USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 780 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 SER OG : rot -130:sc= 0.963 USER MOD Set 1.2: A 132 LYS NZ :NH3+ -176:sc= 1.4 (180deg=0.378) USER MOD Single : A 5 THR OG1 : rot 48:sc= 0.278 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot -75:sc= 0.146 USER MOD Single : A 11 THR OG1 : rot 47:sc= 1.24 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -1.77 K(o=-1.8,f=-0.86) USER MOD Single : A 19 GLN : amide:sc= -0.0144 K(o=-0.014,f=-1.2) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -104:sc= -3.64! (180deg=-6.11!) USER MOD Single : A 31 LYS NZ :NH3+ -125:sc= 0.186 (180deg=-2.08!) USER MOD Single : A 33 HIS : no HE2:sc= 1.12 K(o=1.1,f=-5!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 161:sc= -0.0523 (180deg=-0.336) USER MOD Single : A 42 ASN : amide:sc= -0.0347 K(o=-0.035,f=-1.4!) USER MOD Single : A 47 THR OG1 : rot -144:sc= 0.531 USER MOD Single : A 48 MET CE :methyl -121:sc= -0.251 (180deg=-1.26) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 71 LYS NZ :NH3+ 151:sc= 1.26 (180deg=0.417) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 30:sc= 0.0621 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -0.111 K(o=-0.11,f=-8.2!) USER MOD Single : A 124 ASN : amide:sc= -0.358 K(o=-0.36,f=-5.1!) USER MOD Single : A 126 TYR OH : rot -153:sc= 1.26 USER MOD Single : A 129 MET CE :methyl -116:sc= -1.41 (180deg=-2.26!) USER MOD Single : A 130 LYS NZ :NH3+ -108:sc= 0.355 (180deg=-0.11) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 3 -12.598 15.592 -2.451 1.00 25.44 N ATOM 33 CA ASP A 3 -11.872 14.644 -3.301 1.00 50.20 C ATOM 34 C ASP A 3 -12.779 13.544 -3.827 1.00 1.41 C ATOM 35 O ASP A 3 -12.875 12.467 -3.240 1.00 35.21 O ATOM 36 CB ASP A 3 -10.678 14.018 -2.574 1.00 55.31 C ATOM 37 CG ASP A 3 -9.700 15.045 -2.048 1.00 24.12 C ATOM 38 OD1 ASP A 3 -9.360 15.992 -2.788 1.00 14.31 O ATOM 39 OD2 ASP A 3 -9.276 14.911 -0.885 1.00 42.20 O ATOM 0 HA ASP A 3 -11.499 15.223 -4.146 1.00 50.20 H new ATOM 0 HB2 ASP A 3 -11.042 13.413 -1.744 1.00 55.31 H new ATOM 0 HB3 ASP A 3 -10.158 13.345 -3.255 1.00 55.31 H new ATOM 44 N ARG A 4 -13.450 13.824 -4.933 1.00 34.51 N ATOM 45 CA ARG A 4 -14.304 12.838 -5.578 1.00 20.34 C ATOM 46 C ARG A 4 -13.751 12.490 -6.951 1.00 41.13 C ATOM 47 O ARG A 4 -14.353 11.733 -7.713 1.00 31.44 O ATOM 48 CB ARG A 4 -15.732 13.375 -5.699 1.00 2.55 C ATOM 49 CG ARG A 4 -16.342 13.758 -4.364 1.00 63.25 C ATOM 50 CD ARG A 4 -17.741 14.327 -4.525 1.00 14.45 C ATOM 51 NE ARG A 4 -18.302 14.734 -3.242 1.00 53.24 N ATOM 52 CZ ARG A 4 -19.502 15.287 -3.085 1.00 50.40 C ATOM 53 NH1 ARG A 4 -20.268 15.548 -4.137 1.00 44.12 N ATOM 54 NH2 ARG A 4 -19.923 15.594 -1.867 1.00 23.35 N ATOM 0 H ARG A 4 -13.420 14.728 -5.404 1.00 34.51 H new ATOM 0 HA ARG A 4 -14.324 11.934 -4.969 1.00 20.34 H new ATOM 0 HB2 ARG A 4 -15.731 14.246 -6.354 1.00 2.55 H new ATOM 0 HB3 ARG A 4 -16.358 12.620 -6.174 1.00 2.55 H new ATOM 0 HG2 ARG A 4 -16.378 12.882 -3.716 1.00 63.25 H new ATOM 0 HG3 ARG A 4 -15.705 14.493 -3.871 1.00 63.25 H new ATOM 0 HD2 ARG A 4 -17.712 15.183 -5.199 1.00 14.45 H new ATOM 0 HD3 ARG A 4 -18.388 13.581 -4.986 1.00 14.45 H new ATOM 0 HE ARG A 4 -17.735 14.584 -2.407 1.00 53.24 H new ATOM 0 HH11 ARG A 4 -19.938 15.324 -5.076 1.00 44.12 H new ATOM 0 HH12 ARG A 4 -21.186 15.972 -4.006 1.00 44.12 H new ATOM 0 HH21 ARG A 4 -19.329 15.406 -1.060 1.00 23.35 H new ATOM 0 HH22 ARG A 4 -20.841 16.018 -1.737 1.00 23.35 H new ATOM 68 N THR A 5 -12.592 13.045 -7.260 1.00 73.45 N ATOM 69 CA THR A 5 -11.971 12.838 -8.552 1.00 64.31 C ATOM 70 C THR A 5 -10.548 12.309 -8.405 1.00 33.11 C ATOM 71 O THR A 5 -9.611 13.085 -8.194 1.00 64.12 O ATOM 72 CB THR A 5 -11.959 14.145 -9.366 1.00 11.42 C ATOM 73 OG1 THR A 5 -11.450 15.220 -8.562 1.00 25.31 O ATOM 74 CG2 THR A 5 -13.356 14.489 -9.856 1.00 11.22 C ATOM 0 H THR A 5 -12.061 13.645 -6.629 1.00 73.45 H new ATOM 0 HA THR A 5 -12.563 12.093 -9.083 1.00 64.31 H new ATOM 0 HB THR A 5 -11.312 14.002 -10.232 1.00 11.42 H new ATOM 0 HG1 THR A 5 -10.627 14.932 -8.114 1.00 25.31 H new ATOM 0 HG21 THR A 5 -13.323 15.416 -10.428 1.00 11.22 H new ATOM 0 HG22 THR A 5 -13.728 13.684 -10.490 1.00 11.22 H new ATOM 0 HG23 THR A 5 -14.021 14.614 -9.001 1.00 11.22 H new ATOM 82 N GLU A 6 -10.411 10.982 -8.499 1.00 1.44 N ATOM 83 CA GLU A 6 -9.110 10.304 -8.459 1.00 44.13 C ATOM 84 C GLU A 6 -8.455 10.394 -7.078 1.00 21.34 C ATOM 85 O GLU A 6 -8.250 11.480 -6.535 1.00 32.13 O ATOM 86 CB GLU A 6 -8.181 10.865 -9.543 1.00 62.10 C ATOM 87 CG GLU A 6 -6.802 10.228 -9.569 1.00 42.55 C ATOM 88 CD GLU A 6 -6.012 10.619 -10.800 1.00 50.01 C ATOM 89 OE1 GLU A 6 -5.456 11.738 -10.831 1.00 15.30 O ATOM 90 OE2 GLU A 6 -5.946 9.809 -11.750 1.00 52.22 O ATOM 0 H GLU A 6 -11.201 10.346 -8.605 1.00 1.44 H new ATOM 0 HA GLU A 6 -9.285 9.247 -8.659 1.00 44.13 H new ATOM 0 HB2 GLU A 6 -8.651 10.727 -10.517 1.00 62.10 H new ATOM 0 HB3 GLU A 6 -8.071 11.939 -9.392 1.00 62.10 H new ATOM 0 HG2 GLU A 6 -6.250 10.524 -8.677 1.00 42.55 H new ATOM 0 HG3 GLU A 6 -6.904 9.143 -9.535 1.00 42.55 H new ATOM 97 N TYR A 7 -8.128 9.240 -6.515 1.00 54.33 N ATOM 98 CA TYR A 7 -7.470 9.180 -5.218 1.00 41.34 C ATOM 99 C TYR A 7 -5.962 9.103 -5.403 1.00 32.23 C ATOM 100 O TYR A 7 -5.466 8.267 -6.162 1.00 75.22 O ATOM 101 CB TYR A 7 -7.948 7.964 -4.419 1.00 3.50 C ATOM 102 CG TYR A 7 -9.411 8.011 -4.026 1.00 24.22 C ATOM 103 CD1 TYR A 7 -9.814 8.642 -2.856 1.00 50.43 C ATOM 104 CD2 TYR A 7 -10.385 7.414 -4.817 1.00 24.02 C ATOM 105 CE1 TYR A 7 -11.144 8.675 -2.484 1.00 35.34 C ATOM 106 CE2 TYR A 7 -11.716 7.447 -4.452 1.00 40.44 C ATOM 107 CZ TYR A 7 -12.089 8.077 -3.288 1.00 41.35 C ATOM 108 OH TYR A 7 -13.415 8.100 -2.921 1.00 72.11 O ATOM 0 H TYR A 7 -8.308 8.329 -6.938 1.00 54.33 H new ATOM 0 HA TYR A 7 -7.726 10.084 -4.665 1.00 41.34 H new ATOM 0 HB2 TYR A 7 -7.771 7.064 -5.008 1.00 3.50 H new ATOM 0 HB3 TYR A 7 -7.344 7.877 -3.516 1.00 3.50 H new ATOM 0 HD1 TYR A 7 -9.075 9.115 -2.226 1.00 50.43 H new ATOM 0 HD2 TYR A 7 -10.096 6.917 -5.731 1.00 24.02 H new ATOM 0 HE1 TYR A 7 -11.441 9.166 -1.569 1.00 35.34 H new ATOM 0 HE2 TYR A 7 -12.462 6.980 -5.078 1.00 40.44 H new ATOM 0 HH TYR A 7 -13.950 7.635 -3.598 1.00 72.11 H new ATOM 118 N ASP A 8 -5.236 9.966 -4.710 1.00 45.44 N ATOM 119 CA ASP A 8 -3.787 9.995 -4.821 1.00 64.22 C ATOM 120 C ASP A 8 -3.161 9.141 -3.727 1.00 0.43 C ATOM 121 O ASP A 8 -3.477 9.288 -2.545 1.00 24.22 O ATOM 122 CB ASP A 8 -3.263 11.430 -4.739 1.00 34.23 C ATOM 123 CG ASP A 8 -1.774 11.527 -5.027 1.00 31.10 C ATOM 124 OD1 ASP A 8 -1.254 10.685 -5.795 1.00 32.40 O ATOM 125 OD2 ASP A 8 -1.129 12.472 -4.524 1.00 4.11 O ATOM 0 H ASP A 8 -5.626 10.654 -4.066 1.00 45.44 H new ATOM 0 HA ASP A 8 -3.509 9.586 -5.792 1.00 64.22 H new ATOM 0 HB2 ASP A 8 -3.808 12.053 -5.449 1.00 34.23 H new ATOM 0 HB3 ASP A 8 -3.464 11.830 -3.745 1.00 34.23 H new ATOM 130 N VAL A 9 -2.312 8.219 -4.138 1.00 75.10 N ATOM 131 CA VAL A 9 -1.611 7.343 -3.216 1.00 63.03 C ATOM 132 C VAL A 9 -0.126 7.350 -3.549 1.00 74.12 C ATOM 133 O VAL A 9 0.249 7.267 -4.721 1.00 2.35 O ATOM 134 CB VAL A 9 -2.147 5.893 -3.284 1.00 22.15 C ATOM 135 CG1 VAL A 9 -1.462 5.011 -2.249 1.00 53.50 C ATOM 136 CG2 VAL A 9 -3.658 5.859 -3.103 1.00 31.34 C ATOM 0 H VAL A 9 -2.088 8.055 -5.120 1.00 75.10 H new ATOM 0 HA VAL A 9 -1.776 7.714 -2.204 1.00 63.03 H new ATOM 0 HB VAL A 9 -1.916 5.499 -4.274 1.00 22.15 H new ATOM 0 HG11 VAL A 9 -1.856 3.997 -2.317 1.00 53.50 H new ATOM 0 HG12 VAL A 9 -0.388 4.996 -2.437 1.00 53.50 H new ATOM 0 HG13 VAL A 9 -1.650 5.407 -1.251 1.00 53.50 H new ATOM 0 HG21 VAL A 9 -4.008 4.828 -3.155 1.00 31.34 H new ATOM 0 HG22 VAL A 9 -3.918 6.282 -2.132 1.00 31.34 H new ATOM 0 HG23 VAL A 9 -4.132 6.443 -3.892 1.00 31.34 H new ATOM 146 N TYR A 10 0.719 7.463 -2.537 1.00 52.13 N ATOM 147 CA TYR A 10 2.151 7.450 -2.765 1.00 3.45 C ATOM 148 C TYR A 10 2.811 6.329 -1.978 1.00 72.44 C ATOM 149 O TYR A 10 2.302 5.895 -0.940 1.00 55.14 O ATOM 150 CB TYR A 10 2.785 8.807 -2.430 1.00 50.11 C ATOM 151 CG TYR A 10 2.622 9.257 -0.993 1.00 4.45 C ATOM 152 CD1 TYR A 10 1.500 9.973 -0.591 1.00 44.35 C ATOM 153 CD2 TYR A 10 3.604 8.989 -0.046 1.00 13.41 C ATOM 154 CE1 TYR A 10 1.366 10.412 0.712 1.00 43.40 C ATOM 155 CE2 TYR A 10 3.472 9.417 1.259 1.00 62.13 C ATOM 156 CZ TYR A 10 2.352 10.128 1.632 1.00 23.43 C ATOM 157 OH TYR A 10 2.224 10.570 2.924 1.00 61.40 O ATOM 0 H TYR A 10 0.441 7.564 -1.561 1.00 52.13 H new ATOM 0 HA TYR A 10 2.318 7.265 -3.826 1.00 3.45 H new ATOM 0 HB2 TYR A 10 3.849 8.760 -2.661 1.00 50.11 H new ATOM 0 HB3 TYR A 10 2.351 9.564 -3.083 1.00 50.11 H new ATOM 0 HD1 TYR A 10 0.722 10.189 -1.308 1.00 44.35 H new ATOM 0 HD2 TYR A 10 4.485 8.436 -0.337 1.00 13.41 H new ATOM 0 HE1 TYR A 10 0.493 10.975 1.008 1.00 43.40 H new ATOM 0 HE2 TYR A 10 4.242 9.196 1.984 1.00 62.13 H new ATOM 0 HH TYR A 10 2.411 11.531 2.961 1.00 61.40 H new ATOM 167 N THR A 11 3.934 5.861 -2.491 1.00 4.40 N ATOM 168 CA THR A 11 4.651 4.746 -1.905 1.00 45.15 C ATOM 169 C THR A 11 6.094 4.762 -2.403 1.00 31.24 C ATOM 170 O THR A 11 6.454 5.634 -3.202 1.00 2.23 O ATOM 171 CB THR A 11 3.965 3.403 -2.261 1.00 51.52 C ATOM 172 OG1 THR A 11 4.618 2.307 -1.607 1.00 31.13 O ATOM 173 CG2 THR A 11 3.968 3.169 -3.764 1.00 3.11 C ATOM 0 H THR A 11 4.374 6.245 -3.327 1.00 4.40 H new ATOM 0 HA THR A 11 4.642 4.844 -0.819 1.00 45.15 H new ATOM 0 HB THR A 11 2.933 3.462 -1.915 1.00 51.52 H new ATOM 0 HG1 THR A 11 4.767 2.530 -0.664 1.00 31.13 H new ATOM 0 HG21 THR A 11 3.480 2.220 -3.985 1.00 3.11 H new ATOM 0 HG22 THR A 11 3.430 3.977 -4.259 1.00 3.11 H new ATOM 0 HG23 THR A 11 4.996 3.142 -4.126 1.00 3.11 H new ATOM 181 N ASP A 12 6.894 3.796 -1.944 1.00 72.52 N ATOM 182 CA ASP A 12 8.333 3.740 -2.232 1.00 43.50 C ATOM 183 C ASP A 12 9.070 4.888 -1.547 1.00 24.31 C ATOM 184 O ASP A 12 8.489 5.931 -1.246 1.00 34.30 O ATOM 185 CB ASP A 12 8.610 3.740 -3.745 1.00 73.35 C ATOM 186 CG ASP A 12 10.096 3.749 -4.070 1.00 23.31 C ATOM 187 OD1 ASP A 12 10.833 2.885 -3.548 1.00 51.54 O ATOM 188 OD2 ASP A 12 10.538 4.633 -4.839 1.00 21.42 O ATOM 0 H ASP A 12 6.563 3.028 -1.360 1.00 72.52 H new ATOM 0 HA ASP A 12 8.710 2.800 -1.829 1.00 43.50 H new ATOM 0 HB2 ASP A 12 8.149 2.860 -4.194 1.00 73.35 H new ATOM 0 HB3 ASP A 12 8.138 4.613 -4.197 1.00 73.35 H new ATOM 193 N GLY A 13 10.347 4.690 -1.279 1.00 42.25 N ATOM 194 CA GLY A 13 11.114 5.711 -0.610 1.00 72.21 C ATOM 195 C GLY A 13 12.546 5.303 -0.380 1.00 22.04 C ATOM 196 O GLY A 13 13.449 5.760 -1.079 1.00 62.53 O ATOM 0 H GLY A 13 10.865 3.843 -1.512 1.00 42.25 H new ATOM 0 HA2 GLY A 13 11.091 6.625 -1.204 1.00 72.21 H new ATOM 0 HA3 GLY A 13 10.648 5.942 0.348 1.00 72.21 H new ATOM 200 N SER A 14 12.762 4.415 0.578 1.00 61.51 N ATOM 201 CA SER A 14 14.112 4.081 0.985 1.00 52.41 C ATOM 202 C SER A 14 14.355 2.575 1.010 1.00 41.23 C ATOM 203 O SER A 14 13.703 1.835 1.746 1.00 31.24 O ATOM 204 CB SER A 14 14.397 4.676 2.365 1.00 42.51 C ATOM 205 OG SER A 14 15.783 4.650 2.656 1.00 62.12 O ATOM 0 H SER A 14 12.027 3.919 1.082 1.00 61.51 H new ATOM 0 HA SER A 14 14.791 4.507 0.246 1.00 52.41 H new ATOM 0 HB2 SER A 14 14.034 5.703 2.404 1.00 42.51 H new ATOM 0 HB3 SER A 14 13.852 4.116 3.125 1.00 42.51 H new ATOM 0 HG SER A 14 15.924 4.257 3.543 1.00 62.12 H new ATOM 211 N TYR A 15 15.286 2.138 0.178 1.00 31.32 N ATOM 212 CA TYR A 15 15.834 0.797 0.262 1.00 70.43 C ATOM 213 C TYR A 15 17.340 0.933 0.438 1.00 44.34 C ATOM 214 O TYR A 15 18.045 1.295 -0.505 1.00 20.42 O ATOM 215 CB TYR A 15 15.515 -0.011 -1.004 1.00 34.14 C ATOM 216 CG TYR A 15 15.796 -1.500 -0.883 1.00 62.54 C ATOM 217 CD1 TYR A 15 17.018 -1.973 -0.410 1.00 23.32 C ATOM 218 CD2 TYR A 15 14.832 -2.436 -1.237 1.00 12.52 C ATOM 219 CE1 TYR A 15 17.267 -3.325 -0.296 1.00 62.23 C ATOM 220 CE2 TYR A 15 15.076 -3.792 -1.123 1.00 43.33 C ATOM 221 CZ TYR A 15 16.295 -4.230 -0.653 1.00 22.25 C ATOM 222 OH TYR A 15 16.543 -5.580 -0.532 1.00 71.55 O ATOM 0 H TYR A 15 15.682 2.703 -0.573 1.00 31.32 H new ATOM 0 HA TYR A 15 15.391 0.263 1.103 1.00 70.43 H new ATOM 0 HB2 TYR A 15 14.464 0.129 -1.255 1.00 34.14 H new ATOM 0 HB3 TYR A 15 16.097 0.391 -1.833 1.00 34.14 H new ATOM 0 HD1 TYR A 15 17.785 -1.268 -0.127 1.00 23.32 H new ATOM 0 HD2 TYR A 15 13.875 -2.098 -1.608 1.00 12.52 H new ATOM 0 HE1 TYR A 15 18.221 -3.671 0.072 1.00 62.23 H new ATOM 0 HE2 TYR A 15 14.314 -4.505 -1.401 1.00 43.33 H new ATOM 0 HH TYR A 15 15.755 -6.085 -0.824 1.00 71.55 H new ATOM 232 N VAL A 16 17.831 0.668 1.636 1.00 72.54 N ATOM 233 CA VAL A 16 19.235 0.899 1.935 1.00 64.44 C ATOM 234 C VAL A 16 19.799 -0.202 2.828 1.00 50.10 C ATOM 235 O VAL A 16 19.119 -0.695 3.726 1.00 71.23 O ATOM 236 CB VAL A 16 19.437 2.287 2.599 1.00 74.53 C ATOM 237 CG1 VAL A 16 18.695 2.375 3.926 1.00 52.30 C ATOM 238 CG2 VAL A 16 20.916 2.601 2.788 1.00 70.24 C ATOM 0 H VAL A 16 17.284 0.296 2.412 1.00 72.54 H new ATOM 0 HA VAL A 16 19.780 0.883 0.991 1.00 64.44 H new ATOM 0 HB VAL A 16 19.018 3.035 1.926 1.00 74.53 H new ATOM 0 HG11 VAL A 16 18.855 3.359 4.368 1.00 52.30 H new ATOM 0 HG12 VAL A 16 17.629 2.222 3.758 1.00 52.30 H new ATOM 0 HG13 VAL A 16 19.069 1.608 4.604 1.00 52.30 H new ATOM 0 HG21 VAL A 16 21.023 3.580 3.255 1.00 70.24 H new ATOM 0 HG22 VAL A 16 21.370 1.843 3.426 1.00 70.24 H new ATOM 0 HG23 VAL A 16 21.414 2.605 1.818 1.00 70.24 H new ATOM 248 N ASN A 17 21.032 -0.611 2.532 1.00 65.11 N ATOM 249 CA ASN A 17 21.774 -1.569 3.358 1.00 72.14 C ATOM 250 C ASN A 17 21.071 -2.923 3.429 1.00 42.13 C ATOM 251 O ASN A 17 21.226 -3.661 4.403 1.00 4.23 O ATOM 252 CB ASN A 17 21.981 -1.017 4.778 1.00 44.02 C ATOM 253 CG ASN A 17 22.835 0.240 4.810 1.00 44.02 C ATOM 254 OD1 ASN A 17 22.621 1.127 5.636 1.00 22.53 O ATOM 255 ND2 ASN A 17 23.811 0.325 3.918 1.00 63.20 N ATOM 0 H ASN A 17 21.547 -0.289 1.713 1.00 65.11 H new ATOM 0 HA ASN A 17 22.744 -1.716 2.883 1.00 72.14 H new ATOM 0 HB2 ASN A 17 21.010 -0.801 5.223 1.00 44.02 H new ATOM 0 HB3 ASN A 17 22.450 -1.784 5.395 1.00 44.02 H new ATOM 0 HD21 ASN A 17 24.416 1.146 3.900 1.00 63.20 H new ATOM 0 HD22 ASN A 17 23.958 -0.431 3.249 1.00 63.20 H new ATOM 262 N GLY A 18 20.321 -3.260 2.386 1.00 10.34 N ATOM 263 CA GLY A 18 19.604 -4.522 2.368 1.00 34.15 C ATOM 264 C GLY A 18 18.355 -4.494 3.228 1.00 21.21 C ATOM 265 O GLY A 18 17.715 -5.524 3.444 1.00 3.01 O ATOM 0 H GLY A 18 20.197 -2.683 1.554 1.00 10.34 H new ATOM 0 HA2 GLY A 18 19.329 -4.765 1.342 1.00 34.15 H new ATOM 0 HA3 GLY A 18 20.264 -5.316 2.718 1.00 34.15 H new ATOM 269 N GLN A 19 18.013 -3.315 3.724 1.00 24.43 N ATOM 270 CA GLN A 19 16.823 -3.144 4.540 1.00 23.33 C ATOM 271 C GLN A 19 15.657 -2.715 3.663 1.00 62.00 C ATOM 272 O GLN A 19 15.801 -1.819 2.829 1.00 31.14 O ATOM 273 CB GLN A 19 17.056 -2.086 5.625 1.00 30.24 C ATOM 274 CG GLN A 19 18.262 -2.350 6.514 1.00 51.41 C ATOM 275 CD GLN A 19 18.162 -3.654 7.279 1.00 24.31 C ATOM 276 OE1 GLN A 19 17.069 -4.120 7.603 1.00 74.52 O ATOM 277 NE2 GLN A 19 19.303 -4.247 7.586 1.00 73.23 N ATOM 0 H GLN A 19 18.547 -2.459 3.574 1.00 24.43 H new ATOM 0 HA GLN A 19 16.595 -4.096 5.020 1.00 23.33 H new ATOM 0 HB2 GLN A 19 17.179 -1.114 5.147 1.00 30.24 H new ATOM 0 HB3 GLN A 19 16.166 -2.023 6.251 1.00 30.24 H new ATOM 0 HG2 GLN A 19 19.162 -2.364 5.900 1.00 51.41 H new ATOM 0 HG3 GLN A 19 18.371 -1.528 7.221 1.00 51.41 H new ATOM 0 HE21 GLN A 19 20.188 -3.829 7.299 1.00 73.23 H new ATOM 0 HE22 GLN A 19 19.298 -5.122 8.109 1.00 73.23 H new ATOM 286 N TYR A 20 14.515 -3.362 3.837 1.00 75.11 N ATOM 287 CA TYR A 20 13.326 -3.007 3.081 1.00 24.04 C ATOM 288 C TYR A 20 12.077 -3.242 3.917 1.00 2.02 C ATOM 289 O TYR A 20 12.073 -4.071 4.830 1.00 2.54 O ATOM 290 CB TYR A 20 13.245 -3.801 1.772 1.00 12.13 C ATOM 291 CG TYR A 20 13.021 -5.291 1.943 1.00 34.25 C ATOM 292 CD1 TYR A 20 14.064 -6.145 2.281 1.00 5.42 C ATOM 293 CD2 TYR A 20 11.760 -5.842 1.746 1.00 41.51 C ATOM 294 CE1 TYR A 20 13.856 -7.505 2.418 1.00 64.20 C ATOM 295 CE2 TYR A 20 11.545 -7.198 1.884 1.00 52.44 C ATOM 296 CZ TYR A 20 12.594 -8.025 2.219 1.00 64.10 C ATOM 297 OH TYR A 20 12.381 -9.377 2.350 1.00 73.33 O ATOM 0 H TYR A 20 14.387 -4.133 4.493 1.00 75.11 H new ATOM 0 HA TYR A 20 13.390 -1.948 2.831 1.00 24.04 H new ATOM 0 HB2 TYR A 20 12.436 -3.394 1.166 1.00 12.13 H new ATOM 0 HB3 TYR A 20 14.169 -3.649 1.214 1.00 12.13 H new ATOM 0 HD1 TYR A 20 15.053 -5.740 2.439 1.00 5.42 H new ATOM 0 HD2 TYR A 20 10.935 -5.198 1.480 1.00 41.51 H new ATOM 0 HE1 TYR A 20 14.677 -8.156 2.679 1.00 64.20 H new ATOM 0 HE2 TYR A 20 10.558 -7.609 1.730 1.00 52.44 H new ATOM 0 HH TYR A 20 11.437 -9.578 2.178 1.00 73.33 H new ATOM 307 N ALA A 21 11.025 -2.510 3.597 1.00 22.02 N ATOM 308 CA ALA A 21 9.763 -2.613 4.306 1.00 3.04 C ATOM 309 C ALA A 21 8.629 -2.161 3.403 1.00 51.51 C ATOM 310 O ALA A 21 8.869 -1.608 2.330 1.00 32.45 O ATOM 311 CB ALA A 21 9.796 -1.776 5.578 1.00 30.12 C ATOM 0 H ALA A 21 11.022 -1.828 2.839 1.00 22.02 H new ATOM 0 HA ALA A 21 9.599 -3.653 4.587 1.00 3.04 H new ATOM 0 HB1 ALA A 21 8.842 -1.865 6.097 1.00 30.12 H new ATOM 0 HB2 ALA A 21 10.596 -2.132 6.227 1.00 30.12 H new ATOM 0 HB3 ALA A 21 9.974 -0.732 5.322 1.00 30.12 H new ATOM 317 N TRP A 22 7.404 -2.398 3.829 1.00 41.12 N ATOM 318 CA TRP A 22 6.244 -1.962 3.072 1.00 4.13 C ATOM 319 C TRP A 22 5.823 -0.615 3.614 1.00 23.11 C ATOM 320 O TRP A 22 5.678 -0.464 4.821 1.00 13.54 O ATOM 321 CB TRP A 22 5.043 -2.911 3.213 1.00 60.21 C ATOM 322 CG TRP A 22 5.346 -4.337 3.578 1.00 44.03 C ATOM 323 CD1 TRP A 22 6.181 -4.783 4.562 1.00 21.02 C ATOM 324 CD2 TRP A 22 4.756 -5.505 3.000 1.00 35.32 C ATOM 325 NE1 TRP A 22 6.153 -6.145 4.630 1.00 43.14 N ATOM 326 CE2 TRP A 22 5.287 -6.614 3.683 1.00 64.10 C ATOM 327 CE3 TRP A 22 3.832 -5.726 1.972 1.00 34.31 C ATOM 328 CZ2 TRP A 22 4.926 -7.913 3.379 1.00 24.30 C ATOM 329 CZ3 TRP A 22 3.475 -7.026 1.667 1.00 61.02 C ATOM 330 CH2 TRP A 22 4.019 -8.107 2.372 1.00 13.42 C ATOM 0 H TRP A 22 7.185 -2.890 4.695 1.00 41.12 H new ATOM 0 HA TRP A 22 6.527 -1.933 2.020 1.00 4.13 H new ATOM 0 HB2 TRP A 22 4.373 -2.502 3.969 1.00 60.21 H new ATOM 0 HB3 TRP A 22 4.497 -2.910 2.270 1.00 60.21 H new ATOM 0 HD1 TRP A 22 6.779 -4.147 5.197 1.00 21.02 H new ATOM 0 HE1 TRP A 22 6.690 -6.719 5.280 1.00 43.14 H new ATOM 0 HE3 TRP A 22 3.406 -4.896 1.427 1.00 34.31 H new ATOM 0 HZ2 TRP A 22 5.346 -8.749 3.919 1.00 24.30 H new ATOM 0 HZ3 TRP A 22 2.766 -7.211 0.873 1.00 61.02 H new ATOM 0 HH2 TRP A 22 3.717 -9.112 2.117 1.00 13.42 H new ATOM 341 N ALA A 23 5.620 0.357 2.751 1.00 5.14 N ATOM 342 CA ALA A 23 5.160 1.654 3.208 1.00 2.25 C ATOM 343 C ALA A 23 4.138 2.225 2.248 1.00 42.21 C ATOM 344 O ALA A 23 4.340 2.210 1.032 1.00 4.24 O ATOM 345 CB ALA A 23 6.338 2.601 3.371 1.00 24.33 C ATOM 0 H ALA A 23 5.763 0.279 1.744 1.00 5.14 H new ATOM 0 HA ALA A 23 4.679 1.532 4.179 1.00 2.25 H new ATOM 0 HB1 ALA A 23 5.980 3.571 3.714 1.00 24.33 H new ATOM 0 HB2 ALA A 23 7.035 2.192 4.102 1.00 24.33 H new ATOM 0 HB3 ALA A 23 6.845 2.720 2.413 1.00 24.33 H new ATOM 351 N TYR A 24 3.045 2.734 2.798 1.00 12.31 N ATOM 352 CA TYR A 24 1.975 3.310 1.997 1.00 14.15 C ATOM 353 C TYR A 24 1.279 4.405 2.783 1.00 45.53 C ATOM 354 O TYR A 24 1.185 4.334 4.010 1.00 21.22 O ATOM 355 CB TYR A 24 0.929 2.252 1.604 1.00 2.25 C ATOM 356 CG TYR A 24 1.455 1.090 0.791 1.00 15.11 C ATOM 357 CD1 TYR A 24 1.578 1.179 -0.588 1.00 15.12 C ATOM 358 CD2 TYR A 24 1.816 -0.101 1.407 1.00 53.24 C ATOM 359 CE1 TYR A 24 2.047 0.113 -1.332 1.00 23.31 C ATOM 360 CE2 TYR A 24 2.288 -1.171 0.672 1.00 71.11 C ATOM 361 CZ TYR A 24 2.403 -1.058 -0.696 1.00 54.34 C ATOM 362 OH TYR A 24 2.870 -2.122 -1.434 1.00 74.13 O ATOM 0 H TYR A 24 2.876 2.760 3.804 1.00 12.31 H new ATOM 0 HA TYR A 24 2.425 3.713 1.090 1.00 14.15 H new ATOM 0 HB2 TYR A 24 0.474 1.860 2.514 1.00 2.25 H new ATOM 0 HB3 TYR A 24 0.137 2.742 1.037 1.00 2.25 H new ATOM 0 HD1 TYR A 24 1.303 2.096 -1.088 1.00 15.12 H new ATOM 0 HD2 TYR A 24 1.726 -0.192 2.479 1.00 53.24 H new ATOM 0 HE1 TYR A 24 2.134 0.196 -2.405 1.00 23.31 H new ATOM 0 HE2 TYR A 24 2.565 -2.090 1.167 1.00 71.11 H new ATOM 0 HH TYR A 24 3.077 -2.870 -0.835 1.00 74.13 H new ATOM 372 N ALA A 25 0.797 5.411 2.077 1.00 41.42 N ATOM 373 CA ALA A 25 0.015 6.465 2.694 1.00 51.02 C ATOM 374 C ALA A 25 -1.010 7.001 1.708 1.00 72.01 C ATOM 375 O ALA A 25 -0.668 7.418 0.600 1.00 52.32 O ATOM 376 CB ALA A 25 0.916 7.579 3.201 1.00 23.45 C ATOM 0 H ALA A 25 0.934 5.520 1.072 1.00 41.42 H new ATOM 0 HA ALA A 25 -0.515 6.050 3.551 1.00 51.02 H new ATOM 0 HB1 ALA A 25 0.308 8.359 3.660 1.00 23.45 H new ATOM 0 HB2 ALA A 25 1.610 7.178 3.940 1.00 23.45 H new ATOM 0 HB3 ALA A 25 1.478 8.001 2.367 1.00 23.45 H new ATOM 382 N PHE A 26 -2.267 6.964 2.114 1.00 32.20 N ATOM 383 CA PHE A 26 -3.361 7.421 1.272 1.00 12.21 C ATOM 384 C PHE A 26 -3.622 8.898 1.538 1.00 21.00 C ATOM 385 O PHE A 26 -4.058 9.273 2.629 1.00 32.53 O ATOM 386 CB PHE A 26 -4.619 6.586 1.551 1.00 31.32 C ATOM 387 CG PHE A 26 -4.390 5.100 1.429 1.00 60.01 C ATOM 388 CD1 PHE A 26 -4.392 4.486 0.188 1.00 12.32 C ATOM 389 CD2 PHE A 26 -4.164 4.320 2.557 1.00 41.10 C ATOM 390 CE1 PHE A 26 -4.173 3.127 0.070 1.00 13.23 C ATOM 391 CE2 PHE A 26 -3.946 2.960 2.444 1.00 13.22 C ATOM 392 CZ PHE A 26 -3.949 2.363 1.198 1.00 1.41 C ATOM 0 H PHE A 26 -2.558 6.619 3.029 1.00 32.20 H new ATOM 0 HA PHE A 26 -3.094 7.296 0.223 1.00 12.21 H new ATOM 0 HB2 PHE A 26 -4.979 6.810 2.555 1.00 31.32 H new ATOM 0 HB3 PHE A 26 -5.405 6.883 0.857 1.00 31.32 H new ATOM 0 HD1 PHE A 26 -4.567 5.077 -0.699 1.00 12.32 H new ATOM 0 HD2 PHE A 26 -4.159 4.782 3.533 1.00 41.10 H new ATOM 0 HE1 PHE A 26 -4.177 2.662 -0.905 1.00 13.23 H new ATOM 0 HE2 PHE A 26 -3.774 2.365 3.328 1.00 13.22 H new ATOM 0 HZ PHE A 26 -3.776 1.301 1.107 1.00 1.41 H new ATOM 402 N VAL A 27 -3.345 9.739 0.550 1.00 51.44 N ATOM 403 CA VAL A 27 -3.398 11.181 0.749 1.00 55.02 C ATOM 404 C VAL A 27 -4.643 11.802 0.107 1.00 11.53 C ATOM 405 O VAL A 27 -4.919 11.614 -1.078 1.00 62.35 O ATOM 406 CB VAL A 27 -2.108 11.868 0.230 1.00 11.32 C ATOM 407 CG1 VAL A 27 -1.869 11.569 -1.240 1.00 4.11 C ATOM 408 CG2 VAL A 27 -2.158 13.368 0.466 1.00 21.33 C ATOM 0 H VAL A 27 -3.083 9.449 -0.392 1.00 51.44 H new ATOM 0 HA VAL A 27 -3.465 11.352 1.823 1.00 55.02 H new ATOM 0 HB VAL A 27 -1.271 11.457 0.795 1.00 11.32 H new ATOM 0 HG11 VAL A 27 -0.957 12.067 -1.569 1.00 4.11 H new ATOM 0 HG12 VAL A 27 -1.766 10.493 -1.380 1.00 4.11 H new ATOM 0 HG13 VAL A 27 -2.712 11.932 -1.827 1.00 4.11 H new ATOM 0 HG21 VAL A 27 -1.242 13.826 0.093 1.00 21.33 H new ATOM 0 HG22 VAL A 27 -3.015 13.791 -0.059 1.00 21.33 H new ATOM 0 HG23 VAL A 27 -2.254 13.565 1.534 1.00 21.33 H new ATOM 418 N LYS A 28 -5.401 12.516 0.930 1.00 72.13 N ATOM 419 CA LYS A 28 -6.599 13.225 0.504 1.00 30.45 C ATOM 420 C LYS A 28 -7.061 14.117 1.642 1.00 2.42 C ATOM 421 O LYS A 28 -6.702 13.870 2.795 1.00 53.11 O ATOM 422 CB LYS A 28 -7.732 12.287 0.055 1.00 62.40 C ATOM 423 CG LYS A 28 -8.367 11.470 1.165 1.00 1.13 C ATOM 424 CD LYS A 28 -9.674 10.838 0.702 1.00 14.23 C ATOM 425 CE LYS A 28 -10.895 11.687 1.064 1.00 12.13 C ATOM 426 NZ LYS A 28 -10.816 13.088 0.558 1.00 40.24 N ATOM 0 H LYS A 28 -5.198 12.620 1.924 1.00 72.13 H new ATOM 0 HA LYS A 28 -6.344 13.820 -0.373 1.00 30.45 H new ATOM 0 HB2 LYS A 28 -8.508 12.883 -0.426 1.00 62.40 H new ATOM 0 HB3 LYS A 28 -7.341 11.605 -0.699 1.00 62.40 H new ATOM 0 HG2 LYS A 28 -7.677 10.691 1.488 1.00 1.13 H new ATOM 0 HG3 LYS A 28 -8.554 12.108 2.029 1.00 1.13 H new ATOM 0 HD2 LYS A 28 -9.642 10.695 -0.378 1.00 14.23 H new ATOM 0 HD3 LYS A 28 -9.776 9.850 1.152 1.00 14.23 H new ATOM 0 HE2 LYS A 28 -11.790 11.213 0.660 1.00 12.13 H new ATOM 0 HE3 LYS A 28 -11.006 11.706 2.148 1.00 12.13 H new ATOM 0 HZ1 LYS A 28 -10.584 13.728 1.344 1.00 40.24 H new ATOM 0 HZ2 LYS A 28 -10.077 13.153 -0.171 1.00 40.24 H new ATOM 0 HZ3 LYS A 28 -11.732 13.361 0.148 1.00 40.24 H new ATOM 440 N ASP A 29 -7.808 15.167 1.306 1.00 52.40 N ATOM 441 CA ASP A 29 -8.275 16.174 2.270 1.00 1.31 C ATOM 442 C ASP A 29 -7.141 17.125 2.618 1.00 14.15 C ATOM 443 O ASP A 29 -7.202 17.848 3.612 1.00 41.01 O ATOM 444 CB ASP A 29 -8.826 15.540 3.564 1.00 33.34 C ATOM 445 CG ASP A 29 -9.802 14.408 3.314 1.00 21.33 C ATOM 446 OD1 ASP A 29 -10.891 14.661 2.764 1.00 73.24 O ATOM 447 OD2 ASP A 29 -9.479 13.250 3.660 1.00 61.00 O ATOM 0 H ASP A 29 -8.111 15.349 0.349 1.00 52.40 H new ATOM 0 HA ASP A 29 -9.091 16.718 1.794 1.00 1.31 H new ATOM 0 HB2 ASP A 29 -7.993 15.166 4.159 1.00 33.34 H new ATOM 0 HB3 ASP A 29 -9.320 16.311 4.155 1.00 33.34 H new ATOM 452 N GLY A 30 -6.111 17.132 1.778 1.00 10.05 N ATOM 453 CA GLY A 30 -4.965 17.995 1.999 1.00 52.05 C ATOM 454 C GLY A 30 -4.006 17.432 3.028 1.00 44.13 C ATOM 455 O GLY A 30 -3.003 18.062 3.367 1.00 73.14 O ATOM 0 H GLY A 30 -6.050 16.551 0.942 1.00 10.05 H new ATOM 0 HA2 GLY A 30 -4.437 18.141 1.057 1.00 52.05 H new ATOM 0 HA3 GLY A 30 -5.310 18.976 2.327 1.00 52.05 H new ATOM 459 N LYS A 31 -4.313 16.239 3.517 1.00 13.54 N ATOM 460 CA LYS A 31 -3.515 15.595 4.551 1.00 32.20 C ATOM 461 C LYS A 31 -3.497 14.083 4.353 1.00 4.31 C ATOM 462 O LYS A 31 -4.084 13.567 3.404 1.00 15.30 O ATOM 463 CB LYS A 31 -4.046 15.967 5.950 1.00 33.11 C ATOM 464 CG LYS A 31 -5.567 16.082 6.047 1.00 11.32 C ATOM 465 CD LYS A 31 -6.260 14.730 6.136 1.00 24.31 C ATOM 466 CE LYS A 31 -6.013 14.059 7.479 1.00 24.24 C ATOM 467 NZ LYS A 31 -6.833 12.829 7.642 1.00 31.20 N ATOM 0 H LYS A 31 -5.118 15.692 3.210 1.00 13.54 H new ATOM 0 HA LYS A 31 -2.489 15.954 4.472 1.00 32.20 H new ATOM 0 HB2 LYS A 31 -3.706 15.217 6.664 1.00 33.11 H new ATOM 0 HB3 LYS A 31 -3.604 16.917 6.251 1.00 33.11 H new ATOM 0 HG2 LYS A 31 -5.826 16.675 6.924 1.00 11.32 H new ATOM 0 HG3 LYS A 31 -5.942 16.620 5.176 1.00 11.32 H new ATOM 0 HD2 LYS A 31 -7.332 14.860 5.986 1.00 24.31 H new ATOM 0 HD3 LYS A 31 -5.902 14.084 5.335 1.00 24.31 H new ATOM 0 HE2 LYS A 31 -4.957 13.806 7.570 1.00 24.24 H new ATOM 0 HE3 LYS A 31 -6.244 14.759 8.283 1.00 24.24 H new ATOM 0 HZ1 LYS A 31 -7.392 12.898 8.517 1.00 31.20 H new ATOM 0 HZ2 LYS A 31 -7.474 12.729 6.829 1.00 31.20 H new ATOM 0 HZ3 LYS A 31 -6.208 11.999 7.695 1.00 31.20 H new ATOM 481 N VAL A 32 -2.803 13.379 5.227 1.00 22.21 N ATOM 482 CA VAL A 32 -2.745 11.932 5.149 1.00 61.11 C ATOM 483 C VAL A 32 -4.018 11.332 5.737 1.00 15.42 C ATOM 484 O VAL A 32 -4.302 11.495 6.924 1.00 34.12 O ATOM 485 CB VAL A 32 -1.514 11.372 5.891 1.00 30.43 C ATOM 486 CG1 VAL A 32 -1.443 9.861 5.752 1.00 22.10 C ATOM 487 CG2 VAL A 32 -0.236 12.019 5.379 1.00 12.13 C ATOM 0 H VAL A 32 -2.272 13.785 5.998 1.00 22.21 H new ATOM 0 HA VAL A 32 -2.658 11.656 4.098 1.00 61.11 H new ATOM 0 HB VAL A 32 -1.617 11.612 6.949 1.00 30.43 H new ATOM 0 HG11 VAL A 32 -0.567 9.488 6.283 1.00 22.10 H new ATOM 0 HG12 VAL A 32 -2.342 9.414 6.176 1.00 22.10 H new ATOM 0 HG13 VAL A 32 -1.368 9.596 4.697 1.00 22.10 H new ATOM 0 HG21 VAL A 32 0.620 11.609 5.916 1.00 12.13 H new ATOM 0 HG22 VAL A 32 -0.127 11.816 4.314 1.00 12.13 H new ATOM 0 HG23 VAL A 32 -0.284 13.096 5.540 1.00 12.13 H new ATOM 497 N HIS A 33 -4.794 10.661 4.899 1.00 22.21 N ATOM 498 CA HIS A 33 -6.060 10.086 5.327 1.00 41.20 C ATOM 499 C HIS A 33 -5.808 8.776 6.065 1.00 61.22 C ATOM 500 O HIS A 33 -6.524 8.433 7.004 1.00 64.24 O ATOM 501 CB HIS A 33 -6.979 9.865 4.120 1.00 14.35 C ATOM 502 CG HIS A 33 -8.430 9.704 4.473 1.00 41.34 C ATOM 503 ND1 HIS A 33 -9.339 10.745 4.435 1.00 74.32 N ATOM 504 CD2 HIS A 33 -9.135 8.611 4.853 1.00 64.34 C ATOM 505 CE1 HIS A 33 -10.530 10.297 4.778 1.00 65.21 C ATOM 506 NE2 HIS A 33 -10.435 9.008 5.034 1.00 65.12 N ATOM 0 H HIS A 33 -4.569 10.501 3.917 1.00 22.21 H new ATOM 0 HA HIS A 33 -6.556 10.778 6.007 1.00 41.20 H new ATOM 0 HB2 HIS A 33 -6.874 10.709 3.438 1.00 14.35 H new ATOM 0 HB3 HIS A 33 -6.647 8.977 3.582 1.00 14.35 H new ATOM 0 HD1 HIS A 33 -9.122 11.709 4.181 1.00 74.32 H new ATOM 0 HD2 HIS A 33 -8.745 7.613 4.988 1.00 64.34 H new ATOM 0 HE1 HIS A 33 -11.432 10.887 4.839 1.00 65.21 H new ATOM 515 N TYR A 34 -4.775 8.054 5.635 1.00 70.12 N ATOM 516 CA TYR A 34 -4.351 6.837 6.318 1.00 54.33 C ATOM 517 C TYR A 34 -2.893 6.530 6.019 1.00 12.40 C ATOM 518 O TYR A 34 -2.415 6.765 4.910 1.00 52.12 O ATOM 519 CB TYR A 34 -5.222 5.646 5.929 1.00 30.11 C ATOM 520 CG TYR A 34 -5.799 4.934 7.129 1.00 72.31 C ATOM 521 CD1 TYR A 34 -5.010 4.092 7.900 1.00 73.51 C ATOM 522 CD2 TYR A 34 -7.124 5.114 7.500 1.00 30.31 C ATOM 523 CE1 TYR A 34 -5.525 3.449 9.006 1.00 30.45 C ATOM 524 CE2 TYR A 34 -7.646 4.470 8.606 1.00 24.03 C ATOM 525 CZ TYR A 34 -6.843 3.640 9.355 1.00 21.23 C ATOM 526 OH TYR A 34 -7.354 3.004 10.459 1.00 61.20 O ATOM 0 H TYR A 34 -4.217 8.293 4.815 1.00 70.12 H new ATOM 0 HA TYR A 34 -4.465 7.009 7.388 1.00 54.33 H new ATOM 0 HB2 TYR A 34 -6.035 5.988 5.289 1.00 30.11 H new ATOM 0 HB3 TYR A 34 -4.630 4.943 5.344 1.00 30.11 H new ATOM 0 HD1 TYR A 34 -3.976 3.938 7.629 1.00 73.51 H new ATOM 0 HD2 TYR A 34 -7.756 5.767 6.916 1.00 30.31 H new ATOM 0 HE1 TYR A 34 -4.897 2.798 9.596 1.00 30.45 H new ATOM 0 HE2 TYR A 34 -8.680 4.617 8.881 1.00 24.03 H new ATOM 0 HH TYR A 34 -8.298 3.245 10.568 1.00 61.20 H new ATOM 536 N GLU A 35 -2.204 5.998 7.015 1.00 34.32 N ATOM 537 CA GLU A 35 -0.774 5.733 6.922 1.00 11.32 C ATOM 538 C GLU A 35 -0.396 4.537 7.793 1.00 14.22 C ATOM 539 O GLU A 35 -0.819 4.454 8.949 1.00 33.21 O ATOM 540 CB GLU A 35 0.006 6.969 7.385 1.00 2.35 C ATOM 541 CG GLU A 35 1.514 6.774 7.453 1.00 1.23 C ATOM 542 CD GLU A 35 2.184 7.811 8.330 1.00 51.43 C ATOM 543 OE1 GLU A 35 2.381 8.955 7.874 1.00 24.14 O ATOM 544 OE2 GLU A 35 2.499 7.490 9.494 1.00 23.40 O ATOM 0 H GLU A 35 -2.617 5.737 7.910 1.00 34.32 H new ATOM 0 HA GLU A 35 -0.525 5.506 5.885 1.00 11.32 H new ATOM 0 HB2 GLU A 35 -0.211 7.795 6.707 1.00 2.35 H new ATOM 0 HB3 GLU A 35 -0.355 7.263 8.371 1.00 2.35 H new ATOM 0 HG2 GLU A 35 1.733 5.778 7.838 1.00 1.23 H new ATOM 0 HG3 GLU A 35 1.931 6.826 6.447 1.00 1.23 H new ATOM 551 N ASP A 36 0.381 3.614 7.234 1.00 22.22 N ATOM 552 CA ASP A 36 0.919 2.486 7.997 1.00 11.13 C ATOM 553 C ASP A 36 2.033 1.809 7.203 1.00 54.33 C ATOM 554 O ASP A 36 2.160 2.026 5.995 1.00 32.20 O ATOM 555 CB ASP A 36 -0.176 1.470 8.343 1.00 14.43 C ATOM 556 CG ASP A 36 0.246 0.527 9.456 1.00 51.43 C ATOM 557 OD1 ASP A 36 0.191 0.936 10.637 1.00 13.01 O ATOM 558 OD2 ASP A 36 0.647 -0.616 9.163 1.00 71.42 O ATOM 0 H ASP A 36 0.655 3.623 6.251 1.00 22.22 H new ATOM 0 HA ASP A 36 1.323 2.871 8.933 1.00 11.13 H new ATOM 0 HB2 ASP A 36 -1.080 2.001 8.642 1.00 14.43 H new ATOM 0 HB3 ASP A 36 -0.426 0.891 7.454 1.00 14.43 H new ATOM 563 N ALA A 37 2.836 0.993 7.873 1.00 30.53 N ATOM 564 CA ALA A 37 3.975 0.353 7.233 1.00 61.15 C ATOM 565 C ALA A 37 4.357 -0.944 7.943 1.00 14.32 C ATOM 566 O ALA A 37 4.593 -0.946 9.154 1.00 13.35 O ATOM 567 CB ALA A 37 5.161 1.310 7.215 1.00 35.11 C ATOM 0 H ALA A 37 2.719 0.759 8.859 1.00 30.53 H new ATOM 0 HA ALA A 37 3.694 0.103 6.210 1.00 61.15 H new ATOM 0 HB1 ALA A 37 6.012 0.826 6.735 1.00 35.11 H new ATOM 0 HB2 ALA A 37 4.894 2.210 6.660 1.00 35.11 H new ATOM 0 HB3 ALA A 37 5.427 1.580 8.237 1.00 35.11 H new ATOM 573 N ASP A 38 4.416 -2.045 7.194 1.00 20.24 N ATOM 574 CA ASP A 38 4.881 -3.315 7.744 1.00 5.25 C ATOM 575 C ASP A 38 6.388 -3.419 7.546 1.00 20.11 C ATOM 576 O ASP A 38 6.966 -2.681 6.745 1.00 71.41 O ATOM 577 CB ASP A 38 4.202 -4.520 7.065 1.00 21.11 C ATOM 578 CG ASP A 38 4.427 -5.814 7.825 1.00 14.43 C ATOM 579 OD1 ASP A 38 4.691 -5.749 9.051 1.00 1.45 O ATOM 580 OD2 ASP A 38 4.339 -6.894 7.202 1.00 54.43 O ATOM 0 H ASP A 38 4.149 -2.082 6.210 1.00 20.24 H new ATOM 0 HA ASP A 38 4.624 -3.337 8.803 1.00 5.25 H new ATOM 0 HB2 ASP A 38 3.132 -4.332 6.982 1.00 21.11 H new ATOM 0 HB3 ASP A 38 4.586 -4.626 6.050 1.00 21.11 H new ATOM 585 N VAL A 39 7.021 -4.330 8.258 1.00 32.33 N ATOM 586 CA VAL A 39 8.443 -4.556 8.104 1.00 14.03 C ATOM 587 C VAL A 39 8.695 -5.650 7.071 1.00 1.21 C ATOM 588 O VAL A 39 7.852 -6.524 6.868 1.00 63.25 O ATOM 589 CB VAL A 39 9.101 -4.932 9.446 1.00 70.32 C ATOM 590 CG1 VAL A 39 9.202 -3.718 10.354 1.00 64.33 C ATOM 591 CG2 VAL A 39 8.323 -6.041 10.134 1.00 50.45 C ATOM 0 H VAL A 39 6.570 -4.927 8.951 1.00 32.33 H new ATOM 0 HA VAL A 39 8.893 -3.626 7.757 1.00 14.03 H new ATOM 0 HB VAL A 39 10.108 -5.293 9.239 1.00 70.32 H new ATOM 0 HG11 VAL A 39 9.669 -4.006 11.296 1.00 64.33 H new ATOM 0 HG12 VAL A 39 9.805 -2.950 9.869 1.00 64.33 H new ATOM 0 HG13 VAL A 39 8.204 -3.326 10.549 1.00 64.33 H new ATOM 0 HG21 VAL A 39 8.805 -6.291 11.079 1.00 50.45 H new ATOM 0 HG22 VAL A 39 7.303 -5.706 10.324 1.00 50.45 H new ATOM 0 HG23 VAL A 39 8.302 -6.922 9.493 1.00 50.45 H new ATOM 601 N GLY A 40 9.847 -5.594 6.413 1.00 15.31 N ATOM 602 CA GLY A 40 10.140 -6.522 5.334 1.00 73.45 C ATOM 603 C GLY A 40 10.427 -7.931 5.815 1.00 44.44 C ATOM 604 O GLY A 40 11.582 -8.359 5.855 1.00 40.43 O ATOM 0 H GLY A 40 10.587 -4.920 6.608 1.00 15.31 H new ATOM 0 HA2 GLY A 40 9.295 -6.546 4.645 1.00 73.45 H new ATOM 0 HA3 GLY A 40 10.999 -6.155 4.772 1.00 73.45 H new ATOM 608 N LYS A 41 9.378 -8.646 6.190 1.00 62.33 N ATOM 609 CA LYS A 41 9.488 -10.033 6.593 1.00 42.32 C ATOM 610 C LYS A 41 8.553 -10.857 5.726 1.00 12.52 C ATOM 611 O LYS A 41 8.009 -10.349 4.744 1.00 2.34 O ATOM 612 CB LYS A 41 9.113 -10.204 8.074 1.00 72.24 C ATOM 613 CG LYS A 41 9.519 -9.028 8.948 1.00 41.13 C ATOM 614 CD LYS A 41 9.374 -9.342 10.431 1.00 44.33 C ATOM 615 CE LYS A 41 10.453 -10.296 10.918 1.00 24.41 C ATOM 616 NZ LYS A 41 11.814 -9.703 10.807 1.00 21.34 N ATOM 0 H LYS A 41 8.427 -8.278 6.222 1.00 62.33 H new ATOM 0 HA LYS A 41 10.518 -10.367 6.467 1.00 42.32 H new ATOM 0 HB2 LYS A 41 8.035 -10.348 8.152 1.00 72.24 H new ATOM 0 HB3 LYS A 41 9.584 -11.109 8.457 1.00 72.24 H new ATOM 0 HG2 LYS A 41 10.553 -8.758 8.734 1.00 41.13 H new ATOM 0 HG3 LYS A 41 8.905 -8.162 8.699 1.00 41.13 H new ATOM 0 HD2 LYS A 41 9.423 -8.416 11.004 1.00 44.33 H new ATOM 0 HD3 LYS A 41 8.393 -9.780 10.615 1.00 44.33 H new ATOM 0 HE2 LYS A 41 10.258 -10.564 11.956 1.00 24.41 H new ATOM 0 HE3 LYS A 41 10.411 -11.218 10.338 1.00 24.41 H new ATOM 0 HZ1 LYS A 41 12.470 -10.222 11.424 1.00 21.34 H new ATOM 0 HZ2 LYS A 41 12.141 -9.767 9.822 1.00 21.34 H new ATOM 0 HZ3 LYS A 41 11.783 -8.705 11.097 1.00 21.34 H new ATOM 630 N ASN A 42 8.364 -12.112 6.079 1.00 15.52 N ATOM 631 CA ASN A 42 7.425 -12.958 5.357 1.00 71.51 C ATOM 632 C ASN A 42 5.998 -12.619 5.759 1.00 34.30 C ATOM 633 O ASN A 42 5.727 -12.318 6.924 1.00 40.44 O ATOM 634 CB ASN A 42 7.703 -14.442 5.604 1.00 42.41 C ATOM 635 CG ASN A 42 8.938 -14.930 4.869 1.00 54.13 C ATOM 636 OD1 ASN A 42 9.308 -14.393 3.823 1.00 52.23 O ATOM 637 ND2 ASN A 42 9.581 -15.953 5.407 1.00 33.45 N ATOM 0 H ASN A 42 8.842 -12.570 6.855 1.00 15.52 H new ATOM 0 HA ASN A 42 7.554 -12.766 4.292 1.00 71.51 H new ATOM 0 HB2 ASN A 42 7.829 -14.612 6.673 1.00 42.41 H new ATOM 0 HB3 ASN A 42 6.840 -15.028 5.288 1.00 42.41 H new ATOM 0 HD21 ASN A 42 10.416 -16.326 4.955 1.00 33.45 H new ATOM 0 HD22 ASN A 42 9.242 -16.369 6.274 1.00 33.45 H new ATOM 644 N PRO A 43 5.063 -12.680 4.795 1.00 72.14 N ATOM 645 CA PRO A 43 3.659 -12.298 5.010 1.00 21.22 C ATOM 646 C PRO A 43 2.963 -13.148 6.067 1.00 74.31 C ATOM 647 O PRO A 43 1.975 -12.725 6.662 1.00 1.13 O ATOM 648 CB PRO A 43 3.006 -12.519 3.640 1.00 31.40 C ATOM 649 CG PRO A 43 3.929 -13.434 2.911 1.00 51.21 C ATOM 650 CD PRO A 43 5.305 -13.107 3.406 1.00 74.04 C ATOM 0 HA PRO A 43 3.582 -11.275 5.378 1.00 21.22 H new ATOM 0 HB2 PRO A 43 2.014 -12.960 3.743 1.00 31.40 H new ATOM 0 HB3 PRO A 43 2.882 -11.577 3.106 1.00 31.40 H new ATOM 0 HG2 PRO A 43 3.681 -14.477 3.107 1.00 51.21 H new ATOM 0 HG3 PRO A 43 3.856 -13.286 1.834 1.00 51.21 H new ATOM 0 HD2 PRO A 43 5.967 -13.971 3.359 1.00 74.04 H new ATOM 0 HD3 PRO A 43 5.769 -12.317 2.816 1.00 74.04 H new ATOM 658 N ALA A 44 3.487 -14.342 6.303 1.00 63.12 N ATOM 659 CA ALA A 44 2.909 -15.247 7.282 1.00 41.05 C ATOM 660 C ALA A 44 3.260 -14.814 8.702 1.00 15.45 C ATOM 661 O ALA A 44 2.612 -15.226 9.664 1.00 11.30 O ATOM 662 CB ALA A 44 3.387 -16.669 7.028 1.00 44.02 C ATOM 0 H ALA A 44 4.313 -14.706 5.828 1.00 63.12 H new ATOM 0 HA ALA A 44 1.824 -15.215 7.178 1.00 41.05 H new ATOM 0 HB1 ALA A 44 2.947 -17.338 7.768 1.00 44.02 H new ATOM 0 HB2 ALA A 44 3.083 -16.982 6.029 1.00 44.02 H new ATOM 0 HB3 ALA A 44 4.474 -16.707 7.105 1.00 44.02 H new ATOM 668 N ALA A 45 4.285 -13.984 8.828 1.00 21.21 N ATOM 669 CA ALA A 45 4.743 -13.537 10.134 1.00 12.32 C ATOM 670 C ALA A 45 4.223 -12.140 10.461 1.00 70.10 C ATOM 671 O ALA A 45 3.369 -11.967 11.331 1.00 31.25 O ATOM 672 CB ALA A 45 6.263 -13.567 10.201 1.00 64.53 C ATOM 0 H ALA A 45 4.815 -13.607 8.042 1.00 21.21 H new ATOM 0 HA ALA A 45 4.343 -14.223 10.880 1.00 12.32 H new ATOM 0 HB1 ALA A 45 6.591 -13.230 11.184 1.00 64.53 H new ATOM 0 HB2 ALA A 45 6.615 -14.585 10.031 1.00 64.53 H new ATOM 0 HB3 ALA A 45 6.674 -12.908 9.436 1.00 64.53 H new ATOM 678 N ALA A 46 4.734 -11.150 9.742 1.00 62.12 N ATOM 679 CA ALA A 46 4.441 -9.754 10.044 1.00 71.34 C ATOM 680 C ALA A 46 3.123 -9.301 9.424 1.00 43.22 C ATOM 681 O ALA A 46 2.306 -8.652 10.082 1.00 61.23 O ATOM 682 CB ALA A 46 5.584 -8.872 9.566 1.00 43.34 C ATOM 0 H ALA A 46 5.354 -11.287 8.944 1.00 62.12 H new ATOM 0 HA ALA A 46 4.338 -9.660 11.125 1.00 71.34 H new ATOM 0 HB1 ALA A 46 5.360 -7.830 9.794 1.00 43.34 H new ATOM 0 HB2 ALA A 46 6.505 -9.164 10.071 1.00 43.34 H new ATOM 0 HB3 ALA A 46 5.708 -8.989 8.489 1.00 43.34 H new ATOM 688 N THR A 47 2.908 -9.675 8.172 1.00 11.30 N ATOM 689 CA THR A 47 1.755 -9.220 7.408 1.00 64.24 C ATOM 690 C THR A 47 0.502 -10.041 7.733 1.00 53.15 C ATOM 691 O THR A 47 -0.513 -9.970 7.037 1.00 53.01 O ATOM 692 CB THR A 47 2.065 -9.310 5.909 1.00 22.54 C ATOM 693 OG1 THR A 47 3.463 -9.068 5.709 1.00 61.31 O ATOM 694 CG2 THR A 47 1.258 -8.290 5.123 1.00 74.23 C ATOM 0 H THR A 47 3.527 -10.302 7.657 1.00 11.30 H new ATOM 0 HA THR A 47 1.553 -8.185 7.683 1.00 64.24 H new ATOM 0 HB THR A 47 1.797 -10.305 5.554 1.00 22.54 H new ATOM 0 HG1 THR A 47 3.593 -8.575 4.872 1.00 61.31 H new ATOM 0 HG21 THR A 47 1.497 -8.376 4.063 1.00 74.23 H new ATOM 0 HG22 THR A 47 0.194 -8.475 5.271 1.00 74.23 H new ATOM 0 HG23 THR A 47 1.503 -7.286 5.470 1.00 74.23 H new ATOM 702 N MET A 48 0.575 -10.797 8.815 1.00 13.55 N ATOM 703 CA MET A 48 -0.536 -11.572 9.291 1.00 32.43 C ATOM 704 C MET A 48 -1.180 -10.791 10.411 1.00 62.23 C ATOM 705 O MET A 48 -0.669 -10.745 11.532 1.00 54.42 O ATOM 706 CB MET A 48 -0.089 -12.959 9.765 1.00 42.32 C ATOM 707 CG MET A 48 -1.227 -13.814 10.305 1.00 2.45 C ATOM 708 SD MET A 48 -0.726 -15.508 10.669 1.00 22.31 S ATOM 709 CE MET A 48 -0.430 -16.136 9.015 1.00 54.14 C ATOM 0 H MET A 48 1.416 -10.884 9.385 1.00 13.55 H new ATOM 0 HA MET A 48 -1.251 -11.742 8.486 1.00 32.43 H new ATOM 0 HB2 MET A 48 0.385 -13.482 8.935 1.00 42.32 H new ATOM 0 HB3 MET A 48 0.667 -12.842 10.542 1.00 42.32 H new ATOM 0 HG2 MET A 48 -1.620 -13.355 11.212 1.00 2.45 H new ATOM 0 HG3 MET A 48 -2.039 -13.830 9.578 1.00 2.45 H new ATOM 0 HE1 MET A 48 -1.077 -16.993 8.830 1.00 54.14 H new ATOM 0 HE2 MET A 48 -0.645 -15.355 8.285 1.00 54.14 H new ATOM 0 HE3 MET A 48 0.612 -16.442 8.923 1.00 54.14 H new ATOM 719 N ARG A 49 -2.269 -10.140 10.049 1.00 65.21 N ATOM 720 CA ARG A 49 -3.012 -9.228 10.926 1.00 43.11 C ATOM 721 C ARG A 49 -2.276 -7.887 10.979 1.00 32.01 C ATOM 722 O ARG A 49 -1.376 -7.649 10.171 1.00 72.30 O ATOM 723 CB ARG A 49 -3.168 -9.819 12.343 1.00 62.41 C ATOM 724 CG ARG A 49 -4.379 -9.313 13.115 1.00 42.24 C ATOM 725 CD ARG A 49 -5.670 -9.869 12.541 1.00 25.05 C ATOM 726 NE ARG A 49 -5.657 -11.329 12.501 1.00 2.02 N ATOM 727 CZ ARG A 49 -6.246 -12.054 11.557 1.00 14.23 C ATOM 728 NH1 ARG A 49 -6.929 -11.462 10.584 1.00 74.02 N ATOM 729 NH2 ARG A 49 -6.152 -13.375 11.596 1.00 41.44 N ATOM 0 H ARG A 49 -2.678 -10.226 9.119 1.00 65.21 H new ATOM 0 HA ARG A 49 -4.015 -9.083 10.524 1.00 43.11 H new ATOM 0 HB2 ARG A 49 -3.232 -10.904 12.264 1.00 62.41 H new ATOM 0 HB3 ARG A 49 -2.269 -9.594 12.917 1.00 62.41 H new ATOM 0 HG2 ARG A 49 -4.291 -9.600 14.163 1.00 42.24 H new ATOM 0 HG3 ARG A 49 -4.404 -8.224 13.084 1.00 42.24 H new ATOM 0 HD2 ARG A 49 -6.513 -9.529 13.143 1.00 25.05 H new ATOM 0 HD3 ARG A 49 -5.819 -9.478 11.534 1.00 25.05 H new ATOM 0 HE ARG A 49 -5.164 -11.823 13.245 1.00 2.02 H new ATOM 0 HH11 ARG A 49 -7.003 -10.445 10.559 1.00 74.02 H new ATOM 0 HH12 ARG A 49 -7.379 -12.024 9.862 1.00 74.02 H new ATOM 0 HH21 ARG A 49 -5.630 -13.827 12.347 1.00 41.44 H new ATOM 0 HH22 ARG A 49 -6.601 -13.940 10.875 1.00 41.44 H new ATOM 743 N ASN A 50 -2.693 -7.005 11.884 1.00 1.31 N ATOM 744 CA ASN A 50 -2.058 -5.697 12.070 1.00 2.11 C ATOM 745 C ASN A 50 -2.371 -4.765 10.900 1.00 2.53 C ATOM 746 O ASN A 50 -3.346 -4.015 10.938 1.00 74.34 O ATOM 747 CB ASN A 50 -0.533 -5.824 12.242 1.00 34.10 C ATOM 748 CG ASN A 50 -0.132 -6.696 13.417 1.00 63.11 C ATOM 749 OD1 ASN A 50 -0.802 -6.723 14.453 1.00 22.51 O ATOM 750 ND2 ASN A 50 0.959 -7.433 13.256 1.00 62.45 N ATOM 0 H ASN A 50 -3.480 -7.174 12.510 1.00 1.31 H new ATOM 0 HA ASN A 50 -2.470 -5.270 12.984 1.00 2.11 H new ATOM 0 HB2 ASN A 50 -0.105 -6.237 11.329 1.00 34.10 H new ATOM 0 HB3 ASN A 50 -0.105 -4.830 12.373 1.00 34.10 H new ATOM 0 HD21 ASN A 50 1.272 -8.051 14.005 1.00 62.45 H new ATOM 0 HD22 ASN A 50 1.485 -7.382 12.384 1.00 62.45 H new ATOM 757 N VAL A 51 -1.576 -4.867 9.840 1.00 11.12 N ATOM 758 CA VAL A 51 -1.674 -3.957 8.700 1.00 71.33 C ATOM 759 C VAL A 51 -3.019 -4.103 7.993 1.00 12.55 C ATOM 760 O VAL A 51 -3.598 -3.121 7.527 1.00 11.23 O ATOM 761 CB VAL A 51 -0.542 -4.212 7.683 1.00 74.03 C ATOM 762 CG1 VAL A 51 -0.517 -3.129 6.615 1.00 63.13 C ATOM 763 CG2 VAL A 51 0.805 -4.303 8.380 1.00 42.20 C ATOM 0 H VAL A 51 -0.850 -5.577 9.745 1.00 11.12 H new ATOM 0 HA VAL A 51 -1.582 -2.944 9.093 1.00 71.33 H new ATOM 0 HB VAL A 51 -0.740 -5.167 7.197 1.00 74.03 H new ATOM 0 HG11 VAL A 51 0.290 -3.331 5.910 1.00 63.13 H new ATOM 0 HG12 VAL A 51 -1.469 -3.120 6.084 1.00 63.13 H new ATOM 0 HG13 VAL A 51 -0.354 -2.159 7.084 1.00 63.13 H new ATOM 0 HG21 VAL A 51 1.586 -4.483 7.641 1.00 42.20 H new ATOM 0 HG22 VAL A 51 1.008 -3.368 8.902 1.00 42.20 H new ATOM 0 HG23 VAL A 51 0.789 -5.123 9.098 1.00 42.20 H new ATOM 773 N ALA A 52 -3.516 -5.334 7.944 1.00 25.12 N ATOM 774 CA ALA A 52 -4.756 -5.646 7.238 1.00 72.11 C ATOM 775 C ALA A 52 -5.936 -4.841 7.778 1.00 71.21 C ATOM 776 O ALA A 52 -6.898 -4.571 7.054 1.00 64.32 O ATOM 777 CB ALA A 52 -5.054 -7.134 7.331 1.00 51.41 C ATOM 0 H ALA A 52 -3.075 -6.139 8.389 1.00 25.12 H new ATOM 0 HA ALA A 52 -4.617 -5.369 6.193 1.00 72.11 H new ATOM 0 HB1 ALA A 52 -5.981 -7.353 6.801 1.00 51.41 H new ATOM 0 HB2 ALA A 52 -4.237 -7.698 6.881 1.00 51.41 H new ATOM 0 HB3 ALA A 52 -5.159 -7.419 8.378 1.00 51.41 H new ATOM 783 N GLY A 53 -5.857 -4.459 9.049 1.00 62.12 N ATOM 784 CA GLY A 53 -6.915 -3.677 9.652 1.00 13.04 C ATOM 785 C GLY A 53 -6.917 -2.243 9.166 1.00 5.25 C ATOM 786 O GLY A 53 -7.965 -1.692 8.831 1.00 43.01 O ATOM 0 H GLY A 53 -5.078 -4.678 9.670 1.00 62.12 H new ATOM 0 HA2 GLY A 53 -7.877 -4.136 9.426 1.00 13.04 H new ATOM 0 HA3 GLY A 53 -6.802 -3.691 10.736 1.00 13.04 H new ATOM 790 N GLU A 54 -5.735 -1.648 9.094 1.00 12.34 N ATOM 791 CA GLU A 54 -5.599 -0.249 8.709 1.00 50.40 C ATOM 792 C GLU A 54 -5.942 -0.039 7.232 1.00 40.23 C ATOM 793 O GLU A 54 -6.420 1.027 6.840 1.00 11.31 O ATOM 794 CB GLU A 54 -4.178 0.247 9.003 1.00 12.04 C ATOM 795 CG GLU A 54 -3.931 0.607 10.467 1.00 11.30 C ATOM 796 CD GLU A 54 -4.018 -0.580 11.411 1.00 35.11 C ATOM 797 OE1 GLU A 54 -5.142 -0.939 11.823 1.00 62.13 O ATOM 798 OE2 GLU A 54 -2.959 -1.143 11.760 1.00 33.13 O ATOM 0 H GLU A 54 -4.851 -2.115 9.298 1.00 12.34 H new ATOM 0 HA GLU A 54 -6.307 0.331 9.301 1.00 50.40 H new ATOM 0 HB2 GLU A 54 -3.467 -0.524 8.705 1.00 12.04 H new ATOM 0 HB3 GLU A 54 -3.976 1.123 8.386 1.00 12.04 H new ATOM 0 HG2 GLU A 54 -2.944 1.061 10.559 1.00 11.30 H new ATOM 0 HG3 GLU A 54 -4.658 1.359 10.775 1.00 11.30 H new ATOM 805 N ILE A 55 -5.712 -1.062 6.421 1.00 3.13 N ATOM 806 CA ILE A 55 -6.003 -0.991 4.991 1.00 75.23 C ATOM 807 C ILE A 55 -7.514 -1.002 4.736 1.00 43.45 C ATOM 808 O ILE A 55 -7.990 -0.424 3.757 1.00 23.15 O ATOM 809 CB ILE A 55 -5.347 -2.160 4.222 1.00 15.04 C ATOM 810 CG1 ILE A 55 -3.837 -2.201 4.483 1.00 61.33 C ATOM 811 CG2 ILE A 55 -5.625 -2.054 2.727 1.00 74.01 C ATOM 812 CD1 ILE A 55 -3.103 -0.946 4.056 1.00 53.04 C ATOM 0 H ILE A 55 -5.324 -1.954 6.727 1.00 3.13 H new ATOM 0 HA ILE A 55 -5.584 -0.053 4.627 1.00 75.23 H new ATOM 0 HB ILE A 55 -5.786 -3.089 4.586 1.00 15.04 H new ATOM 0 HG12 ILE A 55 -3.667 -2.365 5.547 1.00 61.33 H new ATOM 0 HG13 ILE A 55 -3.411 -3.055 3.957 1.00 61.33 H new ATOM 0 HG21 ILE A 55 -5.152 -2.888 2.209 1.00 74.01 H new ATOM 0 HG22 ILE A 55 -6.701 -2.082 2.554 1.00 74.01 H new ATOM 0 HG23 ILE A 55 -5.221 -1.116 2.347 1.00 74.01 H new ATOM 0 HD11 ILE A 55 -2.040 -1.054 4.274 1.00 53.04 H new ATOM 0 HD12 ILE A 55 -3.240 -0.791 2.986 1.00 53.04 H new ATOM 0 HD13 ILE A 55 -3.500 -0.089 4.601 1.00 53.04 H new ATOM 824 N ALA A 56 -8.258 -1.650 5.629 1.00 5.32 N ATOM 825 CA ALA A 56 -9.698 -1.853 5.452 1.00 34.34 C ATOM 826 C ALA A 56 -10.452 -0.542 5.209 1.00 31.44 C ATOM 827 O ALA A 56 -11.399 -0.504 4.423 1.00 43.45 O ATOM 828 CB ALA A 56 -10.278 -2.573 6.658 1.00 14.13 C ATOM 0 H ALA A 56 -7.885 -2.048 6.491 1.00 5.32 H new ATOM 0 HA ALA A 56 -9.827 -2.467 4.561 1.00 34.34 H new ATOM 0 HB1 ALA A 56 -11.349 -2.718 6.515 1.00 14.13 H new ATOM 0 HB2 ALA A 56 -9.792 -3.542 6.771 1.00 14.13 H new ATOM 0 HB3 ALA A 56 -10.109 -1.976 7.554 1.00 14.13 H new ATOM 834 N ALA A 57 -10.026 0.529 5.868 1.00 44.31 N ATOM 835 CA ALA A 57 -10.668 1.831 5.704 1.00 75.51 C ATOM 836 C ALA A 57 -10.511 2.347 4.276 1.00 65.55 C ATOM 837 O ALA A 57 -11.422 2.964 3.722 1.00 51.15 O ATOM 838 CB ALA A 57 -10.093 2.832 6.692 1.00 65.03 C ATOM 0 H ALA A 57 -9.241 0.524 6.520 1.00 44.31 H new ATOM 0 HA ALA A 57 -11.733 1.709 5.904 1.00 75.51 H new ATOM 0 HB1 ALA A 57 -10.581 3.797 6.558 1.00 65.03 H new ATOM 0 HB2 ALA A 57 -10.263 2.478 7.709 1.00 65.03 H new ATOM 0 HB3 ALA A 57 -9.022 2.940 6.519 1.00 65.03 H new ATOM 844 N ALA A 58 -9.356 2.080 3.683 1.00 24.14 N ATOM 845 CA ALA A 58 -9.080 2.512 2.321 1.00 73.01 C ATOM 846 C ALA A 58 -9.836 1.646 1.325 1.00 34.33 C ATOM 847 O ALA A 58 -10.150 2.083 0.220 1.00 23.12 O ATOM 848 CB ALA A 58 -7.588 2.468 2.041 1.00 63.15 C ATOM 0 H ALA A 58 -8.594 1.565 4.125 1.00 24.14 H new ATOM 0 HA ALA A 58 -9.420 3.542 2.210 1.00 73.01 H new ATOM 0 HB1 ALA A 58 -7.400 2.794 1.018 1.00 63.15 H new ATOM 0 HB2 ALA A 58 -7.068 3.129 2.734 1.00 63.15 H new ATOM 0 HB3 ALA A 58 -7.224 1.449 2.170 1.00 63.15 H new ATOM 854 N LEU A 59 -10.139 0.420 1.733 1.00 13.01 N ATOM 855 CA LEU A 59 -10.885 -0.507 0.892 1.00 35.14 C ATOM 856 C LEU A 59 -12.283 0.035 0.615 1.00 21.52 C ATOM 857 O LEU A 59 -12.828 -0.146 -0.474 1.00 21.43 O ATOM 858 CB LEU A 59 -10.956 -1.881 1.565 1.00 62.11 C ATOM 859 CG LEU A 59 -11.636 -2.990 0.755 1.00 65.24 C ATOM 860 CD1 LEU A 59 -10.892 -4.302 0.933 1.00 41.43 C ATOM 861 CD2 LEU A 59 -13.087 -3.153 1.185 1.00 74.43 C ATOM 0 H LEU A 59 -9.878 0.044 2.645 1.00 13.01 H new ATOM 0 HA LEU A 59 -10.369 -0.615 -0.062 1.00 35.14 H new ATOM 0 HB2 LEU A 59 -9.941 -2.201 1.801 1.00 62.11 H new ATOM 0 HB3 LEU A 59 -11.485 -1.773 2.512 1.00 62.11 H new ATOM 0 HG LEU A 59 -11.614 -2.709 -0.298 1.00 65.24 H new ATOM 0 HD11 LEU A 59 -11.385 -5.082 0.352 1.00 41.43 H new ATOM 0 HD12 LEU A 59 -9.865 -4.187 0.588 1.00 41.43 H new ATOM 0 HD13 LEU A 59 -10.892 -4.580 1.987 1.00 41.43 H new ATOM 0 HD21 LEU A 59 -13.553 -3.945 0.599 1.00 74.43 H new ATOM 0 HD22 LEU A 59 -13.126 -3.413 2.243 1.00 74.43 H new ATOM 0 HD23 LEU A 59 -13.622 -2.218 1.022 1.00 74.43 H new ATOM 873 N TYR A 60 -12.857 0.708 1.602 1.00 63.44 N ATOM 874 CA TYR A 60 -14.158 1.347 1.432 1.00 31.44 C ATOM 875 C TYR A 60 -14.055 2.507 0.440 1.00 34.32 C ATOM 876 O TYR A 60 -14.957 2.729 -0.373 1.00 4.21 O ATOM 877 CB TYR A 60 -14.695 1.837 2.779 1.00 62.10 C ATOM 878 CG TYR A 60 -16.012 2.574 2.674 1.00 70.55 C ATOM 879 CD1 TYR A 60 -17.205 1.886 2.481 1.00 43.35 C ATOM 880 CD2 TYR A 60 -16.059 3.960 2.751 1.00 44.24 C ATOM 881 CE1 TYR A 60 -18.406 2.560 2.370 1.00 51.22 C ATOM 882 CE2 TYR A 60 -17.255 4.640 2.636 1.00 51.41 C ATOM 883 CZ TYR A 60 -18.425 3.936 2.446 1.00 54.34 C ATOM 884 OH TYR A 60 -19.616 4.613 2.323 1.00 74.21 O ATOM 0 H TYR A 60 -12.445 0.827 2.528 1.00 63.44 H new ATOM 0 HA TYR A 60 -14.856 0.611 1.032 1.00 31.44 H new ATOM 0 HB2 TYR A 60 -14.819 0.982 3.444 1.00 62.10 H new ATOM 0 HB3 TYR A 60 -13.956 2.494 3.238 1.00 62.10 H new ATOM 0 HD1 TYR A 60 -17.193 0.808 2.417 1.00 43.35 H new ATOM 0 HD2 TYR A 60 -15.145 4.515 2.903 1.00 44.24 H new ATOM 0 HE1 TYR A 60 -19.325 2.012 2.224 1.00 51.22 H new ATOM 0 HE2 TYR A 60 -17.274 5.718 2.695 1.00 51.41 H new ATOM 0 HH TYR A 60 -19.454 5.576 2.401 1.00 74.21 H new ATOM 894 N ALA A 61 -12.940 3.227 0.497 1.00 51.12 N ATOM 895 CA ALA A 61 -12.699 4.337 -0.418 1.00 34.31 C ATOM 896 C ALA A 61 -12.598 3.831 -1.853 1.00 11.42 C ATOM 897 O ALA A 61 -13.136 4.443 -2.776 1.00 20.22 O ATOM 898 CB ALA A 61 -11.435 5.093 -0.026 1.00 74.22 C ATOM 0 H ALA A 61 -12.189 3.062 1.167 1.00 51.12 H new ATOM 0 HA ALA A 61 -13.542 5.025 -0.353 1.00 34.31 H new ATOM 0 HB1 ALA A 61 -11.273 5.917 -0.721 1.00 74.22 H new ATOM 0 HB2 ALA A 61 -11.545 5.487 0.984 1.00 74.22 H new ATOM 0 HB3 ALA A 61 -10.581 4.417 -0.060 1.00 74.22 H new ATOM 904 N VAL A 62 -11.912 2.703 -2.025 1.00 1.12 N ATOM 905 CA VAL A 62 -11.795 2.057 -3.331 1.00 54.54 C ATOM 906 C VAL A 62 -13.171 1.626 -3.838 1.00 0.23 C ATOM 907 O VAL A 62 -13.481 1.760 -5.024 1.00 70.22 O ATOM 908 CB VAL A 62 -10.857 0.830 -3.267 1.00 63.31 C ATOM 909 CG1 VAL A 62 -10.767 0.135 -4.618 1.00 32.14 C ATOM 910 CG2 VAL A 62 -9.475 1.241 -2.792 1.00 5.31 C ATOM 0 H VAL A 62 -11.426 2.215 -1.272 1.00 1.12 H new ATOM 0 HA VAL A 62 -11.367 2.783 -4.022 1.00 54.54 H new ATOM 0 HB VAL A 62 -11.278 0.124 -2.551 1.00 63.31 H new ATOM 0 HG11 VAL A 62 -10.100 -0.724 -4.542 1.00 32.14 H new ATOM 0 HG12 VAL A 62 -11.759 -0.201 -4.921 1.00 32.14 H new ATOM 0 HG13 VAL A 62 -10.378 0.832 -5.360 1.00 32.14 H new ATOM 0 HG21 VAL A 62 -8.828 0.365 -2.753 1.00 5.31 H new ATOM 0 HG22 VAL A 62 -9.055 1.972 -3.483 1.00 5.31 H new ATOM 0 HG23 VAL A 62 -9.548 1.682 -1.798 1.00 5.31 H new ATOM 920 N LYS A 63 -14.000 1.130 -2.926 1.00 64.14 N ATOM 921 CA LYS A 63 -15.362 0.733 -3.260 1.00 63.33 C ATOM 922 C LYS A 63 -16.159 1.913 -3.814 1.00 62.23 C ATOM 923 O LYS A 63 -16.828 1.793 -4.841 1.00 74.53 O ATOM 924 CB LYS A 63 -16.067 0.143 -2.036 1.00 12.25 C ATOM 925 CG LYS A 63 -15.626 -1.274 -1.710 1.00 60.32 C ATOM 926 CD LYS A 63 -16.500 -1.890 -0.630 1.00 44.35 C ATOM 927 CE LYS A 63 -16.205 -3.370 -0.448 1.00 51.34 C ATOM 928 NZ LYS A 63 -17.140 -4.017 0.513 1.00 53.24 N ATOM 0 H LYS A 63 -13.751 0.993 -1.946 1.00 64.14 H new ATOM 0 HA LYS A 63 -15.307 -0.033 -4.034 1.00 63.33 H new ATOM 0 HB2 LYS A 63 -15.877 0.782 -1.174 1.00 12.25 H new ATOM 0 HB3 LYS A 63 -17.143 0.150 -2.207 1.00 12.25 H new ATOM 0 HG2 LYS A 63 -15.670 -1.887 -2.610 1.00 60.32 H new ATOM 0 HG3 LYS A 63 -14.587 -1.267 -1.380 1.00 60.32 H new ATOM 0 HD2 LYS A 63 -16.337 -1.367 0.313 1.00 44.35 H new ATOM 0 HD3 LYS A 63 -17.550 -1.757 -0.891 1.00 44.35 H new ATOM 0 HE2 LYS A 63 -16.273 -3.873 -1.412 1.00 51.34 H new ATOM 0 HE3 LYS A 63 -15.181 -3.494 -0.095 1.00 51.34 H new ATOM 0 HZ1 LYS A 63 -16.901 -5.025 0.605 1.00 53.24 H new ATOM 0 HZ2 LYS A 63 -17.058 -3.555 1.441 1.00 53.24 H new ATOM 0 HZ3 LYS A 63 -18.115 -3.923 0.165 1.00 53.24 H new ATOM 942 N LYS A 64 -16.068 3.058 -3.145 1.00 72.25 N ATOM 943 CA LYS A 64 -16.768 4.257 -3.595 1.00 52.33 C ATOM 944 C LYS A 64 -16.175 4.787 -4.895 1.00 3.45 C ATOM 945 O LYS A 64 -16.875 5.401 -5.699 1.00 23.33 O ATOM 946 CB LYS A 64 -16.737 5.350 -2.527 1.00 21.12 C ATOM 947 CG LYS A 64 -17.668 5.083 -1.357 1.00 12.14 C ATOM 948 CD LYS A 64 -17.747 6.280 -0.424 1.00 54.32 C ATOM 949 CE LYS A 64 -18.175 7.541 -1.159 1.00 62.54 C ATOM 950 NZ LYS A 64 -18.373 8.685 -0.235 1.00 5.20 N ATOM 0 H LYS A 64 -15.520 3.181 -2.294 1.00 72.25 H new ATOM 0 HA LYS A 64 -17.806 3.975 -3.775 1.00 52.33 H new ATOM 0 HB2 LYS A 64 -15.718 5.453 -2.154 1.00 21.12 H new ATOM 0 HB3 LYS A 64 -17.006 6.302 -2.985 1.00 21.12 H new ATOM 0 HG2 LYS A 64 -18.664 4.845 -1.730 1.00 12.14 H new ATOM 0 HG3 LYS A 64 -17.318 4.211 -0.804 1.00 12.14 H new ATOM 0 HD2 LYS A 64 -18.454 6.069 0.379 1.00 54.32 H new ATOM 0 HD3 LYS A 64 -16.775 6.443 0.042 1.00 54.32 H new ATOM 0 HE2 LYS A 64 -17.420 7.801 -1.901 1.00 62.54 H new ATOM 0 HE3 LYS A 64 -19.101 7.348 -1.700 1.00 62.54 H new ATOM 0 HZ1 LYS A 64 -18.664 9.523 -0.778 1.00 5.20 H new ATOM 0 HZ2 LYS A 64 -19.111 8.448 0.458 1.00 5.20 H new ATOM 0 HZ3 LYS A 64 -17.483 8.887 0.263 1.00 5.20 H new ATOM 964 N ALA A 65 -14.888 4.539 -5.102 1.00 15.42 N ATOM 965 CA ALA A 65 -14.203 4.986 -6.310 1.00 21.20 C ATOM 966 C ALA A 65 -14.819 4.358 -7.556 1.00 33.13 C ATOM 967 O ALA A 65 -14.793 4.949 -8.637 1.00 42.01 O ATOM 968 CB ALA A 65 -12.721 4.661 -6.230 1.00 75.22 C ATOM 0 H ALA A 65 -14.295 4.029 -4.447 1.00 15.42 H new ATOM 0 HA ALA A 65 -14.321 6.067 -6.384 1.00 21.20 H new ATOM 0 HB1 ALA A 65 -12.224 5.001 -7.139 1.00 75.22 H new ATOM 0 HB2 ALA A 65 -12.284 5.165 -5.368 1.00 75.22 H new ATOM 0 HB3 ALA A 65 -12.590 3.584 -6.126 1.00 75.22 H new ATOM 974 N SER A 66 -15.383 3.165 -7.396 1.00 34.14 N ATOM 975 CA SER A 66 -16.043 2.478 -8.495 1.00 1.44 C ATOM 976 C SER A 66 -17.287 3.252 -8.924 1.00 25.21 C ATOM 977 O SER A 66 -17.572 3.386 -10.116 1.00 11.01 O ATOM 978 CB SER A 66 -16.418 1.048 -8.085 1.00 74.34 C ATOM 979 OG SER A 66 -16.916 0.310 -9.189 1.00 51.40 O ATOM 0 H SER A 66 -15.395 2.655 -6.513 1.00 34.14 H new ATOM 0 HA SER A 66 -15.355 2.424 -9.338 1.00 1.44 H new ATOM 0 HB2 SER A 66 -15.544 0.544 -7.673 1.00 74.34 H new ATOM 0 HB3 SER A 66 -17.170 1.079 -7.296 1.00 74.34 H new ATOM 0 HG SER A 66 -17.145 -0.598 -8.899 1.00 51.40 H new ATOM 985 N GLN A 67 -18.008 3.783 -7.944 1.00 50.43 N ATOM 986 CA GLN A 67 -19.205 4.566 -8.212 1.00 45.03 C ATOM 987 C GLN A 67 -18.824 5.902 -8.835 1.00 30.00 C ATOM 988 O GLN A 67 -19.461 6.367 -9.783 1.00 34.01 O ATOM 989 CB GLN A 67 -19.984 4.798 -6.917 1.00 2.31 C ATOM 990 CG GLN A 67 -21.459 5.087 -7.136 1.00 24.33 C ATOM 991 CD GLN A 67 -22.190 5.390 -5.845 1.00 51.25 C ATOM 992 OE1 GLN A 67 -21.818 4.907 -4.774 1.00 71.55 O ATOM 993 NE2 GLN A 67 -23.248 6.177 -5.940 1.00 14.21 N ATOM 0 H GLN A 67 -17.783 3.684 -6.954 1.00 50.43 H new ATOM 0 HA GLN A 67 -19.836 4.015 -8.909 1.00 45.03 H new ATOM 0 HB2 GLN A 67 -19.886 3.918 -6.281 1.00 2.31 H new ATOM 0 HB3 GLN A 67 -19.535 5.632 -6.378 1.00 2.31 H new ATOM 0 HG2 GLN A 67 -21.563 5.933 -7.815 1.00 24.33 H new ATOM 0 HG3 GLN A 67 -21.926 4.230 -7.621 1.00 24.33 H new ATOM 0 HE21 GLN A 67 -23.522 6.556 -6.846 1.00 14.21 H new ATOM 0 HE22 GLN A 67 -23.790 6.405 -5.107 1.00 14.21 H new ATOM 1002 N LEU A 68 -17.765 6.500 -8.299 1.00 11.51 N ATOM 1003 CA LEU A 68 -17.254 7.779 -8.787 1.00 32.03 C ATOM 1004 C LEU A 68 -16.644 7.627 -10.181 1.00 33.50 C ATOM 1005 O LEU A 68 -16.542 8.597 -10.932 1.00 25.34 O ATOM 1006 CB LEU A 68 -16.207 8.339 -7.812 1.00 24.01 C ATOM 1007 CG LEU A 68 -16.755 9.141 -6.617 1.00 23.31 C ATOM 1008 CD1 LEU A 68 -17.848 8.381 -5.881 1.00 64.34 C ATOM 1009 CD2 LEU A 68 -15.627 9.484 -5.658 1.00 4.45 C ATOM 0 H LEU A 68 -17.237 6.114 -7.516 1.00 11.51 H new ATOM 0 HA LEU A 68 -18.089 8.476 -8.852 1.00 32.03 H new ATOM 0 HB2 LEU A 68 -15.618 7.507 -7.426 1.00 24.01 H new ATOM 0 HB3 LEU A 68 -15.525 8.980 -8.371 1.00 24.01 H new ATOM 0 HG LEU A 68 -17.193 10.059 -7.008 1.00 23.31 H new ATOM 0 HD11 LEU A 68 -18.208 8.980 -5.045 1.00 64.34 H new ATOM 0 HD12 LEU A 68 -18.673 8.178 -6.564 1.00 64.34 H new ATOM 0 HD13 LEU A 68 -17.447 7.439 -5.506 1.00 64.34 H new ATOM 0 HD21 LEU A 68 -16.025 10.051 -4.816 1.00 4.45 H new ATOM 0 HD22 LEU A 68 -15.168 8.565 -5.292 1.00 4.45 H new ATOM 0 HD23 LEU A 68 -14.878 10.082 -6.177 1.00 4.45 H new ATOM 1021 N GLY A 69 -16.234 6.407 -10.512 1.00 35.22 N ATOM 1022 CA GLY A 69 -15.700 6.130 -11.832 1.00 41.40 C ATOM 1023 C GLY A 69 -14.254 6.557 -11.975 1.00 31.14 C ATOM 1024 O GLY A 69 -13.829 6.992 -13.046 1.00 25.21 O ATOM 0 H GLY A 69 -16.263 5.602 -9.886 1.00 35.22 H new ATOM 0 HA2 GLY A 69 -15.782 5.063 -12.037 1.00 41.40 H new ATOM 0 HA3 GLY A 69 -16.303 6.645 -12.580 1.00 41.40 H new ATOM 1028 N VAL A 70 -13.490 6.430 -10.903 1.00 10.43 N ATOM 1029 CA VAL A 70 -12.090 6.830 -10.916 1.00 33.35 C ATOM 1030 C VAL A 70 -11.191 5.669 -10.517 1.00 32.42 C ATOM 1031 O VAL A 70 -11.669 4.625 -10.073 1.00 2.34 O ATOM 1032 CB VAL A 70 -11.823 8.034 -9.982 1.00 60.43 C ATOM 1033 CG1 VAL A 70 -12.563 9.271 -10.469 1.00 52.44 C ATOM 1034 CG2 VAL A 70 -12.216 7.711 -8.547 1.00 35.30 C ATOM 0 H VAL A 70 -13.814 6.053 -10.012 1.00 10.43 H new ATOM 0 HA VAL A 70 -11.859 7.133 -11.937 1.00 33.35 H new ATOM 0 HB VAL A 70 -10.753 8.241 -10.004 1.00 60.43 H new ATOM 0 HG11 VAL A 70 -12.360 10.105 -9.797 1.00 52.44 H new ATOM 0 HG12 VAL A 70 -12.225 9.525 -11.474 1.00 52.44 H new ATOM 0 HG13 VAL A 70 -13.634 9.071 -10.486 1.00 52.44 H new ATOM 0 HG21 VAL A 70 -12.018 8.575 -7.912 1.00 35.30 H new ATOM 0 HG22 VAL A 70 -13.278 7.467 -8.507 1.00 35.30 H new ATOM 0 HG23 VAL A 70 -11.634 6.860 -8.193 1.00 35.30 H new ATOM 1044 N LYS A 71 -9.891 5.857 -10.678 1.00 74.14 N ATOM 1045 CA LYS A 71 -8.917 4.834 -10.330 1.00 54.23 C ATOM 1046 C LYS A 71 -8.040 5.332 -9.193 1.00 71.01 C ATOM 1047 O LYS A 71 -8.010 6.530 -8.902 1.00 44.13 O ATOM 1048 CB LYS A 71 -8.040 4.503 -11.543 1.00 75.32 C ATOM 1049 CG LYS A 71 -8.824 4.049 -12.763 1.00 55.00 C ATOM 1050 CD LYS A 71 -9.303 2.614 -12.634 1.00 62.31 C ATOM 1051 CE LYS A 71 -10.195 2.233 -13.801 1.00 43.05 C ATOM 1052 NZ LYS A 71 -10.424 0.768 -13.873 1.00 50.12 N ATOM 0 H LYS A 71 -9.483 6.715 -11.050 1.00 74.14 H new ATOM 0 HA LYS A 71 -9.447 3.934 -10.018 1.00 54.23 H new ATOM 0 HB2 LYS A 71 -7.454 5.383 -11.807 1.00 75.32 H new ATOM 0 HB3 LYS A 71 -7.333 3.721 -11.266 1.00 75.32 H new ATOM 0 HG2 LYS A 71 -9.682 4.705 -12.906 1.00 55.00 H new ATOM 0 HG3 LYS A 71 -8.199 4.143 -13.651 1.00 55.00 H new ATOM 0 HD2 LYS A 71 -8.445 1.943 -12.593 1.00 62.31 H new ATOM 0 HD3 LYS A 71 -9.849 2.492 -11.699 1.00 62.31 H new ATOM 0 HE2 LYS A 71 -11.153 2.745 -13.707 1.00 43.05 H new ATOM 0 HE3 LYS A 71 -9.741 2.575 -14.731 1.00 43.05 H new ATOM 0 HZ1 LYS A 71 -11.351 0.582 -14.307 1.00 50.12 H new ATOM 0 HZ2 LYS A 71 -9.678 0.328 -14.449 1.00 50.12 H new ATOM 0 HZ3 LYS A 71 -10.404 0.366 -12.914 1.00 50.12 H new ATOM 1066 N ILE A 72 -7.342 4.417 -8.538 1.00 65.35 N ATOM 1067 CA ILE A 72 -6.388 4.805 -7.504 1.00 2.42 C ATOM 1068 C ILE A 72 -4.958 4.594 -7.995 1.00 62.13 C ATOM 1069 O ILE A 72 -4.723 3.824 -8.928 1.00 1.03 O ATOM 1070 CB ILE A 72 -6.621 4.050 -6.169 1.00 62.12 C ATOM 1071 CG1 ILE A 72 -6.437 2.535 -6.324 1.00 55.21 C ATOM 1072 CG2 ILE A 72 -8.005 4.360 -5.621 1.00 22.31 C ATOM 1073 CD1 ILE A 72 -5.033 2.057 -6.016 1.00 50.35 C ATOM 0 H ILE A 72 -7.414 3.412 -8.699 1.00 65.35 H new ATOM 0 HA ILE A 72 -6.546 5.864 -7.302 1.00 2.42 H new ATOM 0 HB ILE A 72 -5.868 4.399 -5.462 1.00 62.12 H new ATOM 0 HG12 ILE A 72 -7.138 2.024 -5.665 1.00 55.21 H new ATOM 0 HG13 ILE A 72 -6.693 2.249 -7.344 1.00 55.21 H new ATOM 0 HG21 ILE A 72 -8.154 3.823 -4.684 1.00 22.31 H new ATOM 0 HG22 ILE A 72 -8.094 5.432 -5.443 1.00 22.31 H new ATOM 0 HG23 ILE A 72 -8.760 4.048 -6.342 1.00 22.31 H new ATOM 0 HD11 ILE A 72 -4.980 0.976 -6.147 1.00 50.35 H new ATOM 0 HD12 ILE A 72 -4.328 2.540 -6.692 1.00 50.35 H new ATOM 0 HD13 ILE A 72 -4.780 2.310 -4.986 1.00 50.35 H new ATOM 1085 N ARG A 73 -4.012 5.286 -7.381 1.00 11.21 N ATOM 1086 CA ARG A 73 -2.618 5.196 -7.793 1.00 22.22 C ATOM 1087 C ARG A 73 -1.881 4.118 -7.006 1.00 72.13 C ATOM 1088 O ARG A 73 -1.627 4.260 -5.812 1.00 61.40 O ATOM 1089 CB ARG A 73 -1.937 6.555 -7.644 1.00 20.35 C ATOM 1090 CG ARG A 73 -2.508 7.594 -8.593 1.00 35.30 C ATOM 1091 CD ARG A 73 -1.850 8.951 -8.418 1.00 65.24 C ATOM 1092 NE ARG A 73 -2.315 9.905 -9.421 1.00 43.12 N ATOM 1093 CZ ARG A 73 -2.234 11.227 -9.292 1.00 21.02 C ATOM 1094 NH1 ARG A 73 -1.728 11.770 -8.190 1.00 63.54 N ATOM 1095 NH2 ARG A 73 -2.671 12.003 -10.271 1.00 25.32 N ATOM 0 H ARG A 73 -4.182 5.916 -6.597 1.00 11.21 H new ATOM 0 HA ARG A 73 -2.585 4.909 -8.844 1.00 22.22 H new ATOM 0 HB2 ARG A 73 -2.048 6.904 -6.617 1.00 20.35 H new ATOM 0 HB3 ARG A 73 -0.868 6.446 -7.829 1.00 20.35 H new ATOM 0 HG2 ARG A 73 -2.375 7.257 -9.621 1.00 35.30 H new ATOM 0 HG3 ARG A 73 -3.581 7.687 -8.424 1.00 35.30 H new ATOM 0 HD2 ARG A 73 -2.066 9.335 -7.421 1.00 65.24 H new ATOM 0 HD3 ARG A 73 -0.768 8.844 -8.491 1.00 65.24 H new ATOM 0 HE ARG A 73 -2.729 9.534 -10.276 1.00 43.12 H new ATOM 0 HH11 ARG A 73 -1.397 11.172 -7.433 1.00 63.54 H new ATOM 0 HH12 ARG A 73 -1.671 12.785 -8.101 1.00 63.54 H new ATOM 0 HH21 ARG A 73 -3.065 11.587 -11.114 1.00 25.32 H new ATOM 0 HH22 ARG A 73 -2.613 13.017 -10.182 1.00 25.32 H new ATOM 1109 N ILE A 74 -1.565 3.032 -7.693 1.00 60.12 N ATOM 1110 CA ILE A 74 -0.925 1.876 -7.084 1.00 54.11 C ATOM 1111 C ILE A 74 0.473 1.660 -7.673 1.00 55.25 C ATOM 1112 O ILE A 74 0.700 1.920 -8.857 1.00 15.15 O ATOM 1113 CB ILE A 74 -1.795 0.612 -7.265 1.00 73.22 C ATOM 1114 CG1 ILE A 74 -1.191 -0.585 -6.527 1.00 71.30 C ATOM 1115 CG2 ILE A 74 -1.978 0.297 -8.740 1.00 72.35 C ATOM 1116 CD1 ILE A 74 -2.054 -1.826 -6.587 1.00 15.34 C ATOM 0 H ILE A 74 -1.745 2.927 -8.691 1.00 60.12 H new ATOM 0 HA ILE A 74 -0.820 2.067 -6.016 1.00 54.11 H new ATOM 0 HB ILE A 74 -2.774 0.812 -6.830 1.00 73.22 H new ATOM 0 HG12 ILE A 74 -0.214 -0.810 -6.954 1.00 71.30 H new ATOM 0 HG13 ILE A 74 -1.028 -0.315 -5.484 1.00 71.30 H new ATOM 0 HG21 ILE A 74 -2.593 -0.596 -8.848 1.00 72.35 H new ATOM 0 HG22 ILE A 74 -2.468 1.137 -9.233 1.00 72.35 H new ATOM 0 HG23 ILE A 74 -1.004 0.124 -9.199 1.00 72.35 H new ATOM 0 HD11 ILE A 74 -1.566 -2.635 -6.044 1.00 15.34 H new ATOM 0 HD12 ILE A 74 -3.023 -1.618 -6.134 1.00 15.34 H new ATOM 0 HD13 ILE A 74 -2.196 -2.121 -7.627 1.00 15.34 H new ATOM 1643 N ARG A 107 -10.517 -6.576 -7.917 1.00 53.14 N ATOM 1644 CA ARG A 107 -9.646 -5.738 -8.734 1.00 1.30 C ATOM 1645 C ARG A 107 -10.465 -4.975 -9.773 1.00 45.33 C ATOM 1646 O ARG A 107 -11.386 -5.523 -10.382 1.00 51.42 O ATOM 1647 CB ARG A 107 -8.564 -6.607 -9.396 1.00 3.34 C ATOM 1648 CG ARG A 107 -7.557 -5.854 -10.258 1.00 4.02 C ATOM 1649 CD ARG A 107 -8.023 -5.738 -11.702 1.00 64.43 C ATOM 1650 NE ARG A 107 -6.945 -5.315 -12.599 1.00 22.04 N ATOM 1651 CZ ARG A 107 -7.056 -5.265 -13.930 1.00 40.31 C ATOM 1652 NH1 ARG A 107 -8.205 -5.580 -14.523 1.00 23.05 N ATOM 1653 NH2 ARG A 107 -6.012 -4.896 -14.665 1.00 12.54 N ATOM 0 HA ARG A 107 -9.152 -5.002 -8.100 1.00 1.30 H new ATOM 0 HB2 ARG A 107 -8.021 -7.139 -8.615 1.00 3.34 H new ATOM 0 HB3 ARG A 107 -9.054 -7.360 -10.013 1.00 3.34 H new ATOM 0 HG2 ARG A 107 -7.400 -4.857 -9.846 1.00 4.02 H new ATOM 0 HG3 ARG A 107 -6.596 -6.367 -10.226 1.00 4.02 H new ATOM 0 HD2 ARG A 107 -8.413 -6.700 -12.034 1.00 64.43 H new ATOM 0 HD3 ARG A 107 -8.844 -5.023 -11.761 1.00 64.43 H new ATOM 0 HE ARG A 107 -6.055 -5.042 -12.182 1.00 22.04 H new ATOM 0 HH11 ARG A 107 -9.008 -5.862 -13.961 1.00 23.05 H new ATOM 0 HH12 ARG A 107 -8.282 -5.540 -15.539 1.00 23.05 H new ATOM 0 HH21 ARG A 107 -5.131 -4.652 -14.213 1.00 12.54 H new ATOM 0 HH22 ARG A 107 -6.092 -4.856 -15.681 1.00 12.54 H new ATOM 1667 N GLY A 108 -10.132 -3.705 -9.958 1.00 73.24 N ATOM 1668 CA GLY A 108 -10.866 -2.870 -10.886 1.00 74.42 C ATOM 1669 C GLY A 108 -10.502 -1.411 -10.730 1.00 70.12 C ATOM 1670 O GLY A 108 -10.150 -0.745 -11.699 1.00 21.42 O ATOM 0 H GLY A 108 -9.363 -3.237 -9.479 1.00 73.24 H new ATOM 0 HA2 GLY A 108 -10.658 -3.190 -11.907 1.00 74.42 H new ATOM 0 HA3 GLY A 108 -11.936 -2.998 -10.723 1.00 74.42 H new ATOM 1674 N ILE A 109 -10.587 -0.912 -9.506 1.00 24.21 N ATOM 1675 CA ILE A 109 -10.187 0.460 -9.213 1.00 11.02 C ATOM 1676 C ILE A 109 -8.683 0.537 -9.030 1.00 1.21 C ATOM 1677 O ILE A 109 -8.043 1.513 -9.427 1.00 25.24 O ATOM 1678 CB ILE A 109 -10.906 1.002 -7.962 1.00 32.33 C ATOM 1679 CG1 ILE A 109 -12.421 0.940 -8.169 1.00 32.21 C ATOM 1680 CG2 ILE A 109 -10.463 2.425 -7.654 1.00 41.12 C ATOM 1681 CD1 ILE A 109 -12.888 1.624 -9.439 1.00 10.53 C ATOM 0 H ILE A 109 -10.929 -1.434 -8.699 1.00 24.21 H new ATOM 0 HA ILE A 109 -10.477 1.083 -10.059 1.00 11.02 H new ATOM 0 HB ILE A 109 -10.639 0.379 -7.108 1.00 32.33 H new ATOM 0 HG12 ILE A 109 -12.734 -0.104 -8.192 1.00 32.21 H new ATOM 0 HG13 ILE A 109 -12.915 1.402 -7.314 1.00 32.21 H new ATOM 0 HG21 ILE A 109 -10.985 2.785 -6.767 1.00 41.12 H new ATOM 0 HG22 ILE A 109 -9.388 2.441 -7.474 1.00 41.12 H new ATOM 0 HG23 ILE A 109 -10.699 3.071 -8.500 1.00 41.12 H new ATOM 0 HD11 ILE A 109 -13.972 1.540 -9.520 1.00 10.53 H new ATOM 0 HD12 ILE A 109 -12.606 2.677 -9.410 1.00 10.53 H new ATOM 0 HD13 ILE A 109 -12.422 1.147 -10.301 1.00 10.53 H new ATOM 1693 N TYR A 110 -8.115 -0.494 -8.429 1.00 55.23 N ATOM 1694 CA TYR A 110 -6.675 -0.609 -8.372 1.00 45.41 C ATOM 1695 C TYR A 110 -6.207 -1.538 -9.482 1.00 31.21 C ATOM 1696 O TYR A 110 -6.874 -2.527 -9.798 1.00 22.51 O ATOM 1697 CB TYR A 110 -6.207 -1.121 -6.999 1.00 71.11 C ATOM 1698 CG TYR A 110 -6.602 -2.548 -6.689 1.00 60.13 C ATOM 1699 CD1 TYR A 110 -7.896 -2.866 -6.297 1.00 62.21 C ATOM 1700 CD2 TYR A 110 -5.673 -3.578 -6.783 1.00 13.44 C ATOM 1701 CE1 TYR A 110 -8.252 -4.169 -6.012 1.00 3.25 C ATOM 1702 CE2 TYR A 110 -6.023 -4.881 -6.500 1.00 44.23 C ATOM 1703 CZ TYR A 110 -7.311 -5.172 -6.114 1.00 42.24 C ATOM 1704 OH TYR A 110 -7.661 -6.471 -5.835 1.00 2.53 O ATOM 0 H TYR A 110 -8.625 -1.254 -7.979 1.00 55.23 H new ATOM 0 HA TYR A 110 -6.236 0.379 -8.513 1.00 45.41 H new ATOM 0 HB2 TYR A 110 -5.121 -1.039 -6.947 1.00 71.11 H new ATOM 0 HB3 TYR A 110 -6.614 -0.469 -6.225 1.00 71.11 H new ATOM 0 HD1 TYR A 110 -8.635 -2.082 -6.214 1.00 62.21 H new ATOM 0 HD2 TYR A 110 -4.660 -3.354 -7.083 1.00 13.44 H new ATOM 0 HE1 TYR A 110 -9.263 -4.402 -5.711 1.00 3.25 H new ATOM 0 HE2 TYR A 110 -5.290 -5.670 -6.581 1.00 44.23 H new ATOM 0 HH TYR A 110 -6.882 -7.053 -5.956 1.00 2.53 H new ATOM 1714 N SER A 111 -5.065 -1.217 -10.058 1.00 41.12 N ATOM 1715 CA SER A 111 -4.489 -2.000 -11.135 1.00 20.33 C ATOM 1716 C SER A 111 -3.114 -1.454 -11.460 1.00 65.13 C ATOM 1717 O SER A 111 -2.956 -0.247 -11.657 1.00 70.22 O ATOM 1718 CB SER A 111 -5.391 -1.952 -12.374 1.00 15.45 C ATOM 1719 OG SER A 111 -5.761 -0.616 -12.687 1.00 53.42 O ATOM 0 H SER A 111 -4.509 -0.404 -9.792 1.00 41.12 H new ATOM 0 HA SER A 111 -4.402 -3.040 -10.822 1.00 20.33 H new ATOM 0 HB2 SER A 111 -4.872 -2.397 -13.223 1.00 15.45 H new ATOM 0 HB3 SER A 111 -6.286 -2.549 -12.199 1.00 15.45 H new ATOM 0 HG SER A 111 -5.050 -0.005 -12.403 1.00 53.42 H new ATOM 1725 N PHE A 112 -2.125 -2.325 -11.524 1.00 73.45 N ATOM 1726 CA PHE A 112 -0.757 -1.876 -11.697 1.00 35.11 C ATOM 1727 C PHE A 112 -0.302 -2.051 -13.136 1.00 3.55 C ATOM 1728 O PHE A 112 -0.593 -3.059 -13.780 1.00 44.32 O ATOM 1729 CB PHE A 112 0.182 -2.617 -10.731 1.00 31.01 C ATOM 1730 CG PHE A 112 0.123 -4.120 -10.828 1.00 61.44 C ATOM 1731 CD1 PHE A 112 -0.849 -4.834 -10.141 1.00 2.11 C ATOM 1732 CD2 PHE A 112 1.040 -4.819 -11.600 1.00 0.33 C ATOM 1733 CE1 PHE A 112 -0.906 -6.212 -10.226 1.00 65.45 C ATOM 1734 CE2 PHE A 112 0.986 -6.197 -11.687 1.00 10.12 C ATOM 1735 CZ PHE A 112 0.012 -6.894 -10.999 1.00 53.12 C ATOM 0 H PHE A 112 -2.241 -3.336 -11.460 1.00 73.45 H new ATOM 0 HA PHE A 112 -0.718 -0.812 -11.463 1.00 35.11 H new ATOM 0 HB2 PHE A 112 1.206 -2.294 -10.920 1.00 31.01 H new ATOM 0 HB3 PHE A 112 -0.062 -2.322 -9.710 1.00 31.01 H new ATOM 0 HD1 PHE A 112 -1.569 -4.306 -9.533 1.00 2.11 H new ATOM 0 HD2 PHE A 112 1.805 -4.280 -12.139 1.00 0.33 H new ATOM 0 HE1 PHE A 112 -1.669 -6.755 -9.688 1.00 65.45 H new ATOM 0 HE2 PHE A 112 1.705 -6.729 -12.293 1.00 10.12 H new ATOM 0 HZ PHE A 112 -0.031 -7.971 -11.066 1.00 53.12 H new ATOM 1745 N GLU A 113 0.390 -1.042 -13.631 1.00 64.53 N ATOM 1746 CA GLU A 113 0.951 -1.064 -14.970 1.00 53.02 C ATOM 1747 C GLU A 113 2.404 -0.628 -14.904 1.00 21.43 C ATOM 1748 O GLU A 113 2.775 0.156 -14.022 1.00 71.04 O ATOM 1749 CB GLU A 113 0.176 -0.126 -15.900 1.00 42.43 C ATOM 1750 CG GLU A 113 -1.302 -0.458 -16.034 1.00 42.43 C ATOM 1751 CD GLU A 113 -2.011 0.459 -17.007 1.00 25.14 C ATOM 1752 OE1 GLU A 113 -1.932 0.209 -18.227 1.00 52.21 O ATOM 1753 OE2 GLU A 113 -2.648 1.437 -16.562 1.00 11.34 O ATOM 0 H GLU A 113 0.580 -0.182 -13.116 1.00 64.53 H new ATOM 0 HA GLU A 113 0.880 -2.077 -15.367 1.00 53.02 H new ATOM 0 HB2 GLU A 113 0.275 0.895 -15.532 1.00 42.43 H new ATOM 0 HB3 GLU A 113 0.634 -0.154 -16.889 1.00 42.43 H new ATOM 0 HG2 GLU A 113 -1.411 -1.491 -16.366 1.00 42.43 H new ATOM 0 HG3 GLU A 113 -1.779 -0.385 -15.056 1.00 42.43 H new ATOM 1760 N LYS A 114 3.226 -1.131 -15.807 1.00 61.25 N ATOM 1761 CA LYS A 114 4.611 -0.730 -15.854 1.00 44.25 C ATOM 1762 C LYS A 114 4.762 0.520 -16.708 1.00 30.43 C ATOM 1763 O LYS A 114 5.122 0.459 -17.884 1.00 11.52 O ATOM 1764 CB LYS A 114 5.480 -1.871 -16.373 1.00 43.14 C ATOM 1765 CG LYS A 114 5.382 -3.126 -15.523 1.00 20.34 C ATOM 1766 CD LYS A 114 6.441 -4.141 -15.893 1.00 0.54 C ATOM 1767 CE LYS A 114 6.267 -5.426 -15.103 1.00 13.11 C ATOM 1768 NZ LYS A 114 7.413 -6.352 -15.290 1.00 62.04 N ATOM 0 H LYS A 114 2.955 -1.815 -16.513 1.00 61.25 H new ATOM 0 HA LYS A 114 4.949 -0.493 -14.845 1.00 44.25 H new ATOM 0 HB2 LYS A 114 5.186 -2.108 -17.396 1.00 43.14 H new ATOM 0 HB3 LYS A 114 6.519 -1.542 -16.408 1.00 43.14 H new ATOM 0 HG2 LYS A 114 5.485 -2.861 -14.471 1.00 20.34 H new ATOM 0 HG3 LYS A 114 4.394 -3.571 -15.645 1.00 20.34 H new ATOM 0 HD2 LYS A 114 6.386 -4.356 -16.960 1.00 0.54 H new ATOM 0 HD3 LYS A 114 7.430 -3.725 -15.703 1.00 0.54 H new ATOM 0 HE2 LYS A 114 6.161 -5.189 -14.044 1.00 13.11 H new ATOM 0 HE3 LYS A 114 5.347 -5.921 -15.413 1.00 13.11 H new ATOM 0 HZ1 LYS A 114 7.255 -7.217 -14.734 1.00 62.04 H new ATOM 0 HZ2 LYS A 114 7.499 -6.599 -16.297 1.00 62.04 H new ATOM 0 HZ3 LYS A 114 8.288 -5.890 -14.970 1.00 62.04 H new ATOM 1782 N VAL A 115 4.430 1.647 -16.101 1.00 73.25 N ATOM 1783 CA VAL A 115 4.503 2.945 -16.752 1.00 1.45 C ATOM 1784 C VAL A 115 5.329 3.888 -15.893 1.00 51.15 C ATOM 1785 O VAL A 115 5.567 3.604 -14.718 1.00 14.21 O ATOM 1786 CB VAL A 115 3.100 3.559 -16.970 1.00 21.42 C ATOM 1787 CG1 VAL A 115 2.261 2.684 -17.887 1.00 14.52 C ATOM 1788 CG2 VAL A 115 2.389 3.781 -15.640 1.00 31.44 C ATOM 0 H VAL A 115 4.100 1.688 -15.137 1.00 73.25 H new ATOM 0 HA VAL A 115 4.966 2.805 -17.729 1.00 1.45 H new ATOM 0 HB VAL A 115 3.231 4.528 -17.451 1.00 21.42 H new ATOM 0 HG11 VAL A 115 1.279 3.137 -18.024 1.00 14.52 H new ATOM 0 HG12 VAL A 115 2.756 2.590 -18.854 1.00 14.52 H new ATOM 0 HG13 VAL A 115 2.145 1.696 -17.441 1.00 14.52 H new ATOM 0 HG21 VAL A 115 1.405 4.213 -15.821 1.00 31.44 H new ATOM 0 HG22 VAL A 115 2.277 2.828 -15.124 1.00 31.44 H new ATOM 0 HG23 VAL A 115 2.976 4.461 -15.023 1.00 31.44 H new ATOM 1798 N LYS A 116 5.790 4.985 -16.467 1.00 2.30 N ATOM 1799 CA LYS A 116 6.508 5.978 -15.687 1.00 35.52 C ATOM 1800 C LYS A 116 5.534 6.689 -14.747 1.00 71.54 C ATOM 1801 O LYS A 116 4.454 7.112 -15.164 1.00 44.41 O ATOM 1802 CB LYS A 116 7.258 6.963 -16.607 1.00 22.32 C ATOM 1803 CG LYS A 116 6.395 7.664 -17.646 1.00 34.24 C ATOM 1804 CD LYS A 116 5.652 8.854 -17.060 1.00 24.51 C ATOM 1805 CE LYS A 116 6.580 10.021 -16.761 1.00 52.51 C ATOM 1806 NZ LYS A 116 5.836 11.177 -16.196 1.00 23.22 N ATOM 0 H LYS A 116 5.683 5.209 -17.456 1.00 2.30 H new ATOM 0 HA LYS A 116 7.266 5.485 -15.078 1.00 35.52 H new ATOM 0 HB2 LYS A 116 7.739 7.720 -15.987 1.00 22.32 H new ATOM 0 HB3 LYS A 116 8.051 6.422 -17.122 1.00 22.32 H new ATOM 0 HG2 LYS A 116 7.022 7.999 -18.472 1.00 34.24 H new ATOM 0 HG3 LYS A 116 5.677 6.955 -18.058 1.00 34.24 H new ATOM 0 HD2 LYS A 116 4.879 9.176 -17.757 1.00 24.51 H new ATOM 0 HD3 LYS A 116 5.147 8.549 -16.143 1.00 24.51 H new ATOM 0 HE2 LYS A 116 7.350 9.704 -16.058 1.00 52.51 H new ATOM 0 HE3 LYS A 116 7.089 10.326 -17.675 1.00 52.51 H new ATOM 0 HZ1 LYS A 116 6.498 11.955 -16.004 1.00 23.22 H new ATOM 0 HZ2 LYS A 116 5.118 11.494 -16.878 1.00 23.22 H new ATOM 0 HZ3 LYS A 116 5.371 10.891 -15.311 1.00 23.22 H new ATOM 1820 N ALA A 117 5.901 6.766 -13.473 1.00 71.20 N ATOM 1821 CA ALA A 117 5.062 7.398 -12.456 1.00 33.31 C ATOM 1822 C ALA A 117 5.695 7.299 -11.071 1.00 10.51 C ATOM 1823 O ALA A 117 5.296 6.466 -10.257 1.00 12.40 O ATOM 1824 CB ALA A 117 3.667 6.778 -12.421 1.00 40.34 C ATOM 0 H ALA A 117 6.782 6.396 -13.115 1.00 71.20 H new ATOM 0 HA ALA A 117 4.975 8.450 -12.730 1.00 33.31 H new ATOM 0 HB1 ALA A 117 3.069 7.271 -11.654 1.00 40.34 H new ATOM 0 HB2 ALA A 117 3.188 6.905 -13.392 1.00 40.34 H new ATOM 0 HB3 ALA A 117 3.747 5.715 -12.192 1.00 40.34 H new ATOM 1830 N HIS A 118 6.716 8.106 -10.826 1.00 35.43 N ATOM 1831 CA HIS A 118 7.274 8.228 -9.480 1.00 2.01 C ATOM 1832 C HIS A 118 7.736 9.661 -9.236 1.00 34.44 C ATOM 1833 O HIS A 118 8.548 9.929 -8.356 1.00 60.11 O ATOM 1834 CB HIS A 118 8.414 7.218 -9.241 1.00 51.44 C ATOM 1835 CG HIS A 118 9.679 7.470 -10.006 1.00 23.23 C ATOM 1836 ND1 HIS A 118 10.803 8.025 -9.434 1.00 62.11 N ATOM 1837 CD2 HIS A 118 10.006 7.206 -11.291 1.00 41.23 C ATOM 1838 CE1 HIS A 118 11.765 8.093 -10.332 1.00 4.10 C ATOM 1839 NE2 HIS A 118 11.309 7.599 -11.467 1.00 72.32 N ATOM 0 H HIS A 118 7.174 8.683 -11.531 1.00 35.43 H new ATOM 0 HA HIS A 118 6.490 7.990 -8.761 1.00 2.01 H new ATOM 0 HB2 HIS A 118 8.650 7.210 -8.177 1.00 51.44 H new ATOM 0 HB3 HIS A 118 8.051 6.222 -9.494 1.00 51.44 H new ATOM 0 HD2 HIS A 118 9.362 6.768 -12.039 1.00 41.23 H new ATOM 0 HE1 HIS A 118 12.757 8.486 -10.167 1.00 4.10 H new ATOM 0 HE2 HIS A 118 11.839 7.522 -12.335 1.00 72.32 H new ATOM 1848 N SER A 119 7.177 10.581 -10.008 1.00 21.50 N ATOM 1849 CA SER A 119 7.550 11.986 -9.935 1.00 63.42 C ATOM 1850 C SER A 119 6.466 12.787 -9.214 1.00 44.41 C ATOM 1851 O SER A 119 6.215 13.947 -9.542 1.00 64.32 O ATOM 1852 CB SER A 119 7.744 12.539 -11.349 1.00 53.22 C ATOM 1853 OG SER A 119 8.600 11.706 -12.117 1.00 25.22 O ATOM 0 H SER A 119 6.456 10.376 -10.699 1.00 21.50 H new ATOM 0 HA SER A 119 8.482 12.075 -9.377 1.00 63.42 H new ATOM 0 HB2 SER A 119 6.777 12.624 -11.844 1.00 53.22 H new ATOM 0 HB3 SER A 119 8.164 13.543 -11.294 1.00 53.22 H new ATOM 0 HG SER A 119 8.704 12.083 -13.015 1.00 25.22 H new ATOM 1859 N GLY A 120 5.844 12.164 -8.220 1.00 4.13 N ATOM 1860 CA GLY A 120 4.717 12.777 -7.539 1.00 31.51 C ATOM 1861 C GLY A 120 5.118 13.840 -6.530 1.00 11.15 C ATOM 1862 O GLY A 120 5.967 14.691 -6.802 1.00 21.42 O ATOM 0 H GLY A 120 6.101 11.241 -7.871 1.00 4.13 H new ATOM 0 HA2 GLY A 120 4.055 13.224 -8.281 1.00 31.51 H new ATOM 0 HA3 GLY A 120 4.146 12.001 -7.029 1.00 31.51 H new ATOM 1866 N ASN A 121 4.499 13.788 -5.362 1.00 13.14 N ATOM 1867 CA ASN A 121 4.703 14.800 -4.332 1.00 10.13 C ATOM 1868 C ASN A 121 5.916 14.442 -3.473 1.00 71.42 C ATOM 1869 O ASN A 121 6.353 13.292 -3.466 1.00 10.35 O ATOM 1870 CB ASN A 121 3.439 14.902 -3.467 1.00 54.21 C ATOM 1871 CG ASN A 121 3.266 16.255 -2.794 1.00 34.05 C ATOM 1872 OD1 ASN A 121 4.236 16.926 -2.446 1.00 53.44 O ATOM 1873 ND2 ASN A 121 2.020 16.661 -2.611 1.00 14.42 N ATOM 0 H ASN A 121 3.845 13.050 -5.100 1.00 13.14 H new ATOM 0 HA ASN A 121 4.893 15.765 -4.801 1.00 10.13 H new ATOM 0 HB2 ASN A 121 2.567 14.701 -4.089 1.00 54.21 H new ATOM 0 HB3 ASN A 121 3.470 14.127 -2.701 1.00 54.21 H new ATOM 0 HD21 ASN A 121 1.837 17.561 -2.167 1.00 14.42 H new ATOM 0 HD22 ASN A 121 1.243 16.074 -2.914 1.00 14.42 H new ATOM 1880 N GLU A 122 6.446 15.418 -2.734 1.00 44.22 N ATOM 1881 CA GLU A 122 7.637 15.201 -1.909 1.00 74.52 C ATOM 1882 C GLU A 122 7.306 14.402 -0.651 1.00 22.42 C ATOM 1883 O GLU A 122 8.163 14.191 0.209 1.00 34.03 O ATOM 1884 CB GLU A 122 8.298 16.526 -1.529 1.00 25.35 C ATOM 1885 CG GLU A 122 8.844 17.294 -2.717 1.00 51.41 C ATOM 1886 CD GLU A 122 9.865 18.335 -2.306 1.00 50.12 C ATOM 1887 OE1 GLU A 122 9.463 19.449 -1.909 1.00 70.41 O ATOM 1888 OE2 GLU A 122 11.079 18.033 -2.368 1.00 41.13 O ATOM 0 H GLU A 122 6.070 16.365 -2.689 1.00 44.22 H new ATOM 0 HA GLU A 122 8.340 14.623 -2.509 1.00 74.52 H new ATOM 0 HB2 GLU A 122 7.571 17.149 -1.007 1.00 25.35 H new ATOM 0 HB3 GLU A 122 9.110 16.330 -0.829 1.00 25.35 H new ATOM 0 HG2 GLU A 122 9.301 16.597 -3.419 1.00 51.41 H new ATOM 0 HG3 GLU A 122 8.022 17.781 -3.241 1.00 51.41 H new ATOM 1895 N PHE A 123 6.062 13.955 -0.558 1.00 73.02 N ATOM 1896 CA PHE A 123 5.644 13.041 0.495 1.00 43.21 C ATOM 1897 C PHE A 123 6.434 11.735 0.419 1.00 50.15 C ATOM 1898 O PHE A 123 6.556 11.017 1.408 1.00 1.31 O ATOM 1899 CB PHE A 123 4.141 12.765 0.417 1.00 32.35 C ATOM 1900 CG PHE A 123 3.296 13.853 1.017 1.00 42.21 C ATOM 1901 CD1 PHE A 123 3.109 13.916 2.388 1.00 60.34 C ATOM 1902 CD2 PHE A 123 2.686 14.804 0.217 1.00 51.20 C ATOM 1903 CE1 PHE A 123 2.330 14.908 2.950 1.00 41.21 C ATOM 1904 CE2 PHE A 123 1.906 15.801 0.773 1.00 3.42 C ATOM 1905 CZ PHE A 123 1.729 15.853 2.142 1.00 72.42 C ATOM 0 H PHE A 123 5.318 14.214 -1.206 1.00 73.02 H new ATOM 0 HA PHE A 123 5.851 13.515 1.454 1.00 43.21 H new ATOM 0 HB2 PHE A 123 3.859 12.632 -0.627 1.00 32.35 H new ATOM 0 HB3 PHE A 123 3.926 11.826 0.928 1.00 32.35 H new ATOM 0 HD1 PHE A 123 3.578 13.181 3.025 1.00 60.34 H new ATOM 0 HD2 PHE A 123 2.821 14.767 -0.854 1.00 51.20 H new ATOM 0 HE1 PHE A 123 2.191 14.945 4.020 1.00 41.21 H new ATOM 0 HE2 PHE A 123 1.436 16.538 0.138 1.00 3.42 H new ATOM 0 HZ PHE A 123 1.122 16.631 2.580 1.00 72.42 H new ATOM 1915 N ASN A 124 6.960 11.424 -0.763 1.00 52.34 N ATOM 1916 CA ASN A 124 7.802 10.241 -0.939 1.00 63.42 C ATOM 1917 C ASN A 124 9.053 10.339 -0.058 1.00 43.34 C ATOM 1918 O ASN A 124 9.608 9.329 0.366 1.00 12.31 O ATOM 1919 CB ASN A 124 8.197 10.061 -2.413 1.00 23.11 C ATOM 1920 CG ASN A 124 9.101 11.163 -2.950 1.00 61.33 C ATOM 1921 OD1 ASN A 124 9.059 12.309 -2.497 1.00 64.24 O ATOM 1922 ND2 ASN A 124 9.918 10.820 -3.931 1.00 3.20 N ATOM 0 H ASN A 124 6.819 11.972 -1.612 1.00 52.34 H new ATOM 0 HA ASN A 124 7.227 9.367 -0.633 1.00 63.42 H new ATOM 0 HB2 ASN A 124 8.702 9.102 -2.529 1.00 23.11 H new ATOM 0 HB3 ASN A 124 7.292 10.020 -3.019 1.00 23.11 H new ATOM 0 HD21 ASN A 124 10.543 11.514 -4.340 1.00 3.20 H new ATOM 0 HD22 ASN A 124 9.923 9.861 -4.279 1.00 3.20 H new ATOM 1929 N ASP A 125 9.485 11.562 0.214 1.00 71.14 N ATOM 1930 CA ASP A 125 10.584 11.801 1.141 1.00 1.54 C ATOM 1931 C ASP A 125 10.108 11.632 2.582 1.00 12.12 C ATOM 1932 O ASP A 125 10.846 11.176 3.455 1.00 31.41 O ATOM 1933 CB ASP A 125 11.145 13.204 0.932 1.00 11.41 C ATOM 1934 CG ASP A 125 12.212 13.558 1.939 1.00 22.35 C ATOM 1935 OD1 ASP A 125 13.371 13.137 1.753 1.00 71.43 O ATOM 1936 OD2 ASP A 125 11.896 14.267 2.918 1.00 35.12 O ATOM 0 H ASP A 125 9.090 12.408 -0.196 1.00 71.14 H new ATOM 0 HA ASP A 125 11.372 11.073 0.948 1.00 1.54 H new ATOM 0 HB2 ASP A 125 11.560 13.279 -0.073 1.00 11.41 H new ATOM 0 HB3 ASP A 125 10.334 13.929 0.997 1.00 11.41 H new ATOM 1941 N TYR A 126 8.855 11.991 2.807 1.00 2.34 N ATOM 1942 CA TYR A 126 8.220 11.844 4.109 1.00 42.42 C ATOM 1943 C TYR A 126 8.098 10.365 4.480 1.00 23.21 C ATOM 1944 O TYR A 126 8.359 9.975 5.621 1.00 11.23 O ATOM 1945 CB TYR A 126 6.850 12.536 4.077 1.00 14.30 C ATOM 1946 CG TYR A 126 5.937 12.212 5.237 1.00 41.31 C ATOM 1947 CD1 TYR A 126 6.203 12.674 6.519 1.00 5.02 C ATOM 1948 CD2 TYR A 126 4.797 11.449 5.037 1.00 32.23 C ATOM 1949 CE1 TYR A 126 5.354 12.380 7.570 1.00 71.41 C ATOM 1950 CE2 TYR A 126 3.945 11.153 6.080 1.00 55.40 C ATOM 1951 CZ TYR A 126 4.227 11.617 7.342 1.00 22.02 C ATOM 1952 OH TYR A 126 3.376 11.316 8.382 1.00 23.15 O ATOM 0 H TYR A 126 8.248 12.393 2.093 1.00 2.34 H new ATOM 0 HA TYR A 126 8.832 12.318 4.877 1.00 42.42 H new ATOM 0 HB2 TYR A 126 7.006 13.614 4.049 1.00 14.30 H new ATOM 0 HB3 TYR A 126 6.345 12.263 3.151 1.00 14.30 H new ATOM 0 HD1 TYR A 126 7.085 13.271 6.698 1.00 5.02 H new ATOM 0 HD2 TYR A 126 4.572 11.080 4.047 1.00 32.23 H new ATOM 0 HE1 TYR A 126 5.571 12.745 8.563 1.00 71.41 H new ATOM 0 HE2 TYR A 126 3.060 10.559 5.906 1.00 55.40 H new ATOM 0 HH TYR A 126 2.916 10.471 8.194 1.00 23.15 H new ATOM 1962 N VAL A 127 7.724 9.540 3.508 1.00 73.14 N ATOM 1963 CA VAL A 127 7.628 8.102 3.731 1.00 71.12 C ATOM 1964 C VAL A 127 9.023 7.461 3.727 1.00 42.43 C ATOM 1965 O VAL A 127 9.222 6.374 4.274 1.00 34.13 O ATOM 1966 CB VAL A 127 6.705 7.413 2.690 1.00 60.45 C ATOM 1967 CG1 VAL A 127 7.289 7.490 1.292 1.00 4.00 C ATOM 1968 CG2 VAL A 127 6.434 5.970 3.077 1.00 33.05 C ATOM 0 H VAL A 127 7.484 9.840 2.563 1.00 73.14 H new ATOM 0 HA VAL A 127 7.177 7.954 4.712 1.00 71.12 H new ATOM 0 HB VAL A 127 5.758 7.952 2.685 1.00 60.45 H new ATOM 0 HG11 VAL A 127 6.617 6.998 0.589 1.00 4.00 H new ATOM 0 HG12 VAL A 127 7.412 8.535 1.006 1.00 4.00 H new ATOM 0 HG13 VAL A 127 8.259 6.993 1.275 1.00 4.00 H new ATOM 0 HG21 VAL A 127 5.785 5.509 2.332 1.00 33.05 H new ATOM 0 HG22 VAL A 127 7.376 5.423 3.126 1.00 33.05 H new ATOM 0 HG23 VAL A 127 5.946 5.940 4.051 1.00 33.05 H new ATOM 1978 N ASP A 128 9.994 8.155 3.134 1.00 23.25 N ATOM 1979 CA ASP A 128 11.394 7.721 3.165 1.00 14.12 C ATOM 1980 C ASP A 128 11.896 7.651 4.606 1.00 75.31 C ATOM 1981 O ASP A 128 12.561 6.691 5.002 1.00 1.43 O ATOM 1982 CB ASP A 128 12.270 8.683 2.351 1.00 14.12 C ATOM 1983 CG ASP A 128 13.758 8.411 2.498 1.00 42.33 C ATOM 1984 OD1 ASP A 128 14.369 8.903 3.475 1.00 53.21 O ATOM 1985 OD2 ASP A 128 14.333 7.728 1.628 1.00 15.32 O ATOM 0 H ASP A 128 9.838 9.024 2.624 1.00 23.25 H new ATOM 0 HA ASP A 128 11.457 6.727 2.721 1.00 14.12 H new ATOM 0 HB2 ASP A 128 11.997 8.610 1.298 1.00 14.12 H new ATOM 0 HB3 ASP A 128 12.062 9.706 2.664 1.00 14.12 H new ATOM 1990 N MET A 129 11.557 8.671 5.387 1.00 41.14 N ATOM 1991 CA MET A 129 11.943 8.726 6.793 1.00 73.55 C ATOM 1992 C MET A 129 11.234 7.630 7.583 1.00 70.42 C ATOM 1993 O MET A 129 11.783 7.082 8.539 1.00 54.22 O ATOM 1994 CB MET A 129 11.630 10.105 7.382 1.00 33.33 C ATOM 1995 CG MET A 129 12.413 11.234 6.728 1.00 62.30 C ATOM 1996 SD MET A 129 12.056 12.853 7.448 1.00 55.13 S ATOM 1997 CE MET A 129 10.319 13.030 7.047 1.00 54.32 C ATOM 0 H MET A 129 11.014 9.474 5.069 1.00 41.14 H new ATOM 0 HA MET A 129 13.018 8.560 6.864 1.00 73.55 H new ATOM 0 HB2 MET A 129 10.564 10.304 7.276 1.00 33.33 H new ATOM 0 HB3 MET A 129 11.847 10.093 8.450 1.00 33.33 H new ATOM 0 HG2 MET A 129 13.480 11.029 6.820 1.00 62.30 H new ATOM 0 HG3 MET A 129 12.183 11.258 5.663 1.00 62.30 H new ATOM 0 HE1 MET A 129 10.186 13.873 6.369 1.00 54.32 H new ATOM 0 HE2 MET A 129 9.962 12.119 6.567 1.00 54.32 H new ATOM 0 HE3 MET A 129 9.751 13.206 7.960 1.00 54.32 H new ATOM 2007 N LYS A 130 10.012 7.308 7.166 1.00 32.11 N ATOM 2008 CA LYS A 130 9.264 6.201 7.756 1.00 2.11 C ATOM 2009 C LYS A 130 10.016 4.889 7.566 1.00 20.42 C ATOM 2010 O LYS A 130 10.203 4.131 8.514 1.00 64.14 O ATOM 2011 CB LYS A 130 7.869 6.084 7.132 1.00 62.42 C ATOM 2012 CG LYS A 130 6.756 6.745 7.934 1.00 52.03 C ATOM 2013 CD LYS A 130 7.001 8.228 8.148 1.00 34.21 C ATOM 2014 CE LYS A 130 5.787 8.907 8.763 1.00 30.53 C ATOM 2015 NZ LYS A 130 5.377 8.284 10.051 1.00 62.31 N ATOM 0 H LYS A 130 9.518 7.799 6.421 1.00 32.11 H new ATOM 0 HA LYS A 130 9.155 6.405 8.821 1.00 2.11 H new ATOM 0 HB2 LYS A 130 7.893 6.527 6.136 1.00 62.42 H new ATOM 0 HB3 LYS A 130 7.630 5.028 7.006 1.00 62.42 H new ATOM 0 HG2 LYS A 130 5.807 6.607 7.416 1.00 52.03 H new ATOM 0 HG3 LYS A 130 6.666 6.251 8.901 1.00 52.03 H new ATOM 0 HD2 LYS A 130 7.865 8.366 8.798 1.00 34.21 H new ATOM 0 HD3 LYS A 130 7.240 8.700 7.195 1.00 34.21 H new ATOM 0 HE2 LYS A 130 6.009 9.961 8.928 1.00 30.53 H new ATOM 0 HE3 LYS A 130 4.955 8.862 8.060 1.00 30.53 H new ATOM 0 HZ1 LYS A 130 4.493 7.753 9.914 1.00 62.31 H new ATOM 0 HZ2 LYS A 130 6.123 7.637 10.377 1.00 62.31 H new ATOM 0 HZ3 LYS A 130 5.228 9.026 10.764 1.00 62.31 H new ATOM 2029 N ALA A 131 10.459 4.643 6.334 1.00 73.14 N ATOM 2030 CA ALA A 131 11.189 3.423 6.003 1.00 54.33 C ATOM 2031 C ALA A 131 12.447 3.288 6.853 1.00 23.11 C ATOM 2032 O ALA A 131 12.779 2.197 7.314 1.00 21.22 O ATOM 2033 CB ALA A 131 11.542 3.405 4.523 1.00 51.40 C ATOM 0 H ALA A 131 10.324 5.276 5.546 1.00 73.14 H new ATOM 0 HA ALA A 131 10.544 2.572 6.221 1.00 54.33 H new ATOM 0 HB1 ALA A 131 12.086 2.490 4.290 1.00 51.40 H new ATOM 0 HB2 ALA A 131 10.628 3.445 3.930 1.00 51.40 H new ATOM 0 HB3 ALA A 131 12.165 4.268 4.287 1.00 51.40 H new ATOM 2039 N LYS A 132 13.131 4.408 7.069 1.00 64.44 N ATOM 2040 CA LYS A 132 14.326 4.432 7.909 1.00 43.00 C ATOM 2041 C LYS A 132 14.019 3.871 9.293 1.00 12.34 C ATOM 2042 O LYS A 132 14.708 2.981 9.792 1.00 40.13 O ATOM 2043 CB LYS A 132 14.848 5.863 8.066 1.00 3.12 C ATOM 2044 CG LYS A 132 15.323 6.513 6.777 1.00 11.14 C ATOM 2045 CD LYS A 132 16.540 5.808 6.204 1.00 13.33 C ATOM 2046 CE LYS A 132 17.218 6.647 5.133 1.00 74.02 C ATOM 2047 NZ LYS A 132 16.318 6.943 3.988 1.00 74.24 N ATOM 0 H LYS A 132 12.878 5.313 6.673 1.00 64.44 H new ATOM 0 HA LYS A 132 15.084 3.818 7.423 1.00 43.00 H new ATOM 0 HB2 LYS A 132 14.058 6.478 8.497 1.00 3.12 H new ATOM 0 HB3 LYS A 132 15.672 5.858 8.779 1.00 3.12 H new ATOM 0 HG2 LYS A 132 14.516 6.499 6.044 1.00 11.14 H new ATOM 0 HG3 LYS A 132 15.564 7.559 6.965 1.00 11.14 H new ATOM 0 HD2 LYS A 132 17.249 5.596 7.004 1.00 13.33 H new ATOM 0 HD3 LYS A 132 16.241 4.849 5.781 1.00 13.33 H new ATOM 0 HE2 LYS A 132 17.561 7.583 5.573 1.00 74.02 H new ATOM 0 HE3 LYS A 132 18.102 6.122 4.770 1.00 74.02 H new ATOM 0 HZ1 LYS A 132 16.846 7.459 3.255 1.00 74.24 H new ATOM 0 HZ2 LYS A 132 15.956 6.052 3.592 1.00 74.24 H new ATOM 0 HZ3 LYS A 132 15.521 7.526 4.315 1.00 74.24 H new ATOM 2061 N SER A 133 12.957 4.387 9.888 1.00 34.34 N ATOM 2062 CA SER A 133 12.601 4.054 11.254 1.00 35.43 C ATOM 2063 C SER A 133 11.999 2.649 11.336 1.00 41.33 C ATOM 2064 O SER A 133 12.195 1.937 12.322 1.00 13.31 O ATOM 2065 CB SER A 133 11.607 5.095 11.779 1.00 23.21 C ATOM 2066 OG SER A 133 11.537 5.085 13.193 1.00 2.10 O ATOM 0 H SER A 133 12.321 5.046 9.439 1.00 34.34 H new ATOM 0 HA SER A 133 13.500 4.064 11.870 1.00 35.43 H new ATOM 0 HB2 SER A 133 11.903 6.086 11.436 1.00 23.21 H new ATOM 0 HB3 SER A 133 10.619 4.896 11.364 1.00 23.21 H new ATOM 0 HG SER A 133 10.895 5.762 13.494 1.00 2.10 H new ATOM 2072 N ALA A 134 11.297 2.250 10.281 1.00 32.23 N ATOM 2073 CA ALA A 134 10.558 0.991 10.264 1.00 70.03 C ATOM 2074 C ALA A 134 11.468 -0.227 10.410 1.00 64.53 C ATOM 2075 O ALA A 134 11.063 -1.236 10.983 1.00 13.13 O ATOM 2076 CB ALA A 134 9.743 0.882 8.985 1.00 21.24 C ATOM 0 H ALA A 134 11.224 2.787 9.417 1.00 32.23 H new ATOM 0 HA ALA A 134 9.892 0.999 11.127 1.00 70.03 H new ATOM 0 HB1 ALA A 134 9.195 -0.060 8.982 1.00 21.24 H new ATOM 0 HB2 ALA A 134 9.038 1.712 8.931 1.00 21.24 H new ATOM 0 HB3 ALA A 134 10.411 0.917 8.124 1.00 21.24 H new ATOM 2082 N LEU A 135 12.695 -0.131 9.910 1.00 12.22 N ATOM 2083 CA LEU A 135 13.604 -1.271 9.923 1.00 23.34 C ATOM 2084 C LEU A 135 14.320 -1.383 11.257 1.00 70.00 C ATOM 2085 O LEU A 135 15.007 -2.373 11.519 1.00 44.32 O ATOM 2086 CB LEU A 135 14.630 -1.187 8.786 1.00 1.12 C ATOM 2087 CG LEU A 135 14.170 -1.751 7.437 1.00 42.33 C ATOM 2088 CD1 LEU A 135 13.650 -3.170 7.602 1.00 73.35 C ATOM 2089 CD2 LEU A 135 13.115 -0.860 6.806 1.00 60.24 C ATOM 0 H LEU A 135 13.081 0.717 9.494 1.00 12.22 H new ATOM 0 HA LEU A 135 12.998 -2.165 9.772 1.00 23.34 H new ATOM 0 HB2 LEU A 135 14.907 -0.142 8.647 1.00 1.12 H new ATOM 0 HB3 LEU A 135 15.531 -1.718 9.093 1.00 1.12 H new ATOM 0 HG LEU A 135 15.030 -1.776 6.768 1.00 42.33 H new ATOM 0 HD11 LEU A 135 13.328 -3.554 6.634 1.00 73.35 H new ATOM 0 HD12 LEU A 135 14.443 -3.804 7.999 1.00 73.35 H new ATOM 0 HD13 LEU A 135 12.806 -3.170 8.292 1.00 73.35 H new ATOM 0 HD21 LEU A 135 12.806 -1.283 5.850 1.00 60.24 H new ATOM 0 HD22 LEU A 135 12.252 -0.792 7.469 1.00 60.24 H new ATOM 0 HD23 LEU A 135 13.528 0.136 6.646 1.00 60.24 H new ATOM 2101 N GLY A 136 14.153 -0.376 12.102 1.00 14.12 N ATOM 2102 CA GLY A 136 14.781 -0.411 13.400 1.00 23.32 C ATOM 2103 C GLY A 136 15.802 0.689 13.597 1.00 52.33 C ATOM 2104 O GLY A 136 16.489 0.725 14.617 1.00 43.23 O ATOM 0 H GLY A 136 13.597 0.458 11.911 1.00 14.12 H new ATOM 0 HA2 GLY A 136 14.014 -0.328 14.170 1.00 23.32 H new ATOM 0 HA3 GLY A 136 15.266 -1.377 13.536 1.00 23.32 H new ATOM 2108 N ILE A 137 15.920 1.582 12.626 1.00 1.12 N ATOM 2109 CA ILE A 137 16.825 2.711 12.758 1.00 4.51 C ATOM 2110 C ILE A 137 16.088 3.878 13.400 1.00 70.21 C ATOM 2111 O ILE A 137 15.458 4.689 12.718 1.00 40.31 O ATOM 2112 CB ILE A 137 17.414 3.148 11.399 1.00 34.23 C ATOM 2113 CG1 ILE A 137 18.024 1.945 10.674 1.00 74.52 C ATOM 2114 CG2 ILE A 137 18.464 4.233 11.601 1.00 55.32 C ATOM 2115 CD1 ILE A 137 18.547 2.266 9.289 1.00 53.22 C ATOM 0 H ILE A 137 15.405 1.547 11.746 1.00 1.12 H new ATOM 0 HA ILE A 137 17.658 2.398 13.388 1.00 4.51 H new ATOM 0 HB ILE A 137 16.610 3.554 10.785 1.00 34.23 H new ATOM 0 HG12 ILE A 137 18.840 1.545 11.276 1.00 74.52 H new ATOM 0 HG13 ILE A 137 17.271 1.160 10.595 1.00 74.52 H new ATOM 0 HG21 ILE A 137 18.870 4.531 10.634 1.00 55.32 H new ATOM 0 HG22 ILE A 137 18.007 5.096 12.084 1.00 55.32 H new ATOM 0 HG23 ILE A 137 19.268 3.849 12.229 1.00 55.32 H new ATOM 0 HD11 ILE A 137 18.963 1.365 8.839 1.00 53.22 H new ATOM 0 HD12 ILE A 137 17.731 2.637 8.669 1.00 53.22 H new ATOM 0 HD13 ILE A 137 19.323 3.028 9.361 1.00 53.22 H new