USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=19 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 91 LYS NZ :NH3+ 155:sc= 0.923 (180deg=0.128) USER MOD Set 1.2: A 95 TYR OH : rot -132:sc= 1.27 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 ASN : amide:sc= -0.0485 X(o=-0.049,f=-0.0043) USER MOD Single : A 5 SER OG : rot 180:sc=-0.00205 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= -0.0461 X(o=-0.046,f=-0.046) USER MOD Single : A 14 ASN : amide:sc= -0.115 X(o=-0.12,f=-0.12) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= -2.14 X(o=-2.1,f=-1.9) USER MOD Single : A 39 HIS : no HD1:sc= -0.029 X(o=-0.029,f=-0.029) USER MOD Single : A 40 GLN : amide:sc= 0.754 K(o=0.75,f=0) USER MOD Single : A 45 CYS SG : rot 180:sc= 0.0054 USER MOD Single : A 48 SER OG : rot 91:sc= 0.892 USER MOD Single : A 50 GLN : amide:sc= -0.0944 K(o=-0.094,f=-1.5) USER MOD Single : A 54 SER OG : rot 180:sc= 0.194 USER MOD Single : A 55 HIS : no HD1:sc= -0.313 X(o=-0.31,f=-0.31) USER MOD Single : A 57 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 151:sc= 1.21 (180deg=0.803) USER MOD Single : A 96 LYS NZ :NH3+ -152:sc= 0.763 (180deg=0.419) USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 99 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 101 THR OG1 : rot 56:sc= 0.172 USER MOD Single : A 102 MET CE :methyl -168:sc= -0.436 (180deg=-0.68) USER MOD Single : A 117 CYS SG : rot 20:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -0.0496 X(o=-0.05,f=-0.14) USER MOD Single : A 121 THR OG1 : rot -9:sc= 0.221 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc=-0.00463 X(o=-0.0046,f=0) USER MOD Single : A 134 THR OG1 : rot -42:sc= 1.08 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 33.492 35.474 3.893 1.00 20.41 N ATOM 35 CA HIS A 3 32.416 35.896 4.779 1.00 20.23 C ATOM 36 C HIS A 3 32.566 35.241 6.152 1.00 34.53 C ATOM 37 O HIS A 3 32.428 35.911 7.173 1.00 62.21 O ATOM 38 CB HIS A 3 31.065 35.535 4.148 1.00 62.33 C ATOM 39 CG HIS A 3 29.882 35.892 5.012 1.00 43.13 C ATOM 40 ND1 HIS A 3 29.745 37.134 5.616 1.00 11.31 N ATOM 41 CD2 HIS A 3 28.777 35.175 5.405 1.00 51.20 C ATOM 42 CE1 HIS A 3 28.601 37.111 6.322 1.00 24.51 C ATOM 43 NE2 HIS A 3 27.962 35.943 6.232 1.00 21.24 N ATOM 0 HA HIS A 3 32.465 36.976 4.917 1.00 20.23 H new ATOM 0 HB2 HIS A 3 30.972 36.047 3.190 1.00 62.33 H new ATOM 0 HB3 HIS A 3 31.044 34.465 3.941 1.00 62.33 H new ATOM 0 HD2 HIS A 3 28.570 34.156 5.112 1.00 51.20 H new ATOM 0 HE1 HIS A 3 28.238 37.948 6.900 1.00 24.51 H new ATOM 0 HE2 HIS A 3 27.080 35.675 6.668 1.00 21.24 H new ATOM 51 N ASN A 4 32.841 33.928 6.159 1.00 4.23 N ATOM 52 CA ASN A 4 32.936 33.083 7.345 1.00 32.22 C ATOM 53 C ASN A 4 31.553 32.845 7.961 1.00 71.14 C ATOM 54 O ASN A 4 30.541 33.314 7.441 1.00 71.02 O ATOM 55 CB ASN A 4 33.944 33.624 8.375 1.00 0.10 C ATOM 56 CG ASN A 4 35.275 34.026 7.742 1.00 34.32 C ATOM 57 OD1 ASN A 4 36.127 33.179 7.490 1.00 5.53 O ATOM 58 ND2 ASN A 4 35.455 35.323 7.487 1.00 72.42 N ATOM 0 H ASN A 4 33.010 33.409 5.297 1.00 4.23 H new ATOM 0 HA ASN A 4 33.326 32.117 7.023 1.00 32.22 H new ATOM 0 HB2 ASN A 4 33.512 34.487 8.882 1.00 0.10 H new ATOM 0 HB3 ASN A 4 34.123 32.864 9.136 1.00 0.10 H new ATOM 0 HD21 ASN A 4 36.327 35.644 7.067 1.00 72.42 H new ATOM 0 HD22 ASN A 4 34.720 35.994 7.712 1.00 72.42 H new ATOM 65 N SER A 5 31.514 32.086 9.061 1.00 2.33 N ATOM 66 CA SER A 5 30.286 31.712 9.749 1.00 30.22 C ATOM 67 C SER A 5 30.568 31.469 11.234 1.00 54.01 C ATOM 68 O SER A 5 29.806 31.931 12.083 1.00 41.44 O ATOM 69 CB SER A 5 29.669 30.487 9.062 1.00 43.32 C ATOM 70 OG SER A 5 28.381 30.233 9.579 1.00 41.12 O ATOM 0 H SER A 5 32.354 31.710 9.502 1.00 2.33 H new ATOM 0 HA SER A 5 29.561 32.524 9.691 1.00 30.22 H new ATOM 0 HB2 SER A 5 29.610 30.656 7.987 1.00 43.32 H new ATOM 0 HB3 SER A 5 30.307 29.617 9.213 1.00 43.32 H new ATOM 0 HG SER A 5 27.997 29.450 9.132 1.00 41.12 H new ATOM 76 N ILE A 6 31.674 30.772 11.536 1.00 61.11 N ATOM 77 CA ILE A 6 32.233 30.607 12.874 1.00 52.43 C ATOM 78 C ILE A 6 31.189 30.013 13.826 1.00 73.34 C ATOM 79 O ILE A 6 30.655 30.708 14.690 1.00 24.31 O ATOM 80 CB ILE A 6 32.842 31.932 13.385 1.00 40.34 C ATOM 81 CG1 ILE A 6 33.734 32.633 12.340 1.00 23.34 C ATOM 82 CG2 ILE A 6 33.640 31.706 14.681 1.00 22.43 C ATOM 83 CD1 ILE A 6 34.878 31.769 11.793 1.00 21.02 C ATOM 0 H ILE A 6 32.221 30.291 10.822 1.00 61.11 H new ATOM 0 HA ILE A 6 33.055 29.892 12.831 1.00 52.43 H new ATOM 0 HB ILE A 6 31.998 32.592 13.584 1.00 40.34 H new ATOM 0 HG12 ILE A 6 33.110 32.956 11.507 1.00 23.34 H new ATOM 0 HG13 ILE A 6 34.157 33.532 12.788 1.00 23.34 H new ATOM 0 HG21 ILE A 6 34.059 32.653 15.020 1.00 22.43 H new ATOM 0 HG22 ILE A 6 32.979 31.305 15.450 1.00 22.43 H new ATOM 0 HG23 ILE A 6 34.448 30.999 14.492 1.00 22.43 H new ATOM 0 HD11 ILE A 6 35.452 32.343 11.065 1.00 21.02 H new ATOM 0 HD12 ILE A 6 35.530 31.467 12.613 1.00 21.02 H new ATOM 0 HD13 ILE A 6 34.466 30.882 11.312 1.00 21.02 H new ATOM 95 N ARG A 7 30.893 28.720 13.653 1.00 20.25 N ATOM 96 CA ARG A 7 29.961 28.008 14.514 1.00 5.11 C ATOM 97 C ARG A 7 30.711 27.456 15.724 1.00 51.03 C ATOM 98 O ARG A 7 31.852 27.013 15.594 1.00 34.35 O ATOM 99 CB ARG A 7 29.238 26.895 13.743 1.00 23.23 C ATOM 100 CG ARG A 7 28.642 27.312 12.387 1.00 4.04 C ATOM 101 CD ARG A 7 27.953 28.684 12.354 1.00 3.20 C ATOM 102 NE ARG A 7 27.062 28.906 13.502 1.00 33.54 N ATOM 103 CZ ARG A 7 26.888 30.076 14.146 1.00 63.40 C ATOM 104 NH1 ARG A 7 27.513 31.198 13.756 1.00 75.13 N ATOM 105 NH2 ARG A 7 26.076 30.121 15.210 1.00 4.24 N ATOM 0 H ARG A 7 31.295 28.145 12.913 1.00 20.25 H new ATOM 0 HA ARG A 7 29.195 28.700 14.864 1.00 5.11 H new ATOM 0 HB2 ARG A 7 29.939 26.077 13.577 1.00 23.23 H new ATOM 0 HB3 ARG A 7 28.436 26.505 14.369 1.00 23.23 H new ATOM 0 HG2 ARG A 7 29.440 27.309 11.644 1.00 4.04 H new ATOM 0 HG3 ARG A 7 27.919 26.556 12.081 1.00 4.04 H new ATOM 0 HD2 ARG A 7 28.712 29.466 12.334 1.00 3.20 H new ATOM 0 HD3 ARG A 7 27.378 28.774 11.432 1.00 3.20 H new ATOM 0 HE ARG A 7 26.529 28.104 13.840 1.00 33.54 H new ATOM 0 HH11 ARG A 7 28.140 31.179 12.952 1.00 75.13 H new ATOM 0 HH12 ARG A 7 27.361 32.069 14.264 1.00 75.13 H new ATOM 0 HH21 ARG A 7 25.599 29.276 15.523 1.00 4.24 H new ATOM 0 HH22 ARG A 7 25.935 31.000 15.707 1.00 4.24 H new ATOM 119 N SER A 8 30.071 27.508 16.898 1.00 42.44 N ATOM 120 CA SER A 8 30.671 27.164 18.180 1.00 1.14 C ATOM 121 C SER A 8 29.752 26.230 18.969 1.00 33.55 C ATOM 122 O SER A 8 28.589 26.041 18.614 1.00 14.41 O ATOM 123 CB SER A 8 30.939 28.449 18.973 1.00 31.32 C ATOM 124 OG SER A 8 31.746 29.331 18.219 1.00 42.11 O ATOM 0 H SER A 8 29.097 27.799 16.978 1.00 42.44 H new ATOM 0 HA SER A 8 31.613 26.643 18.008 1.00 1.14 H new ATOM 0 HB2 SER A 8 29.995 28.933 19.224 1.00 31.32 H new ATOM 0 HB3 SER A 8 31.433 28.207 19.914 1.00 31.32 H new ATOM 0 HG SER A 8 31.908 30.148 18.735 1.00 42.11 H new ATOM 130 N GLY A 9 30.288 25.660 20.055 1.00 44.21 N ATOM 131 CA GLY A 9 29.545 24.813 20.974 1.00 11.41 C ATOM 132 C GLY A 9 28.579 25.626 21.836 1.00 44.12 C ATOM 133 O GLY A 9 28.404 26.827 21.629 1.00 31.45 O ATOM 0 H GLY A 9 31.266 25.781 20.317 1.00 44.21 H new ATOM 0 HA2 GLY A 9 28.988 24.065 20.410 1.00 11.41 H new ATOM 0 HA3 GLY A 9 30.241 24.275 21.617 1.00 11.41 H new ATOM 137 N HIS A 10 27.947 24.949 22.802 1.00 72.12 N ATOM 138 CA HIS A 10 26.930 25.525 23.675 1.00 13.14 C ATOM 139 C HIS A 10 27.202 25.114 25.122 1.00 52.13 C ATOM 140 O HIS A 10 27.400 25.972 25.979 1.00 0.45 O ATOM 141 CB HIS A 10 25.537 25.090 23.200 1.00 53.32 C ATOM 142 CG HIS A 10 25.259 25.492 21.774 1.00 3.31 C ATOM 143 ND1 HIS A 10 25.461 24.633 20.703 1.00 63.42 N ATOM 144 CD2 HIS A 10 24.852 26.679 21.212 1.00 12.40 C ATOM 145 CE1 HIS A 10 25.176 25.316 19.582 1.00 65.33 C ATOM 146 NE2 HIS A 10 24.794 26.572 19.825 1.00 22.41 N ATOM 0 H HIS A 10 28.136 23.966 22.999 1.00 72.12 H new ATOM 0 HA HIS A 10 26.967 26.613 23.631 1.00 13.14 H new ATOM 0 HB2 HIS A 10 25.447 24.008 23.293 1.00 53.32 H new ATOM 0 HB3 HIS A 10 24.781 25.529 23.851 1.00 53.32 H new ATOM 0 HD2 HIS A 10 24.610 27.572 21.770 1.00 12.40 H new ATOM 0 HE1 HIS A 10 25.248 24.894 18.590 1.00 65.33 H new ATOM 0 HE2 HIS A 10 24.523 27.288 19.151 1.00 22.41 H new ATOM 154 N GLY A 11 27.227 23.803 25.390 1.00 44.43 N ATOM 155 CA GLY A 11 27.513 23.268 26.710 1.00 31.12 C ATOM 156 C GLY A 11 27.210 21.772 26.767 1.00 3.33 C ATOM 157 O GLY A 11 26.725 21.191 25.797 1.00 13.10 O ATOM 0 H GLY A 11 27.047 23.086 24.687 1.00 44.43 H new ATOM 0 HA2 GLY A 11 28.560 23.441 26.958 1.00 31.12 H new ATOM 0 HA3 GLY A 11 26.917 23.793 27.457 1.00 31.12 H new ATOM 161 N GLY A 12 27.500 21.159 27.918 1.00 63.03 N ATOM 162 CA GLY A 12 27.251 19.751 28.176 1.00 30.53 C ATOM 163 C GLY A 12 27.516 19.461 29.651 1.00 23.15 C ATOM 164 O GLY A 12 28.449 20.018 30.227 1.00 74.42 O ATOM 0 H GLY A 12 27.923 21.644 28.709 1.00 63.03 H new ATOM 0 HA2 GLY A 12 26.222 19.498 27.922 1.00 30.53 H new ATOM 0 HA3 GLY A 12 27.895 19.134 27.549 1.00 30.53 H new ATOM 168 N LEU A 13 26.675 18.617 30.261 1.00 11.13 N ATOM 169 CA LEU A 13 26.747 18.250 31.669 1.00 31.02 C ATOM 170 C LEU A 13 26.642 16.729 31.802 1.00 53.21 C ATOM 171 O LEU A 13 26.220 16.047 30.869 1.00 43.20 O ATOM 172 CB LEU A 13 25.630 18.942 32.471 1.00 24.13 C ATOM 173 CG LEU A 13 25.737 20.480 32.481 1.00 71.51 C ATOM 174 CD1 LEU A 13 24.893 21.124 31.372 1.00 64.14 C ATOM 175 CD2 LEU A 13 25.254 21.025 33.831 1.00 21.21 C ATOM 0 H LEU A 13 25.906 18.161 29.770 1.00 11.13 H new ATOM 0 HA LEU A 13 27.703 18.581 32.075 1.00 31.02 H new ATOM 0 HB2 LEU A 13 24.664 18.656 32.053 1.00 24.13 H new ATOM 0 HB3 LEU A 13 25.653 18.578 33.498 1.00 24.13 H new ATOM 0 HG LEU A 13 26.784 20.730 32.311 1.00 71.51 H new ATOM 0 HD11 LEU A 13 24.999 22.208 31.417 1.00 64.14 H new ATOM 0 HD12 LEU A 13 25.234 20.766 30.401 1.00 64.14 H new ATOM 0 HD13 LEU A 13 23.846 20.856 31.510 1.00 64.14 H new ATOM 0 HD21 LEU A 13 25.332 22.112 33.833 1.00 21.21 H new ATOM 0 HD22 LEU A 13 24.215 20.735 33.990 1.00 21.21 H new ATOM 0 HD23 LEU A 13 25.871 20.616 34.631 1.00 21.21 H new ATOM 187 N ASN A 14 27.030 16.204 32.970 1.00 52.14 N ATOM 188 CA ASN A 14 27.003 14.787 33.285 1.00 30.11 C ATOM 189 C ASN A 14 26.821 14.607 34.793 1.00 65.55 C ATOM 190 O ASN A 14 27.222 15.467 35.576 1.00 42.15 O ATOM 191 CB ASN A 14 28.311 14.139 32.812 1.00 33.13 C ATOM 192 CG ASN A 14 28.339 12.647 33.128 1.00 4.55 C ATOM 193 OD1 ASN A 14 29.180 12.181 33.892 1.00 63.24 O ATOM 194 ND2 ASN A 14 27.393 11.902 32.558 1.00 61.40 N ATOM 0 H ASN A 14 27.380 16.777 33.738 1.00 52.14 H new ATOM 0 HA ASN A 14 26.170 14.304 32.775 1.00 30.11 H new ATOM 0 HB2 ASN A 14 28.425 14.287 31.738 1.00 33.13 H new ATOM 0 HB3 ASN A 14 29.157 14.630 33.293 1.00 33.13 H new ATOM 0 HD21 ASN A 14 27.347 10.901 32.750 1.00 61.40 H new ATOM 0 HD22 ASN A 14 26.715 12.332 31.929 1.00 61.40 H new ATOM 201 N GLN A 15 26.220 13.480 35.188 1.00 44.25 N ATOM 202 CA GLN A 15 26.060 13.065 36.573 1.00 4.32 C ATOM 203 C GLN A 15 25.923 11.542 36.624 1.00 24.24 C ATOM 204 O GLN A 15 25.669 10.909 35.600 1.00 14.04 O ATOM 205 CB GLN A 15 24.851 13.772 37.208 1.00 72.33 C ATOM 206 CG GLN A 15 23.527 13.434 36.510 1.00 32.30 C ATOM 207 CD GLN A 15 22.356 14.167 37.158 1.00 22.11 C ATOM 208 OE1 GLN A 15 21.817 15.112 36.587 1.00 75.22 O ATOM 209 NE2 GLN A 15 21.953 13.731 38.353 1.00 11.41 N ATOM 0 H GLN A 15 25.821 12.815 34.526 1.00 44.25 H new ATOM 0 HA GLN A 15 26.937 13.352 37.153 1.00 4.32 H new ATOM 0 HB2 GLN A 15 24.784 13.492 38.259 1.00 72.33 H new ATOM 0 HB3 GLN A 15 25.008 14.850 37.175 1.00 72.33 H new ATOM 0 HG2 GLN A 15 23.590 13.704 35.456 1.00 32.30 H new ATOM 0 HG3 GLN A 15 23.355 12.359 36.553 1.00 32.30 H new ATOM 0 HE21 GLN A 15 22.427 12.943 38.795 1.00 11.41 H new ATOM 0 HE22 GLN A 15 21.171 14.186 38.825 1.00 11.41 H new ATOM 218 N LEU A 16 26.086 10.964 37.820 1.00 23.12 N ATOM 219 CA LEU A 16 25.951 9.535 38.069 1.00 43.11 C ATOM 220 C LEU A 16 25.102 9.367 39.328 1.00 52.21 C ATOM 221 O LEU A 16 25.623 9.337 40.442 1.00 32.12 O ATOM 222 CB LEU A 16 27.352 8.906 38.159 1.00 64.52 C ATOM 223 CG LEU A 16 27.433 7.366 38.135 1.00 52.11 C ATOM 224 CD1 LEU A 16 26.922 6.703 39.418 1.00 71.40 C ATOM 225 CD2 LEU A 16 26.738 6.754 36.913 1.00 73.25 C ATOM 0 H LEU A 16 26.321 11.496 38.658 1.00 23.12 H new ATOM 0 HA LEU A 16 25.442 9.010 37.260 1.00 43.11 H new ATOM 0 HB2 LEU A 16 27.949 9.289 37.331 1.00 64.52 H new ATOM 0 HB3 LEU A 16 27.821 9.255 39.079 1.00 64.52 H new ATOM 0 HG LEU A 16 28.500 7.154 38.064 1.00 52.11 H new ATOM 0 HD11 LEU A 16 27.010 5.620 39.328 1.00 71.40 H new ATOM 0 HD12 LEU A 16 27.515 7.046 40.266 1.00 71.40 H new ATOM 0 HD13 LEU A 16 25.877 6.970 39.574 1.00 71.40 H new ATOM 0 HD21 LEU A 16 26.827 5.668 36.950 1.00 73.25 H new ATOM 0 HD22 LEU A 16 25.684 7.032 36.917 1.00 73.25 H new ATOM 0 HD23 LEU A 16 27.208 7.126 36.003 1.00 73.25 H new ATOM 375 N PRO A 27 23.351 -3.192 43.783 1.00 12.05 N ATOM 376 CA PRO A 27 22.886 -4.280 42.931 1.00 20.11 C ATOM 377 C PRO A 27 24.094 -5.041 42.356 1.00 43.22 C ATOM 378 O PRO A 27 25.157 -5.057 42.978 1.00 2.13 O ATOM 379 CB PRO A 27 22.039 -3.569 41.866 1.00 11.31 C ATOM 380 CG PRO A 27 22.814 -2.273 41.649 1.00 43.31 C ATOM 381 CD PRO A 27 23.260 -1.925 43.069 1.00 41.41 C ATOM 0 HA PRO A 27 22.298 -5.041 43.445 1.00 20.11 H new ATOM 0 HB2 PRO A 27 21.961 -4.155 40.950 1.00 11.31 H new ATOM 0 HB3 PRO A 27 21.023 -3.382 42.212 1.00 11.31 H new ATOM 0 HG2 PRO A 27 23.662 -2.412 40.978 1.00 43.31 H new ATOM 0 HG3 PRO A 27 22.189 -1.492 41.215 1.00 43.31 H new ATOM 0 HD2 PRO A 27 24.221 -1.412 43.061 1.00 41.41 H new ATOM 0 HD3 PRO A 27 22.546 -1.257 43.550 1.00 41.41 H new ATOM 389 N GLU A 28 23.918 -5.683 41.190 1.00 74.22 N ATOM 390 CA GLU A 28 24.906 -6.441 40.421 1.00 5.31 C ATOM 391 C GLU A 28 26.351 -5.970 40.612 1.00 73.23 C ATOM 392 O GLU A 28 27.215 -6.775 40.956 1.00 5.41 O ATOM 393 CB GLU A 28 24.484 -6.433 38.950 1.00 32.11 C ATOM 394 CG GLU A 28 25.332 -7.398 38.115 1.00 12.44 C ATOM 395 CD GLU A 28 26.658 -6.807 37.633 1.00 32.35 C ATOM 396 OE1 GLU A 28 26.654 -5.620 37.243 1.00 12.03 O ATOM 397 OE2 GLU A 28 27.655 -7.560 37.656 1.00 43.22 O ATOM 0 H GLU A 28 23.008 -5.683 40.728 1.00 74.22 H new ATOM 0 HA GLU A 28 24.915 -7.462 40.803 1.00 5.31 H new ATOM 0 HB2 GLU A 28 23.433 -6.710 38.871 1.00 32.11 H new ATOM 0 HB3 GLU A 28 24.579 -5.424 38.549 1.00 32.11 H new ATOM 0 HG2 GLU A 28 25.538 -8.290 38.707 1.00 12.44 H new ATOM 0 HG3 GLU A 28 24.753 -7.718 37.249 1.00 12.44 H new ATOM 404 N VAL A 29 26.587 -4.670 40.400 1.00 70.24 N ATOM 405 CA VAL A 29 27.875 -3.985 40.478 1.00 21.10 C ATOM 406 C VAL A 29 28.770 -4.439 41.642 1.00 3.51 C ATOM 407 O VAL A 29 29.990 -4.478 41.488 1.00 61.42 O ATOM 408 CB VAL A 29 27.618 -2.466 40.508 1.00 52.35 C ATOM 409 CG1 VAL A 29 26.887 -2.034 41.785 1.00 22.22 C ATOM 410 CG2 VAL A 29 28.915 -1.663 40.351 1.00 1.33 C ATOM 0 H VAL A 29 25.832 -4.030 40.154 1.00 70.24 H new ATOM 0 HA VAL A 29 28.447 -4.257 39.591 1.00 21.10 H new ATOM 0 HB VAL A 29 26.975 -2.249 39.655 1.00 52.35 H new ATOM 0 HG11 VAL A 29 26.726 -0.956 41.765 1.00 22.22 H new ATOM 0 HG12 VAL A 29 25.925 -2.544 41.844 1.00 22.22 H new ATOM 0 HG13 VAL A 29 27.490 -2.295 42.655 1.00 22.22 H new ATOM 0 HG21 VAL A 29 28.689 -0.597 40.378 1.00 1.33 H new ATOM 0 HG22 VAL A 29 29.596 -1.910 41.165 1.00 1.33 H new ATOM 0 HG23 VAL A 29 29.383 -1.911 39.398 1.00 1.33 H new ATOM 420 N VAL A 30 28.187 -4.780 42.801 1.00 0.15 N ATOM 421 CA VAL A 30 28.931 -5.183 43.991 1.00 31.22 C ATOM 422 C VAL A 30 29.925 -6.314 43.693 1.00 51.41 C ATOM 423 O VAL A 30 31.028 -6.321 44.240 1.00 12.10 O ATOM 424 CB VAL A 30 27.958 -5.541 45.130 1.00 14.44 C ATOM 425 CG1 VAL A 30 27.272 -6.893 44.915 1.00 64.12 C ATOM 426 CG2 VAL A 30 28.673 -5.545 46.487 1.00 1.13 C ATOM 0 H VAL A 30 27.176 -4.782 42.934 1.00 0.15 H new ATOM 0 HA VAL A 30 29.534 -4.337 44.320 1.00 31.22 H new ATOM 0 HB VAL A 30 27.189 -4.768 45.124 1.00 14.44 H new ATOM 0 HG11 VAL A 30 26.598 -7.095 45.747 1.00 64.12 H new ATOM 0 HG12 VAL A 30 26.704 -6.869 43.985 1.00 64.12 H new ATOM 0 HG13 VAL A 30 28.026 -7.679 44.860 1.00 64.12 H new ATOM 0 HG21 VAL A 30 27.962 -5.801 47.272 1.00 1.13 H new ATOM 0 HG22 VAL A 30 29.477 -6.280 46.472 1.00 1.13 H new ATOM 0 HG23 VAL A 30 29.089 -4.556 46.682 1.00 1.13 H new ATOM 436 N ARG A 31 29.544 -7.246 42.808 1.00 62.35 N ATOM 437 CA ARG A 31 30.332 -8.419 42.456 1.00 73.15 C ATOM 438 C ARG A 31 31.708 -8.067 41.873 1.00 33.11 C ATOM 439 O ARG A 31 32.613 -8.897 41.937 1.00 45.52 O ATOM 440 CB ARG A 31 29.523 -9.336 41.523 1.00 42.00 C ATOM 441 CG ARG A 31 29.333 -8.807 40.091 1.00 53.32 C ATOM 442 CD ARG A 31 30.084 -9.631 39.040 1.00 42.24 C ATOM 443 NE ARG A 31 31.528 -9.683 39.315 1.00 54.25 N ATOM 444 CZ ARG A 31 32.528 -9.539 38.430 1.00 41.54 C ATOM 445 NH1 ARG A 31 32.286 -9.413 37.117 1.00 72.03 N ATOM 446 NH2 ARG A 31 33.789 -9.517 38.879 1.00 34.03 N ATOM 0 H ARG A 31 28.656 -7.197 42.309 1.00 62.35 H new ATOM 0 HA ARG A 31 30.543 -8.962 43.377 1.00 73.15 H new ATOM 0 HB2 ARG A 31 30.019 -10.305 41.473 1.00 42.00 H new ATOM 0 HB3 ARG A 31 28.541 -9.503 41.965 1.00 42.00 H new ATOM 0 HG2 ARG A 31 28.270 -8.804 39.850 1.00 53.32 H new ATOM 0 HG3 ARG A 31 29.674 -7.773 40.044 1.00 53.32 H new ATOM 0 HD2 ARG A 31 29.682 -10.644 39.017 1.00 42.24 H new ATOM 0 HD3 ARG A 31 29.917 -9.199 38.053 1.00 42.24 H new ATOM 0 HE ARG A 31 31.800 -9.846 40.284 1.00 54.25 H new ATOM 0 HH11 ARG A 31 31.326 -9.425 36.772 1.00 72.03 H new ATOM 0 HH12 ARG A 31 33.062 -9.305 36.464 1.00 72.03 H new ATOM 0 HH21 ARG A 31 33.977 -9.609 39.877 1.00 34.03 H new ATOM 0 HH22 ARG A 31 34.562 -9.409 38.223 1.00 34.03 H new ATOM 460 N GLN A 32 31.858 -6.870 41.283 1.00 64.51 N ATOM 461 CA GLN A 32 33.114 -6.352 40.751 1.00 22.44 C ATOM 462 C GLN A 32 33.683 -5.249 41.654 1.00 21.44 C ATOM 463 O GLN A 32 34.899 -5.112 41.750 1.00 22.33 O ATOM 464 CB GLN A 32 32.974 -5.967 39.264 1.00 20.01 C ATOM 465 CG GLN A 32 32.249 -4.656 38.910 1.00 42.11 C ATOM 466 CD GLN A 32 32.938 -3.383 39.378 1.00 50.44 C ATOM 467 OE1 GLN A 32 32.277 -2.437 39.801 1.00 11.33 O ATOM 468 NE2 GLN A 32 34.267 -3.353 39.328 1.00 74.44 N ATOM 0 H GLN A 32 31.080 -6.221 41.163 1.00 64.51 H new ATOM 0 HA GLN A 32 33.864 -7.143 40.765 1.00 22.44 H new ATOM 0 HB2 GLN A 32 33.976 -5.917 38.839 1.00 20.01 H new ATOM 0 HB3 GLN A 32 32.454 -6.781 38.758 1.00 20.01 H new ATOM 0 HG2 GLN A 32 32.129 -4.607 37.828 1.00 42.11 H new ATOM 0 HG3 GLN A 32 31.248 -4.687 39.340 1.00 42.11 H new ATOM 0 HE21 GLN A 32 34.782 -4.157 38.971 1.00 74.44 H new ATOM 0 HE22 GLN A 32 34.771 -2.526 39.647 1.00 74.44 H new ATOM 477 N ARG A 33 32.829 -4.458 42.320 1.00 74.44 N ATOM 478 CA ARG A 33 33.260 -3.373 43.178 1.00 14.12 C ATOM 479 C ARG A 33 34.127 -3.887 44.325 1.00 14.14 C ATOM 480 O ARG A 33 35.184 -3.322 44.589 1.00 63.25 O ATOM 481 CB ARG A 33 32.026 -2.652 43.718 1.00 44.33 C ATOM 482 CG ARG A 33 32.442 -1.372 44.440 1.00 54.01 C ATOM 483 CD ARG A 33 31.191 -0.698 45.000 1.00 51.43 C ATOM 484 NE ARG A 33 31.490 0.510 45.783 1.00 51.14 N ATOM 485 CZ ARG A 33 31.826 0.522 47.085 1.00 11.43 C ATOM 486 NH1 ARG A 33 32.109 -0.612 47.738 1.00 5.12 N ATOM 487 NH2 ARG A 33 31.863 1.682 47.750 1.00 44.03 N ATOM 0 H ARG A 33 31.816 -4.564 42.270 1.00 74.44 H new ATOM 0 HA ARG A 33 33.868 -2.679 42.598 1.00 14.12 H new ATOM 0 HB2 ARG A 33 31.347 -2.413 42.899 1.00 44.33 H new ATOM 0 HB3 ARG A 33 31.484 -3.305 44.402 1.00 44.33 H new ATOM 0 HG2 ARG A 33 33.140 -1.602 45.245 1.00 54.01 H new ATOM 0 HG3 ARG A 33 32.958 -0.701 43.753 1.00 54.01 H new ATOM 0 HD2 ARG A 33 30.527 -0.435 44.176 1.00 51.43 H new ATOM 0 HD3 ARG A 33 30.653 -1.408 45.629 1.00 51.43 H new ATOM 0 HE ARG A 33 31.439 1.408 45.302 1.00 51.14 H new ATOM 0 HH11 ARG A 33 32.072 -1.506 47.248 1.00 5.12 H new ATOM 0 HH12 ARG A 33 32.362 -0.582 48.726 1.00 5.12 H new ATOM 0 HH21 ARG A 33 31.637 2.553 47.269 1.00 44.03 H new ATOM 0 HH22 ARG A 33 32.117 1.696 48.738 1.00 44.03 H new ATOM 501 N ILE A 34 33.682 -4.950 45.004 1.00 73.43 N ATOM 502 CA ILE A 34 34.418 -5.573 46.096 1.00 52.23 C ATOM 503 C ILE A 34 35.813 -6.014 45.645 1.00 40.30 C ATOM 504 O ILE A 34 36.756 -5.944 46.430 1.00 54.12 O ATOM 505 CB ILE A 34 33.593 -6.740 46.669 1.00 3.23 C ATOM 506 CG1 ILE A 34 32.299 -6.244 47.345 1.00 44.52 C ATOM 507 CG2 ILE A 34 34.418 -7.606 47.632 1.00 1.33 C ATOM 508 CD1 ILE A 34 32.503 -5.426 48.624 1.00 43.30 C ATOM 0 H ILE A 34 32.790 -5.403 44.804 1.00 73.43 H new ATOM 0 HA ILE A 34 34.571 -4.842 46.890 1.00 52.23 H new ATOM 0 HB ILE A 34 33.308 -7.368 45.825 1.00 3.23 H new ATOM 0 HG12 ILE A 34 31.744 -5.637 46.630 1.00 44.52 H new ATOM 0 HG13 ILE A 34 31.677 -7.108 47.581 1.00 44.52 H new ATOM 0 HG21 ILE A 34 33.798 -8.418 48.013 1.00 1.33 H new ATOM 0 HG22 ILE A 34 35.276 -8.022 47.103 1.00 1.33 H new ATOM 0 HG23 ILE A 34 34.767 -6.994 48.464 1.00 1.33 H new ATOM 0 HD11 ILE A 34 31.534 -5.125 49.022 1.00 43.30 H new ATOM 0 HD12 ILE A 34 33.026 -6.032 49.364 1.00 43.30 H new ATOM 0 HD13 ILE A 34 33.094 -4.539 48.398 1.00 43.30 H new ATOM 520 N VAL A 35 35.951 -6.447 44.386 1.00 30.40 N ATOM 521 CA VAL A 35 37.226 -6.855 43.813 1.00 54.24 C ATOM 522 C VAL A 35 38.196 -5.669 43.834 1.00 30.14 C ATOM 523 O VAL A 35 39.275 -5.763 44.420 1.00 74.11 O ATOM 524 CB VAL A 35 37.023 -7.412 42.389 1.00 52.00 C ATOM 525 CG1 VAL A 35 38.318 -8.037 41.864 1.00 50.14 C ATOM 526 CG2 VAL A 35 35.903 -8.460 42.341 1.00 55.54 C ATOM 0 H VAL A 35 35.169 -6.522 43.735 1.00 30.40 H new ATOM 0 HA VAL A 35 37.659 -7.657 44.410 1.00 54.24 H new ATOM 0 HB VAL A 35 36.738 -6.571 41.757 1.00 52.00 H new ATOM 0 HG11 VAL A 35 38.154 -8.424 40.858 1.00 50.14 H new ATOM 0 HG12 VAL A 35 39.103 -7.281 41.838 1.00 50.14 H new ATOM 0 HG13 VAL A 35 38.621 -8.852 42.521 1.00 50.14 H new ATOM 0 HG21 VAL A 35 35.792 -8.827 41.321 1.00 55.54 H new ATOM 0 HG22 VAL A 35 36.154 -9.291 43.001 1.00 55.54 H new ATOM 0 HG23 VAL A 35 34.967 -8.007 42.668 1.00 55.54 H new ATOM 536 N ASP A 36 37.791 -4.549 43.222 1.00 54.41 N ATOM 537 CA ASP A 36 38.567 -3.315 43.176 1.00 25.31 C ATOM 538 C ASP A 36 38.887 -2.805 44.584 1.00 52.33 C ATOM 539 O ASP A 36 40.027 -2.447 44.876 1.00 50.51 O ATOM 540 CB ASP A 36 37.785 -2.257 42.389 1.00 11.42 C ATOM 541 CG ASP A 36 38.585 -0.964 42.257 1.00 45.30 C ATOM 542 OD1 ASP A 36 39.506 -0.951 41.412 1.00 23.13 O ATOM 543 OD2 ASP A 36 38.265 -0.017 43.007 1.00 0.11 O ATOM 0 H ASP A 36 36.896 -4.480 42.737 1.00 54.41 H new ATOM 0 HA ASP A 36 39.515 -3.517 42.678 1.00 25.31 H new ATOM 0 HB2 ASP A 36 37.544 -2.642 41.398 1.00 11.42 H new ATOM 0 HB3 ASP A 36 36.839 -2.053 42.890 1.00 11.42 H new ATOM 548 N LEU A 37 37.869 -2.777 45.451 1.00 33.53 N ATOM 549 CA LEU A 37 37.977 -2.305 46.822 1.00 42.45 C ATOM 550 C LEU A 37 39.058 -3.090 47.566 1.00 3.34 C ATOM 551 O LEU A 37 39.987 -2.491 48.096 1.00 35.14 O ATOM 552 CB LEU A 37 36.608 -2.405 47.516 1.00 50.14 C ATOM 553 CG LEU A 37 36.571 -1.731 48.898 1.00 34.15 C ATOM 554 CD1 LEU A 37 36.563 -0.200 48.783 1.00 52.05 C ATOM 555 CD2 LEU A 37 35.303 -2.163 49.644 1.00 1.32 C ATOM 0 H LEU A 37 36.930 -3.090 45.207 1.00 33.53 H new ATOM 0 HA LEU A 37 38.276 -1.257 46.828 1.00 42.45 H new ATOM 0 HB2 LEU A 37 35.851 -1.949 46.878 1.00 50.14 H new ATOM 0 HB3 LEU A 37 36.341 -3.456 47.626 1.00 50.14 H new ATOM 0 HG LEU A 37 37.467 -2.038 49.438 1.00 34.15 H new ATOM 0 HD11 LEU A 37 36.537 0.240 49.780 1.00 52.05 H new ATOM 0 HD12 LEU A 37 37.463 0.131 48.264 1.00 52.05 H new ATOM 0 HD13 LEU A 37 35.684 0.118 48.223 1.00 52.05 H new ATOM 0 HD21 LEU A 37 35.277 -1.685 50.623 1.00 1.32 H new ATOM 0 HD22 LEU A 37 34.425 -1.865 49.071 1.00 1.32 H new ATOM 0 HD23 LEU A 37 35.305 -3.246 49.768 1.00 1.32 H new ATOM 567 N ALA A 38 38.956 -4.425 47.582 1.00 2.44 N ATOM 568 CA ALA A 38 39.939 -5.308 48.199 1.00 31.40 C ATOM 569 C ALA A 38 41.344 -5.044 47.649 1.00 65.51 C ATOM 570 O ALA A 38 42.304 -4.956 48.416 1.00 44.14 O ATOM 571 CB ALA A 38 39.533 -6.766 47.971 1.00 63.21 C ATOM 0 H ALA A 38 38.174 -4.924 47.158 1.00 2.44 H new ATOM 0 HA ALA A 38 39.964 -5.107 49.270 1.00 31.40 H new ATOM 0 HB1 ALA A 38 40.268 -7.425 48.433 1.00 63.21 H new ATOM 0 HB2 ALA A 38 38.555 -6.945 48.417 1.00 63.21 H new ATOM 0 HB3 ALA A 38 39.486 -6.968 46.901 1.00 63.21 H new ATOM 577 N HIS A 39 41.445 -4.902 46.322 1.00 1.45 N ATOM 578 CA HIS A 39 42.687 -4.687 45.589 1.00 33.14 C ATOM 579 C HIS A 39 43.399 -3.379 45.965 1.00 12.22 C ATOM 580 O HIS A 39 44.586 -3.248 45.671 1.00 35.12 O ATOM 581 CB HIS A 39 42.402 -4.780 44.083 1.00 73.03 C ATOM 582 CG HIS A 39 43.622 -4.638 43.210 1.00 34.51 C ATOM 583 ND1 HIS A 39 43.922 -3.464 42.536 1.00 1.11 N ATOM 584 CD2 HIS A 39 44.637 -5.509 42.892 1.00 71.32 C ATOM 585 CE1 HIS A 39 45.074 -3.667 41.875 1.00 15.41 C ATOM 586 NE2 HIS A 39 45.560 -4.899 42.048 1.00 2.22 N ATOM 0 H HIS A 39 40.629 -4.936 45.711 1.00 1.45 H new ATOM 0 HA HIS A 39 43.387 -5.472 45.874 1.00 33.14 H new ATOM 0 HB2 HIS A 39 41.930 -5.740 43.873 1.00 73.03 H new ATOM 0 HB3 HIS A 39 41.684 -4.006 43.813 1.00 73.03 H new ATOM 0 HD2 HIS A 39 44.708 -6.526 43.248 1.00 71.32 H new ATOM 0 HE1 HIS A 39 45.556 -2.914 41.268 1.00 15.41 H new ATOM 0 HE2 HIS A 39 46.411 -5.300 41.653 1.00 2.22 H new ATOM 594 N GLN A 40 42.733 -2.432 46.650 1.00 13.50 N ATOM 595 CA GLN A 40 43.419 -1.262 47.199 1.00 20.44 C ATOM 596 C GLN A 40 44.497 -1.682 48.207 1.00 4.44 C ATOM 597 O GLN A 40 45.477 -0.964 48.393 1.00 20.42 O ATOM 598 CB GLN A 40 42.419 -0.262 47.812 1.00 41.25 C ATOM 599 CG GLN A 40 42.113 -0.526 49.295 1.00 10.00 C ATOM 600 CD GLN A 40 40.986 0.360 49.817 1.00 75.03 C ATOM 601 OE1 GLN A 40 41.233 1.437 50.352 1.00 50.02 O ATOM 602 NE2 GLN A 40 39.742 -0.101 49.683 1.00 11.33 N ATOM 0 H GLN A 40 41.730 -2.458 46.832 1.00 13.50 H new ATOM 0 HA GLN A 40 43.920 -0.749 46.378 1.00 20.44 H new ATOM 0 HB2 GLN A 40 42.817 0.747 47.706 1.00 41.25 H new ATOM 0 HB3 GLN A 40 41.488 -0.299 47.246 1.00 41.25 H new ATOM 0 HG2 GLN A 40 41.841 -1.573 49.427 1.00 10.00 H new ATOM 0 HG3 GLN A 40 43.012 -0.353 49.886 1.00 10.00 H new ATOM 0 HE21 GLN A 40 39.577 -1.001 49.232 1.00 11.33 H new ATOM 0 HE22 GLN A 40 38.955 0.447 50.031 1.00 11.33 H new ATOM 611 N GLY A 41 44.297 -2.838 48.856 1.00 14.20 N ATOM 612 CA GLY A 41 45.180 -3.398 49.863 1.00 71.05 C ATOM 613 C GLY A 41 44.471 -3.435 51.213 1.00 31.01 C ATOM 614 O GLY A 41 44.989 -2.902 52.194 1.00 51.30 O ATOM 0 H GLY A 41 43.481 -3.424 48.680 1.00 14.20 H new ATOM 0 HA2 GLY A 41 45.483 -4.404 49.574 1.00 71.05 H new ATOM 0 HA3 GLY A 41 46.088 -2.800 49.936 1.00 71.05 H new ATOM 618 N VAL A 42 43.290 -4.067 51.259 1.00 22.12 N ATOM 619 CA VAL A 42 42.505 -4.245 52.472 1.00 14.24 C ATOM 620 C VAL A 42 41.949 -5.671 52.489 1.00 31.21 C ATOM 621 O VAL A 42 41.464 -6.163 51.471 1.00 53.15 O ATOM 622 CB VAL A 42 41.426 -3.149 52.554 1.00 44.52 C ATOM 623 CG1 VAL A 42 40.359 -3.271 51.462 1.00 33.14 C ATOM 624 CG2 VAL A 42 40.741 -3.119 53.924 1.00 24.43 C ATOM 0 H VAL A 42 42.851 -4.474 50.433 1.00 22.12 H new ATOM 0 HA VAL A 42 43.116 -4.131 53.367 1.00 14.24 H new ATOM 0 HB VAL A 42 41.963 -2.213 52.399 1.00 44.52 H new ATOM 0 HG11 VAL A 42 39.629 -2.470 51.576 1.00 33.14 H new ATOM 0 HG12 VAL A 42 40.831 -3.196 50.482 1.00 33.14 H new ATOM 0 HG13 VAL A 42 39.857 -4.234 51.550 1.00 33.14 H new ATOM 0 HG21 VAL A 42 39.988 -2.331 53.937 1.00 24.43 H new ATOM 0 HG22 VAL A 42 40.264 -4.081 54.113 1.00 24.43 H new ATOM 0 HG23 VAL A 42 41.483 -2.924 54.698 1.00 24.43 H new ATOM 634 N ARG A 43 42.069 -6.349 53.637 1.00 32.24 N ATOM 635 CA ARG A 43 41.671 -7.742 53.799 1.00 53.31 C ATOM 636 C ARG A 43 40.148 -7.859 53.664 1.00 22.23 C ATOM 637 O ARG A 43 39.438 -6.915 54.004 1.00 13.10 O ATOM 638 CB ARG A 43 42.125 -8.247 55.177 1.00 23.52 C ATOM 639 CG ARG A 43 43.643 -8.133 55.382 1.00 43.41 C ATOM 640 CD ARG A 43 44.048 -8.488 56.819 1.00 13.14 C ATOM 641 NE ARG A 43 43.651 -9.857 57.184 1.00 21.12 N ATOM 642 CZ ARG A 43 42.811 -10.224 58.169 1.00 25.13 C ATOM 643 NH1 ARG A 43 42.153 -9.324 58.916 1.00 10.00 N ATOM 644 NH2 ARG A 43 42.623 -11.531 58.405 1.00 2.12 N ATOM 0 H ARG A 43 42.451 -5.935 54.487 1.00 32.24 H new ATOM 0 HA ARG A 43 42.141 -8.351 53.027 1.00 53.31 H new ATOM 0 HB2 ARG A 43 41.614 -7.678 55.954 1.00 23.52 H new ATOM 0 HB3 ARG A 43 41.824 -9.288 55.295 1.00 23.52 H new ATOM 0 HG2 ARG A 43 44.156 -8.796 54.685 1.00 43.41 H new ATOM 0 HG3 ARG A 43 43.966 -7.118 55.153 1.00 43.41 H new ATOM 0 HD2 ARG A 43 45.128 -8.383 56.927 1.00 13.14 H new ATOM 0 HD3 ARG A 43 43.588 -7.781 57.510 1.00 13.14 H new ATOM 0 HE ARG A 43 44.057 -10.611 56.629 1.00 21.12 H new ATOM 0 HH11 ARG A 43 42.282 -8.327 58.745 1.00 10.00 H new ATOM 0 HH12 ARG A 43 41.523 -9.637 59.655 1.00 10.00 H new ATOM 0 HH21 ARG A 43 43.113 -12.226 57.842 1.00 2.12 H new ATOM 0 HH22 ARG A 43 41.990 -11.829 59.147 1.00 2.12 H new ATOM 658 N PRO A 44 39.617 -9.003 53.201 1.00 34.24 N ATOM 659 CA PRO A 44 38.181 -9.213 53.103 1.00 5.32 C ATOM 660 C PRO A 44 37.524 -9.143 54.485 1.00 22.34 C ATOM 661 O PRO A 44 36.404 -8.653 54.613 1.00 23.44 O ATOM 662 CB PRO A 44 38.003 -10.573 52.425 1.00 33.34 C ATOM 663 CG PRO A 44 39.292 -11.316 52.772 1.00 70.31 C ATOM 664 CD PRO A 44 40.339 -10.202 52.808 1.00 13.11 C ATOM 0 HA PRO A 44 37.690 -8.436 52.518 1.00 5.32 H new ATOM 0 HB2 PRO A 44 37.124 -11.097 52.801 1.00 33.34 H new ATOM 0 HB3 PRO A 44 37.876 -10.471 51.347 1.00 33.34 H new ATOM 0 HG2 PRO A 44 39.216 -11.828 53.731 1.00 70.31 H new ATOM 0 HG3 PRO A 44 39.534 -12.072 52.025 1.00 70.31 H new ATOM 0 HD2 PRO A 44 41.133 -10.433 53.518 1.00 13.11 H new ATOM 0 HD3 PRO A 44 40.810 -10.075 51.833 1.00 13.11 H new ATOM 672 N CYS A 45 38.243 -9.582 55.527 1.00 45.40 N ATOM 673 CA CYS A 45 37.842 -9.392 56.913 1.00 3.22 C ATOM 674 C CYS A 45 37.735 -7.900 57.239 1.00 33.43 C ATOM 675 O CYS A 45 36.739 -7.458 57.802 1.00 14.23 O ATOM 676 CB CYS A 45 38.846 -10.071 57.848 1.00 63.35 C ATOM 677 SG CYS A 45 38.965 -11.848 57.509 1.00 44.15 S ATOM 0 H CYS A 45 39.126 -10.082 55.422 1.00 45.40 H new ATOM 0 HA CYS A 45 36.862 -9.847 57.059 1.00 3.22 H new ATOM 0 HB2 CYS A 45 39.826 -9.610 57.729 1.00 63.35 H new ATOM 0 HB3 CYS A 45 38.544 -9.916 58.884 1.00 63.35 H new ATOM 0 HG CYS A 45 39.827 -12.388 58.319 1.00 44.15 H new ATOM 683 N ASP A 46 38.766 -7.130 56.878 1.00 11.32 N ATOM 684 CA ASP A 46 38.870 -5.713 57.200 1.00 60.31 C ATOM 685 C ASP A 46 37.775 -4.885 56.518 1.00 35.04 C ATOM 686 O ASP A 46 37.354 -3.885 57.090 1.00 25.33 O ATOM 687 CB ASP A 46 40.265 -5.174 56.852 1.00 34.44 C ATOM 688 CG ASP A 46 41.406 -5.759 57.687 1.00 14.32 C ATOM 689 OD1 ASP A 46 41.160 -6.719 58.450 1.00 32.53 O ATOM 690 OD2 ASP A 46 42.535 -5.252 57.514 1.00 71.33 O ATOM 0 H ASP A 46 39.561 -7.484 56.346 1.00 11.32 H new ATOM 0 HA ASP A 46 38.722 -5.615 58.275 1.00 60.31 H new ATOM 0 HB2 ASP A 46 40.464 -5.374 55.799 1.00 34.44 H new ATOM 0 HB3 ASP A 46 40.262 -4.091 56.975 1.00 34.44 H new ATOM 695 N ILE A 47 37.285 -5.290 55.334 1.00 61.24 N ATOM 696 CA ILE A 47 36.172 -4.617 54.653 1.00 22.53 C ATOM 697 C ILE A 47 34.969 -4.425 55.587 1.00 73.50 C ATOM 698 O ILE A 47 34.289 -3.402 55.503 1.00 74.12 O ATOM 699 CB ILE A 47 35.798 -5.339 53.338 1.00 53.30 C ATOM 700 CG1 ILE A 47 36.924 -5.105 52.315 1.00 13.25 C ATOM 701 CG2 ILE A 47 34.462 -4.828 52.769 1.00 1.34 C ATOM 702 CD1 ILE A 47 36.735 -5.838 50.984 1.00 43.01 C ATOM 0 H ILE A 47 37.651 -6.094 54.824 1.00 61.24 H new ATOM 0 HA ILE A 47 36.506 -3.617 54.376 1.00 22.53 H new ATOM 0 HB ILE A 47 35.680 -6.403 53.544 1.00 53.30 H new ATOM 0 HG12 ILE A 47 37.003 -4.036 52.118 1.00 13.25 H new ATOM 0 HG13 ILE A 47 37.870 -5.418 52.757 1.00 13.25 H new ATOM 0 HG21 ILE A 47 34.233 -5.359 51.845 1.00 1.34 H new ATOM 0 HG22 ILE A 47 33.667 -5.002 53.494 1.00 1.34 H new ATOM 0 HG23 ILE A 47 34.538 -3.760 52.564 1.00 1.34 H new ATOM 0 HD11 ILE A 47 37.574 -5.616 50.324 1.00 43.01 H new ATOM 0 HD12 ILE A 47 36.688 -6.912 51.164 1.00 43.01 H new ATOM 0 HD13 ILE A 47 35.808 -5.508 50.515 1.00 43.01 H new ATOM 714 N SER A 48 34.738 -5.380 56.497 1.00 31.40 N ATOM 715 CA SER A 48 33.701 -5.309 57.523 1.00 30.13 C ATOM 716 C SER A 48 33.701 -3.972 58.274 1.00 61.54 C ATOM 717 O SER A 48 32.632 -3.452 58.592 1.00 32.24 O ATOM 718 CB SER A 48 33.874 -6.454 58.527 1.00 71.14 C ATOM 719 OG SER A 48 33.972 -7.695 57.861 1.00 12.45 O ATOM 0 H SER A 48 35.282 -6.242 56.537 1.00 31.40 H new ATOM 0 HA SER A 48 32.744 -5.398 57.009 1.00 30.13 H new ATOM 0 HB2 SER A 48 34.769 -6.286 59.126 1.00 71.14 H new ATOM 0 HB3 SER A 48 33.029 -6.471 59.215 1.00 71.14 H new ATOM 0 HG SER A 48 34.913 -7.892 57.673 1.00 12.45 H new ATOM 725 N ARG A 49 34.891 -3.423 58.566 1.00 4.34 N ATOM 726 CA ARG A 49 35.038 -2.207 59.353 1.00 44.13 C ATOM 727 C ARG A 49 34.553 -0.966 58.601 1.00 33.25 C ATOM 728 O ARG A 49 34.055 -0.040 59.236 1.00 54.02 O ATOM 729 CB ARG A 49 36.479 -2.065 59.879 1.00 54.23 C ATOM 730 CG ARG A 49 37.485 -1.457 58.885 1.00 41.32 C ATOM 731 CD ARG A 49 37.725 0.039 59.124 1.00 12.12 C ATOM 732 NE ARG A 49 38.406 0.272 60.406 1.00 51.02 N ATOM 733 CZ ARG A 49 38.686 1.478 60.925 1.00 45.11 C ATOM 734 NH1 ARG A 49 38.356 2.602 60.272 1.00 51.55 N ATOM 735 NH2 ARG A 49 39.303 1.558 62.111 1.00 41.45 N ATOM 0 H ARG A 49 35.778 -3.820 58.257 1.00 4.34 H new ATOM 0 HA ARG A 49 34.386 -2.293 60.223 1.00 44.13 H new ATOM 0 HB2 ARG A 49 36.461 -1.447 60.777 1.00 54.23 H new ATOM 0 HB3 ARG A 49 36.838 -3.050 60.177 1.00 54.23 H new ATOM 0 HG2 ARG A 49 38.433 -1.990 58.963 1.00 41.32 H new ATOM 0 HG3 ARG A 49 37.119 -1.604 57.869 1.00 41.32 H new ATOM 0 HD2 ARG A 49 38.325 0.448 58.311 1.00 12.12 H new ATOM 0 HD3 ARG A 49 36.772 0.569 59.114 1.00 12.12 H new ATOM 0 HE ARG A 49 38.688 -0.548 60.944 1.00 51.02 H new ATOM 0 HH11 ARG A 49 37.886 2.548 59.368 1.00 51.55 H new ATOM 0 HH12 ARG A 49 38.575 3.511 60.679 1.00 51.55 H new ATOM 0 HH21 ARG A 49 39.556 0.707 62.613 1.00 41.45 H new ATOM 0 HH22 ARG A 49 39.520 2.470 62.513 1.00 41.45 H new ATOM 749 N GLN A 50 34.686 -0.930 57.265 1.00 31.12 N ATOM 750 CA GLN A 50 34.234 0.198 56.464 1.00 63.24 C ATOM 751 C GLN A 50 32.717 0.362 56.566 1.00 14.31 C ATOM 752 O GLN A 50 32.222 1.481 56.687 1.00 70.21 O ATOM 753 CB GLN A 50 34.643 -0.009 55.003 1.00 24.00 C ATOM 754 CG GLN A 50 36.159 -0.150 54.844 1.00 32.53 C ATOM 755 CD GLN A 50 36.522 -0.495 53.406 1.00 44.03 C ATOM 756 OE1 GLN A 50 35.973 0.073 52.464 1.00 0.35 O ATOM 757 NE2 GLN A 50 37.434 -1.450 53.235 1.00 72.04 N ATOM 0 H GLN A 50 35.109 -1.682 56.721 1.00 31.12 H new ATOM 0 HA GLN A 50 34.702 1.106 56.845 1.00 63.24 H new ATOM 0 HB2 GLN A 50 34.153 -0.901 54.613 1.00 24.00 H new ATOM 0 HB3 GLN A 50 34.293 0.833 54.406 1.00 24.00 H new ATOM 0 HG2 GLN A 50 36.648 0.780 55.134 1.00 32.53 H new ATOM 0 HG3 GLN A 50 36.529 -0.927 55.514 1.00 32.53 H new ATOM 0 HE21 GLN A 50 37.865 -1.895 54.046 1.00 72.04 H new ATOM 0 HE22 GLN A 50 37.702 -1.737 52.293 1.00 72.04 H new ATOM 766 N LEU A 51 31.989 -0.760 56.525 1.00 45.34 N ATOM 767 CA LEU A 51 30.539 -0.792 56.657 1.00 61.21 C ATOM 768 C LEU A 51 30.141 -0.720 58.133 1.00 32.01 C ATOM 769 O LEU A 51 29.031 -0.286 58.438 1.00 71.23 O ATOM 770 CB LEU A 51 29.979 -2.062 55.994 1.00 64.33 C ATOM 771 CG LEU A 51 29.895 -2.020 54.456 1.00 20.53 C ATOM 772 CD1 LEU A 51 28.874 -0.994 53.960 1.00 45.23 C ATOM 773 CD2 LEU A 51 31.253 -1.808 53.777 1.00 63.13 C ATOM 0 H LEU A 51 32.404 -1.683 56.397 1.00 45.34 H new ATOM 0 HA LEU A 51 30.114 0.074 56.150 1.00 61.21 H new ATOM 0 HB2 LEU A 51 30.602 -2.908 56.284 1.00 64.33 H new ATOM 0 HB3 LEU A 51 28.981 -2.249 56.391 1.00 64.33 H new ATOM 0 HG LEU A 51 29.549 -3.011 54.163 1.00 20.53 H new ATOM 0 HD11 LEU A 51 28.851 -1.001 52.870 1.00 45.23 H new ATOM 0 HD12 LEU A 51 27.887 -1.248 54.346 1.00 45.23 H new ATOM 0 HD13 LEU A 51 29.156 -0.001 54.310 1.00 45.23 H new ATOM 0 HD21 LEU A 51 31.120 -1.789 52.695 1.00 63.13 H new ATOM 0 HD22 LEU A 51 31.681 -0.861 54.107 1.00 63.13 H new ATOM 0 HD23 LEU A 51 31.925 -2.623 54.045 1.00 63.13 H new ATOM 785 N ARG A 52 31.045 -1.129 59.033 1.00 74.31 N ATOM 786 CA ARG A 52 30.882 -1.122 60.477 1.00 34.34 C ATOM 787 C ARG A 52 29.828 -2.154 60.885 1.00 72.41 C ATOM 788 O ARG A 52 28.841 -1.809 61.533 1.00 23.33 O ATOM 789 CB ARG A 52 30.564 0.290 61.005 1.00 42.25 C ATOM 790 CG ARG A 52 31.611 1.332 60.584 1.00 43.42 C ATOM 791 CD ARG A 52 31.152 2.751 60.926 1.00 5.32 C ATOM 792 NE ARG A 52 30.002 3.145 60.103 1.00 34.30 N ATOM 793 CZ ARG A 52 29.314 4.291 60.237 1.00 72.00 C ATOM 794 NH1 ARG A 52 29.674 5.203 61.151 1.00 34.14 N ATOM 795 NH2 ARG A 52 28.254 4.518 59.448 1.00 72.31 N ATOM 0 H ARG A 52 31.955 -1.491 58.749 1.00 74.31 H new ATOM 0 HA ARG A 52 31.826 -1.408 60.941 1.00 34.34 H new ATOM 0 HB2 ARG A 52 29.584 0.598 60.639 1.00 42.25 H new ATOM 0 HB3 ARG A 52 30.504 0.261 62.093 1.00 42.25 H new ATOM 0 HG2 ARG A 52 32.557 1.123 61.084 1.00 43.42 H new ATOM 0 HG3 ARG A 52 31.793 1.255 59.512 1.00 43.42 H new ATOM 0 HD2 ARG A 52 30.884 2.806 61.981 1.00 5.32 H new ATOM 0 HD3 ARG A 52 31.973 3.450 60.769 1.00 5.32 H new ATOM 0 HE ARG A 52 29.702 2.499 59.373 1.00 34.30 H new ATOM 0 HH11 ARG A 52 30.478 5.031 61.754 1.00 34.14 H new ATOM 0 HH12 ARG A 52 29.144 6.069 61.243 1.00 34.14 H new ATOM 0 HH21 ARG A 52 27.977 3.824 58.754 1.00 72.31 H new ATOM 0 HH22 ARG A 52 27.725 5.385 59.542 1.00 72.31 H new ATOM 809 N VAL A 53 30.038 -3.418 60.488 1.00 21.41 N ATOM 810 CA VAL A 53 29.102 -4.513 60.723 1.00 2.33 C ATOM 811 C VAL A 53 29.822 -5.747 61.279 1.00 34.13 C ATOM 812 O VAL A 53 31.050 -5.823 61.253 1.00 44.50 O ATOM 813 CB VAL A 53 28.309 -4.829 59.444 1.00 34.33 C ATOM 814 CG1 VAL A 53 27.469 -3.630 58.989 1.00 74.33 C ATOM 815 CG2 VAL A 53 29.216 -5.284 58.295 1.00 72.43 C ATOM 0 H VAL A 53 30.878 -3.706 59.987 1.00 21.41 H new ATOM 0 HA VAL A 53 28.385 -4.200 61.482 1.00 2.33 H new ATOM 0 HB VAL A 53 27.642 -5.652 59.700 1.00 34.33 H new ATOM 0 HG11 VAL A 53 26.923 -3.891 58.083 1.00 74.33 H new ATOM 0 HG12 VAL A 53 26.762 -3.362 59.774 1.00 74.33 H new ATOM 0 HG13 VAL A 53 28.124 -2.783 58.786 1.00 74.33 H new ATOM 0 HG21 VAL A 53 28.609 -5.495 57.414 1.00 72.43 H new ATOM 0 HG22 VAL A 53 29.932 -4.495 58.062 1.00 72.43 H new ATOM 0 HG23 VAL A 53 29.753 -6.185 58.590 1.00 72.43 H new ATOM 825 N SER A 54 29.039 -6.693 61.813 1.00 14.11 N ATOM 826 CA SER A 54 29.520 -7.806 62.619 1.00 10.04 C ATOM 827 C SER A 54 30.011 -8.975 61.758 1.00 14.13 C ATOM 828 O SER A 54 31.215 -9.113 61.552 1.00 72.24 O ATOM 829 CB SER A 54 28.412 -8.227 63.596 1.00 43.52 C ATOM 830 OG SER A 54 27.199 -8.479 62.911 1.00 53.04 O ATOM 0 H SER A 54 28.027 -6.699 61.689 1.00 14.11 H new ATOM 0 HA SER A 54 30.390 -7.482 63.189 1.00 10.04 H new ATOM 0 HB2 SER A 54 28.720 -9.121 64.137 1.00 43.52 H new ATOM 0 HB3 SER A 54 28.259 -7.443 64.337 1.00 43.52 H new ATOM 0 HG SER A 54 26.510 -8.747 63.554 1.00 53.04 H new ATOM 836 N HIS A 55 29.087 -9.838 61.310 1.00 33.33 N ATOM 837 CA HIS A 55 29.390 -11.123 60.684 1.00 42.12 C ATOM 838 C HIS A 55 28.307 -11.515 59.676 1.00 4.42 C ATOM 839 O HIS A 55 28.615 -11.904 58.551 1.00 62.44 O ATOM 840 CB HIS A 55 29.523 -12.208 61.762 1.00 13.22 C ATOM 841 CG HIS A 55 30.653 -11.972 62.731 1.00 74.13 C ATOM 842 ND1 HIS A 55 31.984 -12.037 62.350 1.00 61.15 N ATOM 843 CD2 HIS A 55 30.673 -11.644 64.065 1.00 51.32 C ATOM 844 CE1 HIS A 55 32.724 -11.749 63.434 1.00 63.34 C ATOM 845 NE2 HIS A 55 31.982 -11.500 64.516 1.00 0.21 N ATOM 0 H HIS A 55 28.086 -9.652 61.377 1.00 33.33 H new ATOM 0 HA HIS A 55 30.333 -11.028 60.146 1.00 42.12 H new ATOM 0 HB2 HIS A 55 28.588 -12.270 62.318 1.00 13.22 H new ATOM 0 HB3 HIS A 55 29.670 -13.173 61.276 1.00 13.22 H new ATOM 0 HD2 HIS A 55 29.794 -11.516 64.679 1.00 51.32 H new ATOM 0 HE1 HIS A 55 33.804 -11.722 63.431 1.00 63.34 H new ATOM 0 HE2 HIS A 55 32.300 -11.260 65.455 1.00 0.21 H new ATOM 853 N GLY A 56 27.033 -11.431 60.082 1.00 24.34 N ATOM 854 CA GLY A 56 25.903 -11.789 59.237 1.00 72.04 C ATOM 855 C GLY A 56 25.874 -10.949 57.960 1.00 4.01 C ATOM 856 O GLY A 56 25.729 -11.483 56.862 1.00 5.31 O ATOM 0 H GLY A 56 26.764 -11.110 61.012 1.00 24.34 H new ATOM 0 HA2 GLY A 56 25.961 -12.846 58.978 1.00 72.04 H new ATOM 0 HA3 GLY A 56 24.974 -11.647 59.789 1.00 72.04 H new ATOM 860 N CYS A 57 26.037 -9.629 58.115 1.00 12.32 N ATOM 861 CA CYS A 57 26.069 -8.684 57.011 1.00 71.20 C ATOM 862 C CYS A 57 27.317 -8.901 56.154 1.00 44.11 C ATOM 863 O CYS A 57 27.212 -8.867 54.930 1.00 72.55 O ATOM 864 CB CYS A 57 26.041 -7.251 57.546 1.00 14.45 C ATOM 865 SG CYS A 57 24.525 -6.949 58.494 1.00 21.43 S ATOM 0 H CYS A 57 26.151 -9.189 59.028 1.00 12.32 H new ATOM 0 HA CYS A 57 25.189 -8.848 56.389 1.00 71.20 H new ATOM 0 HB2 CYS A 57 26.912 -7.077 58.178 1.00 14.45 H new ATOM 0 HB3 CYS A 57 26.103 -6.547 56.716 1.00 14.45 H new ATOM 0 HG CYS A 57 24.527 -5.727 58.938 1.00 21.43 H new ATOM 871 N VAL A 58 28.475 -9.115 56.804 1.00 2.31 N ATOM 872 CA VAL A 58 29.787 -9.275 56.180 1.00 10.54 C ATOM 873 C VAL A 58 29.709 -10.206 54.971 1.00 50.41 C ATOM 874 O VAL A 58 30.147 -9.837 53.883 1.00 44.22 O ATOM 875 CB VAL A 58 30.832 -9.747 57.205 1.00 24.32 C ATOM 876 CG1 VAL A 58 32.198 -9.982 56.542 1.00 62.24 C ATOM 877 CG2 VAL A 58 31.004 -8.702 58.311 1.00 31.31 C ATOM 0 H VAL A 58 28.516 -9.183 57.821 1.00 2.31 H new ATOM 0 HA VAL A 58 30.112 -8.301 55.815 1.00 10.54 H new ATOM 0 HB VAL A 58 30.471 -10.685 57.626 1.00 24.32 H new ATOM 0 HG11 VAL A 58 32.914 -10.315 57.293 1.00 62.24 H new ATOM 0 HG12 VAL A 58 32.101 -10.745 55.770 1.00 62.24 H new ATOM 0 HG13 VAL A 58 32.549 -9.053 56.092 1.00 62.24 H new ATOM 0 HG21 VAL A 58 31.747 -9.051 59.029 1.00 31.31 H new ATOM 0 HG22 VAL A 58 31.336 -7.760 57.874 1.00 31.31 H new ATOM 0 HG23 VAL A 58 30.052 -8.550 58.819 1.00 31.31 H new ATOM 887 N SER A 59 29.116 -11.391 55.162 1.00 23.05 N ATOM 888 CA SER A 59 28.883 -12.366 54.106 1.00 0.43 C ATOM 889 C SER A 59 28.324 -11.696 52.845 1.00 0.04 C ATOM 890 O SER A 59 28.940 -11.775 51.783 1.00 43.21 O ATOM 891 CB SER A 59 27.935 -13.451 54.635 1.00 55.22 C ATOM 892 OG SER A 59 27.704 -14.437 53.652 1.00 44.24 O ATOM 0 H SER A 59 28.781 -11.698 56.075 1.00 23.05 H new ATOM 0 HA SER A 59 29.829 -12.826 53.821 1.00 0.43 H new ATOM 0 HB2 SER A 59 28.363 -13.912 55.525 1.00 55.22 H new ATOM 0 HB3 SER A 59 26.989 -13.000 54.933 1.00 55.22 H new ATOM 0 HG SER A 59 27.099 -15.120 54.010 1.00 44.24 H new ATOM 898 N LYS A 60 27.178 -11.020 52.976 1.00 51.50 N ATOM 899 CA LYS A 60 26.440 -10.444 51.863 1.00 70.41 C ATOM 900 C LYS A 60 27.123 -9.219 51.248 1.00 42.13 C ATOM 901 O LYS A 60 27.101 -9.086 50.024 1.00 11.33 O ATOM 902 CB LYS A 60 24.991 -10.154 52.281 1.00 71.34 C ATOM 903 CG LYS A 60 24.167 -11.430 52.540 1.00 22.03 C ATOM 904 CD LYS A 60 24.020 -12.273 51.264 1.00 65.43 C ATOM 905 CE LYS A 60 22.994 -13.403 51.379 1.00 64.43 C ATOM 906 NZ LYS A 60 22.842 -14.109 50.090 1.00 35.13 N ATOM 0 H LYS A 60 26.734 -10.858 53.880 1.00 51.50 H new ATOM 0 HA LYS A 60 26.428 -11.187 51.066 1.00 70.41 H new ATOM 0 HB2 LYS A 60 24.995 -9.543 53.183 1.00 71.34 H new ATOM 0 HB3 LYS A 60 24.505 -9.568 51.501 1.00 71.34 H new ATOM 0 HG2 LYS A 60 24.649 -12.024 53.317 1.00 22.03 H new ATOM 0 HG3 LYS A 60 23.180 -11.158 52.913 1.00 22.03 H new ATOM 0 HD2 LYS A 60 23.734 -11.619 50.440 1.00 65.43 H new ATOM 0 HD3 LYS A 60 24.990 -12.701 51.010 1.00 65.43 H new ATOM 0 HE2 LYS A 60 23.307 -14.107 52.149 1.00 64.43 H new ATOM 0 HE3 LYS A 60 22.032 -12.996 51.691 1.00 64.43 H new ATOM 0 HZ1 LYS A 60 22.141 -14.871 50.192 1.00 35.13 H new ATOM 0 HZ2 LYS A 60 22.521 -13.439 49.363 1.00 35.13 H new ATOM 0 HZ3 LYS A 60 23.757 -14.515 49.807 1.00 35.13 H new ATOM 920 N ILE A 61 27.730 -8.324 52.043 1.00 41.21 N ATOM 921 CA ILE A 61 28.408 -7.162 51.473 1.00 21.33 C ATOM 922 C ILE A 61 29.616 -7.590 50.630 1.00 0.10 C ATOM 923 O ILE A 61 29.808 -7.047 49.545 1.00 23.32 O ATOM 924 CB ILE A 61 28.756 -6.101 52.535 1.00 3.43 C ATOM 925 CG1 ILE A 61 29.610 -6.681 53.668 1.00 61.13 C ATOM 926 CG2 ILE A 61 27.460 -5.481 53.080 1.00 51.22 C ATOM 927 CD1 ILE A 61 30.194 -5.626 54.601 1.00 14.01 C ATOM 0 H ILE A 61 27.763 -8.384 53.061 1.00 41.21 H new ATOM 0 HA ILE A 61 27.708 -6.670 50.798 1.00 21.33 H new ATOM 0 HB ILE A 61 29.356 -5.324 52.061 1.00 3.43 H new ATOM 0 HG12 ILE A 61 29.002 -7.372 54.252 1.00 61.13 H new ATOM 0 HG13 ILE A 61 30.425 -7.261 53.235 1.00 61.13 H new ATOM 0 HG21 ILE A 61 27.704 -4.730 53.832 1.00 51.22 H new ATOM 0 HG22 ILE A 61 26.910 -5.012 52.264 1.00 51.22 H new ATOM 0 HG23 ILE A 61 26.846 -6.260 53.532 1.00 51.22 H new ATOM 0 HD11 ILE A 61 30.785 -6.113 55.376 1.00 14.01 H new ATOM 0 HD12 ILE A 61 30.830 -4.949 54.031 1.00 14.01 H new ATOM 0 HD13 ILE A 61 29.385 -5.061 55.063 1.00 14.01 H new ATOM 939 N LEU A 62 30.387 -8.589 51.086 1.00 31.21 N ATOM 940 CA LEU A 62 31.471 -9.174 50.300 1.00 42.15 C ATOM 941 C LEU A 62 30.913 -9.819 49.025 1.00 51.42 C ATOM 942 O LEU A 62 31.523 -9.702 47.964 1.00 74.31 O ATOM 943 CB LEU A 62 32.276 -10.182 51.139 1.00 60.42 C ATOM 944 CG LEU A 62 33.454 -9.590 51.940 1.00 41.14 C ATOM 945 CD1 LEU A 62 34.610 -9.160 51.030 1.00 43.12 C ATOM 946 CD2 LEU A 62 33.067 -8.415 52.842 1.00 10.23 C ATOM 0 H LEU A 62 30.273 -9.009 52.008 1.00 31.21 H new ATOM 0 HA LEU A 62 32.156 -8.380 50.004 1.00 42.15 H new ATOM 0 HB2 LEU A 62 31.596 -10.673 51.836 1.00 60.42 H new ATOM 0 HB3 LEU A 62 32.663 -10.954 50.474 1.00 60.42 H new ATOM 0 HG LEU A 62 33.777 -10.408 52.585 1.00 41.14 H new ATOM 0 HD11 LEU A 62 35.417 -8.749 51.637 1.00 43.12 H new ATOM 0 HD12 LEU A 62 34.977 -10.023 50.475 1.00 43.12 H new ATOM 0 HD13 LEU A 62 34.259 -8.401 50.331 1.00 43.12 H new ATOM 0 HD21 LEU A 62 33.950 -8.056 53.371 1.00 10.23 H new ATOM 0 HD22 LEU A 62 32.655 -7.610 52.234 1.00 10.23 H new ATOM 0 HD23 LEU A 62 32.320 -8.742 53.565 1.00 10.23 H new ATOM 958 N GLY A 63 29.741 -10.460 49.105 1.00 40.14 N ATOM 959 CA GLY A 63 29.018 -10.905 47.928 1.00 3.04 C ATOM 960 C GLY A 63 27.773 -11.683 48.331 1.00 64.21 C ATOM 961 O GLY A 63 27.782 -12.411 49.317 1.00 62.03 O ATOM 0 H GLY A 63 29.277 -10.680 49.986 1.00 40.14 H new ATOM 0 HA2 GLY A 63 28.736 -10.045 47.320 1.00 3.04 H new ATOM 0 HA3 GLY A 63 29.663 -11.532 47.313 1.00 3.04 H new ATOM 1314 N LYS A 87 -1.025 -0.045 5.858 1.00 72.11 N ATOM 1315 CA LYS A 87 -1.167 -0.513 4.480 1.00 20.13 C ATOM 1316 C LYS A 87 -1.991 -1.804 4.378 1.00 40.44 C ATOM 1317 O LYS A 87 -2.551 -2.088 3.322 1.00 13.03 O ATOM 1318 CB LYS A 87 0.225 -0.671 3.852 1.00 35.04 C ATOM 1319 CG LYS A 87 0.151 -0.766 2.322 1.00 55.45 C ATOM 1320 CD LYS A 87 1.553 -0.741 1.701 1.00 13.55 C ATOM 1321 CE LYS A 87 1.517 -0.864 0.170 1.00 72.02 C ATOM 1322 NZ LYS A 87 0.794 0.252 -0.467 1.00 2.42 N ATOM 0 HA LYS A 87 -1.727 0.236 3.920 1.00 20.13 H new ATOM 0 HB2 LYS A 87 0.850 0.177 4.134 1.00 35.04 H new ATOM 0 HB3 LYS A 87 0.704 -1.566 4.249 1.00 35.04 H new ATOM 0 HG2 LYS A 87 -0.361 -1.685 2.036 1.00 55.45 H new ATOM 0 HG3 LYS A 87 -0.439 0.063 1.931 1.00 55.45 H new ATOM 0 HD2 LYS A 87 2.053 0.187 1.977 1.00 13.55 H new ATOM 0 HD3 LYS A 87 2.145 -1.557 2.115 1.00 13.55 H new ATOM 0 HE2 LYS A 87 2.537 -0.898 -0.213 1.00 72.02 H new ATOM 0 HE3 LYS A 87 1.041 -1.805 -0.105 1.00 72.02 H new ATOM 0 HZ1 LYS A 87 1.181 0.419 -1.418 1.00 2.42 H new ATOM 0 HZ2 LYS A 87 -0.216 0.014 -0.541 1.00 2.42 H new ATOM 0 HZ3 LYS A 87 0.906 1.111 0.108 1.00 2.42 H new ATOM 1336 N VAL A 88 -2.100 -2.566 5.474 1.00 52.41 N ATOM 1337 CA VAL A 88 -2.943 -3.751 5.567 1.00 35.30 C ATOM 1338 C VAL A 88 -4.394 -3.449 5.155 1.00 52.44 C ATOM 1339 O VAL A 88 -5.053 -4.305 4.570 1.00 71.24 O ATOM 1340 CB VAL A 88 -2.844 -4.352 6.980 1.00 12.43 C ATOM 1341 CG1 VAL A 88 -3.697 -5.619 7.095 1.00 74.40 C ATOM 1342 CG2 VAL A 88 -1.393 -4.735 7.301 1.00 24.44 C ATOM 0 H VAL A 88 -1.591 -2.366 6.335 1.00 52.41 H new ATOM 0 HA VAL A 88 -2.581 -4.497 4.860 1.00 35.30 H new ATOM 0 HB VAL A 88 -3.201 -3.596 7.679 1.00 12.43 H new ATOM 0 HG11 VAL A 88 -3.611 -6.025 8.103 1.00 74.40 H new ATOM 0 HG12 VAL A 88 -4.739 -5.376 6.890 1.00 74.40 H new ATOM 0 HG13 VAL A 88 -3.349 -6.359 6.374 1.00 74.40 H new ATOM 0 HG21 VAL A 88 -1.342 -5.158 8.304 1.00 24.44 H new ATOM 0 HG22 VAL A 88 -1.043 -5.472 6.578 1.00 24.44 H new ATOM 0 HG23 VAL A 88 -0.762 -3.847 7.249 1.00 24.44 H new ATOM 1352 N VAL A 89 -4.881 -2.229 5.416 1.00 51.44 N ATOM 1353 CA VAL A 89 -6.198 -1.763 4.986 1.00 41.01 C ATOM 1354 C VAL A 89 -6.392 -1.948 3.473 1.00 33.21 C ATOM 1355 O VAL A 89 -7.454 -2.400 3.044 1.00 21.44 O ATOM 1356 CB VAL A 89 -6.379 -0.296 5.416 1.00 43.30 C ATOM 1357 CG1 VAL A 89 -7.657 0.327 4.844 1.00 22.25 C ATOM 1358 CG2 VAL A 89 -6.445 -0.191 6.947 1.00 13.42 C ATOM 0 H VAL A 89 -4.358 -1.528 5.942 1.00 51.44 H new ATOM 0 HA VAL A 89 -6.968 -2.365 5.468 1.00 41.01 H new ATOM 0 HB VAL A 89 -5.518 0.246 5.026 1.00 43.30 H new ATOM 0 HG11 VAL A 89 -7.738 1.362 5.177 1.00 22.25 H new ATOM 0 HG12 VAL A 89 -7.620 0.298 3.755 1.00 22.25 H new ATOM 0 HG13 VAL A 89 -8.523 -0.235 5.193 1.00 22.25 H new ATOM 0 HG21 VAL A 89 -6.573 0.852 7.235 1.00 13.42 H new ATOM 0 HG22 VAL A 89 -7.288 -0.775 7.316 1.00 13.42 H new ATOM 0 HG23 VAL A 89 -5.521 -0.576 7.378 1.00 13.42 H new ATOM 1368 N GLU A 90 -5.372 -1.618 2.669 1.00 63.23 N ATOM 1369 CA GLU A 90 -5.427 -1.727 1.214 1.00 31.22 C ATOM 1370 C GLU A 90 -5.658 -3.169 0.752 1.00 52.35 C ATOM 1371 O GLU A 90 -6.194 -3.373 -0.334 1.00 60.32 O ATOM 1372 CB GLU A 90 -4.140 -1.190 0.577 1.00 23.11 C ATOM 1373 CG GLU A 90 -3.913 0.298 0.875 1.00 11.34 C ATOM 1374 CD GLU A 90 -2.567 0.790 0.347 1.00 65.12 C ATOM 1375 OE1 GLU A 90 -1.983 0.091 -0.511 1.00 72.15 O ATOM 1376 OE2 GLU A 90 -2.120 1.854 0.826 1.00 10.34 O ATOM 0 H GLU A 90 -4.481 -1.266 3.018 1.00 63.23 H new ATOM 0 HA GLU A 90 -6.275 -1.124 0.888 1.00 31.22 H new ATOM 0 HB2 GLU A 90 -3.290 -1.765 0.944 1.00 23.11 H new ATOM 0 HB3 GLU A 90 -4.183 -1.339 -0.502 1.00 23.11 H new ATOM 0 HG2 GLU A 90 -4.715 0.884 0.425 1.00 11.34 H new ATOM 0 HG3 GLU A 90 -3.962 0.464 1.951 1.00 11.34 H new ATOM 1383 N LYS A 91 -5.256 -4.163 1.556 1.00 34.12 N ATOM 1384 CA LYS A 91 -5.402 -5.568 1.204 1.00 1.10 C ATOM 1385 C LYS A 91 -6.869 -5.967 1.086 1.00 31.44 C ATOM 1386 O LYS A 91 -7.210 -6.723 0.179 1.00 24.33 O ATOM 1387 CB LYS A 91 -4.672 -6.472 2.204 1.00 12.02 C ATOM 1388 CG LYS A 91 -3.174 -6.164 2.332 1.00 54.43 C ATOM 1389 CD LYS A 91 -2.361 -6.250 1.030 1.00 13.41 C ATOM 1390 CE LYS A 91 -2.394 -7.626 0.348 1.00 72.33 C ATOM 1391 NZ LYS A 91 -3.566 -7.793 -0.530 1.00 72.22 N ATOM 0 H LYS A 91 -4.822 -4.008 2.466 1.00 34.12 H new ATOM 0 HA LYS A 91 -4.940 -5.704 0.226 1.00 1.10 H new ATOM 0 HB2 LYS A 91 -5.140 -6.369 3.183 1.00 12.02 H new ATOM 0 HB3 LYS A 91 -4.796 -7.511 1.899 1.00 12.02 H new ATOM 0 HG2 LYS A 91 -3.062 -5.161 2.743 1.00 54.43 H new ATOM 0 HG3 LYS A 91 -2.741 -6.855 3.055 1.00 54.43 H new ATOM 0 HD2 LYS A 91 -2.738 -5.503 0.331 1.00 13.41 H new ATOM 0 HD3 LYS A 91 -1.325 -5.990 1.246 1.00 13.41 H new ATOM 0 HE2 LYS A 91 -1.484 -7.760 -0.237 1.00 72.33 H new ATOM 0 HE3 LYS A 91 -2.401 -8.405 1.110 1.00 72.33 H new ATOM 0 HZ1 LYS A 91 -3.353 -8.500 -1.263 1.00 72.22 H new ATOM 0 HZ2 LYS A 91 -4.379 -8.113 0.034 1.00 72.22 H new ATOM 0 HZ3 LYS A 91 -3.794 -6.884 -0.981 1.00 72.22 H new ATOM 1405 N ILE A 92 -7.742 -5.446 1.958 1.00 42.31 N ATOM 1406 CA ILE A 92 -9.179 -5.629 1.807 1.00 33.41 C ATOM 1407 C ILE A 92 -9.615 -4.989 0.489 1.00 31.12 C ATOM 1408 O ILE A 92 -10.392 -5.589 -0.248 1.00 14.12 O ATOM 1409 CB ILE A 92 -9.942 -5.063 3.019 1.00 33.15 C ATOM 1410 CG1 ILE A 92 -9.743 -5.952 4.261 1.00 44.24 C ATOM 1411 CG2 ILE A 92 -11.448 -4.963 2.722 1.00 62.23 C ATOM 1412 CD1 ILE A 92 -8.380 -5.782 4.932 1.00 43.33 C ATOM 0 H ILE A 92 -7.472 -4.896 2.773 1.00 42.31 H new ATOM 0 HA ILE A 92 -9.419 -6.692 1.774 1.00 33.41 H new ATOM 0 HB ILE A 92 -9.541 -4.069 3.215 1.00 33.15 H new ATOM 0 HG12 ILE A 92 -10.525 -5.726 4.986 1.00 44.24 H new ATOM 0 HG13 ILE A 92 -9.867 -6.996 3.972 1.00 44.24 H new ATOM 0 HG21 ILE A 92 -11.965 -4.561 3.593 1.00 62.23 H new ATOM 0 HG22 ILE A 92 -11.608 -4.304 1.869 1.00 62.23 H new ATOM 0 HG23 ILE A 92 -11.840 -5.954 2.493 1.00 62.23 H new ATOM 0 HD11 ILE A 92 -8.316 -6.441 5.798 1.00 43.33 H new ATOM 0 HD12 ILE A 92 -7.592 -6.036 4.224 1.00 43.33 H new ATOM 0 HD13 ILE A 92 -8.259 -4.747 5.253 1.00 43.33 H new ATOM 1424 N GLY A 93 -9.081 -3.802 0.177 1.00 32.12 N ATOM 1425 CA GLY A 93 -9.268 -3.143 -1.105 1.00 3.55 C ATOM 1426 C GLY A 93 -8.981 -4.090 -2.272 1.00 1.33 C ATOM 1427 O GLY A 93 -9.810 -4.214 -3.171 1.00 63.54 O ATOM 0 H GLY A 93 -8.499 -3.270 0.824 1.00 32.12 H new ATOM 0 HA2 GLY A 93 -10.291 -2.773 -1.179 1.00 3.55 H new ATOM 0 HA3 GLY A 93 -8.610 -2.276 -1.169 1.00 3.55 H new ATOM 1431 N ASP A 94 -7.826 -4.768 -2.258 1.00 62.33 N ATOM 1432 CA ASP A 94 -7.464 -5.744 -3.275 1.00 55.32 C ATOM 1433 C ASP A 94 -8.483 -6.878 -3.322 1.00 13.32 C ATOM 1434 O ASP A 94 -8.998 -7.198 -4.391 1.00 60.14 O ATOM 1435 CB ASP A 94 -6.057 -6.307 -3.030 1.00 63.12 C ATOM 1436 CG ASP A 94 -4.962 -5.250 -2.893 1.00 24.10 C ATOM 1437 OD1 ASP A 94 -5.100 -4.174 -3.518 1.00 31.24 O ATOM 1438 OD2 ASP A 94 -3.987 -5.550 -2.173 1.00 11.15 O ATOM 0 H ASP A 94 -7.118 -4.649 -1.534 1.00 62.33 H new ATOM 0 HA ASP A 94 -7.464 -5.233 -4.238 1.00 55.32 H new ATOM 0 HB2 ASP A 94 -6.075 -6.912 -2.123 1.00 63.12 H new ATOM 0 HB3 ASP A 94 -5.799 -6.974 -3.853 1.00 63.12 H new ATOM 1443 N TYR A 95 -8.776 -7.486 -2.169 1.00 45.31 N ATOM 1444 CA TYR A 95 -9.658 -8.633 -2.083 1.00 22.40 C ATOM 1445 C TYR A 95 -11.083 -8.317 -2.551 1.00 52.24 C ATOM 1446 O TYR A 95 -11.720 -9.193 -3.122 1.00 23.24 O ATOM 1447 CB TYR A 95 -9.604 -9.207 -0.665 1.00 30.25 C ATOM 1448 CG TYR A 95 -8.231 -9.611 -0.142 1.00 64.02 C ATOM 1449 CD1 TYR A 95 -7.155 -9.872 -1.016 1.00 3.00 C ATOM 1450 CD2 TYR A 95 -8.018 -9.680 1.249 1.00 64.44 C ATOM 1451 CE1 TYR A 95 -5.877 -10.151 -0.508 1.00 12.20 C ATOM 1452 CE2 TYR A 95 -6.742 -9.985 1.758 1.00 22.12 C ATOM 1453 CZ TYR A 95 -5.669 -10.206 0.878 1.00 44.32 C ATOM 1454 OH TYR A 95 -4.422 -10.466 1.361 1.00 63.23 O ATOM 0 H TYR A 95 -8.401 -7.188 -1.269 1.00 45.31 H new ATOM 0 HA TYR A 95 -9.306 -9.399 -2.774 1.00 22.40 H new ATOM 0 HB2 TYR A 95 -10.024 -8.468 0.017 1.00 30.25 H new ATOM 0 HB3 TYR A 95 -10.253 -10.082 -0.627 1.00 30.25 H new ATOM 0 HD1 TYR A 95 -7.316 -9.857 -2.084 1.00 3.00 H new ATOM 0 HD2 TYR A 95 -8.838 -9.498 1.928 1.00 64.44 H new ATOM 0 HE1 TYR A 95 -5.053 -10.323 -1.185 1.00 12.20 H new ATOM 0 HE2 TYR A 95 -6.587 -10.049 2.825 1.00 22.12 H new ATOM 0 HH TYR A 95 -4.476 -11.163 2.048 1.00 63.23 H new ATOM 1464 N LYS A 96 -11.576 -7.082 -2.380 1.00 1.12 N ATOM 1465 CA LYS A 96 -12.843 -6.650 -2.967 1.00 35.25 C ATOM 1466 C LYS A 96 -12.828 -6.739 -4.500 1.00 63.21 C ATOM 1467 O LYS A 96 -13.869 -7.013 -5.092 1.00 32.44 O ATOM 1468 CB LYS A 96 -13.198 -5.222 -2.517 1.00 52.32 C ATOM 1469 CG LYS A 96 -13.600 -5.109 -1.038 1.00 34.33 C ATOM 1470 CD LYS A 96 -14.955 -5.739 -0.687 1.00 52.12 C ATOM 1471 CE LYS A 96 -16.155 -5.068 -1.364 1.00 63.32 C ATOM 1472 NZ LYS A 96 -17.423 -5.473 -0.726 1.00 32.22 N ATOM 0 H LYS A 96 -11.107 -6.361 -1.833 1.00 1.12 H new ATOM 0 HA LYS A 96 -13.611 -7.333 -2.605 1.00 35.25 H new ATOM 0 HB2 LYS A 96 -12.342 -4.572 -2.700 1.00 52.32 H new ATOM 0 HB3 LYS A 96 -14.017 -4.852 -3.134 1.00 52.32 H new ATOM 0 HG2 LYS A 96 -12.828 -5.580 -0.430 1.00 34.33 H new ATOM 0 HG3 LYS A 96 -13.624 -4.055 -0.762 1.00 34.33 H new ATOM 0 HD2 LYS A 96 -14.937 -6.792 -0.967 1.00 52.12 H new ATOM 0 HD3 LYS A 96 -15.093 -5.699 0.394 1.00 52.12 H new ATOM 0 HE2 LYS A 96 -16.047 -3.985 -1.310 1.00 63.32 H new ATOM 0 HE3 LYS A 96 -16.175 -5.334 -2.421 1.00 63.32 H new ATOM 0 HZ1 LYS A 96 -18.193 -5.424 -1.423 1.00 32.22 H new ATOM 0 HZ2 LYS A 96 -17.338 -6.447 -0.372 1.00 32.22 H new ATOM 0 HZ3 LYS A 96 -17.632 -4.833 0.067 1.00 32.22 H new ATOM 1486 N ARG A 97 -11.674 -6.512 -5.145 1.00 62.41 N ATOM 1487 CA ARG A 97 -11.539 -6.627 -6.596 1.00 1.34 C ATOM 1488 C ARG A 97 -11.427 -8.097 -7.002 1.00 23.12 C ATOM 1489 O ARG A 97 -12.067 -8.524 -7.961 1.00 40.02 O ATOM 1490 CB ARG A 97 -10.316 -5.847 -7.104 1.00 52.12 C ATOM 1491 CG ARG A 97 -10.324 -4.380 -6.658 1.00 30.30 C ATOM 1492 CD ARG A 97 -9.032 -3.664 -7.078 1.00 2.41 C ATOM 1493 NE ARG A 97 -8.560 -2.779 -5.999 1.00 12.43 N ATOM 1494 CZ ARG A 97 -7.361 -2.844 -5.388 1.00 50.00 C ATOM 1495 NH1 ARG A 97 -6.349 -3.563 -5.893 1.00 73.41 N ATOM 1496 NH2 ARG A 97 -7.172 -2.197 -4.231 1.00 40.42 N ATOM 0 H ARG A 97 -10.811 -6.244 -4.671 1.00 62.41 H new ATOM 0 HA ARG A 97 -12.431 -6.196 -7.051 1.00 1.34 H new ATOM 0 HB2 ARG A 97 -9.407 -6.328 -6.742 1.00 52.12 H new ATOM 0 HB3 ARG A 97 -10.288 -5.892 -8.193 1.00 52.12 H new ATOM 0 HG2 ARG A 97 -11.183 -3.870 -7.093 1.00 30.30 H new ATOM 0 HG3 ARG A 97 -10.436 -4.327 -5.575 1.00 30.30 H new ATOM 0 HD2 ARG A 97 -8.263 -4.399 -7.317 1.00 2.41 H new ATOM 0 HD3 ARG A 97 -9.209 -3.082 -7.983 1.00 2.41 H new ATOM 0 HE ARG A 97 -9.200 -2.049 -5.685 1.00 12.43 H new ATOM 0 HH11 ARG A 97 -6.475 -4.080 -6.763 1.00 73.41 H new ATOM 0 HH12 ARG A 97 -5.453 -3.593 -5.407 1.00 73.41 H new ATOM 0 HH21 ARG A 97 -7.933 -1.659 -3.817 1.00 40.42 H new ATOM 0 HH22 ARG A 97 -6.267 -2.242 -3.763 1.00 40.42 H new ATOM 1510 N GLN A 98 -10.591 -8.860 -6.285 1.00 3.44 N ATOM 1511 CA GLN A 98 -10.308 -10.259 -6.585 1.00 44.30 C ATOM 1512 C GLN A 98 -11.575 -11.104 -6.427 1.00 24.03 C ATOM 1513 O GLN A 98 -11.997 -11.780 -7.364 1.00 23.24 O ATOM 1514 CB GLN A 98 -9.196 -10.776 -5.662 1.00 35.24 C ATOM 1515 CG GLN A 98 -7.851 -10.089 -5.938 1.00 35.13 C ATOM 1516 CD GLN A 98 -6.794 -10.454 -4.897 1.00 11.01 C ATOM 1517 OE1 GLN A 98 -6.927 -11.441 -4.178 1.00 14.15 O ATOM 1518 NE2 GLN A 98 -5.735 -9.646 -4.807 1.00 24.32 N ATOM 0 H GLN A 98 -10.088 -8.512 -5.469 1.00 3.44 H new ATOM 0 HA GLN A 98 -9.971 -10.339 -7.618 1.00 44.30 H new ATOM 0 HB2 GLN A 98 -9.481 -10.610 -4.623 1.00 35.24 H new ATOM 0 HB3 GLN A 98 -9.087 -11.852 -5.794 1.00 35.24 H new ATOM 0 HG2 GLN A 98 -7.496 -10.373 -6.929 1.00 35.13 H new ATOM 0 HG3 GLN A 98 -7.992 -9.008 -5.947 1.00 35.13 H new ATOM 0 HE21 GLN A 98 -5.659 -8.835 -5.421 1.00 24.32 H new ATOM 0 HE22 GLN A 98 -5.002 -9.840 -4.124 1.00 24.32 H new ATOM 1527 N ASN A 99 -12.170 -11.055 -5.232 1.00 74.31 N ATOM 1528 CA ASN A 99 -13.390 -11.756 -4.871 1.00 24.44 C ATOM 1529 C ASN A 99 -14.595 -11.040 -5.492 1.00 75.20 C ATOM 1530 O ASN A 99 -14.484 -9.870 -5.861 1.00 35.13 O ATOM 1531 CB ASN A 99 -13.525 -11.724 -3.337 1.00 33.11 C ATOM 1532 CG ASN A 99 -12.326 -12.300 -2.586 1.00 4.32 C ATOM 1533 OD1 ASN A 99 -11.490 -12.999 -3.153 1.00 41.05 O ATOM 1534 ND2 ASN A 99 -12.246 -12.008 -1.287 1.00 43.01 N ATOM 0 H ASN A 99 -11.794 -10.501 -4.463 1.00 74.31 H new ATOM 0 HA ASN A 99 -13.354 -12.783 -5.233 1.00 24.44 H new ATOM 0 HB2 ASN A 99 -13.676 -10.692 -3.019 1.00 33.11 H new ATOM 0 HB3 ASN A 99 -14.418 -12.279 -3.051 1.00 33.11 H new ATOM 0 HD21 ASN A 99 -11.471 -12.369 -0.730 1.00 43.01 H new ATOM 0 HD22 ASN A 99 -12.959 -11.424 -0.851 1.00 43.01 H new ATOM 1541 N PRO A 100 -15.770 -11.690 -5.547 1.00 62.15 N ATOM 1542 CA PRO A 100 -17.039 -11.006 -5.773 1.00 20.21 C ATOM 1543 C PRO A 100 -17.350 -10.038 -4.620 1.00 14.32 C ATOM 1544 O PRO A 100 -16.564 -9.895 -3.684 1.00 1.53 O ATOM 1545 CB PRO A 100 -18.081 -12.125 -5.898 1.00 1.01 C ATOM 1546 CG PRO A 100 -17.481 -13.263 -5.074 1.00 44.23 C ATOM 1547 CD PRO A 100 -15.985 -13.113 -5.332 1.00 41.42 C ATOM 0 HA PRO A 100 -17.026 -10.387 -6.670 1.00 20.21 H new ATOM 0 HB2 PRO A 100 -19.051 -11.816 -5.509 1.00 1.01 H new ATOM 0 HB3 PRO A 100 -18.233 -12.418 -6.937 1.00 1.01 H new ATOM 0 HG2 PRO A 100 -17.721 -13.166 -4.015 1.00 44.23 H new ATOM 0 HG3 PRO A 100 -17.852 -14.236 -5.397 1.00 44.23 H new ATOM 0 HD2 PRO A 100 -15.402 -13.475 -4.485 1.00 41.42 H new ATOM 0 HD3 PRO A 100 -15.676 -13.693 -6.202 1.00 41.42 H new ATOM 1555 N THR A 101 -18.502 -9.360 -4.698 1.00 73.24 N ATOM 1556 CA THR A 101 -18.926 -8.329 -3.759 1.00 71.45 C ATOM 1557 C THR A 101 -19.410 -8.955 -2.445 1.00 4.43 C ATOM 1558 O THR A 101 -20.593 -8.881 -2.114 1.00 43.51 O ATOM 1559 CB THR A 101 -20.013 -7.462 -4.414 1.00 3.11 C ATOM 1560 OG1 THR A 101 -21.075 -8.277 -4.867 1.00 52.33 O ATOM 1561 CG2 THR A 101 -19.457 -6.661 -5.596 1.00 71.14 C ATOM 0 H THR A 101 -19.181 -9.523 -5.441 1.00 73.24 H new ATOM 0 HA THR A 101 -18.078 -7.690 -3.511 1.00 71.45 H new ATOM 0 HB THR A 101 -20.374 -6.762 -3.660 1.00 3.11 H new ATOM 0 HG1 THR A 101 -21.416 -8.814 -4.121 1.00 52.33 H new ATOM 0 HG21 THR A 101 -20.253 -6.060 -6.035 1.00 71.14 H new ATOM 0 HG22 THR A 101 -18.658 -6.007 -5.248 1.00 71.14 H new ATOM 0 HG23 THR A 101 -19.064 -7.346 -6.347 1.00 71.14 H new ATOM 1569 N MET A 102 -18.482 -9.555 -1.693 1.00 11.13 N ATOM 1570 CA MET A 102 -18.719 -10.149 -0.387 1.00 61.14 C ATOM 1571 C MET A 102 -18.507 -9.125 0.727 1.00 63.03 C ATOM 1572 O MET A 102 -18.051 -8.004 0.490 1.00 21.23 O ATOM 1573 CB MET A 102 -17.814 -11.380 -0.214 1.00 55.31 C ATOM 1574 CG MET A 102 -18.442 -12.620 -0.860 1.00 11.23 C ATOM 1575 SD MET A 102 -19.985 -13.226 -0.116 1.00 10.44 S ATOM 1576 CE MET A 102 -19.450 -13.542 1.586 1.00 0.43 C ATOM 0 H MET A 102 -17.511 -9.640 -1.994 1.00 11.13 H new ATOM 0 HA MET A 102 -19.758 -10.473 -0.321 1.00 61.14 H new ATOM 0 HB2 MET A 102 -16.840 -11.186 -0.663 1.00 55.31 H new ATOM 0 HB3 MET A 102 -17.645 -11.565 0.847 1.00 55.31 H new ATOM 0 HG2 MET A 102 -18.633 -12.398 -1.910 1.00 11.23 H new ATOM 0 HG3 MET A 102 -17.710 -13.427 -0.833 1.00 11.23 H new ATOM 0 HE1 MET A 102 -20.218 -14.113 2.109 1.00 0.43 H new ATOM 0 HE2 MET A 102 -18.520 -14.110 1.575 1.00 0.43 H new ATOM 0 HE3 MET A 102 -19.290 -12.594 2.099 1.00 0.43 H new ATOM 1586 N PHE A 103 -18.890 -9.525 1.944 1.00 51.02 N ATOM 1587 CA PHE A 103 -19.005 -8.657 3.104 1.00 73.34 C ATOM 1588 C PHE A 103 -17.651 -8.172 3.618 1.00 65.31 C ATOM 1589 O PHE A 103 -16.614 -8.786 3.372 1.00 51.43 O ATOM 1590 CB PHE A 103 -19.736 -9.400 4.225 1.00 1.23 C ATOM 1591 CG PHE A 103 -21.088 -9.956 3.828 1.00 44.14 C ATOM 1592 CD1 PHE A 103 -22.139 -9.074 3.515 1.00 43.32 C ATOM 1593 CD2 PHE A 103 -21.302 -11.345 3.776 1.00 60.51 C ATOM 1594 CE1 PHE A 103 -23.383 -9.579 3.103 1.00 13.24 C ATOM 1595 CE2 PHE A 103 -22.548 -11.850 3.367 1.00 60.14 C ATOM 1596 CZ PHE A 103 -23.586 -10.967 3.020 1.00 74.22 C ATOM 0 H PHE A 103 -19.135 -10.494 2.148 1.00 51.02 H new ATOM 0 HA PHE A 103 -19.567 -7.776 2.792 1.00 73.34 H new ATOM 0 HB2 PHE A 103 -19.107 -10.220 4.572 1.00 1.23 H new ATOM 0 HB3 PHE A 103 -19.869 -8.722 5.068 1.00 1.23 H new ATOM 0 HD1 PHE A 103 -21.989 -8.007 3.592 1.00 43.32 H new ATOM 0 HD2 PHE A 103 -20.508 -12.024 4.051 1.00 60.51 H new ATOM 0 HE1 PHE A 103 -24.184 -8.900 2.850 1.00 13.24 H new ATOM 0 HE2 PHE A 103 -22.709 -12.917 3.319 1.00 60.14 H new ATOM 0 HZ PHE A 103 -24.538 -11.355 2.690 1.00 74.22 H new ATOM 1606 N ALA A 104 -17.691 -7.073 4.377 1.00 62.14 N ATOM 1607 CA ALA A 104 -16.529 -6.485 5.022 1.00 31.34 C ATOM 1608 C ALA A 104 -15.900 -7.455 6.026 1.00 62.01 C ATOM 1609 O ALA A 104 -14.676 -7.558 6.078 1.00 11.24 O ATOM 1610 CB ALA A 104 -16.945 -5.174 5.702 1.00 65.22 C ATOM 0 H ALA A 104 -18.554 -6.561 4.560 1.00 62.14 H new ATOM 0 HA ALA A 104 -15.770 -6.274 4.269 1.00 31.34 H new ATOM 0 HB1 ALA A 104 -16.079 -4.726 6.189 1.00 65.22 H new ATOM 0 HB2 ALA A 104 -17.338 -4.485 4.954 1.00 65.22 H new ATOM 0 HB3 ALA A 104 -17.714 -5.379 6.447 1.00 65.22 H new ATOM 1616 N TRP A 105 -16.717 -8.168 6.814 1.00 35.14 N ATOM 1617 CA TRP A 105 -16.229 -9.045 7.866 1.00 13.23 C ATOM 1618 C TRP A 105 -15.516 -10.263 7.276 1.00 25.41 C ATOM 1619 O TRP A 105 -14.413 -10.585 7.714 1.00 12.24 O ATOM 1620 CB TRP A 105 -17.370 -9.420 8.820 1.00 4.51 C ATOM 1621 CG TRP A 105 -18.642 -9.904 8.191 1.00 74.52 C ATOM 1622 CD1 TRP A 105 -18.864 -11.157 7.745 1.00 73.05 C ATOM 1623 CD2 TRP A 105 -19.872 -9.168 7.919 1.00 42.10 C ATOM 1624 NE1 TRP A 105 -20.139 -11.264 7.233 1.00 33.24 N ATOM 1625 CE2 TRP A 105 -20.808 -10.060 7.317 1.00 63.45 C ATOM 1626 CE3 TRP A 105 -20.287 -7.832 8.107 1.00 70.20 C ATOM 1627 CZ2 TRP A 105 -22.091 -9.648 6.926 1.00 44.45 C ATOM 1628 CZ3 TRP A 105 -21.569 -7.407 7.710 1.00 70.11 C ATOM 1629 CH2 TRP A 105 -22.468 -8.310 7.118 1.00 32.11 C ATOM 0 H TRP A 105 -17.734 -8.147 6.733 1.00 35.14 H new ATOM 0 HA TRP A 105 -15.484 -8.514 8.458 1.00 13.23 H new ATOM 0 HB2 TRP A 105 -17.008 -10.195 9.495 1.00 4.51 H new ATOM 0 HB3 TRP A 105 -17.603 -8.548 9.431 1.00 4.51 H new ATOM 0 HD1 TRP A 105 -18.145 -11.962 7.784 1.00 73.05 H new ATOM 0 HE1 TRP A 105 -20.535 -12.119 6.844 1.00 33.24 H new ATOM 0 HE3 TRP A 105 -19.610 -7.124 8.563 1.00 70.20 H new ATOM 0 HZ2 TRP A 105 -22.780 -10.352 6.483 1.00 44.45 H new ATOM 0 HZ3 TRP A 105 -21.864 -6.379 7.862 1.00 70.11 H new ATOM 0 HH2 TRP A 105 -23.448 -7.975 6.811 1.00 32.11 H new ATOM 1640 N GLU A 106 -16.109 -10.911 6.263 1.00 13.22 N ATOM 1641 CA GLU A 106 -15.481 -12.017 5.555 1.00 30.21 C ATOM 1642 C GLU A 106 -14.082 -11.628 5.085 1.00 74.30 C ATOM 1643 O GLU A 106 -13.119 -12.362 5.303 1.00 55.41 O ATOM 1644 CB GLU A 106 -16.351 -12.421 4.353 1.00 70.21 C ATOM 1645 CG GLU A 106 -17.469 -13.385 4.768 1.00 44.42 C ATOM 1646 CD GLU A 106 -16.936 -14.719 5.284 1.00 42.32 C ATOM 1647 OE1 GLU A 106 -15.970 -15.217 4.667 1.00 3.13 O ATOM 1648 OE2 GLU A 106 -17.504 -15.221 6.276 1.00 21.23 O ATOM 0 H GLU A 106 -17.039 -10.676 5.917 1.00 13.22 H new ATOM 0 HA GLU A 106 -15.390 -12.864 6.235 1.00 30.21 H new ATOM 0 HB2 GLU A 106 -16.787 -11.530 3.902 1.00 70.21 H new ATOM 0 HB3 GLU A 106 -15.727 -12.891 3.593 1.00 70.21 H new ATOM 0 HG2 GLU A 106 -18.077 -12.918 5.542 1.00 44.42 H new ATOM 0 HG3 GLU A 106 -18.123 -13.565 3.915 1.00 44.42 H new ATOM 1655 N ILE A 107 -13.982 -10.473 4.426 1.00 52.31 N ATOM 1656 CA ILE A 107 -12.762 -10.059 3.766 1.00 62.41 C ATOM 1657 C ILE A 107 -11.725 -9.538 4.772 1.00 30.02 C ATOM 1658 O ILE A 107 -10.528 -9.701 4.540 1.00 21.12 O ATOM 1659 CB ILE A 107 -13.120 -9.098 2.628 1.00 74.40 C ATOM 1660 CG1 ILE A 107 -14.053 -9.846 1.651 1.00 12.44 C ATOM 1661 CG2 ILE A 107 -11.847 -8.683 1.884 1.00 34.14 C ATOM 1662 CD1 ILE A 107 -14.644 -8.921 0.597 1.00 42.13 C ATOM 0 H ILE A 107 -14.748 -9.805 4.340 1.00 52.31 H new ATOM 0 HA ILE A 107 -12.260 -10.910 3.306 1.00 62.41 H new ATOM 0 HB ILE A 107 -13.608 -8.208 3.026 1.00 74.40 H new ATOM 0 HG12 ILE A 107 -13.497 -10.645 1.160 1.00 12.44 H new ATOM 0 HG13 ILE A 107 -14.860 -10.318 2.212 1.00 12.44 H new ATOM 0 HG21 ILE A 107 -12.105 -7.999 1.075 1.00 34.14 H new ATOM 0 HG22 ILE A 107 -11.167 -8.186 2.576 1.00 34.14 H new ATOM 0 HG23 ILE A 107 -11.362 -9.568 1.471 1.00 34.14 H new ATOM 0 HD11 ILE A 107 -15.293 -9.493 -0.066 1.00 42.13 H new ATOM 0 HD12 ILE A 107 -15.224 -8.137 1.085 1.00 42.13 H new ATOM 0 HD13 ILE A 107 -13.839 -8.469 0.017 1.00 42.13 H new ATOM 1674 N ARG A 108 -12.160 -8.985 5.915 1.00 71.50 N ATOM 1675 CA ARG A 108 -11.278 -8.711 7.047 1.00 65.44 C ATOM 1676 C ARG A 108 -10.580 -10.011 7.446 1.00 62.03 C ATOM 1677 O ARG A 108 -9.352 -10.084 7.459 1.00 43.25 O ATOM 1678 CB ARG A 108 -12.092 -8.121 8.215 1.00 0.11 C ATOM 1679 CG ARG A 108 -11.242 -7.442 9.301 1.00 21.13 C ATOM 1680 CD ARG A 108 -10.462 -8.387 10.224 1.00 70.34 C ATOM 1681 NE ARG A 108 -11.323 -9.385 10.882 1.00 32.43 N ATOM 1682 CZ ARG A 108 -11.421 -9.632 12.202 1.00 63.40 C ATOM 1683 NH1 ARG A 108 -10.813 -8.865 13.120 1.00 41.13 N ATOM 1684 NH2 ARG A 108 -12.154 -10.677 12.606 1.00 75.35 N ATOM 0 H ARG A 108 -13.131 -8.718 6.075 1.00 71.50 H new ATOM 0 HA ARG A 108 -10.521 -7.976 6.773 1.00 65.44 H new ATOM 0 HB2 ARG A 108 -12.800 -7.394 7.818 1.00 0.11 H new ATOM 0 HB3 ARG A 108 -12.677 -8.918 8.674 1.00 0.11 H new ATOM 0 HG2 ARG A 108 -10.533 -6.772 8.815 1.00 21.13 H new ATOM 0 HG3 ARG A 108 -11.897 -6.823 9.915 1.00 21.13 H new ATOM 0 HD2 ARG A 108 -9.695 -8.901 9.645 1.00 70.34 H new ATOM 0 HD3 ARG A 108 -9.947 -7.801 10.985 1.00 70.34 H new ATOM 0 HE ARG A 108 -11.910 -9.952 10.270 1.00 32.43 H new ATOM 0 HH11 ARG A 108 -10.254 -8.064 12.826 1.00 41.13 H new ATOM 0 HH12 ARG A 108 -10.910 -9.083 14.112 1.00 41.13 H new ATOM 0 HH21 ARG A 108 -12.624 -11.267 11.919 1.00 75.35 H new ATOM 0 HH22 ARG A 108 -12.243 -10.884 13.601 1.00 75.35 H new ATOM 1698 N ASP A 109 -11.379 -11.045 7.730 1.00 44.04 N ATOM 1699 CA ASP A 109 -10.904 -12.353 8.155 1.00 51.22 C ATOM 1700 C ASP A 109 -10.098 -13.075 7.069 1.00 61.33 C ATOM 1701 O ASP A 109 -9.452 -14.073 7.379 1.00 74.43 O ATOM 1702 CB ASP A 109 -12.086 -13.202 8.638 1.00 44.53 C ATOM 1703 CG ASP A 109 -12.646 -12.708 9.971 1.00 40.14 C ATOM 1704 OD1 ASP A 109 -12.986 -11.508 10.054 1.00 63.21 O ATOM 1705 OD2 ASP A 109 -12.708 -13.530 10.909 1.00 72.12 O ATOM 0 H ASP A 109 -12.395 -10.988 7.667 1.00 44.04 H new ATOM 0 HA ASP A 109 -10.213 -12.201 8.984 1.00 51.22 H new ATOM 0 HB2 ASP A 109 -12.875 -13.185 7.886 1.00 44.53 H new ATOM 0 HB3 ASP A 109 -11.767 -14.239 8.742 1.00 44.53 H new ATOM 1710 N ARG A 110 -10.087 -12.579 5.822 1.00 53.50 N ATOM 1711 CA ARG A 110 -9.225 -13.123 4.781 1.00 63.21 C ATOM 1712 C ARG A 110 -7.757 -13.035 5.198 1.00 35.15 C ATOM 1713 O ARG A 110 -7.023 -14.000 5.027 1.00 15.21 O ATOM 1714 CB ARG A 110 -9.477 -12.454 3.425 1.00 72.01 C ATOM 1715 CG ARG A 110 -9.322 -13.457 2.271 1.00 55.42 C ATOM 1716 CD ARG A 110 -10.672 -14.048 1.839 1.00 24.35 C ATOM 1717 NE ARG A 110 -11.410 -14.666 2.953 1.00 4.53 N ATOM 1718 CZ ARG A 110 -12.745 -14.678 3.108 1.00 3.13 C ATOM 1719 NH1 ARG A 110 -13.566 -14.158 2.183 1.00 4.32 N ATOM 1720 NH2 ARG A 110 -13.264 -15.231 4.208 1.00 11.44 N ATOM 0 H ARG A 110 -10.670 -11.800 5.517 1.00 53.50 H new ATOM 0 HA ARG A 110 -9.473 -14.177 4.656 1.00 63.21 H new ATOM 0 HB2 ARG A 110 -10.480 -12.029 3.408 1.00 72.01 H new ATOM 0 HB3 ARG A 110 -8.778 -11.629 3.289 1.00 72.01 H new ATOM 0 HG2 ARG A 110 -8.854 -12.962 1.420 1.00 55.42 H new ATOM 0 HG3 ARG A 110 -8.655 -14.263 2.578 1.00 55.42 H new ATOM 0 HD2 ARG A 110 -11.283 -13.261 1.398 1.00 24.35 H new ATOM 0 HD3 ARG A 110 -10.504 -14.794 1.063 1.00 24.35 H new ATOM 0 HE ARG A 110 -10.857 -15.128 3.674 1.00 4.53 H new ATOM 0 HH11 ARG A 110 -13.181 -13.740 1.336 1.00 4.32 H new ATOM 0 HH12 ARG A 110 -14.576 -14.181 2.327 1.00 4.32 H new ATOM 0 HH21 ARG A 110 -12.649 -15.636 4.914 1.00 11.44 H new ATOM 0 HH22 ARG A 110 -14.275 -15.249 4.342 1.00 11.44 H new ATOM 1734 N LEU A 111 -7.346 -11.908 5.792 1.00 22.14 N ATOM 1735 CA LEU A 111 -5.994 -11.721 6.305 1.00 4.22 C ATOM 1736 C LEU A 111 -5.615 -12.816 7.303 1.00 24.43 C ATOM 1737 O LEU A 111 -4.513 -13.357 7.241 1.00 3.13 O ATOM 1738 CB LEU A 111 -5.874 -10.353 6.979 1.00 32.01 C ATOM 1739 CG LEU A 111 -5.936 -9.200 5.969 1.00 42.00 C ATOM 1740 CD1 LEU A 111 -6.190 -7.901 6.733 1.00 65.24 C ATOM 1741 CD2 LEU A 111 -4.622 -9.064 5.192 1.00 54.41 C ATOM 0 H LEU A 111 -7.951 -11.098 5.928 1.00 22.14 H new ATOM 0 HA LEU A 111 -5.309 -11.778 5.459 1.00 4.22 H new ATOM 0 HB2 LEU A 111 -6.676 -10.238 7.708 1.00 32.01 H new ATOM 0 HB3 LEU A 111 -4.934 -10.302 7.528 1.00 32.01 H new ATOM 0 HG LEU A 111 -6.736 -9.405 5.257 1.00 42.00 H new ATOM 0 HD11 LEU A 111 -6.237 -7.069 6.030 1.00 65.24 H new ATOM 0 HD12 LEU A 111 -7.134 -7.975 7.272 1.00 65.24 H new ATOM 0 HD13 LEU A 111 -5.380 -7.732 7.442 1.00 65.24 H new ATOM 0 HD21 LEU A 111 -4.701 -8.238 4.485 1.00 54.41 H new ATOM 0 HD22 LEU A 111 -3.806 -8.869 5.888 1.00 54.41 H new ATOM 0 HD23 LEU A 111 -4.423 -9.988 4.649 1.00 54.41 H new ATOM 1753 N LEU A 112 -6.526 -13.132 8.230 1.00 12.33 N ATOM 1754 CA LEU A 112 -6.302 -14.123 9.272 1.00 33.11 C ATOM 1755 C LEU A 112 -6.243 -15.528 8.667 1.00 24.25 C ATOM 1756 O LEU A 112 -5.357 -16.309 9.012 1.00 23.12 O ATOM 1757 CB LEU A 112 -7.398 -14.016 10.346 1.00 14.20 C ATOM 1758 CG LEU A 112 -7.508 -12.621 10.991 1.00 4.41 C ATOM 1759 CD1 LEU A 112 -8.650 -12.624 12.013 1.00 24.05 C ATOM 1760 CD2 LEU A 112 -6.208 -12.209 11.692 1.00 62.10 C ATOM 0 H LEU A 112 -7.448 -12.698 8.273 1.00 12.33 H new ATOM 0 HA LEU A 112 -5.342 -13.929 9.751 1.00 33.11 H new ATOM 0 HB2 LEU A 112 -8.358 -14.275 9.899 1.00 14.20 H new ATOM 0 HB3 LEU A 112 -7.201 -14.751 11.126 1.00 14.20 H new ATOM 0 HG LEU A 112 -7.704 -11.901 10.196 1.00 4.41 H new ATOM 0 HD11 LEU A 112 -8.731 -11.638 12.471 1.00 24.05 H new ATOM 0 HD12 LEU A 112 -9.586 -12.869 11.512 1.00 24.05 H new ATOM 0 HD13 LEU A 112 -8.446 -13.367 12.784 1.00 24.05 H new ATOM 0 HD21 LEU A 112 -6.330 -11.220 12.133 1.00 62.10 H new ATOM 0 HD22 LEU A 112 -5.973 -12.929 12.476 1.00 62.10 H new ATOM 0 HD23 LEU A 112 -5.395 -12.185 10.966 1.00 62.10 H new ATOM 1772 N ALA A 113 -7.173 -15.839 7.755 1.00 21.31 N ATOM 1773 CA ALA A 113 -7.256 -17.121 7.067 1.00 11.44 C ATOM 1774 C ALA A 113 -6.000 -17.397 6.235 1.00 72.45 C ATOM 1775 O ALA A 113 -5.491 -18.516 6.235 1.00 2.23 O ATOM 1776 CB ALA A 113 -8.507 -17.143 6.185 1.00 33.34 C ATOM 0 H ALA A 113 -7.904 -15.186 7.473 1.00 21.31 H new ATOM 0 HA ALA A 113 -7.325 -17.912 7.814 1.00 11.44 H new ATOM 0 HB1 ALA A 113 -8.572 -18.101 5.669 1.00 33.34 H new ATOM 0 HB2 ALA A 113 -9.392 -17.005 6.806 1.00 33.34 H new ATOM 0 HB3 ALA A 113 -8.449 -16.339 5.451 1.00 33.34 H new ATOM 1782 N GLU A 114 -5.504 -16.369 5.534 1.00 2.42 N ATOM 1783 CA GLU A 114 -4.279 -16.408 4.751 1.00 3.54 C ATOM 1784 C GLU A 114 -3.071 -16.578 5.676 1.00 61.54 C ATOM 1785 O GLU A 114 -2.170 -17.361 5.382 1.00 64.50 O ATOM 1786 CB GLU A 114 -4.164 -15.094 3.970 1.00 14.11 C ATOM 1787 CG GLU A 114 -5.169 -14.998 2.811 1.00 35.14 C ATOM 1788 CD GLU A 114 -5.378 -13.564 2.314 1.00 53.44 C ATOM 1789 OE1 GLU A 114 -4.812 -12.634 2.931 1.00 21.12 O ATOM 1790 OE2 GLU A 114 -6.118 -13.417 1.318 1.00 24.14 O ATOM 0 H GLU A 114 -5.966 -15.460 5.500 1.00 2.42 H new ATOM 0 HA GLU A 114 -4.303 -17.251 4.061 1.00 3.54 H new ATOM 0 HB2 GLU A 114 -4.321 -14.257 4.651 1.00 14.11 H new ATOM 0 HB3 GLU A 114 -3.152 -14.999 3.576 1.00 14.11 H new ATOM 0 HG2 GLU A 114 -4.820 -15.616 1.983 1.00 35.14 H new ATOM 0 HG3 GLU A 114 -6.126 -15.408 3.133 1.00 35.14 H new ATOM 1797 N GLY A 115 -3.059 -15.826 6.782 1.00 52.23 N ATOM 1798 CA GLY A 115 -1.974 -15.784 7.749 1.00 41.30 C ATOM 1799 C GLY A 115 -1.027 -14.632 7.420 1.00 13.54 C ATOM 1800 O GLY A 115 0.175 -14.839 7.274 1.00 22.30 O ATOM 0 H GLY A 115 -3.834 -15.211 7.030 1.00 52.23 H new ATOM 0 HA2 GLY A 115 -2.376 -15.659 8.754 1.00 41.30 H new ATOM 0 HA3 GLY A 115 -1.429 -16.728 7.738 1.00 41.30 H new ATOM 1804 N VAL A 116 -1.585 -13.420 7.301 1.00 22.44 N ATOM 1805 CA VAL A 116 -0.869 -12.211 6.919 1.00 5.40 C ATOM 1806 C VAL A 116 -0.442 -11.425 8.159 1.00 34.04 C ATOM 1807 O VAL A 116 0.684 -10.932 8.213 1.00 41.43 O ATOM 1808 CB VAL A 116 -1.748 -11.368 5.976 1.00 21.41 C ATOM 1809 CG1 VAL A 116 -1.084 -10.034 5.613 1.00 75.01 C ATOM 1810 CG2 VAL A 116 -2.009 -12.139 4.678 1.00 21.01 C ATOM 0 H VAL A 116 -2.577 -13.256 7.475 1.00 22.44 H new ATOM 0 HA VAL A 116 0.041 -12.480 6.383 1.00 5.40 H new ATOM 0 HB VAL A 116 -2.680 -11.166 6.504 1.00 21.41 H new ATOM 0 HG11 VAL A 116 -1.738 -9.471 4.947 1.00 75.01 H new ATOM 0 HG12 VAL A 116 -0.907 -9.457 6.521 1.00 75.01 H new ATOM 0 HG13 VAL A 116 -0.134 -10.224 5.113 1.00 75.01 H new ATOM 0 HG21 VAL A 116 -2.631 -11.537 4.016 1.00 21.01 H new ATOM 0 HG22 VAL A 116 -1.061 -12.356 4.187 1.00 21.01 H new ATOM 0 HG23 VAL A 116 -2.521 -13.074 4.907 1.00 21.01 H new ATOM 1820 N CYS A 117 -1.342 -11.287 9.141 1.00 65.12 N ATOM 1821 CA CYS A 117 -1.110 -10.497 10.344 1.00 74.21 C ATOM 1822 C CYS A 117 -1.864 -11.087 11.538 1.00 73.22 C ATOM 1823 O CYS A 117 -2.631 -12.039 11.388 1.00 72.04 O ATOM 1824 CB CYS A 117 -1.486 -9.033 10.079 1.00 24.14 C ATOM 1825 SG CYS A 117 -3.247 -8.886 9.680 1.00 63.31 S ATOM 0 H CYS A 117 -2.261 -11.729 9.116 1.00 65.12 H new ATOM 0 HA CYS A 117 -0.051 -10.528 10.601 1.00 74.21 H new ATOM 0 HB2 CYS A 117 -1.255 -8.429 10.956 1.00 24.14 H new ATOM 0 HB3 CYS A 117 -0.888 -8.642 9.256 1.00 24.14 H new ATOM 0 HG CYS A 117 -3.876 -9.945 10.097 1.00 63.31 H new ATOM 1831 N ASP A 118 -1.617 -10.523 12.726 1.00 74.25 N ATOM 1832 CA ASP A 118 -2.143 -11.017 13.992 1.00 11.25 C ATOM 1833 C ASP A 118 -3.590 -10.562 14.210 1.00 53.11 C ATOM 1834 O ASP A 118 -4.040 -9.570 13.638 1.00 14.45 O ATOM 1835 CB ASP A 118 -1.227 -10.565 15.141 1.00 15.04 C ATOM 1836 CG ASP A 118 -1.731 -11.044 16.497 1.00 52.24 C ATOM 1837 OD1 ASP A 118 -1.544 -12.246 16.782 1.00 21.51 O ATOM 1838 OD2 ASP A 118 -2.329 -10.206 17.206 1.00 31.04 O ATOM 0 H ASP A 118 -1.033 -9.693 12.830 1.00 74.25 H new ATOM 0 HA ASP A 118 -2.158 -12.107 13.968 1.00 11.25 H new ATOM 0 HB2 ASP A 118 -0.220 -10.947 14.973 1.00 15.04 H new ATOM 0 HB3 ASP A 118 -1.159 -9.477 15.143 1.00 15.04 H new ATOM 1843 N ASN A 119 -4.302 -11.306 15.065 1.00 14.12 N ATOM 1844 CA ASN A 119 -5.683 -11.077 15.467 1.00 51.45 C ATOM 1845 C ASN A 119 -5.932 -9.670 16.021 1.00 44.34 C ATOM 1846 O ASN A 119 -7.059 -9.186 15.930 1.00 42.03 O ATOM 1847 CB ASN A 119 -6.081 -12.124 16.514 1.00 75.44 C ATOM 1848 CG ASN A 119 -6.002 -13.542 15.954 1.00 51.43 C ATOM 1849 OD1 ASN A 119 -4.992 -14.222 16.120 1.00 11.10 O ATOM 1850 ND2 ASN A 119 -7.064 -13.991 15.282 1.00 23.21 N ATOM 0 H ASN A 119 -3.902 -12.128 15.517 1.00 14.12 H new ATOM 0 HA ASN A 119 -6.297 -11.168 14.571 1.00 51.45 H new ATOM 0 HB2 ASN A 119 -5.426 -12.038 17.381 1.00 75.44 H new ATOM 0 HB3 ASN A 119 -7.095 -11.925 16.860 1.00 75.44 H new ATOM 0 HD21 ASN A 119 -7.056 -14.930 14.884 1.00 23.21 H new ATOM 0 HD22 ASN A 119 -7.884 -13.395 15.166 1.00 23.21 H new ATOM 1857 N ASP A 120 -4.913 -9.021 16.602 1.00 51.21 N ATOM 1858 CA ASP A 120 -5.023 -7.673 17.139 1.00 73.20 C ATOM 1859 C ASP A 120 -4.723 -6.656 16.041 1.00 70.23 C ATOM 1860 O ASP A 120 -5.486 -5.715 15.829 1.00 74.22 O ATOM 1861 CB ASP A 120 -4.048 -7.513 18.307 1.00 62.10 C ATOM 1862 CG ASP A 120 -4.123 -6.113 18.910 1.00 24.45 C ATOM 1863 OD1 ASP A 120 -4.995 -5.916 19.783 1.00 55.41 O ATOM 1864 OD2 ASP A 120 -3.309 -5.266 18.482 1.00 72.03 O ATOM 0 H ASP A 120 -3.984 -9.428 16.709 1.00 51.21 H new ATOM 0 HA ASP A 120 -6.036 -7.500 17.501 1.00 73.20 H new ATOM 0 HB2 ASP A 120 -4.273 -8.253 19.074 1.00 62.10 H new ATOM 0 HB3 ASP A 120 -3.032 -7.709 17.964 1.00 62.10 H new ATOM 1869 N THR A 121 -3.587 -6.849 15.363 1.00 70.14 N ATOM 1870 CA THR A 121 -3.015 -5.898 14.421 1.00 3.11 C ATOM 1871 C THR A 121 -3.902 -5.692 13.191 1.00 44.31 C ATOM 1872 O THR A 121 -3.900 -4.607 12.610 1.00 2.05 O ATOM 1873 CB THR A 121 -1.608 -6.361 14.020 1.00 41.31 C ATOM 1874 OG1 THR A 121 -1.660 -7.636 13.417 1.00 41.30 O ATOM 1875 CG2 THR A 121 -0.680 -6.428 15.237 1.00 31.23 C ATOM 0 H THR A 121 -3.029 -7.697 15.461 1.00 70.14 H new ATOM 0 HA THR A 121 -2.949 -4.929 14.915 1.00 3.11 H new ATOM 0 HB THR A 121 -1.215 -5.633 13.311 1.00 41.31 H new ATOM 0 HG1 THR A 121 -2.560 -8.011 13.521 1.00 41.30 H new ATOM 0 HG21 THR A 121 0.310 -6.759 14.922 1.00 31.23 H new ATOM 0 HG22 THR A 121 -0.605 -5.440 15.692 1.00 31.23 H new ATOM 0 HG23 THR A 121 -1.084 -7.132 15.964 1.00 31.23 H new ATOM 1883 N VAL A 122 -4.641 -6.734 12.791 1.00 11.11 N ATOM 1884 CA VAL A 122 -5.577 -6.713 11.675 1.00 42.52 C ATOM 1885 C VAL A 122 -6.534 -5.512 11.788 1.00 63.31 C ATOM 1886 O VAL A 122 -7.024 -5.235 12.883 1.00 71.20 O ATOM 1887 CB VAL A 122 -6.318 -8.065 11.648 1.00 63.34 C ATOM 1888 CG1 VAL A 122 -7.316 -8.211 12.803 1.00 63.43 C ATOM 1889 CG2 VAL A 122 -7.022 -8.316 10.317 1.00 61.11 C ATOM 0 H VAL A 122 -4.598 -7.642 13.254 1.00 11.11 H new ATOM 0 HA VAL A 122 -5.049 -6.585 10.730 1.00 42.52 H new ATOM 0 HB VAL A 122 -5.544 -8.822 11.772 1.00 63.34 H new ATOM 0 HG11 VAL A 122 -7.810 -9.180 12.737 1.00 63.43 H new ATOM 0 HG12 VAL A 122 -6.786 -8.138 13.753 1.00 63.43 H new ATOM 0 HG13 VAL A 122 -8.062 -7.419 12.742 1.00 63.43 H new ATOM 0 HG21 VAL A 122 -7.529 -9.281 10.350 1.00 61.11 H new ATOM 0 HG22 VAL A 122 -7.753 -7.528 10.138 1.00 61.11 H new ATOM 0 HG23 VAL A 122 -6.287 -8.319 9.512 1.00 61.11 H new ATOM 1899 N PRO A 123 -6.796 -4.769 10.698 1.00 44.32 N ATOM 1900 CA PRO A 123 -7.624 -3.574 10.747 1.00 33.13 C ATOM 1901 C PRO A 123 -9.090 -3.925 11.011 1.00 64.34 C ATOM 1902 O PRO A 123 -9.543 -5.034 10.728 1.00 34.42 O ATOM 1903 CB PRO A 123 -7.435 -2.881 9.395 1.00 64.22 C ATOM 1904 CG PRO A 123 -7.092 -4.038 8.460 1.00 52.13 C ATOM 1905 CD PRO A 123 -6.265 -4.957 9.359 1.00 31.01 C ATOM 0 HA PRO A 123 -7.332 -2.916 11.566 1.00 33.13 H new ATOM 0 HB2 PRO A 123 -8.339 -2.361 9.078 1.00 64.22 H new ATOM 0 HB3 PRO A 123 -6.636 -2.140 9.430 1.00 64.22 H new ATOM 0 HG2 PRO A 123 -7.986 -4.535 8.085 1.00 52.13 H new ATOM 0 HG3 PRO A 123 -6.525 -3.703 7.591 1.00 52.13 H new ATOM 0 HD2 PRO A 123 -6.353 -5.997 9.044 1.00 31.01 H new ATOM 0 HD3 PRO A 123 -5.207 -4.699 9.317 1.00 31.01 H new ATOM 1913 N SER A 124 -9.819 -2.961 11.579 1.00 2.11 N ATOM 1914 CA SER A 124 -11.192 -3.129 12.026 1.00 70.22 C ATOM 1915 C SER A 124 -12.165 -3.259 10.854 1.00 22.10 C ATOM 1916 O SER A 124 -11.965 -2.644 9.807 1.00 53.34 O ATOM 1917 CB SER A 124 -11.572 -1.931 12.900 1.00 3.11 C ATOM 1918 OG SER A 124 -10.930 -2.022 14.154 1.00 71.33 O ATOM 0 H SER A 124 -9.456 -2.022 11.742 1.00 2.11 H new ATOM 0 HA SER A 124 -11.260 -4.054 12.598 1.00 70.22 H new ATOM 0 HB2 SER A 124 -11.287 -1.004 12.403 1.00 3.11 H new ATOM 0 HB3 SER A 124 -12.653 -1.900 13.038 1.00 3.11 H new ATOM 0 HG SER A 124 -11.178 -1.251 14.705 1.00 71.33 H new ATOM 1924 N VAL A 125 -13.244 -4.025 11.068 1.00 15.00 N ATOM 1925 CA VAL A 125 -14.359 -4.181 10.139 1.00 22.34 C ATOM 1926 C VAL A 125 -15.002 -2.820 9.853 1.00 44.30 C ATOM 1927 O VAL A 125 -15.322 -2.503 8.708 1.00 62.13 O ATOM 1928 CB VAL A 125 -15.385 -5.178 10.710 1.00 0.13 C ATOM 1929 CG1 VAL A 125 -16.601 -5.321 9.783 1.00 30.12 C ATOM 1930 CG2 VAL A 125 -14.756 -6.565 10.901 1.00 63.23 C ATOM 0 H VAL A 125 -13.363 -4.569 11.923 1.00 15.00 H new ATOM 0 HA VAL A 125 -13.989 -4.581 9.195 1.00 22.34 H new ATOM 0 HB VAL A 125 -15.707 -4.782 11.673 1.00 0.13 H new ATOM 0 HG11 VAL A 125 -17.306 -6.032 10.215 1.00 30.12 H new ATOM 0 HG12 VAL A 125 -17.087 -4.352 9.668 1.00 30.12 H new ATOM 0 HG13 VAL A 125 -16.274 -5.681 8.807 1.00 30.12 H new ATOM 0 HG21 VAL A 125 -15.501 -7.250 11.305 1.00 63.23 H new ATOM 0 HG22 VAL A 125 -14.402 -6.939 9.940 1.00 63.23 H new ATOM 0 HG23 VAL A 125 -13.917 -6.492 11.593 1.00 63.23 H new ATOM 1940 N SER A 126 -15.171 -2.009 10.902 1.00 33.20 N ATOM 1941 CA SER A 126 -15.644 -0.642 10.789 1.00 42.05 C ATOM 1942 C SER A 126 -14.686 0.198 9.941 1.00 34.45 C ATOM 1943 O SER A 126 -15.140 0.967 9.099 1.00 72.23 O ATOM 1944 CB SER A 126 -15.818 -0.049 12.191 1.00 33.21 C ATOM 1945 OG SER A 126 -14.617 -0.164 12.928 1.00 12.22 O ATOM 0 H SER A 126 -14.978 -2.295 11.862 1.00 33.20 H new ATOM 0 HA SER A 126 -16.610 -0.635 10.283 1.00 42.05 H new ATOM 0 HB2 SER A 126 -16.107 0.999 12.116 1.00 33.21 H new ATOM 0 HB3 SER A 126 -16.623 -0.565 12.714 1.00 33.21 H new ATOM 0 HG SER A 126 -14.743 0.220 13.821 1.00 12.22 H new ATOM 1951 N SER A 127 -13.370 0.053 10.156 1.00 75.42 N ATOM 1952 CA SER A 127 -12.373 0.889 9.506 1.00 43.51 C ATOM 1953 C SER A 127 -12.383 0.649 8.000 1.00 12.33 C ATOM 1954 O SER A 127 -12.641 1.585 7.247 1.00 50.33 O ATOM 1955 CB SER A 127 -10.983 0.662 10.114 1.00 1.53 C ATOM 1956 OG SER A 127 -10.038 1.529 9.523 1.00 14.23 O ATOM 0 H SER A 127 -12.977 -0.647 10.785 1.00 75.42 H new ATOM 0 HA SER A 127 -12.627 1.935 9.677 1.00 43.51 H new ATOM 0 HB2 SER A 127 -11.018 0.832 11.190 1.00 1.53 H new ATOM 0 HB3 SER A 127 -10.679 -0.374 9.964 1.00 1.53 H new ATOM 0 HG SER A 127 -9.157 1.373 9.922 1.00 14.23 H new ATOM 1962 N ILE A 128 -12.130 -0.595 7.570 1.00 52.10 N ATOM 1963 CA ILE A 128 -12.111 -0.977 6.160 1.00 23.24 C ATOM 1964 C ILE A 128 -13.377 -0.500 5.435 1.00 32.11 C ATOM 1965 O ILE A 128 -13.288 0.047 4.338 1.00 71.34 O ATOM 1966 CB ILE A 128 -11.870 -2.491 5.990 1.00 75.14 C ATOM 1967 CG1 ILE A 128 -13.000 -3.313 6.633 1.00 72.13 C ATOM 1968 CG2 ILE A 128 -10.475 -2.859 6.524 1.00 63.13 C ATOM 1969 CD1 ILE A 128 -12.765 -4.820 6.692 1.00 73.13 C ATOM 0 H ILE A 128 -11.931 -1.370 8.203 1.00 52.10 H new ATOM 0 HA ILE A 128 -11.269 -0.471 5.687 1.00 23.24 H new ATOM 0 HB ILE A 128 -11.889 -2.743 4.930 1.00 75.14 H new ATOM 0 HG12 ILE A 128 -13.159 -2.948 7.648 1.00 72.13 H new ATOM 0 HG13 ILE A 128 -13.921 -3.128 6.079 1.00 72.13 H new ATOM 0 HG21 ILE A 128 -10.309 -3.929 6.402 1.00 63.13 H new ATOM 0 HG22 ILE A 128 -9.716 -2.309 5.968 1.00 63.13 H new ATOM 0 HG23 ILE A 128 -10.410 -2.600 7.581 1.00 63.13 H new ATOM 0 HD11 ILE A 128 -13.621 -5.304 7.163 1.00 73.13 H new ATOM 0 HD12 ILE A 128 -12.640 -5.209 5.681 1.00 73.13 H new ATOM 0 HD13 ILE A 128 -11.867 -5.026 7.274 1.00 73.13 H new ATOM 1981 N ASN A 129 -14.549 -0.670 6.062 1.00 23.44 N ATOM 1982 CA ASN A 129 -15.827 -0.265 5.495 1.00 61.14 C ATOM 1983 C ASN A 129 -15.901 1.254 5.319 1.00 52.53 C ATOM 1984 O ASN A 129 -16.271 1.730 4.246 1.00 14.54 O ATOM 1985 CB ASN A 129 -16.967 -0.788 6.375 1.00 2.34 C ATOM 1986 CG ASN A 129 -18.322 -0.516 5.729 1.00 51.21 C ATOM 1987 OD1 ASN A 129 -18.794 -1.312 4.921 1.00 45.31 O ATOM 1988 ND2 ASN A 129 -18.948 0.612 6.069 1.00 11.01 N ATOM 0 H ASN A 129 -14.629 -1.097 6.985 1.00 23.44 H new ATOM 0 HA ASN A 129 -15.927 -0.701 4.501 1.00 61.14 H new ATOM 0 HB2 ASN A 129 -16.845 -1.859 6.537 1.00 2.34 H new ATOM 0 HB3 ASN A 129 -16.924 -0.311 7.354 1.00 2.34 H new ATOM 0 HD21 ASN A 129 -19.852 0.839 5.654 1.00 11.01 H new ATOM 0 HD22 ASN A 129 -18.523 1.248 6.744 1.00 11.01 H new ATOM 1995 N ARG A 130 -15.543 2.006 6.370 1.00 20.21 N ATOM 1996 CA ARG A 130 -15.513 3.466 6.371 1.00 21.33 C ATOM 1997 C ARG A 130 -14.662 4.022 5.225 1.00 10.12 C ATOM 1998 O ARG A 130 -15.017 5.060 4.670 1.00 63.42 O ATOM 1999 CB ARG A 130 -15.003 3.991 7.721 1.00 55.41 C ATOM 2000 CG ARG A 130 -16.039 3.855 8.845 1.00 71.12 C ATOM 2001 CD ARG A 130 -16.961 5.076 8.918 1.00 13.34 C ATOM 2002 NE ARG A 130 -17.922 4.942 10.019 1.00 2.11 N ATOM 2003 CZ ARG A 130 -18.745 5.914 10.447 1.00 64.02 C ATOM 2004 NH1 ARG A 130 -18.772 7.107 9.834 1.00 41.44 N ATOM 2005 NH2 ARG A 130 -19.544 5.689 11.498 1.00 44.31 N ATOM 0 H ARG A 130 -15.260 1.600 7.262 1.00 20.21 H new ATOM 0 HA ARG A 130 -16.535 3.814 6.217 1.00 21.33 H new ATOM 0 HB2 ARG A 130 -14.100 3.448 7.999 1.00 55.41 H new ATOM 0 HB3 ARG A 130 -14.724 5.040 7.616 1.00 55.41 H new ATOM 0 HG2 ARG A 130 -16.636 2.958 8.683 1.00 71.12 H new ATOM 0 HG3 ARG A 130 -15.527 3.729 9.799 1.00 71.12 H new ATOM 0 HD2 ARG A 130 -16.366 5.978 9.058 1.00 13.34 H new ATOM 0 HD3 ARG A 130 -17.496 5.190 7.975 1.00 13.34 H new ATOM 0 HE ARG A 130 -17.969 4.042 10.496 1.00 2.11 H new ATOM 0 HH11 ARG A 130 -18.164 7.283 9.034 1.00 41.44 H new ATOM 0 HH12 ARG A 130 -19.401 7.838 10.167 1.00 41.44 H new ATOM 0 HH21 ARG A 130 -19.525 4.784 11.968 1.00 44.31 H new ATOM 0 HH22 ARG A 130 -20.171 6.423 11.828 1.00 44.31 H new ATOM 2019 N ILE A 131 -13.559 3.353 4.858 1.00 10.12 N ATOM 2020 CA ILE A 131 -12.728 3.810 3.749 1.00 34.54 C ATOM 2021 C ILE A 131 -13.563 3.813 2.464 1.00 23.41 C ATOM 2022 O ILE A 131 -13.628 4.821 1.766 1.00 4.13 O ATOM 2023 CB ILE A 131 -11.460 2.952 3.557 1.00 2.12 C ATOM 2024 CG1 ILE A 131 -10.752 2.498 4.842 1.00 11.00 C ATOM 2025 CG2 ILE A 131 -10.464 3.692 2.655 1.00 41.11 C ATOM 2026 CD1 ILE A 131 -10.520 3.561 5.921 1.00 65.01 C ATOM 0 H ILE A 131 -13.229 2.502 5.312 1.00 10.12 H new ATOM 0 HA ILE A 131 -12.388 4.818 3.985 1.00 34.54 H new ATOM 0 HB ILE A 131 -11.817 2.032 3.095 1.00 2.12 H new ATOM 0 HG12 ILE A 131 -11.335 1.690 5.283 1.00 11.00 H new ATOM 0 HG13 ILE A 131 -9.784 2.079 4.566 1.00 11.00 H new ATOM 0 HG21 ILE A 131 -9.570 3.082 2.523 1.00 41.11 H new ATOM 0 HG22 ILE A 131 -10.922 3.880 1.684 1.00 41.11 H new ATOM 0 HG23 ILE A 131 -10.190 4.641 3.117 1.00 41.11 H new ATOM 0 HD11 ILE A 131 -10.013 3.109 6.773 1.00 65.01 H new ATOM 0 HD12 ILE A 131 -9.904 4.363 5.515 1.00 65.01 H new ATOM 0 HD13 ILE A 131 -11.479 3.968 6.243 1.00 65.01 H new ATOM 2038 N ILE A 132 -14.208 2.679 2.164 1.00 51.22 N ATOM 2039 CA ILE A 132 -14.959 2.472 0.935 1.00 31.03 C ATOM 2040 C ILE A 132 -16.141 3.445 0.815 1.00 0.44 C ATOM 2041 O ILE A 132 -16.476 3.826 -0.305 1.00 3.40 O ATOM 2042 CB ILE A 132 -15.377 0.995 0.799 1.00 62.34 C ATOM 2043 CG1 ILE A 132 -14.191 0.013 0.891 1.00 63.14 C ATOM 2044 CG2 ILE A 132 -16.137 0.756 -0.513 1.00 53.42 C ATOM 2045 CD1 ILE A 132 -13.118 0.189 -0.190 1.00 40.45 C ATOM 0 H ILE A 132 -14.218 1.869 2.784 1.00 51.22 H new ATOM 0 HA ILE A 132 -14.307 2.699 0.092 1.00 31.03 H new ATOM 0 HB ILE A 132 -16.031 0.796 1.648 1.00 62.34 H new ATOM 0 HG12 ILE A 132 -13.722 0.124 1.869 1.00 63.14 H new ATOM 0 HG13 ILE A 132 -14.577 -1.005 0.836 1.00 63.14 H new ATOM 0 HG21 ILE A 132 -16.420 -0.294 -0.583 1.00 53.42 H new ATOM 0 HG22 ILE A 132 -17.034 1.376 -0.532 1.00 53.42 H new ATOM 0 HG23 ILE A 132 -15.498 1.017 -1.356 1.00 53.42 H new ATOM 0 HD11 ILE A 132 -12.327 -0.546 -0.041 1.00 40.45 H new ATOM 0 HD12 ILE A 132 -13.566 0.046 -1.174 1.00 40.45 H new ATOM 0 HD13 ILE A 132 -12.697 1.193 -0.125 1.00 40.45 H new ATOM 2057 N ARG A 133 -16.750 3.880 1.931 1.00 1.40 N ATOM 2058 CA ARG A 133 -17.773 4.928 1.920 1.00 44.22 C ATOM 2059 C ARG A 133 -17.334 6.150 1.110 1.00 31.14 C ATOM 2060 O ARG A 133 -18.111 6.649 0.297 1.00 42.35 O ATOM 2061 CB ARG A 133 -18.162 5.366 3.339 1.00 21.23 C ATOM 2062 CG ARG A 133 -18.819 4.240 4.145 1.00 14.41 C ATOM 2063 CD ARG A 133 -19.430 4.771 5.447 1.00 64.42 C ATOM 2064 NE ARG A 133 -20.539 5.707 5.203 1.00 41.34 N ATOM 2065 CZ ARG A 133 -21.784 5.372 4.822 1.00 11.21 C ATOM 2066 NH1 ARG A 133 -22.137 4.088 4.659 1.00 73.25 N ATOM 2067 NH2 ARG A 133 -22.687 6.337 4.601 1.00 24.30 N ATOM 0 H ARG A 133 -16.545 3.514 2.861 1.00 1.40 H new ATOM 0 HA ARG A 133 -18.647 4.488 1.439 1.00 44.22 H new ATOM 0 HB2 ARG A 133 -17.272 5.713 3.865 1.00 21.23 H new ATOM 0 HB3 ARG A 133 -18.847 6.212 3.279 1.00 21.23 H new ATOM 0 HG2 ARG A 133 -19.594 3.764 3.544 1.00 14.41 H new ATOM 0 HG3 ARG A 133 -18.078 3.474 4.374 1.00 14.41 H new ATOM 0 HD2 ARG A 133 -19.789 3.934 6.045 1.00 64.42 H new ATOM 0 HD3 ARG A 133 -18.657 5.271 6.031 1.00 64.42 H new ATOM 0 HE ARG A 133 -20.346 6.700 5.335 1.00 41.34 H new ATOM 0 HH11 ARG A 133 -21.456 3.347 4.825 1.00 73.25 H new ATOM 0 HH12 ARG A 133 -23.086 3.853 4.369 1.00 73.25 H new ATOM 0 HH21 ARG A 133 -22.427 7.316 4.722 1.00 24.30 H new ATOM 0 HH22 ARG A 133 -23.634 6.093 4.312 1.00 24.30 H new ATOM 2081 N THR A 134 -16.102 6.630 1.321 1.00 14.23 N ATOM 2082 CA THR A 134 -15.593 7.800 0.614 1.00 30.20 C ATOM 2083 C THR A 134 -15.293 7.497 -0.862 1.00 12.21 C ATOM 2084 O THR A 134 -15.232 8.428 -1.663 1.00 23.44 O ATOM 2085 CB THR A 134 -14.385 8.410 1.344 1.00 1.21 C ATOM 2086 OG1 THR A 134 -13.274 7.542 1.321 1.00 33.41 O ATOM 2087 CG2 THR A 134 -14.719 8.766 2.797 1.00 52.23 C ATOM 0 H THR A 134 -15.440 6.220 1.980 1.00 14.23 H new ATOM 0 HA THR A 134 -16.382 8.552 0.616 1.00 30.20 H new ATOM 0 HB THR A 134 -14.132 9.325 0.808 1.00 1.21 H new ATOM 0 HG1 THR A 134 -13.572 6.625 1.497 1.00 33.41 H new ATOM 0 HG21 THR A 134 -13.840 9.194 3.278 1.00 52.23 H new ATOM 0 HG22 THR A 134 -15.532 9.491 2.816 1.00 52.23 H new ATOM 0 HG23 THR A 134 -15.023 7.866 3.331 1.00 52.23 H new