOM 622 CB VAL A 42 23.889 -35.468 48.416 1.00 72.11 C ATOM 623 CG1 VAL A 42 24.647 -35.247 49.721 1.00 11.32 C ATOM 624 CG2 VAL A 42 24.445 -36.739 47.773 1.00 0.32 C ATOM 0 H VAL A 42 21.715 -35.748 46.724 1.00 45.14 H new ATOM 0 HA VAL A 42 22.221 -36.069 49.627 1.00 24.21 H new ATOM 0 HB VAL A 42 24.028 -34.641 47.720 1.00 72.11 H new ATOM 0 HG11 VAL A 42 25.717 -35.202 49.517 1.00 11.32 H new ATOM 0 HG12 VAL A 42 24.325 -34.310 50.175 1.00 11.32 H new ATOM 0 HG13 VAL A 42 24.442 -36.071 50.405 1.00 11.32 H new ATOM 0 HG21 VAL A 42 25.516 -36.624 47.607 1.00 0.32 H new ATOM 0 HG22 VAL A 42 24.269 -37.588 48.433 1.00 0.32 H new ATOM 0 HG23 VAL A 42 23.947 -36.912 46.819 1.00 0.32 H new ATOM 634 N ARG A 43 21.391 -33.756 50.064 1.00 53.21 N ATOM 635 CA ARG A 43 20.984 -32.404 50.444 1.00 31.31 C ATOM 636 C ARG A 43 22.216 -31.483 50.425 1.00 62.12 C ATOM 637 O ARG A 43 23.331 -31.985 50.538 1.00 50.44 O ATOM 638 CB ARG A 43 20.380 -32.455 51.860 1.00 60.31 C ATOM 639 CG ARG A 43 19.201 -33.430 51.970 1.00 53.31 C ATOM 640 CD ARG A 43 18.600 -33.376 53.380 1.00 43.54 C ATOM 641 NE ARG A 43 17.587 -34.423 53.580 1.00 41.24 N ATOM 642 CZ ARG A 43 17.837 -35.728 53.792 1.00 31.52 C ATOM 643 NH1 ARG A 43 19.091 -36.197 53.880 1.00 71.23 N ATOM 644 NH2 ARG A 43 16.809 -36.578 53.915 1.00 0.44 N ATOM 0 H ARG A 43 21.349 -34.414 50.842 1.00 53.21 H new ATOM 0 HA ARG A 43 20.242 -32.016 49.746 1.00 31.31 H new ATOM 0 HB2 ARG A 43 21.154 -32.747 52.570 1.00 60.31 H new ATOM 0 HB3 ARG A 43 20.047 -31.457 52.144 1.00 60.31 H new ATOM 0 HG2 ARG A 43 18.440 -33.177 51.232 1.00 53.31 H new ATOM 0 HG3 ARG A 43 19.535 -34.443 51.748 1.00 53.31 H new ATOM 0 HD2 ARG A 43 19.393 -33.492 54.118 1.00 43.54 H new ATOM 0 HD3 ARG A 43 18.150 -32.397 53.546 1.00 43.54 H new ATOM 0 HE ARG A 43 16.609 -34.135 53.556 1.00 41.24 H new ATOM 0 HH11 ARG A 43 19.882 -35.560 53.786 1.00 71.23 H new ATOM 0 HH12 ARG A 43 19.254 -37.191 54.041 1.00 71.23 H new ATOM 0 HH21 ARG A 43 15.851 -36.233 53.848 1.00 0.44 H new ATOM 0 HH22 ARG A 43 16.984 -37.570 54.076 1.00 0.44 H new ATOM 658 N PRO A 44 22.069 -30.149 50.327 1.00 40.11 N ATOM 659 CA PRO A 44 23.202 -29.232 50.421 1.00 75.53 C ATOM 660 C PRO A 44 23.962 -29.413 51.741 1.00 61.41 C ATOM 661 O PRO A 44 25.189 -29.355 51.755 1.00 30.20 O ATOM 662 CB PRO A 44 22.623 -27.822 50.269 1.00 53.55 C ATOM 663 CG PRO A 44 21.155 -27.988 50.663 1.00 4.10 C ATOM 664 CD PRO A 44 20.830 -29.402 50.182 1.00 1.11 C ATOM 0 HA PRO A 44 23.938 -29.427 49.641 1.00 75.53 H new ATOM 0 HB2 PRO A 44 23.133 -27.108 50.916 1.00 53.55 H new ATOM 0 HB3 PRO A 44 22.724 -27.456 49.247 1.00 53.55 H new ATOM 0 HG2 PRO A 44 21.011 -27.884 51.738 1.00 4.10 H new ATOM 0 HG3 PRO A 44 20.521 -27.242 50.183 1.00 4.10 H new ATOM 0 HD2 PRO A 44 20.031 -29.846 50.776 1.00 1.11 H new ATOM 0 HD3 PRO A 44 20.492 -29.397 49.146 1.00 1.11 H new ATOM 672 N CYS A 45 23.238 -29.679 52.835 1.00 51.41 N ATOM 673 CA CYS A 45 23.812 -30.016 54.133 1.00 3.41 C ATOM 674 C CYS A 45 24.618 -31.316 54.065 1.00 65.11 C ATOM 675 O CYS A 45 25.719 -31.399 54.610 1.00 12.44 O ATOM 676 CB CYS A 45 22.700 -30.125 55.178 1.00 53.34 C ATOM 677 SG CYS A 45 21.855 -28.531 55.372 1.00 53.23 S ATOM 0 H CYS A 45 22.218 -29.664 52.837 1.00 51.41 H new ATOM 0 HA CYS A 45 24.498 -29.220 54.423 1.00 3.41 H new ATOM 0 HB2 CYS A 45 21.983 -30.889 54.877 1.00 53.34 H new ATOM 0 HB3 CYS A 45 23.120 -30.440 56.133 1.00 53.34 H new ATOM 0 HG CYS A 45 20.913 -28.644 56.261 1.00 53.23 H new ATOM 683 N ASP A 46 24.068 -32.333 53.394 1.00 1.53 N ATOM 684 CA ASP A 46 24.703 -33.637 53.262 1.00 61.42 C ATOM 685 C ASP A 46 25.857 -33.633 52.248 1.00 71.35 C ATOM 686 O ASP A 46 26.683 -34.542 52.270 1.00 61.20 O ATOM 687 CB ASP A 46 23.662 -34.727 52.984 1.00 14.54 C ATOM 688 CG ASP A 46 22.784 -35.018 54.200 1.00 63.24 C ATOM 689 OD1 ASP A 46 23.354 -35.418 55.240 1.00 12.21 O ATOM 690 OD2 ASP A 46 21.551 -34.855 54.063 1.00 43.14 O ATOM 0 H ASP A 46 23.164 -32.269 52.926 1.00 1.53 H new ATOM 0 HA ASP A 46 25.167 -33.875 54.219 1.00 61.42 H new ATOM 0 HB2 ASP A 46 23.032 -34.419 52.150 1.00 14.54 H new ATOM 0 HB3 ASP A 46 24.170 -35.642 52.679 1.00 14.54 H new ATOM 695 N ILE A 47 25.956 -32.610 51.388 1.00 22.22 N ATOM 696 CA ILE A 47 27.165 -32.342 50.614 1.00 60.40 C ATOM 697 C ILE A 47 28.184 -31.683 51.545 1.00 41.42 C ATOM 698 O ILE A 47 29.339 -32.103 51.592 1.00 50.21 O ATOM 699 CB ILE A 47 26.847 -31.469 49.382 1.00 20.20 C ATOM 700 CG1 ILE A 47 25.998 -32.281 48.386 1.00 51.31 C ATOM 701 CG2 ILE A 47 28.143 -30.995 48.701 1.00 41.12 C ATOM 702 CD1 ILE A 47 25.434 -31.445 47.237 1.00 44.32 C ATOM 0 H ILE A 47 25.199 -31.949 51.213 1.00 22.22 H new ATOM 0 HA ILE A 47 27.585 -33.270 50.226 1.00 60.40 H new ATOM 0 HB ILE A 47 26.290 -30.590 49.708 1.00 20.20 H new ATOM 0 HG12 ILE A 47 26.607 -33.085 47.974 1.00 51.31 H new ATOM 0 HG13 ILE A 47 25.173 -32.749 48.923 1.00 51.31 H new ATOM 0 HG21 ILE A 47 27.895 -30.381 47.835 1.00 41.12 H new ATOM 0 HG22 ILE A 47 28.731 -30.407 49.406 1.00 41.12 H new ATOM 0 HG23 ILE A 47 28.722 -31.860 48.379 1.00 41.12 H new ATOM 0 HD11 ILE A 47 24.847 -32.083 46.576 1.00 44.32 H new ATOM 0 HD12 ILE A 47 24.798 -30.657 47.639 1.00 44.32 H new ATOM 0 HD13 ILE A 47 26.254 -30.998 46.675 1.00 44.32 H new ATOM 714 N SER A 48 27.747 -30.657 52.287 1.00 33.42 N ATOM 715 CA SER A 48 28.582 -29.869 53.182 1.00 63.41 C ATOM 716 C SER A 48 29.378 -30.739 54.157 1.00 30.22 C ATOM 717 O SER A 48 30.532 -30.427 54.435 1.00 51.22 O ATOM 718 CB SER A 48 27.719 -28.854 53.936 1.00 53.30 C ATOM 719 OG SER A 48 28.527 -27.872 54.542 1.00 63.33 O ATOM 0 H SER A 48 26.775 -30.349 52.276 1.00 33.42 H new ATOM 0 HA SER A 48 29.313 -29.339 52.572 1.00 63.41 H new ATOM 0 HB2 SER A 48 27.018 -28.382 53.248 1.00 53.30 H new ATOM 0 HB3 SER A 48 27.126 -29.365 54.695 1.00 53.30 H new ATOM 0 HG SER A 48 29.102 -28.291 55.216 1.00 63.33 H new ATOM 725 N ARG A 49 28.775 -31.818 54.677 1.00 72.32 N ATOM 726 CA ARG A 49 29.439 -32.720 55.610 1.00 24.24 C ATOM 727 C ARG A 49 30.552 -33.516 54.918 1.00 73.34 C ATOM 728 O ARG A 49 31.655 -33.593 55.453 1.00 71.44 O ATOM 729 CB ARG A 49 28.415 -33.602 56.343 1.00 13.41 C ATOM 730 CG ARG A 49 27.721 -34.595 55.410 1.00 33.31 C ATOM 731 CD ARG A 49 26.473 -35.229 56.030 1.00 11.21 C ATOM 732 NE ARG A 49 26.776 -36.065 57.194 1.00 24.53 N ATOM 733 CZ ARG A 49 25.842 -36.758 57.868 1.00 40.31 C ATOM 734 NH1 ARG A 49 24.557 -36.730 57.482 1.00 15.31 N ATOM 735 NH2 ARG A 49 26.199 -37.482 58.937 1.00 54.33 N ATOM 0 H ARG A 49 27.815 -32.084 54.459 1.00 72.32 H new ATOM 0 HA ARG A 49 29.934 -32.127 56.379 1.00 24.24 H new ATOM 0 HB2 ARG A 49 28.917 -34.149 57.141 1.00 13.41 H new ATOM 0 HB3 ARG A 49 27.665 -32.967 56.814 1.00 13.41 H new ATOM 0 HG2 ARG A 49 27.442 -34.085 54.488 1.00 33.31 H new ATOM 0 HG3 ARG A 49 28.424 -35.382 55.138 1.00 33.31 H new ATOM 0 HD2 ARG A 49 25.780 -34.441 56.325 1.00 11.21 H new ATOM 0 HD3 ARG A 49 25.966 -35.833 55.277 1.00 11.21 H new ATOM 0 HE ARG A 49 27.744 -36.124 57.509 1.00 24.53 H new ATOM 0 HH11 ARG A 49 24.280 -36.179 56.669 1.00 15.31 H new ATOM 0 HH12 ARG A 49 23.857 -37.260 58.001 1.00 15.31 H new ATOM 0 HH21 ARG A 49 27.174 -37.505 59.235 1.00 54.33 H new ATOM 0 HH22 ARG A 49 25.496 -38.010 59.453 1.00 54.33 H new ATOM 749 N GLN A 50 30.295 -34.079 53.725 1.00 42.33 N ATOM 750 CA GLN A 50 31.299 -34.805 52.958 1.00 24.54 C ATOM 751 C GLN A 50 32.470 -33.902 52.559 1.00 33.13 C ATOM 752 O GLN A 50 33.621 -34.331 52.610 1.00 64.33 O ATOM 753 CB GLN A 50 30.648 -35.427 51.719 1.00 12.15 C ATOM 754 CG GLN A 50 29.589 -36.462 52.108 1.00 64.15 C ATOM 755 CD GLN A 50 28.933 -37.050 50.865 1.00 64.53 C ATOM 756 OE1 GLN A 50 29.373 -38.073 50.346 1.00 75.41 O ATOM 757 NE2 GLN A 50 27.880 -36.392 50.381 1.00 31.21 N ATOM 0 H GLN A 50 29.382 -34.039 53.272 1.00 42.33 H new ATOM 0 HA GLN A 50 31.705 -35.596 53.588 1.00 24.54 H new ATOM 0 HB2 GLN A 50 30.190 -34.644 51.114 1.00 12.15 H new ATOM 0 HB3 GLN A 50 31.412 -35.900 51.102 1.00 12.15 H new ATOM 0 HG2 GLN A 50 30.048 -37.258 52.694 1.00 64.15 H new ATOM 0 HG3 GLN A 50 28.832 -35.997 52.740 1.00 64.15 H new ATOM 0 HE21 GLN A 50 27.550 -35.546 50.846 1.00 31.21 H new ATOM 0 HE22 GLN A 50 27.404 -36.734 49.546 1.00 31.21 H new ATOM 766 N LEU A 51 32.182 -32.650 52.179 1.00 3.14 N ATOM 767 CA LEU A 51 33.196 -31.654 51.848 1.00 42.21 C ATOM 768 C LEU A 51 33.832 -31.064 53.114 1.00 43.51 C ATOM 769 O LEU A 51 34.854 -30.390 53.009 1.00 4.45 O ATOM 770 CB LEU A 51 32.571 -30.543 50.982 1.00 73.22 C ATOM 771 CG LEU A 51 32.551 -30.825 49.467 1.00 21.21 C ATOM 772 CD1 LEU A 51 33.946 -30.681 48.843 1.00 35.41 C ATOM 773 CD2 LEU A 51 31.961 -32.194 49.107 1.00 11.15 C ATOM 0 H LEU A 51 31.227 -32.302 52.094 1.00 3.14 H new ATOM 0 HA LEU A 51 33.989 -32.143 51.282 1.00 42.21 H new ATOM 0 HB2 LEU A 51 31.548 -30.375 51.318 1.00 73.22 H new ATOM 0 HB3 LEU A 51 33.119 -29.617 51.156 1.00 73.22 H new ATOM 0 HG LEU A 51 31.890 -30.067 49.046 1.00 21.21 H new ATOM 0 HD11 LEU A 51 33.890 -30.888 47.774 1.00 35.41 H new ATOM 0 HD12 LEU A 51 34.311 -29.665 48.997 1.00 35.41 H new ATOM 0 HD13 LEU A 51 34.630 -31.387 49.314 1.00 35.41 H new ATOM 0 HD21 LEU A 51 31.979 -32.325 48.025 1.00 11.15 H new ATOM 0 HD22 LEU A 51 32.552 -32.980 49.577 1.00 11.15 H new ATOM 0 HD23 LEU A 51 30.932 -32.252 49.463 1.00 11.15 H new ATOM 785 N ARG A 52 33.239 -31.315 54.291 1.00 51.01 N ATOM 786 CA ARG A 52 33.579 -30.740 55.584 1.00 61.23 C ATOM 787 C ARG A 52 33.741 -29.216 55.526 1.00 62.24 C ATOM 788 O ARG A 52 34.814 -28.683 55.805 1.00 21.14 O ATOM 789 CB ARG A 52 34.739 -31.491 56.267 1.00 4.44 C ATOM 790 CG ARG A 52 36.046 -31.561 55.465 1.00 4.54 C ATOM 791 CD ARG A 52 37.157 -32.198 56.300 1.00 41.30 C ATOM 792 NE ARG A 52 38.417 -32.244 55.546 1.00 33.14 N ATOM 793 CZ ARG A 52 39.577 -32.732 56.016 1.00 73.42 C ATOM 794 NH1 ARG A 52 39.653 -33.239 57.256 1.00 11.45 N ATOM 795 NH2 ARG A 52 40.669 -32.713 55.240 1.00 31.03 N ATOM 0 H ARG A 52 32.459 -31.969 54.360 1.00 51.01 H new ATOM 0 HA ARG A 52 32.725 -30.892 56.244 1.00 61.23 H new ATOM 0 HB2 ARG A 52 34.946 -31.011 57.224 1.00 4.44 H new ATOM 0 HB3 ARG A 52 34.412 -32.508 56.484 1.00 4.44 H new ATOM 0 HG2 ARG A 52 35.890 -32.141 54.555 1.00 4.54 H new ATOM 0 HG3 ARG A 52 36.344 -30.559 55.157 1.00 4.54 H new ATOM 0 HD2 ARG A 52 37.299 -31.629 57.219 1.00 41.30 H new ATOM 0 HD3 ARG A 52 36.866 -33.207 56.591 1.00 41.30 H new ATOM 0 HE ARG A 52 38.411 -31.878 54.594 1.00 33.14 H new ATOM 0 HH11 ARG A 52 38.825 -33.256 57.851 1.00 11.45 H new ATOM 0 HH12 ARG A 52 40.539 -33.607 57.603 1.00 11.45 H new ATOM 0 HH21 ARG A 52 40.618 -32.329 54.296 1.00 31.03 H new ATOM 0 HH22 ARG A 52 41.552 -33.082 55.593 1.00 31.03 H new ATOM 809 N VAL A 53 32.649 -28.520 55.179 1.00 22.10 N ATOM 810 CA VAL A 53 32.574 -27.064 55.098 1.00 44.22 C ATOM 811 C VAL A 53 31.307 -26.556 55.803 1.00 30.54 C ATOM 812 O VAL A 53 30.544 -27.349 56.355 1.00 63.12 O ATOM 813 CB VAL A 53 32.649 -26.608 53.628 1.00 15.01 C ATOM 814 CG1 VAL A 53 34.004 -26.944 52.997 1.00 74.15 C ATOM 815 CG2 VAL A 53 31.522 -27.206 52.780 1.00 3.23 C ATOM 0 H VAL A 53 31.768 -28.975 54.940 1.00 22.10 H new ATOM 0 HA VAL A 53 33.428 -26.627 55.616 1.00 44.22 H new ATOM 0 HB VAL A 53 32.529 -25.525 53.642 1.00 15.01 H new ATOM 0 HG11 VAL A 53 34.017 -26.606 51.961 1.00 74.15 H new ATOM 0 HG12 VAL A 53 34.798 -26.443 53.551 1.00 74.15 H new ATOM 0 HG13 VAL A 53 34.163 -28.022 53.029 1.00 74.15 H new ATOM 0 HG21 VAL A 53 31.616 -26.857 51.752 1.00 3.23 H new ATOM 0 HG22 VAL A 53 31.589 -28.294 52.801 1.00 3.23 H new ATOM 0 HG23 VAL A 53 30.559 -26.894 53.183 1.00 3.23 H new ATOM 825 N SER A 54 31.109 -25.229 55.804 1.00 21.24 N ATOM 826 CA SER A 54 30.051 -24.548 56.540 1.00 45.31 C ATOM 827 C SER A 54 28.803 -24.334 55.672 1.00 51.25 C ATOM 828 O SER A 54 27.896 -25.163 55.690 1.00 4.41 O ATOM 829 CB SER A 54 30.604 -23.234 57.115 1.00 24.54 C ATOM 830 OG SER A 54 31.188 -22.430 56.106 1.00 65.13 O ATOM 0 H SER A 54 31.701 -24.588 55.276 1.00 21.24 H new ATOM 0 HA SER A 54 29.726 -25.176 57.370 1.00 45.31 H new ATOM 0 HB2 SER A 54 29.800 -22.682 57.601 1.00 24.54 H new ATOM 0 HB3 SER A 54 31.347 -23.455 57.881 1.00 24.54 H new ATOM 0 HG SER A 54 31.528 -21.602 56.504 1.00 65.13 H new ATOM 836 N HIS A 55 28.738 -23.208 54.948 1.00 42.34 N ATOM 837 CA HIS A 55 27.576 -22.796 54.166 1.00 45.41 C ATOM 838 C HIS A 55 27.969 -21.774 53.095 1.00 61.12 C ATOM 839 O HIS A 55 27.548 -21.887 51.945 1.00 1.42 O ATOM 840 CB HIS A 55 26.461 -22.262 55.080 1.00 11.32 C ATOM 841 CG HIS A 55 26.854 -21.081 55.931 1.00 35.23 C ATOM 842 ND1 HIS A 55 26.719 -19.769 55.499 1.00 10.44 N ATOM 843 CD2 HIS A 55 27.365 -20.991 57.204 1.00 74.41 C ATOM 844 CE1 HIS A 55 27.176 -18.976 56.483 1.00 21.31 C ATOM 845 NE2 HIS A 55 27.584 -19.662 57.552 1.00 33.12 N ATOM 0 H HIS A 55 29.513 -22.547 54.892 1.00 42.34 H new ATOM 0 HA HIS A 55 27.184 -23.673 53.650 1.00 45.41 H new ATOM 0 HB2 HIS A 55 25.608 -21.980 54.463 1.00 11.32 H new ATOM 0 HB3 HIS A 55 26.128 -23.069 55.733 1.00 11.32 H new ATOM 0 HD2 HIS A 55 27.568 -21.836 57.846 1.00 74.41 H new ATOM 0 HE1 HIS A 55 27.209 -17.899 56.416 1.00 21.31 H new ATOM 0 HE2 HIS A 55 27.968 -19.296 58.423 1.00 33.12 H new ATOM 853 N GLY A 56 28.792 -20.783 53.459 1.00 54.42 N ATOM 854 CA GLY A 56 29.302 -19.788 52.527 1.00 25.21 C ATOM 855 C GLY A 56 30.107 -20.449 51.408 1.00 14.15 C ATOM 856 O GLY A 56 30.018 -20.043 50.251 1.00 71.42 O ATOM 0 H GLY A 56 29.121 -20.654 54.416 1.00 54.42 H new ATOM 0 HA2 GLY A 56 28.472 -19.225 52.100 1.00 25.21 H new ATOM 0 HA3 GLY A 56 29.930 -19.074 53.059 1.00 25.21 H new ATOM 860 N CYS A 57 30.871 -21.491 51.755 1.00 25.40 N ATOM 861 CA CYS A 57 31.611 -22.297 50.803 1.00 42.42 C ATOM 862 C CYS A 57 30.640 -23.141 49.973 1.00 64.23 C ATOM 863 O CYS A 57 30.767 -23.183 48.752 1.00 54.24 O ATOM 864 CB CYS A 57 32.621 -23.158 51.565 1.00 25.11 C ATOM 865 SG CYS A 57 33.637 -24.090 50.393 1.00 0.13 S ATOM 0 H CYS A 57 30.988 -21.795 52.722 1.00 25.40 H new ATOM 0 HA CYS A 57 32.161 -21.663 50.108 1.00 42.42 H new ATOM 0 HB2 CYS A 57 33.254 -22.527 52.188 1.00 25.11 H new ATOM 0 HB3 CYS A 57 32.099 -23.843 52.233 1.00 25.11 H new ATOM 0 HG CYS A 57 34.625 -24.650 51.025 1.00 0.13 H new ATOM 871 N VAL A 58 29.667 -23.794 50.624 1.00 33.25 N ATOM 872 CA VAL A 58 28.674 -24.643 49.967 1.00 1.10 C ATOM 873 C VAL A 58 28.025 -23.897 48.800 1.00 12.43 C ATOM 874 O VAL A 58 27.892 -24.454 47.714 1.00 60.24 O ATOM 875 CB VAL A 58 27.604 -25.120 50.967 1.00 3.12 C ATOM 876 CG1 VAL A 58 26.612 -26.085 50.300 1.00 51.23 C ATOM 877 CG2 VAL A 58 28.223 -25.846 52.164 1.00 23.51 C ATOM 0 H VAL A 58 29.550 -23.744 51.636 1.00 33.25 H new ATOM 0 HA VAL A 58 29.185 -25.524 49.577 1.00 1.10 H new ATOM 0 HB VAL A 58 27.090 -24.221 51.309 1.00 3.12 H new ATOM 0 HG11 VAL A 58 25.869 -26.405 51.030 1.00 51.23 H new ATOM 0 HG12 VAL A 58 26.114 -25.580 49.472 1.00 51.23 H new ATOM 0 HG13 VAL A 58 27.149 -26.956 49.924 1.00 51.23 H new ATOM 0 HG21 VAL A 58 27.433 -26.165 52.844 1.00 23.51 H new ATOM 0 HG22 VAL A 58 28.776 -26.718 51.815 1.00 23.51 H new ATOM 0 HG23 VAL A 58 28.902 -25.172 52.687 1.00 23.51 H new ATOM 887 N SER A 59 27.652 -22.630 49.020 1.00 71.21 N ATOM 888 CA SER A 59 27.054 -21.762 48.028 1.00 5.50 C ATOM 889 C SER A 59 27.831 -21.768 46.706 1.00 62.30 C ATOM 890 O SER A 59 27.220 -21.918 45.651 1.00 22.52 O ATOM 891 CB SER A 59 26.964 -20.351 48.612 1.00 30.14 C ATOM 892 OG SER A 59 26.279 -20.353 49.849 1.00 4.53 O ATOM 0 H SER A 59 27.767 -22.177 49.927 1.00 71.21 H new ATOM 0 HA SER A 59 26.056 -22.131 47.790 1.00 5.50 H new ATOM 0 HB2 SER A 59 27.967 -19.947 48.749 1.00 30.14 H new ATOM 0 HB3 SER A 59 26.449 -19.696 47.909 1.00 30.14 H new ATOM 0 HG SER A 59 26.848 -20.757 50.537 1.00 4.53 H new ATOM 898 N LYS A 60 29.163 -21.621 46.762 1.00 42.15 N ATOM 899 CA LYS A 60 30.011 -21.585 45.573 1.00 31.43 C ATOM 900 C LYS A 60 30.364 -22.984 45.051 1.00 73.44 C ATOM 901 O LYS A 60 30.566 -23.140 43.850 1.00 14.31 O ATOM 902 CB LYS A 60 31.248 -20.698 45.779 1.00 12.34 C ATOM 903 CG LYS A 60 32.135 -21.107 46.961 1.00 21.54 C ATOM 904 CD LYS A 60 33.431 -20.288 47.031 1.00 32.32 C ATOM 905 CE LYS A 60 34.438 -20.688 45.944 1.00 64.34 C ATOM 906 NZ LYS A 60 35.708 -19.954 46.092 1.00 44.32 N ATOM 0 H LYS A 60 29.678 -21.524 47.637 1.00 42.15 H new ATOM 0 HA LYS A 60 29.421 -21.119 44.784 1.00 31.43 H new ATOM 0 HB2 LYS A 60 31.847 -20.715 44.869 1.00 12.34 H new ATOM 0 HB3 LYS A 60 30.921 -19.669 45.926 1.00 12.34 H new ATOM 0 HG2 LYS A 60 31.579 -20.981 47.890 1.00 21.54 H new ATOM 0 HG3 LYS A 60 32.381 -22.166 46.878 1.00 21.54 H new ATOM 0 HD2 LYS A 60 33.194 -19.229 46.930 1.00 32.32 H new ATOM 0 HD3 LYS A 60 33.888 -20.420 48.012 1.00 32.32 H new ATOM 0 HE2 LYS A 60 34.627 -21.760 45.998 1.00 64.34 H new ATOM 0 HE3 LYS A 60 34.013 -20.488 44.960 1.00 64.34 H new ATOM 0 HZ1 LYS A 60 36.367 -20.246 45.343 1.00 44.32 H new ATOM 0 HZ2 LYS A 60 35.529 -18.932 46.016 1.00 44.32 H new ATOM 0 HZ3 LYS A 60 36.125 -20.165 47.021 1.00 44.32 H new ATOM 920 N ILE A 61 30.431 -24.003 45.919 1.00 64.21 N ATOM 921 CA ILE A 61 30.625 -25.387 45.494 1.00 42.22 C ATOM 922 C ILE A 61 29.458 -25.824 44.600 1.00 73.11 C ATOM 923 O ILE A 61 29.680 -26.319 43.495 1.00 2.52 O ATOM 924 CB ILE A 61 30.792 -26.306 46.722 1.00 35.32 C ATOM 925 CG1 ILE A 61 32.063 -25.988 47.534 1.00 31.04 C ATOM 926 CG2 ILE A 61 30.791 -27.786 46.325 1.00 53.02 C ATOM 927 CD1 ILE A 61 33.379 -26.378 46.857 1.00 40.43 C ATOM 0 H ILE A 61 30.352 -23.887 46.929 1.00 64.21 H new ATOM 0 HA ILE A 61 31.540 -25.465 44.907 1.00 42.22 H new ATOM 0 HB ILE A 61 29.930 -26.108 47.359 1.00 35.32 H new ATOM 0 HG12 ILE A 61 32.083 -24.919 47.744 1.00 31.04 H new ATOM 0 HG13 ILE A 61 32.000 -26.500 48.494 1.00 31.04 H new ATOM 0 HG21 ILE A 61 30.911 -28.402 47.216 1.00 53.02 H new ATOM 0 HG22 ILE A 61 29.847 -28.032 45.838 1.00 53.02 H new ATOM 0 HG23 ILE A 61 31.615 -27.979 45.637 1.00 53.02 H new ATOM 0 HD11 ILE A 61 34.214 -26.114 47.506 1.00 40.43 H new ATOM 0 HD12 ILE A 61 33.388 -27.452 46.672 1.00 40.43 H new ATOM 0 HD13 ILE A 61 33.473 -25.846 45.910 1.00 40.43 H new ATOM 939 N LEU A 62 28.220 -25.626 45.069 1.00 4.20 N ATOM 940 CA LEU A 62 27.009 -25.925 44.316 1.00 11.13 C ATOM 941 C LEU A 62 26.889 -24.965 43.129 1.00 21.23 C ATOM 942 O LEU A 62 26.839 -25.406 41.982 1.00 32.21 O ATOM 943 CB LEU A 62 25.774 -25.817 45.230 1.00 12.22 C ATOM 944 CG LEU A 62 25.438 -27.082 46.043 1.00 74.24 C ATOM 945 CD1 LEU A 62 24.856 -28.186 45.153 1.00 75.03 C ATOM 946 CD2 LEU A 62 26.627 -27.628 46.840 1.00 74.23 C ATOM 0 H LEU A 62 28.035 -25.247 45.998 1.00 4.20 H new ATOM 0 HA LEU A 62 27.064 -26.945 43.937 1.00 11.13 H new ATOM 0 HB2 LEU A 62 25.928 -24.991 45.924 1.00 12.22 H new ATOM 0 HB3 LEU A 62 24.911 -25.561 44.616 1.00 12.22 H new ATOM 0 HG LEU A 62 24.684 -26.768 46.765 1.00 74.24 H new ATOM 0 HD11 LEU A 62 24.631 -29.063 45.761 1.00 75.03 H new ATOM 0 HD12 LEU A 62 23.941 -27.828 44.680 1.00 75.03 H new ATOM 0 HD13 LEU A 62 25.581 -28.454 44.384 1.00 75.03 H new ATOM 0 HD21 LEU A 62 26.319 -28.518 47.388 1.00 74.23 H new ATOM 0 HD22 LEU A 62 27.436 -27.885 46.156 1.00 74.23 H new ATOM 0 HD23 LEU A 62 26.973 -26.870 47.543 1.00 74.23 H new ATOM 958 N GLY A 63 26.822 -23.660 43.415 1.00 64.25 N ATOM 959 CA GLY A 63 26.583 -22.611 42.440 1.00 41.40 C ATOM 960 C GLY A 63 27.749 -21.630 42.427 1.00 71.52 C ATOM 961 O GLY A 63 27.658 -20.553 43.007 1.00 1.03 O ATOM 0 H GLY A 63 26.937 -23.302 44.363 1.00 64.25 H new ATOM 0 HA2 GLY A 63 26.454 -23.047 41.450 1.00 41.40 H new ATOM 0 HA3 GLY A 63 25.659 -22.085 42.679 1.00 41.40 H new ATOM 1314 N LYS A 87 -1.396 -0.812 5.114 1.00 15.11 N ATOM 1315 CA LYS A 87 -1.419 -1.606 3.888 1.00 33.34 C ATOM 1316 C LYS A 87 -2.632 -2.543 3.805 1.00 13.45 C ATOM 1317 O LYS A 87 -3.035 -2.932 2.709 1.00 23.24 O ATOM 1318 CB LYS A 87 -0.097 -2.383 3.803 1.00 44.12 C ATOM 1319 CG LYS A 87 0.172 -3.095 2.470 1.00 24.12 C ATOM 1320 CD LYS A 87 0.257 -2.112 1.297 1.00 1.53 C ATOM 1321 CE LYS A 87 0.841 -2.798 0.057 1.00 33.11 C ATOM 1322 NZ LYS A 87 1.043 -1.844 -1.048 1.00 11.05 N ATOM 0 HA LYS A 87 -1.520 -0.936 3.034 1.00 33.34 H new ATOM 0 HB2 LYS A 87 0.723 -1.691 3.996 1.00 44.12 H new ATOM 0 HB3 LYS A 87 -0.082 -3.126 4.600 1.00 44.12 H new ATOM 0 HG2 LYS A 87 1.104 -3.655 2.541 1.00 24.12 H new ATOM 0 HG3 LYS A 87 -0.621 -3.818 2.279 1.00 24.12 H new ATOM 0 HD2 LYS A 87 -0.735 -1.722 1.070 1.00 1.53 H new ATOM 0 HD3 LYS A 87 0.878 -1.260 1.574 1.00 1.53 H new ATOM 0 HE2 LYS A 87 1.792 -3.265 0.313 1.00 33.11 H new ATOM 0 HE3 LYS A 87 0.172 -3.595 -0.268 1.00 33.11 H new ATOM 0 HZ1 LYS A 87 1.753 -2.222 -1.707 1.00 11.05 H new ATOM 0 HZ2 LYS A 87 0.144 -1.701 -1.552 1.00 11.05 H new ATOM 0 HZ3 LYS A 87 1.374 -0.935 -0.666 1.00 11.05 H new ATOM 1336 N VAL A 88 -3.235 -2.881 4.954 1.00 23.41 N ATOM 1337 CA VAL A 88 -4.482 -3.630 5.032 1.00 4.24 C ATOM 1338 C VAL A 88 -5.589 -3.026 4.154 1.00 0.43 C ATOM 1339 O VAL A 88 -6.390 -3.776 3.603 1.00 44.21 O ATOM 1340 CB VAL A 88 -4.930 -3.805 6.496 1.00 62.13 C ATOM 1341 CG1 VAL A 88 -3.901 -4.625 7.285 1.00 54.52 C ATOM 1342 CG2 VAL A 88 -5.191 -2.473 7.213 1.00 34.54 C ATOM 0 H VAL A 88 -2.857 -2.633 5.868 1.00 23.41 H new ATOM 0 HA VAL A 88 -4.288 -4.623 4.625 1.00 4.24 H new ATOM 0 HB VAL A 88 -5.879 -4.341 6.458 1.00 62.13 H new ATOM 0 HG11 VAL A 88 -4.237 -4.736 8.316 1.00 54.52 H new ATOM 0 HG12 VAL A 88 -3.794 -5.610 6.830 1.00 54.52 H new ATOM 0 HG13 VAL A 88 -2.939 -4.113 7.271 1.00 54.52 H new ATOM 0 HG21 VAL A 88 -5.503 -2.667 8.239 1.00 34.54 H new ATOM 0 HG22 VAL A 88 -4.278 -1.877 7.218 1.00 34.54 H new ATOM 0 HG23 VAL A 88 -5.978 -1.927 6.692 1.00 34.54 H new ATOM 1352 N VAL A 89 -5.629 -1.695 3.987 1.00 4.10 N ATOM 1353 CA VAL A 89 -6.613 -1.033 3.132 1.00 10.11 C ATOM 1354 C VAL A 89 -6.511 -1.530 1.684 1.00 53.11 C ATOM 1355 O VAL A 89 -7.529 -1.778 1.041 1.00 30.30 O ATOM 1356 CB VAL A 89 -6.485 0.500 3.246 1.00 73.52 C ATOM 1357 CG1 VAL A 89 -5.288 1.071 2.472 1.00 11.52 C ATOM 1358 CG2 VAL A 89 -7.759 1.197 2.752 1.00 41.31 C ATOM 0 H VAL A 89 -4.980 -1.053 4.442 1.00 4.10 H new ATOM 0 HA VAL A 89 -7.612 -1.297 3.478 1.00 10.11 H new ATOM 0 HB VAL A 89 -6.327 0.697 4.306 1.00 73.52 H new ATOM 0 HG11 VAL A 89 -5.258 2.154 2.595 1.00 11.52 H new ATOM 0 HG12 VAL A 89 -4.365 0.636 2.856 1.00 11.52 H new ATOM 0 HG13 VAL A 89 -5.390 0.829 1.414 1.00 11.52 H new ATOM 0 HG21 VAL A 89 -7.642 2.277 2.843 1.00 41.31 H new ATOM 0 HG22 VAL A 89 -7.934 0.938 1.708 1.00 41.31 H new ATOM 0 HG23 VAL A 89 -8.608 0.872 3.353 1.00 41.31 H new ATOM 1368 N GLU A 90 -5.279 -1.703 1.185 1.00 1.43 N ATOM 1369 CA GLU A 90 -5.022 -2.225 -0.146 1.00 54.44 C ATOM 1370 C GLU A 90 -5.382 -3.708 -0.206 1.00 14.52 C ATOM 1371 O GLU A 90 -5.948 -4.147 -1.202 1.00 3.43 O ATOM 1372 CB GLU A 90 -3.562 -1.988 -0.547 1.00 62.01 C ATOM 1373 CG GLU A 90 -3.254 -0.489 -0.655 1.00 53.41 C ATOM 1374 CD GLU A 90 -1.797 -0.238 -1.022 1.00 3.55 C ATOM 1375 OE1 GLU A 90 -1.363 -0.790 -2.057 1.00 10.11 O ATOM 1376 OE2 GLU A 90 -1.120 0.471 -0.249 1.00 45.33 O ATOM 0 H GLU A 90 -4.431 -1.480 1.706 1.00 1.43 H new ATOM 0 HA GLU A 90 -5.650 -1.694 -0.861 1.00 54.44 H new ATOM 0 HB2 GLU A 90 -2.901 -2.446 0.189 1.00 62.01 H new ATOM 0 HB3 GLU A 90 -3.361 -2.473 -1.502 1.00 62.01 H new ATOM 0 HG2 GLU A 90 -3.902 -0.038 -1.407 1.00 53.41 H new ATOM 0 HG3 GLU A 90 -3.479 -0.002 0.294 1.00 53.41 H new ATOM 1383 N LYS A 91 -5.087 -4.469 0.859 1.00 33.14 N ATOM 1384 CA LYS A 91 -5.444 -5.880 0.926 1.00 22.15 C ATOM 1385 C LYS A 91 -6.958 -6.093 0.868 1.00 44.41 C ATOM 1386 O LYS A 91 -7.391 -7.010 0.175 1.00 73.22 O ATOM 1387 CB LYS A 91 -4.824 -6.569 2.148 1.00 34.52 C ATOM 1388 CG LYS A 91 -3.298 -6.722 2.064 1.00 14.33 C ATOM 1389 CD LYS A 91 -2.869 -7.588 0.867 1.00 14.53 C ATOM 1390 CE LYS A 91 -1.402 -8.021 0.940 1.00 53.14 C ATOM 1391 NZ LYS A 91 -1.179 -9.055 1.966 1.00 73.52 N ATOM 0 H LYS A 91 -4.600 -4.122 1.685 1.00 33.14 H new ATOM 0 HA LYS A 91 -5.021 -6.353 0.040 1.00 22.15 H new ATOM 0 HB2 LYS A 91 -5.074 -5.997 3.042 1.00 34.52 H new ATOM 0 HB3 LYS A 91 -5.273 -7.555 2.264 1.00 34.52 H new ATOM 0 HG2 LYS A 91 -2.839 -5.737 1.981 1.00 14.33 H new ATOM 0 HG3 LYS A 91 -2.928 -7.170 2.986 1.00 14.33 H new ATOM 0 HD2 LYS A 91 -3.502 -8.474 0.821 1.00 14.53 H new ATOM 0 HD3 LYS A 91 -3.033 -7.031 -0.055 1.00 14.53 H new ATOM 0 HE2 LYS A 91 -1.088 -8.402 -0.032 1.00 53.14 H new ATOM 0 HE3 LYS A 91 -0.779 -7.154 1.159 1.00 53.14 H new ATOM 0 HZ1 LYS A 91 -0.206 -9.415 1.890 1.00 73.52 H new ATOM 0 HZ2 LYS A 91 -1.323 -8.644 2.910 1.00 73.52 H new ATOM 0 HZ3 LYS A 91 -1.850 -9.837 1.823 1.00 73.52 H new ATOM 1405 N ILE A 92 -7.770 -5.250 1.526 1.00 10.55 N ATOM 1406 CA ILE A 92 -9.217 -5.277 1.333 1.00 4.01 C ATOM 1407 C ILE A 92 -9.550 -5.127 -0.159 1.00 15.22 C ATOM 1408 O ILE A 92 -10.408 -5.844 -0.668 1.00 1.20 O ATOM 1409 CB ILE A 92 -9.915 -4.237 2.240 1.00 25.31 C ATOM 1410 CG1 ILE A 92 -10.326 -4.833 3.603 1.00 11.31 C ATOM 1411 CG2 ILE A 92 -11.198 -3.671 1.608 1.00 61.04 C ATOM 1412 CD1 ILE A 92 -9.191 -5.482 4.401 1.00 72.33 C ATOM 0 H ILE A 92 -7.446 -4.548 2.191 1.00 10.55 H new ATOM 0 HA ILE A 92 -9.613 -6.244 1.643 1.00 4.01 H new ATOM 0 HB ILE A 92 -9.174 -3.448 2.370 1.00 25.31 H new ATOM 0 HG12 ILE A 92 -10.768 -4.042 4.209 1.00 11.31 H new ATOM 0 HG13 ILE A 92 -11.103 -5.579 3.436 1.00 11.31 H new ATOM 0 HG21 ILE A 92 -11.648 -2.946 2.286 1.00 61.04 H new ATOM 0 HG22 ILE A 92 -10.954 -3.183 0.664 1.00 61.04 H new ATOM 0 HG23 ILE A 92 -11.902 -4.483 1.425 1.00 61.04 H new ATOM 0 HD11 ILE A 92 -9.583 -5.870 5.341 1.00 72.33 H new ATOM 0 HD12 ILE A 92 -8.761 -6.300 3.823 1.00 72.33 H new ATOM 0 HD13 ILE A 92 -8.421 -4.739 4.608 1.00 72.33 H new ATOM 1424 N GLY A 93 -8.846 -4.230 -0.862 1.00 11.44 N ATOM 1425 CA GLY A 93 -8.974 -4.049 -2.300 1.00 14.14 C ATOM 1426 C GLY A 93 -8.654 -5.329 -3.077 1.00 11.04 C ATOM 1427 O GLY A 93 -9.470 -5.772 -3.883 1.00 54.14 O ATOM 0 H GLY A 93 -8.164 -3.604 -0.434 1.00 11.44 H new ATOM 0 HA2 GLY A 93 -9.989 -3.728 -2.535 1.00 14.14 H new ATOM 0 HA3 GLY A 93 -8.305 -3.252 -2.625 1.00 14.14 H new ATOM 1431 N ASP A 94 -7.475 -5.923 -2.851 1.00 2.12 N ATOM 1432 CA ASP A 94 -7.053 -7.141 -3.532 1.00 45.04 C ATOM 1433 C ASP A 94 -8.063 -8.264 -3.315 1.00 4.32 C ATOM 1434 O ASP A 94 -8.470 -8.922 -4.265 1.00 21.23 O ATOM 1435 CB ASP A 94 -5.667 -7.584 -3.047 1.00 22.43 C ATOM 1436 CG ASP A 94 -4.566 -6.564 -3.334 1.00 33.45 C ATOM 1437 OD1 ASP A 94 -4.324 -6.302 -4.533 1.00 50.40 O ATOM 1438 OD2 ASP A 94 -3.973 -6.070 -2.352 1.00 71.12 O ATOM 0 H ASP A 94 -6.788 -5.566 -2.187 1.00 2.12 H new ATOM 0 HA ASP A 94 -6.998 -6.923 -4.599 1.00 45.04 H new ATOM 0 HB2 ASP A 94 -5.709 -7.770 -1.974 1.00 22.43 H new ATOM 0 HB3 ASP A 94 -5.409 -8.529 -3.524 1.00 22.43 H new ATOM 1443 N TYR A 95 -8.472 -8.473 -2.066 1.00 51.30 N ATOM 1444 CA TYR A 95 -9.400 -9.522 -1.688 1.00 33.13 C ATOM 1445 C TYR A 95 -10.773 -9.313 -2.327 1.00 12.20 C ATOM 1446 O TYR A 95 -11.354 -10.275 -2.820 1.00 33.44 O ATOM 1447 CB TYR A 95 -9.491 -9.568 -0.166 1.00 1.32 C ATOM 1448 CG TYR A 95 -8.210 -9.882 0.591 1.00 64.24 C ATOM 1449 CD1 TYR A 95 -7.110 -10.525 -0.017 1.00 45.02 C ATOM 1450 CD2 TYR A 95 -8.129 -9.522 1.946 1.00 13.44 C ATOM 1451 CE1 TYR A 95 -5.937 -10.771 0.718 1.00 21.00 C ATOM 1452 CE2 TYR A 95 -6.975 -9.806 2.686 1.00 62.24 C ATOM 1453 CZ TYR A 95 -5.867 -10.402 2.071 1.00 21.31 C ATOM 1454 OH TYR A 95 -4.732 -10.601 2.797 1.00 24.44 O ATOM 0 H TYR A 95 -8.159 -7.905 -1.279 1.00 51.30 H new ATOM 0 HA TYR A 95 -9.033 -10.480 -2.057 1.00 33.13 H new ATOM 0 HB2 TYR A 95 -9.862 -8.604 0.181 1.00 1.32 H new ATOM 0 HB3 TYR A 95 -10.238 -10.314 0.107 1.00 1.32 H new ATOM 0 HD1 TYR A 95 -7.170 -10.829 -1.052 1.00 45.02 H new ATOM 0 HD2 TYR A 95 -8.962 -9.023 2.420 1.00 13.44 H new ATOM 0 HE1 TYR A 95 -5.090 -11.243 0.242 1.00 21.00 H new ATOM 0 HE2 TYR A 95 -6.939 -9.564 3.738 1.00 62.24 H new ATOM 0 HH TYR A 95 -3.975 -10.738 2.190 1.00 24.44 H new ATOM 1464 N LYS A 96 -11.282 -8.074 -2.353 1.00 31.14 N ATOM 1465 CA LYS A 96 -12.490 -7.715 -3.075 1.00 53.44 C ATOM 1466 C LYS A 96 -12.370 -8.089 -4.556 1.00 62.31 C ATOM 1467 O LYS A 96 -13.295 -8.669 -5.118 1.00 54.44 O ATOM 1468 CB LYS A 96 -12.739 -6.210 -2.894 1.00 4.41 C ATOM 1469 CG LYS A 96 -14.025 -5.710 -3.554 1.00 50.23 C ATOM 1470 CD LYS A 96 -15.256 -6.284 -2.853 1.00 23.31 C ATOM 1471 CE LYS A 96 -16.522 -5.712 -3.501 1.00 54.41 C ATOM 1472 NZ LYS A 96 -17.727 -5.997 -2.704 1.00 15.23 N ATOM 0 H LYS A 96 -10.853 -7.289 -1.863 1.00 31.14 H new ATOM 0 HA LYS A 96 -13.339 -8.270 -2.676 1.00 53.44 H new ATOM 0 HB2 LYS A 96 -12.778 -5.984 -1.828 1.00 4.41 H new ATOM 0 HB3 LYS A 96 -11.893 -5.660 -3.306 1.00 4.41 H new ATOM 0 HG2 LYS A 96 -14.057 -4.621 -3.520 1.00 50.23 H new ATOM 0 HG3 LYS A 96 -14.034 -5.996 -4.606 1.00 50.23 H new ATOM 0 HD2 LYS A 96 -15.256 -7.372 -2.926 1.00 23.31 H new ATOM 0 HD3 LYS A 96 -15.233 -6.036 -1.792 1.00 23.31 H new ATOM 0 HE2 LYS A 96 -16.413 -4.634 -3.620 1.00 54.41 H new ATOM 0 HE3 LYS A 96 -16.640 -6.133 -4.500 1.00 54.41 H new ATOM 0 HZ1 LYS A 96 -18.489 -6.324 -3.332 1.00 15.23 H new ATOM 0 HZ2 LYS A 96 -17.514 -6.736 -2.004 1.00 15.23 H new ATOM 0 HZ3 LYS A 96 -18.031 -5.132 -2.212 1.00 15.23 H new ATOM 1486 N ARG A 97 -11.233 -7.757 -5.181 1.00 10.04 N ATOM 1487 CA ARG A 97 -10.950 -8.070 -6.574 1.00 12.34 C ATOM 1488 C ARG A 97 -10.844 -9.583 -6.814 1.00 60.31 C ATOM 1489 O ARG A 97 -11.232 -10.053 -7.881 1.00 75.11 O ATOM 1490 CB ARG A 97 -9.676 -7.327 -6.999 1.00 64.22 C ATOM 1491 CG ARG A 97 -9.987 -5.837 -7.214 1.00 22.24 C ATOM 1492 CD ARG A 97 -8.762 -4.914 -7.129 1.00 0.21 C ATOM 1493 NE ARG A 97 -7.513 -5.570 -7.549 1.00 1.44 N ATOM 1494 CZ ARG A 97 -6.361 -5.550 -6.855 1.00 15.50 C ATOM 1495 NH1 ARG A 97 -6.174 -4.709 -5.827 1.00 34.22 N ATOM 1496 NH2 ARG A 97 -5.377 -6.399 -7.171 1.00 43.02 N ATOM 0 H ARG A 97 -10.475 -7.255 -4.718 1.00 10.04 H new ATOM 0 HA ARG A 97 -11.782 -7.732 -7.192 1.00 12.34 H new ATOM 0 HB2 ARG A 97 -8.906 -7.440 -6.235 1.00 64.22 H new ATOM 0 HB3 ARG A 97 -9.280 -7.761 -7.917 1.00 64.22 H new ATOM 0 HG2 ARG A 97 -10.453 -5.713 -8.192 1.00 22.24 H new ATOM 0 HG3 ARG A 97 -10.718 -5.520 -6.470 1.00 22.24 H new ATOM 0 HD2 ARG A 97 -8.932 -4.037 -7.753 1.00 0.21 H new ATOM 0 HD3 ARG A 97 -8.652 -4.560 -6.104 1.00 0.21 H new ATOM 0 HE ARG A 97 -7.522 -6.078 -8.433 1.00 1.44 H new ATOM 0 HH11 ARG A 97 -6.916 -4.064 -5.555 1.00 34.22 H new ATOM 0 HH12 ARG A 97 -5.290 -4.715 -5.318 1.00 34.22 H new ATOM 0 HH21 ARG A 97 -5.501 -7.061 -7.937 1.00 43.02 H new ATOM 0 HH22 ARG A 97 -4.503 -6.385 -6.646 1.00 43.02 H new ATOM 1510 N GLN A 98 -10.331 -10.341 -5.838 1.00 14.10 N ATOM 1511 CA GLN A 98 -10.205 -11.790 -5.930 1.00 22.13 C ATOM 1512 C GLN A 98 -11.583 -12.452 -5.840 1.00 34.11 C ATOM 1513 O GLN A 98 -11.986 -13.175 -6.750 1.00 43.24 O ATOM 1514 CB GLN A 98 -9.295 -12.317 -4.811 1.00 21.43 C ATOM 1515 CG GLN A 98 -7.816 -11.989 -5.052 1.00 14.14 C ATOM 1516 CD GLN A 98 -6.993 -12.175 -3.780 1.00 60.32 C ATOM 1517 OE1 GLN A 98 -7.304 -13.024 -2.947 1.00 62.00 O ATOM 1518 NE2 GLN A 98 -5.939 -11.373 -3.620 1.00 50.30 N ATOM 0 H GLN A 98 -9.990 -9.957 -4.957 1.00 14.10 H new ATOM 0 HA GLN A 98 -9.759 -12.038 -6.893 1.00 22.13 H new ATOM 0 HB2 GLN A 98 -9.609 -11.887 -3.860 1.00 21.43 H new ATOM 0 HB3 GLN A 98 -9.415 -13.397 -4.728 1.00 21.43 H new ATOM 0 HG2 GLN A 98 -7.422 -12.631 -5.840 1.00 14.14 H new ATOM 0 HG3 GLN A 98 -7.721 -10.961 -5.402 1.00 14.14 H new ATOM 0 HE21 GLN A 98 -5.712 -10.680 -4.334 1.00 50.30 H new ATOM 0 HE22 GLN A 98 -5.360 -11.453 -2.784 1.00 50.30 H new ATOM 1527 N ASN A 99 -12.276 -12.234 -4.718 1.00 55.21 N ATOM 1528 CA ASN A 99 -13.503 -12.917 -4.343 1.00 12.14 C ATOM 1529 C ASN A 99 -14.731 -12.221 -4.966 1.00 74.51 C ATOM 1530 O ASN A 99 -14.558 -11.253 -5.706 1.00 62.13 O ATOM 1531 CB ASN A 99 -13.488 -13.059 -2.808 1.00 33.42 C ATOM 1532 CG ASN A 99 -14.003 -11.861 -2.008 1.00 64.14 C ATOM 1533 OD1 ASN A 99 -14.261 -10.783 -2.538 1.00 12.40 O ATOM 1534 ND2 ASN A 99 -14.153 -12.060 -0.698 1.00 75.41 N ATOM 0 H ASN A 99 -11.980 -11.548 -4.023 1.00 55.21 H new ATOM 0 HA ASN A 99 -13.574 -13.926 -4.749 1.00 12.14 H new ATOM 0 HB2 ASN A 99 -14.085 -13.931 -2.540 1.00 33.42 H new ATOM 0 HB3 ASN A 99 -12.465 -13.265 -2.494 1.00 33.42 H new ATOM 0 HD21 ASN A 99 -14.492 -11.304 -0.103 1.00 75.41 H new ATOM 0 HD22 ASN A 99 -13.929 -12.968 -0.291 1.00 75.41 H new ATOM 1541 N PRO A 100 -15.967 -12.703 -4.734 1.00 5.02 N ATOM 1542 CA PRO A 100 -17.157 -12.206 -5.415 1.00 45.14 C ATOM 1543 C PRO A 100 -17.717 -10.987 -4.662 1.00 45.33 C ATOM 1544 O PRO A 100 -16.952 -10.235 -4.058 1.00 62.32 O ATOM 1545 CB PRO A 100 -18.088 -13.425 -5.445 1.00 73.15 C ATOM 1546 CG PRO A 100 -17.815 -14.075 -4.092 1.00 70.54 C ATOM 1547 CD PRO A 100 -16.315 -13.841 -3.898 1.00 71.21 C ATOM 0 HA PRO A 100 -16.990 -11.836 -6.426 1.00 45.14 H new ATOM 0 HB2 PRO A 100 -19.133 -13.136 -5.554 1.00 73.15 H new ATOM 0 HB3 PRO A 100 -17.855 -14.095 -6.273 1.00 73.15 H new ATOM 0 HG2 PRO A 100 -18.402 -13.615 -3.297 1.00 70.54 H new ATOM 0 HG3 PRO A 100 -18.061 -15.137 -4.097 1.00 70.54 H new ATOM 0 HD2 PRO A 100 -16.085 -13.639 -2.852 1.00 71.21 H new ATOM 0 HD3 PRO A 100 -15.744 -14.724 -4.185 1.00 71.21 H new ATOM 1555 N THR A 101 -19.040 -10.773 -4.692 1.00 64.41 N ATOM 1556 CA THR A 101 -19.701 -9.637 -4.059 1.00 61.12 C ATOM 1557 C THR A 101 -19.848 -9.858 -2.549 1.00 35.35 C ATOM 1558 O THR A 101 -20.960 -9.875 -2.023 1.00 34.00 O ATOM 1559 CB THR A 101 -21.059 -9.393 -4.736 1.00 54.15 C ATOM 1560 OG1 THR A 101 -21.862 -10.552 -4.642 1.00 42.10 O ATOM 1561 CG2 THR A 101 -20.895 -9.013 -6.211 1.00 34.13 C ATOM 0 H THR A 101 -19.688 -11.401 -5.168 1.00 64.41 H new ATOM 0 HA THR A 101 -19.087 -8.746 -4.188 1.00 61.12 H new ATOM 0 HB THR A 101 -21.539 -8.563 -4.218 1.00 54.15 H new ATOM 0 HG1 THR A 101 -21.991 -10.785 -3.699 1.00 42.10 H new ATOM 0 HG21 THR A 101 -21.876 -8.848 -6.656 1.00 34.13 H new ATOM 0 HG22 THR A 101 -20.304 -8.100 -6.288 1.00 34.13 H new ATOM 0 HG23 THR A 101 -20.388 -9.820 -6.740 1.00 34.13 H new ATOM 1569 N MET A 102 -18.714 -10.003 -1.855 1.00 20.31 N ATOM 1570 CA MET A 102 -18.626 -10.056 -0.406 1.00 60.14 C ATOM 1571 C MET A 102 -18.331 -8.663 0.138 1.00 43.13 C ATOM 1572 O MET A 102 -18.142 -7.716 -0.624 1.00 64.22 O ATOM 1573 CB MET A 102 -17.523 -11.043 -0.009 1.00 75.35 C ATOM 1574 CG MET A 102 -17.967 -12.499 -0.173 1.00 24.12 C ATOM 1575 SD MET A 102 -18.581 -13.352 1.312 1.00 33.21 S ATOM 1576 CE MET A 102 -19.931 -12.274 1.856 1.00 13.01 C ATOM 0 H MET A 102 -17.805 -10.089 -2.310 1.00 20.31 H new ATOM 0 HA MET A 102 -19.571 -10.396 0.017 1.00 60.14 H new ATOM 0 HB2 MET A 102 -16.639 -10.863 -0.620 1.00 75.35 H new ATOM 0 HB3 MET A 102 -17.235 -10.867 1.027 1.00 75.35 H new ATOM 0 HG2 MET A 102 -18.751 -12.530 -0.929 1.00 24.12 H new ATOM 0 HG3 MET A 102 -17.124 -13.067 -0.565 1.00 24.12 H new ATOM 0 HE1 MET A 102 -20.410 -12.706 2.735 1.00 13.01 H new ATOM 0 HE2 MET A 102 -19.533 -11.290 2.106 1.00 13.01 H new ATOM 0 HE3 MET A 102 -20.664 -12.176 1.055 1.00 13.01 H new ATOM 1586 N PHE A 103 -18.311 -8.546 1.468 1.00 52.50 N ATOM 1587 CA PHE A 103 -18.164 -7.281 2.179 1.00 24.44 C ATOM 1588 C PHE A 103 -17.314 -7.486 3.430 1.00 64.24 C ATOM 1589 O PHE A 103 -16.993 -8.624 3.773 1.00 23.44 O ATOM 1590 CB PHE A 103 -19.546 -6.699 2.508 1.00 23.23 C ATOM 1591 CG PHE A 103 -20.420 -6.484 1.286 1.00 4.02 C ATOM 1592 CD1 PHE A 103 -20.202 -5.369 0.452 1.00 75.10 C ATOM 1593 CD2 PHE A 103 -21.343 -7.475 0.897 1.00 21.32 C ATOM 1594 CE1 PHE A 103 -20.910 -5.242 -0.756 1.00 74.41 C ATOM 1595 CE2 PHE A 103 -22.045 -7.349 -0.313 1.00 1.33 C ATOM 1596 CZ PHE A 103 -21.829 -6.234 -1.140 1.00 63.54 C ATOM 0 H PHE A 103 -18.399 -9.349 2.091 1.00 52.50 H new ATOM 0 HA PHE A 103 -17.649 -6.559 1.545 1.00 24.44 H new ATOM 0 HB2 PHE A 103 -20.059 -7.369 3.198 1.00 23.23 H new ATOM 0 HB3 PHE A 103 -19.417 -5.748 3.024 1.00 23.23 H new ATOM 0 HD1 PHE A 103 -19.490 -4.611 0.741 1.00 75.10 H new ATOM 0 HD2 PHE A 103 -21.511 -8.333 1.531 1.00 21.32 H new ATOM 0 HE1 PHE A 103 -20.748 -4.382 -1.389 1.00 74.41 H new ATOM 0 HE2 PHE A 103 -22.752 -8.110 -0.608 1.00 1.33 H new ATOM 0 HZ PHE A 103 -22.369 -6.139 -2.071 1.00 63.54 H new ATOM 1606 N ALA A 104 -16.917 -6.372 4.065 1.00 41.41 N ATOM 1607 CA ALA A 104 -15.813 -6.278 5.018 1.00 44.11 C ATOM 1608 C ALA A 104 -15.772 -7.376 6.090 1.00 23.23 C ATOM 1609 O ALA A 104 -14.684 -7.715 6.542 1.00 22.34 O ATOM 1610 CB ALA A 104 -15.756 -4.874 5.630 1.00 51.24 C ATOM 0 H ALA A 104 -17.381 -5.476 3.918 1.00 41.41 H new ATOM 0 HA ALA A 104 -14.909 -6.456 4.436 1.00 44.11 H new ATOM 0 HB1 ALA A 104 -14.929 -4.819 6.338 1.00 51.24 H new ATOM 0 HB2 ALA A 104 -15.607 -4.138 4.840 1.00 51.24 H new ATOM 0 HB3 ALA A 104 -16.692 -4.665 6.148 1.00 51.24 H new ATOM 1616 N TRP A 105 -16.921 -7.941 6.485 1.00 34.40 N ATOM 1617 CA TRP A 105 -16.999 -9.122 7.342 1.00 11.24 C ATOM 1618 C TRP A 105 -16.049 -10.233 6.869 1.00 43.32 C ATOM 1619 O TRP A 105 -15.108 -10.577 7.579 1.00 61.43 O ATOM 1620 CB TRP A 105 -18.452 -9.611 7.397 1.00 62.23 C ATOM 1621 CG TRP A 105 -19.423 -8.590 7.899 1.00 53.31 C ATOM 1622 CD1 TRP A 105 -20.207 -7.802 7.129 1.00 20.32 C ATOM 1623 CD2 TRP A 105 -19.669 -8.176 9.274 1.00 64.41 C ATOM 1624 NE1 TRP A 105 -20.910 -6.921 7.922 1.00 13.14 N ATOM 1625 CE2 TRP A 105 -20.607 -7.102 9.257 1.00 71.21 C ATOM 1626 CE3 TRP A 105 -19.172 -8.574 10.534 1.00 14.54 C ATOM 1627 CZ2 TRP A 105 -21.026 -6.456 10.427 1.00 1.10 C ATOM 1628 CZ3 TRP A 105 -19.599 -7.943 11.718 1.00 21.32 C ATOM 1629 CH2 TRP A 105 -20.524 -6.884 11.666 1.00 51.32 C ATOM 0 H TRP A 105 -17.835 -7.581 6.211 1.00 34.40 H new ATOM 0 HA TRP A 105 -16.677 -8.849 8.347 1.00 11.24 H new ATOM 0 HB2 TRP A 105 -18.756 -9.925 6.399 1.00 62.23 H new ATOM 0 HB3 TRP A 105 -18.504 -10.491 8.038 1.00 62.23 H new ATOM 0 HD1 TRP A 105 -20.273 -7.855 6.052 1.00 20.32 H new ATOM 0 HE1 TRP A 105 -21.568 -6.226 7.569 1.00 13.14 H new ATOM 0 HE3 TRP A 105 -18.452 -9.377 10.591 1.00 14.54 H new ATOM 0 HZ2 TRP A 105 -21.728 -5.637 10.376 1.00 1.10 H new ATOM 0 HZ3 TRP A 105 -19.214 -8.274 12.671 1.00 21.32 H new ATOM 0 HH2 TRP A 105 -20.847 -6.402 12.577 1.00 51.32 H new ATOM 1640 N GLU A 106 -16.285 -10.756 5.658 1.00 71.45 N ATOM 1641 CA GLU A 106 -15.440 -11.741 4.984 1.00 11.54 C ATOM 1642 C GLU A 106 -14.015 -11.212 4.845 1.00 62.41 C ATOM 1643 O GLU A 106 -13.049 -11.909 5.150 1.00 5.40 O ATOM 1644 CB GLU A 106 -16.055 -12.037 3.603 1.00 11.35 C ATOM 1645 CG GLU A 106 -15.126 -12.695 2.564 1.00 64.11 C ATOM 1646 CD GLU A 106 -14.651 -14.102 2.912 1.00 63.23 C ATOM 1647 OE1 GLU A 106 -15.246 -14.711 3.828 1.00 2.11 O ATOM 1648 OE2 GLU A 106 -13.715 -14.556 2.219 1.00 75.33 O ATOM 0 H GLU A 106 -17.100 -10.493 5.104 1.00 71.45 H new ATOM 0 HA GLU A 106 -15.392 -12.660 5.568 1.00 11.54 H new ATOM 0 HB2 GLU A 106 -16.920 -12.685 3.746 1.00 11.35 H new ATOM 0 HB3 GLU A 106 -16.424 -11.100 3.186 1.00 11.35 H new ATOM 0 HG2 GLU A 106 -15.647 -12.732 1.607 1.00 64.11 H new ATOM 0 HG3 GLU A 106 -14.252 -12.058 2.427 1.00 64.11 H new ATOM 1655 N ILE A 107 -13.890 -9.981 4.340 1.00 51.42 N ATOM 1656 CA ILE A 107 -12.605 -9.434 3.936 1.00 0.41 C ATOM 1657 C ILE A 107 -11.669 -9.241 5.143 1.00 35.52 C ATOM 1658 O ILE A 107 -10.450 -9.301 4.992 1.00 64.41 O ATOM 1659 CB ILE A 107 -12.781 -8.138 3.117 1.00 2.23 C ATOM 1660 CG1 ILE A 107 -13.935 -8.121 2.095 1.00 60.51 C ATOM 1661 CG2 ILE A 107 -11.492 -7.890 2.343 1.00 43.31 C ATOM 1662 CD1 ILE A 107 -13.797 -9.136 0.957 1.00 2.12 C ATOM 0 H ILE A 107 -14.675 -9.345 4.203 1.00 51.42 H new ATOM 0 HA ILE A 107 -12.124 -10.160 3.281 1.00 0.41 H new ATOM 0 HB ILE A 107 -13.024 -7.372 3.853 1.00 2.23 H new ATOM 0 HG12 ILE A 107 -14.871 -8.310 2.621 1.00 60.51 H new ATOM 0 HG13 ILE A 107 -14.007 -7.122 1.666 1.00 60.51 H new ATOM 0 HG21 ILE A 107 -11.591 -6.978 1.755 1.00 43.31 H new ATOM 0 HG22 ILE A 107 -10.663 -7.783 3.042 1.00 43.31 H new ATOM 0 HG23 ILE A 107 -11.299 -8.732 1.678 1.00 43.31 H new ATOM 0 HD11 ILE A 107 -14.653 -9.051 0.288 1.00 2.12 H new ATOM 0 HD12 ILE A 107 -12.881 -8.937 0.401 1.00 2.12 H new ATOM 0 HD13 ILE A 107 -13.758 -10.144 1.371 1.00 2.12 H new ATOM 1674 N ARG A 108 -12.228 -9.033 6.342 1.00 34.02 N ATOM 1675 CA ARG A 108 -11.467 -8.902 7.574 1.00 23.31 C ATOM 1676 C ARG A 108 -10.697 -10.191 7.863 1.00 11.14 C ATOM 1677 O ARG A 108 -9.472 -10.164 7.959 1.00 43.21 O ATOM 1678 CB ARG A 108 -12.402 -8.530 8.735 1.00 72.23 C ATOM 1679 CG ARG A 108 -11.606 -8.383 10.035 1.00 33.12 C ATOM 1680 CD ARG A 108 -12.490 -7.911 11.190 1.00 23.44 C ATOM 1681 NE ARG A 108 -11.686 -7.707 12.403 1.00 24.44 N ATOM 1682 CZ ARG A 108 -11.258 -8.676 13.230 1.00 1.35 C ATOM 1683 NH1 ARG A 108 -11.632 -9.950 13.047 1.00 74.13 N ATOM 1684 NH2 ARG A 108 -10.438 -8.366 14.242 1.00 51.41 N ATOM 0 H ARG A 108 -13.236 -8.951 6.477 1.00 34.02 H new ATOM 0 HA ARG A 108 -10.738 -8.100 7.461 1.00 23.31 H new ATOM 0 HB2 ARG A 108 -12.918 -7.597 8.510 1.00 72.23 H new ATOM 0 HB3 ARG A 108 -13.167 -9.297 8.854 1.00 72.23 H new ATOM 0 HG2 ARG A 108 -11.151 -9.339 10.293 1.00 33.12 H new ATOM 0 HG3 ARG A 108 -10.793 -7.673 9.885 1.00 33.12 H new ATOM 0 HD2 ARG A 108 -12.990 -6.981 10.917 1.00 23.44 H new ATOM 0 HD3 ARG A 108 -13.270 -8.647 11.383 1.00 23.44 H new ATOM 0 HE ARG A 108 -11.431 -6.748 12.637 1.00 24.44 H new ATOM 0 HH11 ARG A 108 -12.249 -10.194 12.272 1.00 74.13 H new ATOM 0 HH12 ARG A 108 -11.300 -10.675 13.682 1.00 74.13 H new ATOM 0 HH21 ARG A 108 -10.142 -7.400 14.381 1.00 51.41 H new ATOM 0 HH22 ARG A 108 -10.109 -9.096 14.874 1.00 51.41 H new ATOM 1698 N ASP A 109 -11.408 -11.317 8.007 1.00 34.10 N ATOM 1699 CA ASP A 109 -10.786 -12.600 8.312 1.00 31.25 C ATOM 1700 C ASP A 109 -9.902 -13.096 7.163 1.00 34.34 C ATOM 1701 O ASP A 109 -8.982 -13.873 7.405 1.00 22.11 O ATOM 1702 CB ASP A 109 -11.840 -13.637 8.716 1.00 5.01 C ATOM 1703 CG ASP A 109 -12.836 -13.929 7.599 1.00 65.24 C ATOM 1704 OD1 ASP A 109 -12.481 -14.738 6.716 1.00 55.43 O ATOM 1705 OD2 ASP A 109 -13.935 -13.336 7.658 1.00 23.12 O ATOM 0 H ASP A 109 -12.423 -11.359 7.915 1.00 34.10 H new ATOM 0 HA ASP A 109 -10.126 -12.452 9.167 1.00 31.25 H new ATOM 0 HB2 ASP A 109 -11.342 -14.563 9.004 1.00 5.01 H new ATOM 0 HB3 ASP A 109 -12.379 -13.279 9.593 1.00 5.01 H new ATOM 1710 N ARG A 110 -10.145 -12.626 5.931 1.00 51.35 N ATOM 1711 CA ARG A 110 -9.320 -12.935 4.770 1.00 71.31 C ATOM 1712 C ARG A 110 -7.845 -12.564 4.999 1.00 30.44 C ATOM 1713 O ARG A 110 -6.959 -13.262 4.506 1.00 23.43 O ATOM 1714 CB ARG A 110 -9.895 -12.218 3.544 1.00 24.42 C ATOM 1715 CG ARG A 110 -9.441 -12.806 2.203 1.00 45.41 C ATOM 1716 CD ARG A 110 -10.215 -14.078 1.846 1.00 52.01 C ATOM 1717 NE ARG A 110 -9.975 -14.457 0.446 1.00 55.43 N ATOM 1718 CZ ARG A 110 -10.882 -14.943 -0.420 1.00 74.03 C ATOM 1719 NH1 ARG A 110 -12.162 -15.148 -0.070 1.00 32.13 N ATOM 1720 NH2 ARG A 110 -10.494 -15.231 -1.670 1.00 54.01 N ATOM 0 H ARG A 110 -10.932 -12.013 5.718 1.00 51.35 H new ATOM 0 HA ARG A 110 -9.341 -14.011 4.600 1.00 71.31 H new ATOM 0 HB2 ARG A 110 -10.983 -12.253 3.594 1.00 24.42 H new ATOM 0 HB3 ARG A 110 -9.608 -11.167 3.583 1.00 24.42 H new ATOM 0 HG2 ARG A 110 -9.579 -12.064 1.416 1.00 45.41 H new ATOM 0 HG3 ARG A 110 -8.375 -13.030 2.247 1.00 45.41 H new ATOM 0 HD2 ARG A 110 -9.912 -14.891 2.505 1.00 52.01 H new ATOM 0 HD3 ARG A 110 -11.281 -13.918 2.007 1.00 52.01 H new ATOM 0 HE ARG A 110 -9.024 -14.339 0.096 1.00 55.43 H new ATOM 0 HH11 ARG A 110 -12.472 -14.934 0.878 1.00 32.13 H new ATOM 0 HH12 ARG A 110 -12.824 -15.518 -0.752 1.00 32.13 H new ATOM 0 HH21 ARG A 110 -9.525 -15.081 -1.951 1.00 54.01 H new ATOM 0 HH22 ARG A 110 -11.168 -15.600 -2.341 1.00 54.01 H new ATOM 1734 N LEU A 111 -7.573 -11.495 5.768 1.00 34.51 N ATOM 1735 CA LEU A 111 -6.219 -11.133 6.187 1.00 13.42 C ATOM 1736 C LEU A 111 -5.557 -12.305 6.910 1.00 52.02 C ATOM 1737 O LEU A 111 -4.433 -12.682 6.586 1.00 31.21 O ATOM 1738 CB LEU A 111 -6.234 -9.901 7.105 1.00 25.30 C ATOM 1739 CG LEU A 111 -6.584 -8.609 6.352 1.00 41.42 C ATOM 1740 CD1 LEU A 111 -7.055 -7.524 7.320 1.00 22.04 C ATOM 1741 CD2 LEU A 111 -5.373 -8.064 5.581 1.00 43.04 C ATOM 0 H LEU A 111 -8.292 -10.860 6.114 1.00 34.51 H new ATOM 0 HA LEU A 111 -5.646 -10.890 5.292 1.00 13.42 H new ATOM 0 HB2 LEU A 111 -6.957 -10.058 7.906 1.00 25.30 H new ATOM 0 HB3 LEU A 111 -5.257 -9.790 7.575 1.00 25.30 H new ATOM 0 HG LEU A 111 -7.381 -8.861 5.653 1.00 41.42 H new ATOM 0 HD11 LEU A 111 -7.297 -6.619 6.763 1.00 22.04 H new ATOM 0 HD12 LEU A 111 -7.941 -7.870 7.852 1.00 22.04 H new ATOM 0 HD13 LEU A 111 -6.263 -7.308 8.037 1.00 22.04 H new ATOM 0 HD21 LEU A 111 -5.655 -7.149 5.059 1.00 43.04 H new ATOM 0 HD22 LEU A 111 -4.564 -7.849 6.279 1.00 43.04 H new ATOM 0 HD23 LEU A 111 -5.039 -8.807 4.856 1.00 43.04 H new ATOM 1753 N LEU A 112 -6.262 -12.876 7.892 1.00 71.42 N ATOM 1754 CA LEU A 112 -5.778 -13.986 8.698 1.00 31.23 C ATOM 1755 C LEU A 112 -5.699 -15.272 7.874 1.00 31.42 C ATOM 1756 O LEU A 112 -4.780 -16.064 8.073 1.00 43.53 O ATOM 1757 CB LEU A 112 -6.669 -14.171 9.935 1.00 52.20 C ATOM 1758 CG LEU A 112 -6.847 -12.893 10.776 1.00 72.02 C ATOM 1759 CD1 LEU A 112 -7.677 -13.221 12.022 1.00 11.11 C ATOM 1760 CD2 LEU A 112 -5.502 -12.301 11.209 1.00 22.43 C ATOM 0 H LEU A 112 -7.201 -12.570 8.148 1.00 71.42 H new ATOM 0 HA LEU A 112 -4.768 -13.753 9.035 1.00 31.23 H new ATOM 0 HB2 LEU A 112 -7.650 -14.522 9.614 1.00 52.20 H new ATOM 0 HB3 LEU A 112 -6.241 -14.951 10.565 1.00 52.20 H new ATOM 0 HG LEU A 112 -7.356 -12.153 10.158 1.00 72.02 H new ATOM 0 HD11 LEU A 112 -7.806 -12.319 12.621 1.00 11.11 H new ATOM 0 HD12 LEU A 112 -8.654 -13.599 11.720 1.00 11.11 H new ATOM 0 HD13 LEU A 112 -7.162 -13.979 12.613 1.00 11.11 H new ATOM 0 HD21 LEU A 112 -5.674 -11.401 11.800 1.00 22.43 H new ATOM 0 HD22 LEU A 112 -4.959 -13.031 11.809 1.00 22.43 H new ATOM 0 HD23 LEU A 112 -4.914 -12.049 10.326 1.00 22.43 H new ATOM 1772 N ALA A 113 -6.637 -15.472 6.940 1.00 42.22 N ATOM 1773 CA ALA A 113 -6.638 -16.615 6.039 1.00 44.11 C ATOM 1774 C ALA A 113 -5.373 -16.627 5.175 1.00 51.25 C ATOM 1775 O ALA A 113 -4.764 -17.681 5.000 1.00 23.04 O ATOM 1776 CB ALA A 113 -7.900 -16.606 5.173 1.00 73.35 C ATOM 0 H ALA A 113 -7.420 -14.836 6.793 1.00 42.22 H new ATOM 0 HA ALA A 113 -6.640 -17.528 6.634 1.00 44.11 H new ATOM 0 HB1 ALA A 113 -7.888 -17.466 4.504 1.00 73.35 H new ATOM 0 HB2 ALA A 113 -8.781 -16.656 5.813 1.00 73.35 H new ATOM 0 HB3 ALA A 113 -7.931 -15.689 4.585 1.00 73.35 H new ATOM 1782 N GLU A 114 -4.961 -15.457 4.664 1.00 45.11 N ATOM 1783 CA GLU A 114 -3.715 -15.308 3.925 1.00 13.20 C ATOM 1784 C GLU A 114 -2.510 -15.385 4.875 1.00 21.21 C ATOM 1785 O GLU A 114 -1.447 -15.862 4.480 1.00 55.35 O ATOM 1786 CB GLU A 114 -3.760 -14.005 3.116 1.00 43.42 C ATOM 1787 CG GLU A 114 -2.521 -13.851 2.222 1.00 12.31 C ATOM 1788 CD GLU A 114 -2.657 -12.670 1.267 1.00 63.12 C ATOM 1789 OE1 GLU A 114 -2.393 -11.536 1.721 1.00 13.45 O ATOM 1790 OE2 GLU A 114 -3.039 -12.913 0.103 1.00 41.30 O ATOM 0 H GLU A 114 -5.490 -14.590 4.756 1.00 45.11 H new ATOM 0 HA GLU A 114 -3.596 -16.130 3.219 1.00 13.20 H new ATOM 0 HB2 GLU A 114 -4.659 -13.990 2.499 1.00 43.42 H new ATOM 0 HB3 GLU A 114 -3.826 -13.156 3.796 1.00 43.42 H new ATOM 0 HG2 GLU A 114 -1.637 -13.715 2.845 1.00 12.31 H new ATOM 0 HG3 GLU A 114 -2.369 -14.766 1.650 1.00 12.31 H new ATOM 1797 N GLY A 115 -2.681 -14.942 6.128 1.00 24.43 N ATOM 1798 CA GLY A 115 -1.681 -15.027 7.184 1.00 11.34 C ATOM 1799 C GLY A 115 -0.899 -13.722 7.319 1.00 61.31 C ATOM 1800 O GLY A 115 0.288 -13.743 7.643 1.00 40.13 O ATOM 0 H GLY A 115 -3.548 -14.502 6.437 1.00 24.43 H new ATOM 0 HA2 GLY A 115 -2.169 -15.260 8.131 1.00 11.34 H new ATOM 0 HA3 GLY A 115 -0.993 -15.845 6.970 1.00 11.34 H new ATOM 1804 N VAL A 116 -1.571 -12.589 7.090 1.00 53.44 N ATOM 1805 CA VAL A 116 -0.985 -11.259 7.135 1.00 74.31 C ATOM 1806 C VAL A 116 -0.956 -10.782 8.584 1.00 40.52 C ATOM 1807 O VAL A 116 0.115 -10.562 9.147 1.00 24.13 O ATOM 1808 CB VAL A 116 -1.792 -10.312 6.225 1.00 11.21 C ATOM 1809 CG1 VAL A 116 -1.202 -8.896 6.218 1.00 13.23 C ATOM 1810 CG2 VAL A 116 -1.813 -10.839 4.786 1.00 51.31 C ATOM 0 H VAL A 116 -2.565 -12.579 6.862 1.00 53.44 H new ATOM 0 HA VAL A 116 0.040 -11.273 6.764 1.00 74.31 H new ATOM 0 HB VAL A 116 -2.805 -10.272 6.625 1.00 11.21 H new ATOM 0 HG11 VAL A 116 -1.797 -8.257 5.566 1.00 13.23 H new ATOM 0 HG12 VAL A 116 -1.213 -8.492 7.230 1.00 13.23 H new ATOM 0 HG13 VAL A 116 -0.176 -8.931 5.853 1.00 13.23 H new ATOM 0 HG21 VAL A 116 -2.387 -10.158 4.158 1.00 51.31 H new ATOM 0 HG22 VAL A 116 -0.793 -10.908 4.409 1.00 51.31 H new ATOM 0 HG23 VAL A 116 -2.274 -11.826 4.767 1.00 51.31 H new ATOM 1820 N CYS A 117 -2.142 -10.638 9.181 1.00 30.43 N ATOM 1821 CA CYS A 117 -2.348 -10.054 10.499 1.00 63.35 C ATOM 1822 C CYS A 117 -2.460 -11.152 11.567 1.00 21.04 C ATOM 1823 O CYS A 117 -2.120 -12.306 11.305 1.00 61.03 O ATOM 1824 CB CYS A 117 -3.589 -9.156 10.411 1.00 51.24 C ATOM 1825 SG CYS A 117 -3.243 -7.742 9.328 1.00 72.13 S ATOM 0 H CYS A 117 -3.012 -10.937 8.741 1.00 30.43 H new ATOM 0 HA CYS A 117 -1.498 -9.445 10.806 1.00 63.35 H new ATOM 0 HB2 CYS A 117 -4.435 -9.725 10.024 1.00 51.24 H new ATOM 0 HB3 CYS A 117 -3.868 -8.806 11.405 1.00 51.24 H new ATOM 0 HG CYS A 117 -3.583 -6.641 9.930 1.00 72.13 H new ATOM 1831 N ASP A 118 -2.913 -10.783 12.776 1.00 41.52 N ATOM 1832 CA ASP A 118 -3.086 -11.675 13.920 1.00 71.41 C ATOM 1833 C ASP A 118 -4.395 -11.354 14.652 1.00 14.42 C ATOM 1834 O ASP A 118 -5.357 -12.112 14.542 1.00 11.20 O ATOM 1835 CB ASP A 118 -1.866 -11.572 14.848 1.00 4.44 C ATOM 1836 CG ASP A 118 -2.065 -12.362 16.138 1.00 31.41 C ATOM 1837 OD1 ASP A 118 -1.972 -13.606 16.060 1.00 35.34 O ATOM 1838 OD2 ASP A 118 -2.311 -11.706 17.172 1.00 5.30 O ATOM 0 H ASP A 118 -3.176 -9.820 12.985 1.00 41.52 H new ATOM 0 HA ASP A 118 -3.155 -12.706 13.573 1.00 71.41 H new ATOM 0 HB2 ASP A 118 -0.982 -11.942 14.328 1.00 4.44 H new ATOM 0 HB3 ASP A 118 -1.680 -10.525 15.088 1.00 4.44 H new ATOM 1843 N ASN A 119 -4.424 -10.247 15.408 1.00 21.11 N ATOM 1844 CA ASN A 119 -5.545 -9.877 16.269 1.00 24.34 C ATOM 1845 C ASN A 119 -5.691 -8.356 16.400 1.00 24.10 C ATOM 1846 O ASN A 119 -6.757 -7.820 16.103 1.00 11.42 O ATOM 1847 CB ASN A 119 -5.398 -10.542 17.643 1.00 30.33 C ATOM 1848 CG ASN A 119 -6.629 -10.278 18.507 1.00 21.03 C ATOM 1849 OD1 ASN A 119 -6.599 -9.437 19.403 1.00 11.33 O ATOM 1850 ND2 ASN A 119 -7.723 -10.992 18.235 1.00 65.44 N ATOM 0 H ASN A 119 -3.655 -9.577 15.435 1.00 21.11 H new ATOM 0 HA ASN A 119 -6.460 -10.240 15.802 1.00 24.34 H new ATOM 0 HB2 ASN A 119 -5.258 -11.616 17.519 1.00 30.33 H new ATOM 0 HB3 ASN A 119 -4.508 -10.160 18.144 1.00 30.33 H new ATOM 0 HD21 ASN A 119 -8.574 -10.849 18.779 1.00 65.44 H new ATOM 0 HD22 ASN A 119 -7.708 -11.681 17.483 1.00 65.44 H new ATOM 1857 N ASP A 120 -4.636 -7.656 16.838 1.00 74.03 N ATOM 1858 CA ASP A 120 -4.627 -6.200 16.927 1.00 34.11 C ATOM 1859 C ASP A 120 -4.435 -5.621 15.529 1.00 22.34 C ATOM 1860 O ASP A 120 -5.089 -4.653 15.143 1.00 75.34 O ATOM 1861 CB ASP A 120 -3.490 -5.738 17.845 1.00 45.54 C ATOM 1862 CG ASP A 120 -3.655 -6.252 19.271 1.00 44.42 C ATOM 1863 OD1 ASP A 120 -3.219 -7.398 19.513 1.00 64.22 O ATOM 1864 OD2 ASP A 120 -4.211 -5.490 20.091 1.00 75.34 O ATOM 0 H ASP A 120 -3.764 -8.091 17.140 1.00 74.03 H new ATOM 0 HA ASP A 120 -5.573 -5.852 17.343 1.00 34.11 H new ATOM 0 HB2 ASP A 120 -2.538 -6.085 17.444 1.00 45.54 H new ATOM 0 HB3 ASP A 120 -3.454 -4.649 17.855 1.00 45.54 H new ATOM 1869 N THR A 121 -3.514 -6.238 14.785 1.00 70.11 N ATOM 1870 CA THR A 121 -3.097 -5.836 13.456 1.00 5.31 C ATOM 1871 C THR A 121 -4.235 -5.949 12.436 1.00 63.22 C ATOM 1872 O THR A 121 -4.287 -5.158 11.495 1.00 23.21 O ATOM 1873 CB THR A 121 -1.866 -6.659 13.048 1.00 12.02 C ATOM 1874 OG1 THR A 121 -2.154 -8.040 13.075 1.00 25.53 O ATOM 1875 CG2 THR A 121 -0.695 -6.400 13.999 1.00 31.12 C ATOM 0 H THR A 121 -3.021 -7.068 15.115 1.00 70.11 H new ATOM 0 HA THR A 121 -2.825 -4.781 13.473 1.00 5.31 H new ATOM 0 HB THR A 121 -1.598 -6.353 12.037 1.00 12.02 H new ATOM 0 HG1 THR A 121 -1.357 -8.546 12.810 1.00 25.53 H new ATOM 0 HG21 THR A 121 0.164 -6.994 13.689 1.00 31.12 H new ATOM 0 HG22 THR A 121 -0.433 -5.342 13.974 1.00 31.12 H new ATOM 0 HG23 THR A 121 -0.981 -6.678 15.013 1.00 31.12 H new ATOM 1883 N VAL A 122 -5.154 -6.910 12.623 1.00 55.42 N ATOM 1884 CA VAL A 122 -6.349 -7.038 11.798 1.00 52.43 C ATOM 1885 C VAL A 122 -7.342 -5.942 12.216 1.00 1.53 C ATOM 1886 O VAL A 122 -7.741 -5.895 13.380 1.00 63.11 O ATOM 1887 CB VAL A 122 -6.928 -8.469 11.845 1.00 50.33 C ATOM 1888 CG1 VAL A 122 -7.121 -9.027 13.254 1.00 3.15 C ATOM 1889 CG2 VAL A 122 -8.250 -8.578 11.078 1.00 33.34 C ATOM 0 H VAL A 122 -5.082 -7.618 13.354 1.00 55.42 H new ATOM 0 HA VAL A 122 -6.105 -6.886 10.747 1.00 52.43 H new ATOM 0 HB VAL A 122 -6.165 -9.078 11.359 1.00 50.33 H new ATOM 0 HG11 VAL A 122 -7.531 -10.035 13.193 1.00 3.15 H new ATOM 0 HG12 VAL A 122 -6.160 -9.056 13.768 1.00 3.15 H new ATOM 0 HG13 VAL A 122 -7.809 -8.388 13.807 1.00 3.15 H new ATOM 0 HG21 VAL A 122 -8.622 -9.601 11.137 1.00 33.34 H new ATOM 0 HG22 VAL A 122 -8.982 -7.900 11.517 1.00 33.34 H new ATOM 0 HG23 VAL A 122 -8.088 -8.311 10.034 1.00 33.34 H new ATOM 1899 N PRO A 123 -7.723 -5.034 11.301 1.00 62.12 N ATOM 1900 CA PRO A 123 -8.536 -3.868 11.609 1.00 10.01 C ATOM 1901 C PRO A 123 -9.997 -4.275 11.808 1.00 34.11 C ATOM 1902 O PRO A 123 -10.391 -5.389 11.467 1.00 61.24 O ATOM 1903 CB PRO A 123 -8.382 -2.950 10.393 1.00 10.02 C ATOM 1904 CG PRO A 123 -8.235 -3.950 9.248 1.00 73.03 C ATOM 1905 CD PRO A 123 -7.406 -5.060 9.884 1.00 5.32 C ATOM 0 HA PRO A 123 -8.225 -3.375 12.530 1.00 10.01 H new ATOM 0 HB2 PRO A 123 -9.249 -2.303 10.259 1.00 10.02 H new ATOM 0 HB3 PRO A 123 -7.511 -2.301 10.481 1.00 10.02 H new ATOM 0 HG2 PRO A 123 -9.202 -4.314 8.900 1.00 73.03 H new ATOM 0 HG3 PRO A 123 -7.732 -3.510 8.387 1.00 73.03 H new ATOM 0 HD2 PRO A 123 -7.650 -6.028 9.447 1.00 5.32 H new ATOM 0 HD3 PRO A 123 -6.341 -4.895 9.719 1.00 5.32 H new ATOM 1913 N SER A 124 -10.806 -3.359 12.348 1.00 73.01 N ATOM 1914 CA SER A 124 -12.229 -3.591 12.526 1.00 40.43 C ATOM 1915 C SER A 124 -12.936 -3.627 11.170 1.00 13.33 C ATOM 1916 O SER A 124 -12.532 -2.940 10.231 1.00 31.40 O ATOM 1917 CB SER A 124 -12.830 -2.513 13.435 1.00 24.44 C ATOM 1918 OG SER A 124 -12.691 -1.231 12.872 1.00 43.44 O ATOM 0 H SER A 124 -10.489 -2.444 12.670 1.00 73.01 H new ATOM 0 HA SER A 124 -12.373 -4.559 13.006 1.00 40.43 H new ATOM 0 HB2 SER A 124 -13.886 -2.725 13.605 1.00 24.44 H new ATOM 0 HB3 SER A 124 -12.339 -2.540 14.408 1.00 24.44 H new ATOM 0 HG SER A 124 -13.085 -0.565 13.473 1.00 43.44 H new ATOM 1924 N VAL A 125 -14.019 -4.410 11.088 1.00 40.20 N ATOM 1925 CA VAL A 125 -14.932 -4.415 9.952 1.00 71.43 C ATOM 1926 C VAL A 125 -15.401 -2.988 9.650 1.00 31.42 C ATOM 1927 O VAL A 125 -15.443 -2.571 8.493 1.00 32.42 O ATOM 1928 CB VAL A 125 -16.101 -5.378 10.238 1.00 72.51 C ATOM 1929 CG1 VAL A 125 -16.942 -5.002 11.467 1.00 3.12 C ATOM 1930 CG2 VAL A 125 -17.028 -5.481 9.025 1.00 44.14 C ATOM 0 H VAL A 125 -14.284 -5.065 11.823 1.00 40.20 H new ATOM 0 HA VAL A 125 -14.422 -4.776 9.059 1.00 71.43 H new ATOM 0 HB VAL A 125 -15.629 -6.337 10.451 1.00 72.51 H new ATOM 0 HG11 VAL A 125 -17.742 -5.730 11.597 1.00 3.12 H new ATOM 0 HG12 VAL A 125 -16.308 -4.997 12.354 1.00 3.12 H new ATOM 0 HG13 VAL A 125 -17.373 -4.011 11.324 1.00 3.12 H new ATOM 0 HG21 VAL A 125 -17.846 -6.166 9.249 1.00 44.14 H new ATOM 0 HG22 VAL A 125 -17.433 -4.496 8.792 1.00 44.14 H new ATOM 0 HG23 VAL A 125 -16.467 -5.854 8.169 1.00 44.14 H new ATOM 1940 N SER A 126 -15.714 -2.240 10.714 1.00 63.32 N ATOM 1941 CA SER A 126 -16.158 -0.861 10.662 1.00 4.35 C ATOM 1942 C SER A 126 -15.095 0.049 10.051 1.00 35.12 C ATOM 1943 O SER A 126 -15.440 0.915 9.253 1.00 62.55 O ATOM 1944 CB SER A 126 -16.522 -0.400 12.076 1.00 3.32 C ATOM 1945 OG SER A 126 -17.428 -1.309 12.665 1.00 13.40 O ATOM 0 H SER A 126 -15.660 -2.601 11.666 1.00 63.32 H new ATOM 0 HA SER A 126 -17.036 -0.799 10.020 1.00 4.35 H new ATOM 0 HB2 SER A 126 -15.622 -0.326 12.686 1.00 3.32 H new ATOM 0 HB3 SER A 126 -16.965 0.595 12.040 1.00 3.32 H new ATOM 0 HG SER A 126 -17.653 -1.006 13.569 1.00 13.40 H new ATOM 1951 N SER A 127 -13.818 -0.125 10.426 1.00 14.21 N ATOM 1952 CA SER A 127 -12.736 0.735 9.968 1.00 74.33 C ATOM 1953 C SER A 127 -12.660 0.757 8.443 1.00 53.21 C ATOM 1954 O SER A 127 -12.879 1.810 7.848 1.00 21.42 O ATOM 1955 CB SER A 127 -11.398 0.326 10.597 1.00 30.11 C ATOM 1956 OG SER A 127 -10.346 1.124 10.099 1.00 25.41 O ATOM 0 H SER A 127 -13.515 -0.868 11.055 1.00 14.21 H new ATOM 0 HA SER A 127 -12.952 1.751 10.298 1.00 74.33 H new ATOM 0 HB2 SER A 127 -11.455 0.426 11.681 1.00 30.11 H new ATOM 0 HB3 SER A 127 -11.197 -0.724 10.384 1.00 30.11 H new ATOM 0 HG SER A 127 -9.502 0.848 10.514 1.00 25.41 H new ATOM 1962 N ILE A 128 -12.344 -0.378 7.803 1.00 34.22 N ATOM 1963 CA ILE A 128 -12.056 -0.360 6.370 1.00 60.50 C ATOM 1964 C ILE A 128 -13.312 -0.028 5.569 1.00 5.22 C ATOM 1965 O ILE A 128 -13.227 0.658 4.554 1.00 33.34 O ATOM 1966 CB ILE A 128 -11.322 -1.619 5.865 1.00 73.11 C ATOM 1967 CG1 ILE A 128 -10.263 -2.132 6.855 1.00 2.30 C ATOM 1968 CG2 ILE A 128 -10.665 -1.271 4.518 1.00 2.22 C ATOM 1969 CD1 ILE A 128 -9.292 -1.033 7.283 1.00 51.52 C ATOM 0 H ILE A 128 -12.283 -1.295 8.245 1.00 34.22 H new ATOM 0 HA ILE A 128 -11.340 0.444 6.201 1.00 60.50 H new ATOM 0 HB ILE A 128 -12.049 -2.424 5.756 1.00 73.11 H new ATOM 0 HG12 ILE A 128 -10.759 -2.539 7.736 1.00 2.30 H new ATOM 0 HG13 ILE A 128 -9.705 -2.949 6.397 1.00 2.30 H new ATOM 0 HG21 ILE A 128 -10.137 -2.144 4.135 1.00 2.22 H new ATOM 0 HG22 ILE A 128 -11.433 -0.970 3.806 1.00 2.22 H new ATOM 0 HG23 ILE A 128 -9.959 -0.452 4.658 1.00 2.22 H new ATOM 0 HD11 ILE A 128 -8.563 -1.443 7.982 1.00 51.52 H new ATOM 0 HD12 ILE A 128 -8.775 -0.643 6.406 1.00 51.52 H new ATOM 0 HD13 ILE A 128 -9.845 -0.227 7.766 1.00 51.52 H new ATOM 1981 N ASN A 129 -14.480 -0.443 6.069 1.00 55.44 N ATOM 1982 CA ASN A 129 -15.760 -0.004 5.529 1.00 74.32 C ATOM 1983 C ASN A 129 -15.846 1.527 5.512 1.00 41.55 C ATOM 1984 O ASN A 129 -16.048 2.113 4.453 1.00 71.11 O ATOM 1985 CB ASN A 129 -16.916 -0.617 6.327 1.00 50.51 C ATOM 1986 CG ASN A 129 -18.261 -0.044 5.877 1.00 74.12 C ATOM 1987 OD1 ASN A 129 -18.736 -0.343 4.784 1.00 32.02 O ATOM 1988 ND2 ASN A 129 -18.869 0.800 6.712 1.00 24.14 N ATOM 0 H ASN A 129 -14.560 -1.089 6.855 1.00 55.44 H new ATOM 0 HA ASN A 129 -15.840 -0.352 4.499 1.00 74.32 H new ATOM 0 HB2 ASN A 129 -16.917 -1.699 6.198 1.00 50.51 H new ATOM 0 HB3 ASN A 129 -16.772 -0.423 7.390 1.00 50.51 H new ATOM 0 HD21 ASN A 129 -19.760 1.222 6.451 1.00 24.14 H new ATOM 0 HD22 ASN A 129 -18.443 1.023 7.611 1.00 24.14 H new ATOM 1995 N ARG A 130 -15.693 2.171 6.675 1.00 63.15 N ATOM 1996 CA ARG A 130 -15.800 3.619 6.824 1.00 61.22 C ATOM 1997 C ARG A 130 -14.783 4.352 5.949 1.00 13.10 C ATOM 1998 O ARG A 130 -15.113 5.369 5.344 1.00 30.31 O ATOM 1999 CB ARG A 130 -15.624 4.013 8.301 1.00 51.30 C ATOM 2000 CG ARG A 130 -16.834 3.638 9.170 1.00 71.00 C ATOM 2001 CD ARG A 130 -17.857 4.773 9.316 1.00 5.54 C ATOM 2002 NE ARG A 130 -18.393 5.219 8.021 1.00 72.01 N ATOM 2003 CZ ARG A 130 -18.063 6.346 7.363 1.00 24.53 C ATOM 2004 NH1 ARG A 130 -17.173 7.215 7.864 1.00 41.02 N ATOM 2005 NH2 ARG A 130 -18.634 6.603 6.179 1.00 62.32 N ATOM 0 H ARG A 130 -15.488 1.689 7.550 1.00 63.15 H new ATOM 0 HA ARG A 130 -16.794 3.918 6.491 1.00 61.22 H new ATOM 0 HB2 ARG A 130 -14.734 3.525 8.698 1.00 51.30 H new ATOM 0 HB3 ARG A 130 -15.455 5.088 8.367 1.00 51.30 H new ATOM 0 HG2 ARG A 130 -17.327 2.768 8.736 1.00 71.00 H new ATOM 0 HG3 ARG A 130 -16.484 3.345 10.160 1.00 71.00 H new ATOM 0 HD2 ARG A 130 -18.678 4.438 9.949 1.00 5.54 H new ATOM 0 HD3 ARG A 130 -17.388 5.617 9.822 1.00 5.54 H new ATOM 0 HE ARG A 130 -19.084 4.614 7.577 1.00 72.01 H new ATOM 0 HH11 ARG A 130 -16.729 7.029 8.763 1.00 41.02 H new ATOM 0 HH12 ARG A 130 -16.940 8.062 7.346 1.00 41.02 H new ATOM 0 HH21 ARG A 130 -19.310 5.948 5.786 1.00 62.32 H new ATOM 0 HH22 ARG A 130 -18.393 7.453 5.670 1.00 62.32 H new ATOM 2019 N ILE A 131 -13.553 3.835 5.875 1.00 43.21 N ATOM 2020 CA ILE A 131 -12.491 4.394 5.054 1.00 3.51 C ATOM 2021 C ILE A 131 -12.914 4.358 3.577 1.00 14.42 C ATOM 2022 O ILE A 131 -12.979 5.402 2.936 1.00 33.41 O ATOM 2023 CB ILE A 131 -11.176 3.654 5.366 1.00 32.23 C ATOM 2024 CG1 ILE A 131 -10.723 4.003 6.801 1.00 13.41 C ATOM 2025 CG2 ILE A 131 -10.068 4.024 4.372 1.00 63.44 C ATOM 2026 CD1 ILE A 131 -9.792 2.952 7.416 1.00 13.13 C ATOM 0 H ILE A 131 -13.269 3.004 6.394 1.00 43.21 H new ATOM 0 HA ILE A 131 -12.311 5.444 5.283 1.00 3.51 H new ATOM 0 HB ILE A 131 -11.359 2.583 5.277 1.00 32.23 H new ATOM 0 HG12 ILE A 131 -10.214 4.967 6.789 1.00 13.41 H new ATOM 0 HG13 ILE A 131 -11.603 4.115 7.435 1.00 13.41 H new ATOM 0 HG21 ILE A 131 -9.157 3.482 4.625 1.00 63.44 H new ATOM 0 HG22 ILE A 131 -10.381 3.757 3.363 1.00 63.44 H new ATOM 0 HG23 ILE A 131 -9.878 5.096 4.421 1.00 63.44 H new ATOM 0 HD11 ILE A 131 -9.512 3.259 8.424 1.00 13.13 H new ATOM 0 HD12 ILE A 131 -10.306 1.992 7.459 1.00 13.13 H new ATOM 0 HD13 ILE A 131 -8.895 2.857 6.803 1.00 13.13 H new ATOM 2038 N ILE A 132 -13.247 3.175 3.047 1.00 64.45 N ATOM 2039 CA ILE A 132 -13.710 2.996 1.671 1.00 35.22 C ATOM 2040 C ILE A 132 -14.926 3.885 1.366 1.00 34.44 C ATOM 2041 O ILE A 132 -14.996 4.464 0.285 1.00 31.12 O ATOM 2042 CB ILE A 132 -13.994 1.504 1.397 1.00 64.40 C ATOM 2043 CG1 ILE A 132 -12.712 0.646 1.443 1.00 64.01 C ATOM 2044 CG2 ILE A 132 -14.729 1.289 0.066 1.00 73.14 C ATOM 2045 CD1 ILE A 132 -11.774 0.804 0.241 1.00 61.35 C ATOM 0 H ILE A 132 -13.201 2.302 3.573 1.00 64.45 H new ATOM 0 HA ILE A 132 -12.919 3.315 0.993 1.00 35.22 H new ATOM 0 HB ILE A 132 -14.649 1.173 2.203 1.00 64.40 H new ATOM 0 HG12 ILE A 132 -12.160 0.896 2.349 1.00 64.01 H new ATOM 0 HG13 ILE A 132 -12.999 -0.402 1.523 1.00 64.01 H new ATOM 0 HG21 ILE A 132 -14.907 0.224 -0.083 1.00 73.14 H new ATOM 0 HG22 ILE A 132 -15.683 1.817 0.088 1.00 73.14 H new ATOM 0 HG23 ILE A 132 -14.120 1.673 -0.752 1.00 73.14 H new ATOM 0 HD11 ILE A 132 -10.905 0.159 0.371 1.00 61.35 H new ATOM 0 HD12 ILE A 132 -12.301 0.523 -0.671 1.00 61.35 H new ATOM 0 HD13 ILE A 132 -11.449 1.842 0.167 1.00 61.35 H new ATOM 2057 N ARG A 133 -15.872 4.013 2.305 1.00 62.54 N ATOM 2058 CA ARG A 133 -17.030 4.886 2.156 1.00 3.40 C ATOM 2059 C ARG A 133 -16.588 6.348 2.009 1.00 62.31 C ATOM 2060 O ARG A 133 -16.982 7.016 1.057 1.00 10.42 O ATOM 2061 CB ARG A 133 -17.989 4.700 3.344 1.00 0.45 C ATOM 2062 CG ARG A 133 -18.715 3.343 3.338 1.00 64.41 C ATOM 2063 CD ARG A 133 -19.922 3.336 2.395 1.00 1.12 C ATOM 2064 NE ARG A 133 -20.565 2.017 2.350 1.00 2.23 N ATOM 2065 CZ ARG A 133 -21.598 1.703 1.548 1.00 35.12 C ATOM 2066 NH1 ARG A 133 -22.160 2.633 0.763 1.00 71.05 N ATOM 2067 NH2 ARG A 133 -22.069 0.449 1.532 1.00 64.43 N ATOM 0 H ARG A 133 -15.850 3.509 3.192 1.00 62.54 H new ATOM 0 HA ARG A 133 -17.566 4.614 1.247 1.00 3.40 H new ATOM 0 HB2 ARG A 133 -17.428 4.799 4.273 1.00 0.45 H new ATOM 0 HB3 ARG A 133 -18.730 5.500 3.332 1.00 0.45 H new ATOM 0 HG2 ARG A 133 -18.017 2.561 3.038 1.00 64.41 H new ATOM 0 HG3 ARG A 133 -19.045 3.105 4.349 1.00 64.41 H new ATOM 0 HD2 ARG A 133 -20.645 4.083 2.723 1.00 1.12 H new ATOM 0 HD3 ARG A 133 -19.603 3.620 1.392 1.00 1.12 H new ATOM 0 HE ARG A 133 -20.204 1.290 2.968 1.00 2.23 H new ATOM 0 HH11 ARG A 133 -21.805 3.589 0.770 1.00 71.05 H new ATOM 0 HH12 ARG A 133 -22.943 2.385 0.158 1.00 71.05 H new ATOM 0 HH21 ARG A 133 -21.644 -0.263 2.126 1.00 64.43 H new ATOM 0 HH22 ARG A 133 -22.852 0.206 0.925 1.00 64.43 H new ATOM 2081 N THR A 134 -15.756 6.851 2.928 1.00 60.10 N ATOM 2082 CA THR A 134 -15.265 8.226 2.863 1.00 73.11 C ATOM 2083 C THR A 134 -14.453 8.498 1.590 1.00 25.22 C ATOM 2084 O THR A 134 -14.459 9.631 1.113 1.00 62.24 O ATOM 2085 CB THR A 134 -14.497 8.613 4.136 1.00 71.55 C ATOM 2086 OG1 THR A 134 -13.480 7.680 4.428 1.00 14.43 O ATOM 2087 CG2 THR A 134 -15.444 8.721 5.333 1.00 12.02 C ATOM 0 H THR A 134 -15.409 6.321 3.728 1.00 60.10 H new ATOM 0 HA THR A 134 -16.141 8.872 2.808 1.00 73.11 H new ATOM 0 HB THR A 134 -14.038 9.584 3.951 1.00 71.55 H new ATOM 0 HG1 THR A 134 -13.465 6.985 3.737 1.00 14.43 H new ATOM 0 HG21 THR A 134 -14.877 8.996 6.222 1.00 12.02 H new ATOM 0 HG22 THR A 134 -16.197 9.483 5.133 1.00 12.02 H new ATOM 0 HG23 THR A 134 -15.933 7.761 5.497 1.00 12.02 H new