USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 774 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 57 SER OG : rot -162:sc= -0.658 USER MOD Set 1.2: A 58 LYS NZ :NH3+ -151:sc= 0.0774 (180deg=0) USER MOD Set 2.1: A 43 THR OG1 : rot -168:sc= 0.65 USER MOD Set 2.2: A 47 THR OG1 : rot -65:sc= 0.632 USER MOD Set 3.1: A 41 GLN : amide:sc= -0.0571 K(o=-3.4,f=-4.5) USER MOD Set 3.2: A 49 GLN : amide:sc= -3.39! C(o=-3.4!,f=-7.5!) USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.468 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -141:sc= -0.0845 (180deg=-0.5) USER MOD Single : A 19 GLN : amide:sc= -1.84 K(o=-1.8,f=-2.5) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=-0.0011) USER MOD Single : A 27 THR OG1 : rot 83:sc= 1.27 USER MOD Single : A 28 GLN : amide:sc= -1.01 K(o=-1,f=-2!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= -0.119 (180deg=-0.119) USER MOD Single : A 42 ASN : amide:sc= -1.23 K(o=-1.2,f=-0.72) USER MOD Single : A 51 GLN : amide:sc= -1.61 K(o=-1.6,f=-3.5!) USER MOD Single : A 53 GLN : amide:sc= -1.08 K(o=-1.1,f=-1.7) USER MOD Single : A 61 HIS : no HD1:sc= -0.125 K(o=-0.12,f=-0.69) USER MOD Single : A 62 MET CE :methyl -126:sc= -4.75! (180deg=-6.42!) USER MOD Single : A 63 GLN : amide:sc= -1.32 K(o=-1.3,f=-2.1) USER MOD Single : A 68 THR OG1 : rot -129:sc= 0.0547 USER MOD Single : A 71 SER OG : rot 170:sc= 0.744 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot -152:sc= 0.192 USER MOD Single : A 75 HIS : no HD1:sc= -0.0175 X(o=-0.018,f=-0.2) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 ASN : amide:sc= -0.517 X(o=-0.52,f=-0.45) USER MOD Single : A 83 ASN : amide:sc= -0.0413 K(o=-0.041,f=-1.8!) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ -159:sc= -0.0774 (180deg=-0.445) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 9.897 1.146 -7.569 1.00 10.34 N ATOM 41 CA ASN A 5 11.061 0.277 -7.442 1.00 61.13 C ATOM 42 C ASN A 5 11.852 0.234 -8.746 1.00 42.22 C ATOM 43 O ASN A 5 11.281 0.095 -9.828 1.00 50.33 O ATOM 44 CB ASN A 5 10.628 -1.137 -7.049 1.00 55.32 C ATOM 45 CG ASN A 5 10.392 -1.276 -5.557 1.00 44.55 C ATOM 46 OD1 ASN A 5 11.262 -0.953 -4.748 1.00 61.10 O ATOM 47 ND2 ASN A 5 9.212 -1.758 -5.187 1.00 52.22 N ATOM 0 HA ASN A 5 11.703 0.684 -6.661 1.00 61.13 H new ATOM 0 HB2 ASN A 5 9.715 -1.396 -7.584 1.00 55.32 H new ATOM 0 HB3 ASN A 5 11.393 -1.848 -7.361 1.00 55.32 H new ATOM 0 HD21 ASN A 5 8.996 -1.874 -4.197 1.00 52.22 H new ATOM 0 HD22 ASN A 5 8.521 -2.013 -5.893 1.00 52.22 H new ATOM 54 N THR A 6 13.172 0.354 -8.636 1.00 33.03 N ATOM 55 CA THR A 6 14.042 0.330 -9.805 1.00 32.34 C ATOM 56 C THR A 6 14.143 -1.076 -10.386 1.00 13.12 C ATOM 57 O THR A 6 15.126 -1.783 -10.161 1.00 10.13 O ATOM 58 CB THR A 6 15.456 0.834 -9.463 1.00 4.35 C ATOM 59 OG1 THR A 6 15.377 1.933 -8.547 1.00 73.43 O ATOM 60 CG2 THR A 6 16.195 1.268 -10.720 1.00 20.22 C ATOM 0 H THR A 6 13.662 0.469 -7.749 1.00 33.03 H new ATOM 0 HA THR A 6 13.596 0.995 -10.545 1.00 32.34 H new ATOM 0 HB THR A 6 16.007 0.015 -9.001 1.00 4.35 H new ATOM 0 HG1 THR A 6 16.281 2.246 -8.333 1.00 73.43 H new ATOM 0 HG21 THR A 6 17.191 1.620 -10.453 1.00 20.22 H new ATOM 0 HG22 THR A 6 16.280 0.422 -11.403 1.00 20.22 H new ATOM 0 HG23 THR A 6 15.644 2.073 -11.206 1.00 20.22 H new ATOM 68 N LEU A 7 13.121 -1.476 -11.135 1.00 1.02 N ATOM 69 CA LEU A 7 13.095 -2.799 -11.750 1.00 2.41 C ATOM 70 C LEU A 7 14.253 -2.967 -12.728 1.00 41.14 C ATOM 71 O LEU A 7 14.352 -2.242 -13.719 1.00 1.44 O ATOM 72 CB LEU A 7 11.765 -3.020 -12.473 1.00 24.53 C ATOM 73 CG LEU A 7 10.621 -3.570 -11.620 1.00 25.21 C ATOM 74 CD1 LEU A 7 10.949 -4.970 -11.126 1.00 24.55 C ATOM 75 CD2 LEU A 7 10.336 -2.642 -10.448 1.00 62.11 C ATOM 0 H LEU A 7 12.300 -0.904 -11.331 1.00 1.02 H new ATOM 0 HA LEU A 7 13.200 -3.543 -10.960 1.00 2.41 H new ATOM 0 HB2 LEU A 7 11.446 -2.071 -12.904 1.00 24.53 H new ATOM 0 HB3 LEU A 7 11.935 -3.706 -13.303 1.00 24.53 H new ATOM 0 HG LEU A 7 9.726 -3.626 -12.239 1.00 25.21 H new ATOM 0 HD11 LEU A 7 10.124 -5.345 -10.521 1.00 24.55 H new ATOM 0 HD12 LEU A 7 11.102 -5.630 -11.980 1.00 24.55 H new ATOM 0 HD13 LEU A 7 11.856 -4.940 -10.523 1.00 24.55 H new ATOM 0 HD21 LEU A 7 9.519 -3.049 -9.852 1.00 62.11 H new ATOM 0 HD22 LEU A 7 11.228 -2.554 -9.828 1.00 62.11 H new ATOM 0 HD23 LEU A 7 10.056 -1.658 -10.823 1.00 62.11 H new ATOM 87 N ILE A 8 15.125 -3.929 -12.445 1.00 50.24 N ATOM 88 CA ILE A 8 16.274 -4.194 -13.302 1.00 72.23 C ATOM 89 C ILE A 8 16.291 -5.647 -13.765 1.00 32.25 C ATOM 90 O ILE A 8 15.628 -6.503 -13.179 1.00 21.51 O ATOM 91 CB ILE A 8 17.598 -3.881 -12.581 1.00 62.13 C ATOM 92 CG1 ILE A 8 17.627 -4.552 -11.207 1.00 32.14 C ATOM 93 CG2 ILE A 8 17.785 -2.377 -12.447 1.00 23.23 C ATOM 94 CD1 ILE A 8 18.986 -4.513 -10.543 1.00 54.31 C ATOM 0 H ILE A 8 15.058 -4.538 -11.629 1.00 50.24 H new ATOM 0 HA ILE A 8 16.179 -3.540 -14.169 1.00 72.23 H new ATOM 0 HB ILE A 8 18.421 -4.278 -13.175 1.00 62.13 H new ATOM 0 HG12 ILE A 8 16.900 -4.063 -10.558 1.00 32.14 H new ATOM 0 HG13 ILE A 8 17.313 -5.590 -11.312 1.00 32.14 H new ATOM 0 HG21 ILE A 8 18.725 -2.171 -11.935 1.00 23.23 H new ATOM 0 HG22 ILE A 8 17.804 -1.923 -13.438 1.00 23.23 H new ATOM 0 HG23 ILE A 8 16.960 -1.958 -11.872 1.00 23.23 H new ATOM 0 HD11 ILE A 8 18.931 -5.007 -9.573 1.00 54.31 H new ATOM 0 HD12 ILE A 8 19.713 -5.027 -11.172 1.00 54.31 H new ATOM 0 HD13 ILE A 8 19.294 -3.477 -10.405 1.00 54.31 H new ATOM 106 N SER A 9 17.055 -5.919 -14.818 1.00 55.50 N ATOM 107 CA SER A 9 17.157 -7.268 -15.361 1.00 30.13 C ATOM 108 C SER A 9 18.612 -7.722 -15.417 1.00 45.24 C ATOM 109 O SER A 9 19.463 -7.049 -16.000 1.00 55.34 O ATOM 110 CB SER A 9 16.538 -7.327 -16.758 1.00 52.25 C ATOM 111 OG SER A 9 16.885 -6.182 -17.519 1.00 22.44 O ATOM 0 H SER A 9 17.613 -5.222 -15.312 1.00 55.50 H new ATOM 0 HA SER A 9 16.610 -7.941 -14.701 1.00 30.13 H new ATOM 0 HB2 SER A 9 16.878 -8.226 -17.272 1.00 52.25 H new ATOM 0 HB3 SER A 9 15.453 -7.398 -16.676 1.00 52.25 H new ATOM 0 HG SER A 9 16.478 -6.245 -18.408 1.00 22.44 H new ATOM 117 N VAL A 10 18.892 -8.869 -14.807 1.00 4.02 N ATOM 118 CA VAL A 10 20.244 -9.415 -14.788 1.00 2.12 C ATOM 119 C VAL A 10 20.225 -10.921 -14.553 1.00 24.04 C ATOM 120 O VAL A 10 19.311 -11.449 -13.919 1.00 64.43 O ATOM 121 CB VAL A 10 21.104 -8.747 -13.698 1.00 51.12 C ATOM 122 CG1 VAL A 10 20.593 -9.116 -12.314 1.00 22.02 C ATOM 123 CG2 VAL A 10 22.565 -9.139 -13.858 1.00 41.34 C ATOM 0 H VAL A 10 18.200 -9.438 -14.319 1.00 4.02 H new ATOM 0 HA VAL A 10 20.683 -9.208 -15.764 1.00 2.12 H new ATOM 0 HB VAL A 10 21.027 -7.666 -13.811 1.00 51.12 H new ATOM 0 HG11 VAL A 10 21.213 -8.635 -11.557 1.00 22.02 H new ATOM 0 HG12 VAL A 10 19.562 -8.780 -12.205 1.00 22.02 H new ATOM 0 HG13 VAL A 10 20.638 -10.198 -12.186 1.00 22.02 H new ATOM 0 HG21 VAL A 10 23.158 -8.658 -13.080 1.00 41.34 H new ATOM 0 HG22 VAL A 10 22.663 -10.221 -13.772 1.00 41.34 H new ATOM 0 HG23 VAL A 10 22.923 -8.819 -14.837 1.00 41.34 H new ATOM 133 N ASP A 11 21.240 -11.607 -15.066 1.00 65.01 N ATOM 134 CA ASP A 11 21.342 -13.053 -14.911 1.00 21.51 C ATOM 135 C ASP A 11 22.653 -13.436 -14.231 1.00 61.33 C ATOM 136 O ASP A 11 23.722 -12.955 -14.607 1.00 24.11 O ATOM 137 CB ASP A 11 21.239 -13.742 -16.272 1.00 71.54 C ATOM 138 CG ASP A 11 21.755 -15.167 -16.241 1.00 25.51 C ATOM 139 OD1 ASP A 11 22.991 -15.352 -16.251 1.00 52.54 O ATOM 140 OD2 ASP A 11 20.924 -16.099 -16.205 1.00 5.43 O ATOM 0 H ASP A 11 22.004 -11.185 -15.593 1.00 65.01 H new ATOM 0 HA ASP A 11 20.517 -13.385 -14.281 1.00 21.51 H new ATOM 0 HB2 ASP A 11 20.199 -13.743 -16.598 1.00 71.54 H new ATOM 0 HB3 ASP A 11 21.803 -13.170 -17.009 1.00 71.54 H new ATOM 145 N TYR A 12 22.563 -14.303 -13.229 1.00 73.41 N ATOM 146 CA TYR A 12 23.741 -14.748 -12.495 1.00 21.15 C ATOM 147 C TYR A 12 24.194 -16.124 -12.973 1.00 31.34 C ATOM 148 O TYR A 12 23.376 -16.961 -13.352 1.00 74.12 O ATOM 149 CB TYR A 12 23.447 -14.788 -10.994 1.00 24.31 C ATOM 150 CG TYR A 12 22.193 -15.556 -10.643 1.00 13.31 C ATOM 151 CD1 TYR A 12 22.189 -16.945 -10.619 1.00 33.03 C ATOM 152 CD2 TYR A 12 21.011 -14.892 -10.336 1.00 44.14 C ATOM 153 CE1 TYR A 12 21.045 -17.651 -10.299 1.00 54.53 C ATOM 154 CE2 TYR A 12 19.863 -15.589 -10.014 1.00 61.04 C ATOM 155 CZ TYR A 12 19.885 -16.968 -9.997 1.00 74.14 C ATOM 156 OH TYR A 12 18.743 -17.666 -9.679 1.00 35.25 O ATOM 0 H TYR A 12 21.686 -14.712 -12.906 1.00 73.41 H new ATOM 0 HA TYR A 12 24.545 -14.036 -12.683 1.00 21.15 H new ATOM 0 HB2 TYR A 12 24.295 -15.238 -10.478 1.00 24.31 H new ATOM 0 HB3 TYR A 12 23.354 -13.767 -10.623 1.00 24.31 H new ATOM 0 HD1 TYR A 12 23.096 -17.482 -10.855 1.00 33.03 H new ATOM 0 HD2 TYR A 12 20.990 -13.812 -10.350 1.00 44.14 H new ATOM 0 HE1 TYR A 12 21.059 -18.731 -10.285 1.00 54.53 H new ATOM 0 HE2 TYR A 12 18.953 -15.057 -9.777 1.00 61.04 H new ATOM 0 HH TYR A 12 18.016 -17.036 -9.492 1.00 35.25 H new ATOM 166 N GLU A 13 25.504 -16.350 -12.950 1.00 32.00 N ATOM 167 CA GLU A 13 26.066 -17.624 -13.381 1.00 62.42 C ATOM 168 C GLU A 13 27.041 -18.168 -12.341 1.00 65.42 C ATOM 169 O GLU A 13 28.063 -17.546 -12.048 1.00 32.34 O ATOM 170 CB GLU A 13 26.776 -17.465 -14.727 1.00 52.44 C ATOM 171 CG GLU A 13 25.908 -17.831 -15.920 1.00 3.21 C ATOM 172 CD GLU A 13 26.335 -17.123 -17.191 1.00 64.22 C ATOM 173 OE1 GLU A 13 27.535 -16.798 -17.314 1.00 70.00 O ATOM 174 OE2 GLU A 13 25.471 -16.894 -18.063 1.00 31.34 O ATOM 0 H GLU A 13 26.195 -15.668 -12.638 1.00 32.00 H new ATOM 0 HA GLU A 13 25.246 -18.334 -13.492 1.00 62.42 H new ATOM 0 HB2 GLU A 13 27.108 -16.432 -14.833 1.00 52.44 H new ATOM 0 HB3 GLU A 13 27.669 -18.089 -14.733 1.00 52.44 H new ATOM 0 HG2 GLU A 13 25.949 -18.909 -16.078 1.00 3.21 H new ATOM 0 HG3 GLU A 13 24.870 -17.580 -15.700 1.00 3.21 H new ATOM 181 N ILE A 14 26.718 -19.332 -11.788 1.00 24.33 N ATOM 182 CA ILE A 14 27.565 -19.960 -10.781 1.00 63.33 C ATOM 183 C ILE A 14 28.237 -21.214 -11.332 1.00 54.22 C ATOM 184 O ILE A 14 27.620 -21.993 -12.059 1.00 51.23 O ATOM 185 CB ILE A 14 26.761 -20.334 -9.522 1.00 41.30 C ATOM 186 CG1 ILE A 14 26.368 -19.073 -8.749 1.00 22.11 C ATOM 187 CG2 ILE A 14 27.567 -21.274 -8.638 1.00 50.03 C ATOM 188 CD1 ILE A 14 25.230 -18.305 -9.383 1.00 74.53 C ATOM 0 H ILE A 14 25.876 -19.859 -12.020 1.00 24.33 H new ATOM 0 HA ILE A 14 28.328 -19.230 -10.511 1.00 63.33 H new ATOM 0 HB ILE A 14 25.850 -20.848 -9.830 1.00 41.30 H new ATOM 0 HG12 ILE A 14 26.086 -19.352 -7.734 1.00 22.11 H new ATOM 0 HG13 ILE A 14 27.237 -18.420 -8.670 1.00 22.11 H new ATOM 0 HG21 ILE A 14 26.985 -21.529 -7.752 1.00 50.03 H new ATOM 0 HG22 ILE A 14 27.802 -22.183 -9.192 1.00 50.03 H new ATOM 0 HG23 ILE A 14 28.493 -20.785 -8.335 1.00 50.03 H new ATOM 0 HD11 ILE A 14 25.006 -17.424 -8.781 1.00 74.53 H new ATOM 0 HD12 ILE A 14 25.516 -17.995 -10.388 1.00 74.53 H new ATOM 0 HD13 ILE A 14 24.347 -18.942 -9.437 1.00 74.53 H new ATOM 200 N PHE A 15 29.504 -21.403 -10.980 1.00 32.34 N ATOM 201 CA PHE A 15 30.260 -22.563 -11.438 1.00 34.11 C ATOM 202 C PHE A 15 30.751 -23.394 -10.256 1.00 3.40 C ATOM 203 O PHE A 15 30.872 -22.893 -9.139 1.00 13.23 O ATOM 204 CB PHE A 15 31.448 -22.119 -12.293 1.00 1.41 C ATOM 205 CG PHE A 15 32.075 -23.237 -13.075 1.00 44.12 C ATOM 206 CD1 PHE A 15 31.407 -23.812 -14.144 1.00 20.31 C ATOM 207 CD2 PHE A 15 33.333 -23.712 -12.742 1.00 65.32 C ATOM 208 CE1 PHE A 15 31.982 -24.842 -14.865 1.00 13.13 C ATOM 209 CE2 PHE A 15 33.913 -24.742 -13.460 1.00 5.52 C ATOM 210 CZ PHE A 15 33.237 -25.306 -14.523 1.00 71.31 C ATOM 0 H PHE A 15 30.029 -20.768 -10.379 1.00 32.34 H new ATOM 0 HA PHE A 15 29.597 -23.181 -12.043 1.00 34.11 H new ATOM 0 HB2 PHE A 15 31.118 -21.343 -12.984 1.00 1.41 H new ATOM 0 HB3 PHE A 15 32.203 -21.670 -11.647 1.00 1.41 H new ATOM 0 HD1 PHE A 15 30.426 -23.452 -14.417 1.00 20.31 H new ATOM 0 HD2 PHE A 15 33.867 -23.273 -11.912 1.00 65.32 H new ATOM 0 HE1 PHE A 15 31.450 -25.283 -15.695 1.00 13.13 H new ATOM 0 HE2 PHE A 15 34.894 -25.105 -13.189 1.00 5.52 H new ATOM 0 HZ PHE A 15 33.689 -26.109 -15.086 1.00 71.31 H new ATOM 220 N GLY A 16 31.034 -24.667 -10.512 1.00 34.51 N ATOM 221 CA GLY A 16 31.508 -25.548 -9.460 1.00 40.13 C ATOM 222 C GLY A 16 30.727 -26.845 -9.394 1.00 32.12 C ATOM 223 O GLY A 16 30.278 -27.362 -10.417 1.00 52.11 O ATOM 0 H GLY A 16 30.944 -25.104 -11.429 1.00 34.51 H new ATOM 0 HA2 GLY A 16 32.562 -25.770 -9.624 1.00 40.13 H new ATOM 0 HA3 GLY A 16 31.436 -25.035 -8.501 1.00 40.13 H new ATOM 227 N LYS A 17 30.565 -27.375 -8.186 1.00 54.01 N ATOM 228 CA LYS A 17 29.833 -28.620 -7.988 1.00 73.55 C ATOM 229 C LYS A 17 28.381 -28.475 -8.435 1.00 24.51 C ATOM 230 O LYS A 17 27.706 -29.466 -8.716 1.00 10.31 O ATOM 231 CB LYS A 17 29.886 -29.039 -6.517 1.00 75.15 C ATOM 232 CG LYS A 17 29.666 -30.526 -6.300 1.00 71.30 C ATOM 233 CD LYS A 17 30.818 -31.347 -6.855 1.00 71.12 C ATOM 234 CE LYS A 17 30.636 -32.829 -6.566 1.00 61.33 C ATOM 235 NZ LYS A 17 30.470 -33.094 -5.110 1.00 71.34 N ATOM 0 H LYS A 17 30.931 -26.961 -7.329 1.00 54.01 H new ATOM 0 HA LYS A 17 30.306 -29.391 -8.596 1.00 73.55 H new ATOM 0 HB2 LYS A 17 30.855 -28.759 -6.103 1.00 75.15 H new ATOM 0 HB3 LYS A 17 29.130 -28.484 -5.962 1.00 75.15 H new ATOM 0 HG2 LYS A 17 29.555 -30.727 -5.234 1.00 71.30 H new ATOM 0 HG3 LYS A 17 28.736 -30.831 -6.780 1.00 71.30 H new ATOM 0 HD2 LYS A 17 30.892 -31.191 -7.931 1.00 71.12 H new ATOM 0 HD3 LYS A 17 31.755 -31.002 -6.418 1.00 71.12 H new ATOM 0 HE2 LYS A 17 29.764 -33.199 -7.104 1.00 61.33 H new ATOM 0 HE3 LYS A 17 31.499 -33.380 -6.939 1.00 61.33 H new ATOM 0 HZ1 LYS A 17 30.978 -33.965 -4.856 1.00 71.34 H new ATOM 0 HZ2 LYS A 17 30.856 -32.296 -4.566 1.00 71.34 H new ATOM 0 HZ3 LYS A 17 29.460 -33.206 -4.891 1.00 71.34 H new ATOM 249 N VAL A 18 27.908 -27.235 -8.499 1.00 71.15 N ATOM 250 CA VAL A 18 26.537 -26.961 -8.915 1.00 4.45 C ATOM 251 C VAL A 18 26.214 -27.650 -10.235 1.00 65.51 C ATOM 252 O VAL A 18 25.069 -28.021 -10.488 1.00 54.04 O ATOM 253 CB VAL A 18 26.289 -25.448 -9.064 1.00 15.11 C ATOM 254 CG1 VAL A 18 26.424 -24.749 -7.720 1.00 35.14 C ATOM 255 CG2 VAL A 18 27.245 -24.849 -10.084 1.00 23.22 C ATOM 0 H VAL A 18 28.453 -26.404 -8.268 1.00 71.15 H new ATOM 0 HA VAL A 18 25.885 -27.355 -8.135 1.00 4.45 H new ATOM 0 HB VAL A 18 25.271 -25.299 -9.423 1.00 15.11 H new ATOM 0 HG11 VAL A 18 26.245 -23.681 -7.846 1.00 35.14 H new ATOM 0 HG12 VAL A 18 25.695 -25.159 -7.022 1.00 35.14 H new ATOM 0 HG13 VAL A 18 27.429 -24.905 -7.328 1.00 35.14 H new ATOM 0 HG21 VAL A 18 27.055 -23.780 -10.176 1.00 23.22 H new ATOM 0 HG22 VAL A 18 28.273 -25.008 -9.757 1.00 23.22 H new ATOM 0 HG23 VAL A 18 27.093 -25.329 -11.051 1.00 23.22 H new ATOM 265 N GLN A 19 27.233 -27.820 -11.072 1.00 53.24 N ATOM 266 CA GLN A 19 27.057 -28.466 -12.368 1.00 15.42 C ATOM 267 C GLN A 19 26.905 -29.975 -12.208 1.00 3.33 C ATOM 268 O GLN A 19 27.886 -30.689 -12.004 1.00 1.23 O ATOM 269 CB GLN A 19 28.243 -28.154 -13.282 1.00 74.11 C ATOM 270 CG GLN A 19 27.984 -28.476 -14.745 1.00 52.52 C ATOM 271 CD GLN A 19 29.180 -28.180 -15.628 1.00 62.11 C ATOM 272 OE1 GLN A 19 30.038 -27.368 -15.280 1.00 21.43 O ATOM 273 NE2 GLN A 19 29.244 -28.839 -16.779 1.00 60.31 N ATOM 0 H GLN A 19 28.188 -27.520 -10.876 1.00 53.24 H new ATOM 0 HA GLN A 19 26.146 -28.074 -12.821 1.00 15.42 H new ATOM 0 HB2 GLN A 19 28.494 -27.097 -13.190 1.00 74.11 H new ATOM 0 HB3 GLN A 19 29.111 -28.719 -12.942 1.00 74.11 H new ATOM 0 HG2 GLN A 19 27.719 -29.529 -14.840 1.00 52.52 H new ATOM 0 HG3 GLN A 19 27.128 -27.899 -15.094 1.00 52.52 H new ATOM 0 HE21 GLN A 19 28.511 -29.503 -17.028 1.00 60.31 H new ATOM 0 HE22 GLN A 19 30.026 -28.681 -17.414 1.00 60.31 H new ATOM 282 N GLY A 20 25.669 -30.454 -12.301 1.00 74.13 N ATOM 283 CA GLY A 20 25.412 -31.876 -12.164 1.00 14.32 C ATOM 284 C GLY A 20 25.052 -32.265 -10.744 1.00 34.22 C ATOM 285 O GLY A 20 25.632 -33.194 -10.181 1.00 13.42 O ATOM 0 H GLY A 20 24.841 -29.883 -12.469 1.00 74.13 H new ATOM 0 HA2 GLY A 20 24.600 -32.162 -12.833 1.00 14.32 H new ATOM 0 HA3 GLY A 20 26.294 -32.434 -12.478 1.00 14.32 H new ATOM 289 N VAL A 21 24.092 -31.553 -10.162 1.00 1.24 N ATOM 290 CA VAL A 21 23.656 -31.828 -8.798 1.00 33.50 C ATOM 291 C VAL A 21 22.192 -31.450 -8.602 1.00 71.03 C ATOM 292 O VAL A 21 21.556 -30.899 -9.501 1.00 64.25 O ATOM 293 CB VAL A 21 24.513 -31.067 -7.770 1.00 22.34 C ATOM 294 CG1 VAL A 21 25.941 -31.592 -7.772 1.00 31.24 C ATOM 295 CG2 VAL A 21 24.485 -29.573 -8.055 1.00 23.33 C ATOM 0 H VAL A 21 23.601 -30.781 -10.614 1.00 1.24 H new ATOM 0 HA VAL A 21 23.776 -32.899 -8.638 1.00 33.50 H new ATOM 0 HB VAL A 21 24.092 -31.232 -6.778 1.00 22.34 H new ATOM 0 HG11 VAL A 21 26.532 -31.042 -7.039 1.00 31.24 H new ATOM 0 HG12 VAL A 21 25.940 -32.651 -7.516 1.00 31.24 H new ATOM 0 HG13 VAL A 21 26.376 -31.459 -8.762 1.00 31.24 H new ATOM 0 HG21 VAL A 21 25.096 -29.051 -7.319 1.00 23.33 H new ATOM 0 HG22 VAL A 21 24.880 -29.386 -9.053 1.00 23.33 H new ATOM 0 HG23 VAL A 21 23.459 -29.211 -7.997 1.00 23.33 H new ATOM 305 N PHE A 22 21.662 -31.749 -7.421 1.00 1.22 N ATOM 306 CA PHE A 22 20.272 -31.440 -7.106 1.00 70.43 C ATOM 307 C PHE A 22 20.144 -30.032 -6.533 1.00 55.15 C ATOM 308 O PHE A 22 19.869 -29.855 -5.346 1.00 60.04 O ATOM 309 CB PHE A 22 19.713 -32.460 -6.112 1.00 24.40 C ATOM 310 CG PHE A 22 19.410 -33.795 -6.730 1.00 33.43 C ATOM 311 CD1 PHE A 22 18.311 -33.956 -7.559 1.00 23.33 C ATOM 312 CD2 PHE A 22 20.222 -34.890 -6.481 1.00 5.32 C ATOM 313 CE1 PHE A 22 18.029 -35.183 -8.129 1.00 62.30 C ATOM 314 CE2 PHE A 22 19.946 -36.119 -7.049 1.00 14.14 C ATOM 315 CZ PHE A 22 18.847 -36.266 -7.873 1.00 30.33 C ATOM 0 H PHE A 22 22.174 -32.205 -6.666 1.00 1.22 H new ATOM 0 HA PHE A 22 19.697 -31.491 -8.030 1.00 70.43 H new ATOM 0 HB2 PHE A 22 20.430 -32.598 -5.303 1.00 24.40 H new ATOM 0 HB3 PHE A 22 18.802 -32.060 -5.666 1.00 24.40 H new ATOM 0 HD1 PHE A 22 17.667 -33.113 -7.762 1.00 23.33 H new ATOM 0 HD2 PHE A 22 21.081 -34.781 -5.835 1.00 5.32 H new ATOM 0 HE1 PHE A 22 17.170 -35.295 -8.774 1.00 62.30 H new ATOM 0 HE2 PHE A 22 20.589 -36.964 -6.849 1.00 14.14 H new ATOM 0 HZ PHE A 22 18.628 -37.226 -8.316 1.00 30.33 H new ATOM 325 N PHE A 23 20.345 -29.032 -7.386 1.00 34.41 N ATOM 326 CA PHE A 23 20.253 -27.639 -6.965 1.00 61.15 C ATOM 327 C PHE A 23 19.131 -26.919 -7.708 1.00 62.42 C ATOM 328 O PHE A 23 18.491 -26.019 -7.165 1.00 52.13 O ATOM 329 CB PHE A 23 21.583 -26.922 -7.209 1.00 31.40 C ATOM 330 CG PHE A 23 21.662 -25.569 -6.563 1.00 13.04 C ATOM 331 CD1 PHE A 23 21.293 -25.397 -5.238 1.00 2.20 C ATOM 332 CD2 PHE A 23 22.105 -24.469 -7.279 1.00 55.02 C ATOM 333 CE1 PHE A 23 21.364 -24.152 -4.641 1.00 60.31 C ATOM 334 CE2 PHE A 23 22.178 -23.222 -6.687 1.00 51.05 C ATOM 335 CZ PHE A 23 21.808 -23.064 -5.366 1.00 40.23 C ATOM 0 H PHE A 23 20.572 -29.161 -8.372 1.00 34.41 H new ATOM 0 HA PHE A 23 20.028 -27.622 -5.899 1.00 61.15 H new ATOM 0 HB2 PHE A 23 22.396 -27.543 -6.833 1.00 31.40 H new ATOM 0 HB3 PHE A 23 21.736 -26.813 -8.283 1.00 31.40 H new ATOM 0 HD1 PHE A 23 20.946 -26.245 -4.666 1.00 2.20 H new ATOM 0 HD2 PHE A 23 22.397 -24.587 -8.312 1.00 55.02 H new ATOM 0 HE1 PHE A 23 21.072 -24.031 -3.608 1.00 60.31 H new ATOM 0 HE2 PHE A 23 22.524 -22.372 -7.257 1.00 51.05 H new ATOM 0 HZ PHE A 23 21.866 -22.091 -4.901 1.00 40.23 H new ATOM 345 N ARG A 24 18.900 -27.323 -8.953 1.00 73.10 N ATOM 346 CA ARG A 24 17.857 -26.716 -9.772 1.00 31.35 C ATOM 347 C ARG A 24 16.495 -26.837 -9.094 1.00 70.02 C ATOM 348 O ARG A 24 15.599 -26.025 -9.328 1.00 20.44 O ATOM 349 CB ARG A 24 17.813 -27.376 -11.151 1.00 32.51 C ATOM 350 CG ARG A 24 17.530 -28.869 -11.103 1.00 31.11 C ATOM 351 CD ARG A 24 16.051 -29.163 -11.303 1.00 44.44 C ATOM 352 NE ARG A 24 15.814 -30.559 -11.660 1.00 50.34 N ATOM 353 CZ ARG A 24 14.636 -31.160 -11.534 1.00 1.53 C ATOM 354 NH1 ARG A 24 13.594 -30.490 -11.062 1.00 12.34 N ATOM 355 NH2 ARG A 24 14.499 -32.433 -11.880 1.00 71.12 N ATOM 0 H ARG A 24 19.421 -28.068 -9.417 1.00 73.10 H new ATOM 0 HA ARG A 24 18.092 -25.658 -9.891 1.00 31.35 H new ATOM 0 HB2 ARG A 24 17.046 -26.889 -11.753 1.00 32.51 H new ATOM 0 HB3 ARG A 24 18.766 -27.211 -11.654 1.00 32.51 H new ATOM 0 HG2 ARG A 24 18.110 -29.375 -11.874 1.00 31.11 H new ATOM 0 HG3 ARG A 24 17.856 -29.271 -10.144 1.00 31.11 H new ATOM 0 HD2 ARG A 24 15.507 -28.925 -10.389 1.00 44.44 H new ATOM 0 HD3 ARG A 24 15.656 -28.516 -12.086 1.00 44.44 H new ATOM 0 HE ARG A 24 16.596 -31.102 -12.026 1.00 50.34 H new ATOM 0 HH11 ARG A 24 13.696 -29.511 -10.795 1.00 12.34 H new ATOM 0 HH12 ARG A 24 12.690 -30.954 -10.966 1.00 12.34 H new ATOM 0 HH21 ARG A 24 15.299 -32.952 -12.243 1.00 71.12 H new ATOM 0 HH22 ARG A 24 13.594 -32.893 -11.783 1.00 71.12 H new ATOM 369 N LYS A 25 16.346 -27.856 -8.255 1.00 12.15 N ATOM 370 CA LYS A 25 15.094 -28.084 -7.542 1.00 43.10 C ATOM 371 C LYS A 25 14.842 -26.981 -6.518 1.00 64.53 C ATOM 372 O LYS A 25 13.732 -26.459 -6.414 1.00 41.15 O ATOM 373 CB LYS A 25 15.121 -29.446 -6.844 1.00 45.34 C ATOM 374 CG LYS A 25 13.796 -29.832 -6.212 1.00 14.30 C ATOM 375 CD LYS A 25 13.990 -30.797 -5.055 1.00 12.14 C ATOM 376 CE LYS A 25 12.658 -31.238 -4.467 1.00 70.23 C ATOM 377 NZ LYS A 25 12.817 -32.387 -3.534 1.00 30.35 N ATOM 0 H LYS A 25 17.077 -28.538 -8.052 1.00 12.15 H new ATOM 0 HA LYS A 25 14.283 -28.072 -8.270 1.00 43.10 H new ATOM 0 HB2 LYS A 25 15.405 -30.210 -7.568 1.00 45.34 H new ATOM 0 HB3 LYS A 25 15.892 -29.435 -6.073 1.00 45.34 H new ATOM 0 HG2 LYS A 25 13.286 -28.936 -5.858 1.00 14.30 H new ATOM 0 HG3 LYS A 25 13.153 -30.289 -6.964 1.00 14.30 H new ATOM 0 HD2 LYS A 25 14.545 -31.671 -5.398 1.00 12.14 H new ATOM 0 HD3 LYS A 25 14.591 -30.321 -4.280 1.00 12.14 H new ATOM 0 HE2 LYS A 25 12.200 -30.402 -3.939 1.00 70.23 H new ATOM 0 HE3 LYS A 25 11.979 -31.516 -5.273 1.00 70.23 H new ATOM 0 HZ1 LYS A 25 11.887 -32.657 -3.155 1.00 30.35 H new ATOM 0 HZ2 LYS A 25 13.231 -33.193 -4.044 1.00 30.35 H new ATOM 0 HZ3 LYS A 25 13.444 -32.114 -2.751 1.00 30.35 H new ATOM 391 N HIS A 26 15.880 -26.631 -5.765 1.00 20.31 N ATOM 392 CA HIS A 26 15.771 -25.589 -4.751 1.00 1.24 C ATOM 393 C HIS A 26 15.868 -24.204 -5.383 1.00 1.54 C ATOM 394 O HIS A 26 15.302 -23.236 -4.874 1.00 12.44 O ATOM 395 CB HIS A 26 16.864 -25.758 -3.695 1.00 64.33 C ATOM 396 CG HIS A 26 16.470 -26.655 -2.563 1.00 33.05 C ATOM 397 ND1 HIS A 26 16.324 -26.210 -1.266 1.00 14.42 N ATOM 398 CD2 HIS A 26 16.188 -27.979 -2.538 1.00 2.20 C ATOM 399 CE1 HIS A 26 15.971 -27.221 -0.492 1.00 41.22 C ATOM 400 NE2 HIS A 26 15.882 -28.306 -1.240 1.00 54.10 N ATOM 0 H HIS A 26 16.805 -27.054 -5.838 1.00 20.31 H new ATOM 0 HA HIS A 26 14.796 -25.684 -4.272 1.00 1.24 H new ATOM 0 HB2 HIS A 26 17.759 -26.159 -4.171 1.00 64.33 H new ATOM 0 HB3 HIS A 26 17.127 -24.778 -3.297 1.00 64.33 H new ATOM 0 HD2 HIS A 26 16.201 -28.653 -3.382 1.00 2.20 H new ATOM 0 HE1 HIS A 26 15.787 -27.169 0.571 1.00 41.22 H new ATOM 0 HE2 HIS A 26 15.627 -29.236 -0.907 1.00 54.10 H new ATOM 408 N THR A 27 16.590 -24.115 -6.495 1.00 64.13 N ATOM 409 CA THR A 27 16.763 -22.849 -7.196 1.00 3.34 C ATOM 410 C THR A 27 15.493 -22.455 -7.941 1.00 2.31 C ATOM 411 O THR A 27 15.253 -21.275 -8.193 1.00 54.55 O ATOM 412 CB THR A 27 17.932 -22.915 -8.196 1.00 65.23 C ATOM 413 OG1 THR A 27 19.088 -23.474 -7.563 1.00 24.54 O ATOM 414 CG2 THR A 27 18.263 -21.532 -8.735 1.00 51.52 C ATOM 0 H THR A 27 17.065 -24.906 -6.930 1.00 64.13 H new ATOM 0 HA THR A 27 16.985 -22.097 -6.439 1.00 3.34 H new ATOM 0 HB THR A 27 17.631 -23.550 -9.029 1.00 65.23 H new ATOM 0 HG1 THR A 27 19.024 -24.452 -7.570 1.00 24.54 H new ATOM 0 HG21 THR A 27 19.092 -21.605 -9.439 1.00 51.52 H new ATOM 0 HG22 THR A 27 17.390 -21.121 -9.243 1.00 51.52 H new ATOM 0 HG23 THR A 27 18.544 -20.878 -7.910 1.00 51.52 H new ATOM 422 N GLN A 28 14.684 -23.450 -8.289 1.00 42.04 N ATOM 423 CA GLN A 28 13.438 -23.206 -9.006 1.00 42.42 C ATOM 424 C GLN A 28 12.429 -22.489 -8.115 1.00 20.10 C ATOM 425 O GLN A 28 11.779 -21.534 -8.540 1.00 21.42 O ATOM 426 CB GLN A 28 12.847 -24.524 -9.508 1.00 62.05 C ATOM 427 CG GLN A 28 11.537 -24.356 -10.261 1.00 44.14 C ATOM 428 CD GLN A 28 10.793 -25.665 -10.438 1.00 4.12 C ATOM 429 OE1 GLN A 28 10.464 -26.059 -11.557 1.00 31.11 O ATOM 430 NE2 GLN A 28 10.524 -26.347 -9.331 1.00 24.12 N ATOM 0 H GLN A 28 14.869 -24.432 -8.086 1.00 42.04 H new ATOM 0 HA GLN A 28 13.659 -22.567 -9.861 1.00 42.42 H new ATOM 0 HB2 GLN A 28 13.571 -25.012 -10.160 1.00 62.05 H new ATOM 0 HB3 GLN A 28 12.685 -25.187 -8.658 1.00 62.05 H new ATOM 0 HG2 GLN A 28 10.902 -23.651 -9.724 1.00 44.14 H new ATOM 0 HG3 GLN A 28 11.738 -23.922 -11.240 1.00 44.14 H new ATOM 0 HE21 GLN A 28 10.816 -25.983 -8.424 1.00 24.12 H new ATOM 0 HE22 GLN A 28 10.026 -27.235 -9.388 1.00 24.12 H new ATOM 439 N ALA A 29 12.303 -22.957 -6.877 1.00 41.24 N ATOM 440 CA ALA A 29 11.374 -22.360 -5.926 1.00 3.41 C ATOM 441 C ALA A 29 12.001 -21.158 -5.227 1.00 42.12 C ATOM 442 O ALA A 29 11.543 -20.027 -5.388 1.00 21.34 O ATOM 443 CB ALA A 29 10.929 -23.394 -4.903 1.00 32.20 C ATOM 0 H ALA A 29 12.833 -23.748 -6.510 1.00 41.24 H new ATOM 0 HA ALA A 29 10.501 -22.012 -6.478 1.00 3.41 H new ATOM 0 HB1 ALA A 29 10.235 -22.934 -4.199 1.00 32.20 H new ATOM 0 HB2 ALA A 29 10.434 -24.221 -5.413 1.00 32.20 H new ATOM 0 HB3 ALA A 29 11.798 -23.769 -4.363 1.00 32.20 H new ATOM 449 N GLU A 30 13.051 -21.411 -4.451 1.00 73.24 N ATOM 450 CA GLU A 30 13.739 -20.349 -3.727 1.00 54.22 C ATOM 451 C GLU A 30 14.124 -19.211 -4.668 1.00 11.53 C ATOM 452 O GLU A 30 14.169 -18.048 -4.267 1.00 62.22 O ATOM 453 CB GLU A 30 14.988 -20.899 -3.036 1.00 12.34 C ATOM 454 CG GLU A 30 14.702 -22.056 -2.093 1.00 42.03 C ATOM 455 CD GLU A 30 14.338 -21.594 -0.696 1.00 32.02 C ATOM 456 OE1 GLU A 30 15.123 -20.828 -0.100 1.00 24.13 O ATOM 457 OE2 GLU A 30 13.266 -21.999 -0.198 1.00 40.25 O ATOM 0 H GLU A 30 13.443 -22.342 -4.308 1.00 73.24 H new ATOM 0 HA GLU A 30 13.057 -19.958 -2.972 1.00 54.22 H new ATOM 0 HB2 GLU A 30 15.698 -21.227 -3.795 1.00 12.34 H new ATOM 0 HB3 GLU A 30 15.467 -20.095 -2.477 1.00 12.34 H new ATOM 0 HG2 GLU A 30 13.887 -22.656 -2.497 1.00 42.03 H new ATOM 0 HG3 GLU A 30 15.578 -22.702 -2.041 1.00 42.03 H new ATOM 464 N GLY A 31 14.402 -19.555 -5.922 1.00 13.24 N ATOM 465 CA GLY A 31 14.780 -18.552 -6.900 1.00 3.23 C ATOM 466 C GLY A 31 13.760 -17.436 -7.011 1.00 22.21 C ATOM 467 O GLY A 31 14.093 -16.316 -7.397 1.00 45.25 O ATOM 0 H GLY A 31 14.372 -20.510 -6.278 1.00 13.24 H new ATOM 0 HA2 GLY A 31 15.747 -18.130 -6.628 1.00 3.23 H new ATOM 0 HA3 GLY A 31 14.902 -19.026 -7.874 1.00 3.23 H new ATOM 471 N LYS A 32 12.512 -17.742 -6.673 1.00 22.01 N ATOM 472 CA LYS A 32 11.439 -16.758 -6.737 1.00 14.55 C ATOM 473 C LYS A 32 10.891 -16.458 -5.345 1.00 23.45 C ATOM 474 O LYS A 32 10.551 -15.317 -5.032 1.00 24.25 O ATOM 475 CB LYS A 32 10.312 -17.259 -7.642 1.00 74.32 C ATOM 476 CG LYS A 32 9.112 -16.329 -7.692 1.00 73.41 C ATOM 477 CD LYS A 32 8.074 -16.702 -6.647 1.00 12.23 C ATOM 478 CE LYS A 32 6.676 -16.278 -7.073 1.00 65.30 C ATOM 479 NZ LYS A 32 5.632 -16.805 -6.151 1.00 51.25 N ATOM 0 H LYS A 32 12.219 -18.665 -6.352 1.00 22.01 H new ATOM 0 HA LYS A 32 11.849 -15.838 -7.153 1.00 14.55 H new ATOM 0 HB2 LYS A 32 10.700 -17.392 -8.652 1.00 74.32 H new ATOM 0 HB3 LYS A 32 9.987 -18.239 -7.294 1.00 74.32 H new ATOM 0 HG2 LYS A 32 9.439 -15.302 -7.531 1.00 73.41 H new ATOM 0 HG3 LYS A 32 8.661 -16.368 -8.684 1.00 73.41 H new ATOM 0 HD2 LYS A 32 8.094 -17.779 -6.481 1.00 12.23 H new ATOM 0 HD3 LYS A 32 8.325 -16.229 -5.698 1.00 12.23 H new ATOM 0 HE2 LYS A 32 6.619 -15.190 -7.102 1.00 65.30 H new ATOM 0 HE3 LYS A 32 6.481 -16.634 -8.084 1.00 65.30 H new ATOM 0 HZ1 LYS A 32 4.694 -16.494 -6.475 1.00 51.25 H new ATOM 0 HZ2 LYS A 32 5.669 -17.844 -6.143 1.00 51.25 H new ATOM 0 HZ3 LYS A 32 5.803 -16.445 -5.191 1.00 51.25 H new ATOM 493 N LYS A 33 10.810 -17.490 -4.511 1.00 71.45 N ATOM 494 CA LYS A 33 10.307 -17.339 -3.151 1.00 51.54 C ATOM 495 C LYS A 33 11.186 -16.384 -2.350 1.00 14.23 C ATOM 496 O LYS A 33 10.710 -15.699 -1.443 1.00 32.10 O ATOM 497 CB LYS A 33 10.245 -18.699 -2.454 1.00 20.23 C ATOM 498 CG LYS A 33 9.043 -19.536 -2.857 1.00 41.51 C ATOM 499 CD LYS A 33 8.986 -20.841 -2.081 1.00 44.05 C ATOM 500 CE LYS A 33 8.403 -21.965 -2.924 1.00 15.22 C ATOM 501 NZ LYS A 33 8.590 -23.295 -2.281 1.00 11.23 N ATOM 0 H LYS A 33 11.087 -18.441 -4.754 1.00 71.45 H new ATOM 0 HA LYS A 33 9.302 -16.921 -3.206 1.00 51.54 H new ATOM 0 HB2 LYS A 33 11.156 -19.255 -2.679 1.00 20.23 H new ATOM 0 HB3 LYS A 33 10.224 -18.544 -1.375 1.00 20.23 H new ATOM 0 HG2 LYS A 33 8.129 -18.968 -2.683 1.00 41.51 H new ATOM 0 HG3 LYS A 33 9.088 -19.749 -3.925 1.00 41.51 H new ATOM 0 HD2 LYS A 33 9.989 -21.114 -1.752 1.00 44.05 H new ATOM 0 HD3 LYS A 33 8.382 -20.706 -1.184 1.00 44.05 H new ATOM 0 HE2 LYS A 33 7.340 -21.785 -3.084 1.00 15.22 H new ATOM 0 HE3 LYS A 33 8.877 -21.966 -3.905 1.00 15.22 H new ATOM 0 HZ1 LYS A 33 8.179 -24.034 -2.886 1.00 11.23 H new ATOM 0 HZ2 LYS A 33 9.605 -23.478 -2.151 1.00 11.23 H new ATOM 0 HZ3 LYS A 33 8.116 -23.303 -1.355 1.00 11.23 H new ATOM 515 N LEU A 34 12.469 -16.342 -2.690 1.00 1.41 N ATOM 516 CA LEU A 34 13.415 -15.469 -2.002 1.00 55.15 C ATOM 517 C LEU A 34 13.821 -14.298 -2.892 1.00 60.40 C ATOM 518 O LEU A 34 14.122 -13.210 -2.404 1.00 65.01 O ATOM 519 CB LEU A 34 14.655 -16.259 -1.581 1.00 52.13 C ATOM 520 CG LEU A 34 15.877 -15.429 -1.188 1.00 25.33 C ATOM 521 CD1 LEU A 34 15.554 -14.530 -0.004 1.00 61.44 C ATOM 522 CD2 LEU A 34 17.056 -16.336 -0.865 1.00 31.35 C ATOM 0 H LEU A 34 12.879 -16.902 -3.438 1.00 1.41 H new ATOM 0 HA LEU A 34 12.926 -15.073 -1.112 1.00 55.15 H new ATOM 0 HB2 LEU A 34 14.387 -16.896 -0.738 1.00 52.13 H new ATOM 0 HB3 LEU A 34 14.937 -16.919 -2.402 1.00 52.13 H new ATOM 0 HG LEU A 34 16.150 -14.797 -2.033 1.00 25.33 H new ATOM 0 HD11 LEU A 34 16.436 -13.947 0.261 1.00 61.44 H new ATOM 0 HD12 LEU A 34 14.740 -13.856 -0.270 1.00 61.44 H new ATOM 0 HD13 LEU A 34 15.254 -15.142 0.847 1.00 61.44 H new ATOM 0 HD21 LEU A 34 17.917 -15.728 -0.587 1.00 31.35 H new ATOM 0 HD22 LEU A 34 16.793 -16.993 -0.036 1.00 31.35 H new ATOM 0 HD23 LEU A 34 17.303 -16.937 -1.740 1.00 31.35 H new ATOM 534 N GLY A 35 13.825 -14.530 -4.201 1.00 72.04 N ATOM 535 CA GLY A 35 14.194 -13.485 -5.139 1.00 35.15 C ATOM 536 C GLY A 35 13.047 -13.092 -6.049 1.00 2.21 C ATOM 537 O GLY A 35 12.040 -12.548 -5.593 1.00 24.24 O ATOM 0 H GLY A 35 13.579 -15.423 -4.629 1.00 72.04 H new ATOM 0 HA2 GLY A 35 14.533 -12.608 -4.587 1.00 35.15 H new ATOM 0 HA3 GLY A 35 15.034 -13.825 -5.744 1.00 35.15 H new ATOM 541 N LEU A 36 13.199 -13.365 -7.340 1.00 51.31 N ATOM 542 CA LEU A 36 12.168 -13.034 -8.318 1.00 62.22 C ATOM 543 C LEU A 36 12.052 -14.126 -9.377 1.00 30.22 C ATOM 544 O LEU A 36 12.729 -15.152 -9.303 1.00 42.31 O ATOM 545 CB LEU A 36 12.481 -11.693 -8.985 1.00 31.35 C ATOM 546 CG LEU A 36 11.508 -10.552 -8.686 1.00 31.25 C ATOM 547 CD1 LEU A 36 10.092 -10.940 -9.083 1.00 42.24 C ATOM 548 CD2 LEU A 36 11.565 -10.174 -7.213 1.00 24.44 C ATOM 0 H LEU A 36 14.026 -13.814 -7.734 1.00 51.31 H new ATOM 0 HA LEU A 36 11.215 -12.958 -7.794 1.00 62.22 H new ATOM 0 HB2 LEU A 36 13.480 -11.382 -8.679 1.00 31.35 H new ATOM 0 HB3 LEU A 36 12.511 -11.845 -10.064 1.00 31.35 H new ATOM 0 HG LEU A 36 11.804 -9.684 -9.275 1.00 31.25 H new ATOM 0 HD11 LEU A 36 9.414 -10.116 -8.863 1.00 42.24 H new ATOM 0 HD12 LEU A 36 10.061 -11.161 -10.150 1.00 42.24 H new ATOM 0 HD13 LEU A 36 9.785 -11.822 -8.521 1.00 42.24 H new ATOM 0 HD21 LEU A 36 10.866 -9.360 -7.019 1.00 24.44 H new ATOM 0 HD22 LEU A 36 11.295 -11.037 -6.605 1.00 24.44 H new ATOM 0 HD23 LEU A 36 12.575 -9.853 -6.959 1.00 24.44 H new ATOM 560 N VAL A 37 11.190 -13.898 -10.363 1.00 22.11 N ATOM 561 CA VAL A 37 10.987 -14.861 -11.439 1.00 45.30 C ATOM 562 C VAL A 37 12.302 -15.186 -12.140 1.00 55.33 C ATOM 563 O VAL A 37 13.338 -14.593 -11.844 1.00 64.35 O ATOM 564 CB VAL A 37 9.979 -14.336 -12.479 1.00 24.12 C ATOM 565 CG1 VAL A 37 8.628 -14.079 -11.830 1.00 0.31 C ATOM 566 CG2 VAL A 37 10.509 -13.075 -13.145 1.00 22.22 C ATOM 0 H VAL A 37 10.621 -13.055 -10.439 1.00 22.11 H new ATOM 0 HA VAL A 37 10.588 -15.767 -10.983 1.00 45.30 H new ATOM 0 HB VAL A 37 9.847 -15.097 -13.248 1.00 24.12 H new ATOM 0 HG11 VAL A 37 7.929 -13.709 -12.580 1.00 0.31 H new ATOM 0 HG12 VAL A 37 8.246 -15.007 -11.405 1.00 0.31 H new ATOM 0 HG13 VAL A 37 8.739 -13.337 -11.040 1.00 0.31 H new ATOM 0 HG21 VAL A 37 9.784 -12.718 -13.877 1.00 22.22 H new ATOM 0 HG22 VAL A 37 10.672 -12.306 -12.390 1.00 22.22 H new ATOM 0 HG23 VAL A 37 11.451 -13.297 -13.646 1.00 22.22 H new ATOM 576 N GLY A 38 12.250 -16.132 -13.073 1.00 62.00 N ATOM 577 CA GLY A 38 13.443 -16.520 -13.803 1.00 1.31 C ATOM 578 C GLY A 38 13.403 -17.967 -14.253 1.00 52.40 C ATOM 579 O GLY A 38 12.327 -18.542 -14.418 1.00 23.40 O ATOM 0 H GLY A 38 11.403 -16.636 -13.336 1.00 62.00 H new ATOM 0 HA2 GLY A 38 13.558 -15.875 -14.674 1.00 1.31 H new ATOM 0 HA3 GLY A 38 14.318 -16.363 -13.172 1.00 1.31 H new ATOM 583 N TRP A 39 14.576 -18.555 -14.454 1.00 4.33 N ATOM 584 CA TRP A 39 14.671 -19.943 -14.890 1.00 34.45 C ATOM 585 C TRP A 39 16.120 -20.416 -14.893 1.00 3.22 C ATOM 586 O TRP A 39 17.033 -19.649 -15.201 1.00 13.21 O ATOM 587 CB TRP A 39 14.066 -20.103 -16.285 1.00 70.54 C ATOM 588 CG TRP A 39 14.643 -19.158 -17.295 1.00 3.12 C ATOM 589 CD1 TRP A 39 15.869 -19.243 -17.891 1.00 22.33 C ATOM 590 CD2 TRP A 39 14.019 -17.983 -17.824 1.00 74.53 C ATOM 591 NE1 TRP A 39 16.044 -18.193 -18.759 1.00 1.32 N ATOM 592 CE2 TRP A 39 14.923 -17.406 -18.737 1.00 71.10 C ATOM 593 CE3 TRP A 39 12.783 -17.365 -17.618 1.00 52.31 C ATOM 594 CZ2 TRP A 39 14.629 -16.240 -19.439 1.00 71.32 C ATOM 595 CZ3 TRP A 39 12.493 -16.208 -18.316 1.00 14.45 C ATOM 596 CH2 TRP A 39 13.412 -15.656 -19.218 1.00 13.53 C ATOM 0 H TRP A 39 15.475 -18.092 -14.322 1.00 4.33 H new ATOM 0 HA TRP A 39 14.110 -20.558 -14.186 1.00 34.45 H new ATOM 0 HB2 TRP A 39 14.222 -21.127 -16.625 1.00 70.54 H new ATOM 0 HB3 TRP A 39 12.989 -19.947 -16.226 1.00 70.54 H new ATOM 0 HD1 TRP A 39 16.594 -20.022 -17.707 1.00 22.33 H new ATOM 0 HE1 TRP A 39 16.874 -18.026 -19.328 1.00 1.32 H new ATOM 0 HE3 TRP A 39 12.067 -17.784 -16.926 1.00 52.31 H new ATOM 0 HZ2 TRP A 39 15.337 -15.812 -20.133 1.00 71.32 H new ATOM 0 HZ3 TRP A 39 11.541 -15.721 -18.163 1.00 14.45 H new ATOM 0 HH2 TRP A 39 13.154 -14.752 -19.749 1.00 13.53 H new ATOM 607 N VAL A 40 16.326 -21.683 -14.548 1.00 62.03 N ATOM 608 CA VAL A 40 17.666 -22.258 -14.513 1.00 13.20 C ATOM 609 C VAL A 40 18.017 -22.914 -15.843 1.00 43.04 C ATOM 610 O VAL A 40 17.236 -23.694 -16.387 1.00 30.01 O ATOM 611 CB VAL A 40 17.799 -23.301 -13.387 1.00 45.45 C ATOM 612 CG1 VAL A 40 19.244 -23.759 -13.253 1.00 34.10 C ATOM 613 CG2 VAL A 40 17.287 -22.733 -12.072 1.00 71.34 C ATOM 0 H VAL A 40 15.582 -22.331 -14.289 1.00 62.03 H new ATOM 0 HA VAL A 40 18.358 -21.438 -14.322 1.00 13.20 H new ATOM 0 HB VAL A 40 17.190 -24.168 -13.643 1.00 45.45 H new ATOM 0 HG11 VAL A 40 19.320 -24.496 -12.453 1.00 34.10 H new ATOM 0 HG12 VAL A 40 19.572 -24.207 -14.191 1.00 34.10 H new ATOM 0 HG13 VAL A 40 19.877 -22.903 -13.019 1.00 34.10 H new ATOM 0 HG21 VAL A 40 17.388 -23.483 -11.288 1.00 71.34 H new ATOM 0 HG22 VAL A 40 17.868 -21.850 -11.807 1.00 71.34 H new ATOM 0 HG23 VAL A 40 16.237 -22.459 -12.178 1.00 71.34 H new ATOM 623 N GLN A 41 19.198 -22.592 -16.362 1.00 23.54 N ATOM 624 CA GLN A 41 19.653 -23.151 -17.629 1.00 63.22 C ATOM 625 C GLN A 41 21.109 -23.596 -17.537 1.00 21.02 C ATOM 626 O GLN A 41 21.875 -23.081 -16.724 1.00 0.24 O ATOM 627 CB GLN A 41 19.492 -22.124 -18.751 1.00 12.31 C ATOM 628 CG GLN A 41 19.180 -22.744 -20.104 1.00 5.44 C ATOM 629 CD GLN A 41 19.322 -21.756 -21.245 1.00 1.33 C ATOM 630 OE1 GLN A 41 18.939 -20.592 -21.124 1.00 42.45 O ATOM 631 NE2 GLN A 41 19.875 -22.216 -22.361 1.00 52.41 N ATOM 0 H GLN A 41 19.856 -21.947 -15.925 1.00 23.54 H new ATOM 0 HA GLN A 41 19.039 -24.023 -17.853 1.00 63.22 H new ATOM 0 HB2 GLN A 41 18.694 -21.431 -18.486 1.00 12.31 H new ATOM 0 HB3 GLN A 41 20.408 -21.539 -18.831 1.00 12.31 H new ATOM 0 HG2 GLN A 41 19.847 -23.589 -20.275 1.00 5.44 H new ATOM 0 HG3 GLN A 41 18.164 -23.138 -20.093 1.00 5.44 H new ATOM 0 HE21 GLN A 41 20.178 -23.188 -22.417 1.00 52.41 H new ATOM 0 HE22 GLN A 41 19.997 -21.597 -23.162 1.00 52.41 H new ATOM 640 N ASN A 42 21.484 -24.556 -18.376 1.00 33.53 N ATOM 641 CA ASN A 42 22.848 -25.072 -18.388 1.00 1.53 C ATOM 642 C ASN A 42 23.647 -24.468 -19.539 1.00 21.31 C ATOM 643 O ASN A 42 23.458 -24.833 -20.700 1.00 21.52 O ATOM 644 CB ASN A 42 22.838 -26.597 -18.503 1.00 64.21 C ATOM 645 CG ASN A 42 22.000 -27.083 -19.670 1.00 22.44 C ATOM 646 OD1 ASN A 42 22.523 -27.373 -20.746 1.00 52.40 O ATOM 647 ND2 ASN A 42 20.692 -27.175 -19.460 1.00 61.41 N ATOM 0 H ASN A 42 20.862 -24.992 -19.057 1.00 33.53 H new ATOM 0 HA ASN A 42 23.326 -24.789 -17.450 1.00 1.53 H new ATOM 0 HB2 ASN A 42 23.860 -26.957 -18.619 1.00 64.21 H new ATOM 0 HB3 ASN A 42 22.452 -27.026 -17.578 1.00 64.21 H new ATOM 0 HD21 ASN A 42 20.077 -27.497 -20.207 1.00 61.41 H new ATOM 0 HD22 ASN A 42 20.302 -26.924 -18.551 1.00 61.41 H new ATOM 654 N THR A 43 24.542 -23.542 -19.209 1.00 63.25 N ATOM 655 CA THR A 43 25.370 -22.888 -20.215 1.00 0.44 C ATOM 656 C THR A 43 26.179 -23.906 -21.009 1.00 22.40 C ATOM 657 O THR A 43 26.434 -25.015 -20.537 1.00 42.43 O ATOM 658 CB THR A 43 26.334 -21.871 -19.574 1.00 15.13 C ATOM 659 OG1 THR A 43 27.351 -22.558 -18.837 1.00 44.20 O ATOM 660 CG2 THR A 43 25.584 -20.923 -18.650 1.00 31.13 C ATOM 0 H THR A 43 24.712 -23.228 -18.253 1.00 63.25 H new ATOM 0 HA THR A 43 24.693 -22.362 -20.888 1.00 0.44 H new ATOM 0 HB THR A 43 26.795 -21.288 -20.371 1.00 15.13 H new ATOM 0 HG1 THR A 43 27.847 -21.916 -18.287 1.00 44.20 H new ATOM 0 HG21 THR A 43 26.285 -20.214 -18.209 1.00 31.13 H new ATOM 0 HG22 THR A 43 24.830 -20.380 -19.220 1.00 31.13 H new ATOM 0 HG23 THR A 43 25.099 -21.494 -17.858 1.00 31.13 H new ATOM 668 N ASP A 44 26.581 -23.524 -22.216 1.00 71.21 N ATOM 669 CA ASP A 44 27.364 -24.405 -23.076 1.00 15.41 C ATOM 670 C ASP A 44 28.632 -24.870 -22.367 1.00 14.12 C ATOM 671 O ASP A 44 29.123 -25.972 -22.612 1.00 14.04 O ATOM 672 CB ASP A 44 27.726 -23.690 -24.379 1.00 32.22 C ATOM 673 CG ASP A 44 28.710 -24.481 -25.218 1.00 40.23 C ATOM 674 OD1 ASP A 44 28.260 -25.314 -26.033 1.00 43.32 O ATOM 675 OD2 ASP A 44 29.930 -24.266 -25.061 1.00 31.00 O ATOM 0 H ASP A 44 26.378 -22.610 -22.621 1.00 71.21 H new ATOM 0 HA ASP A 44 26.757 -25.280 -23.307 1.00 15.41 H new ATOM 0 HB2 ASP A 44 26.819 -23.513 -24.957 1.00 32.22 H new ATOM 0 HB3 ASP A 44 28.152 -22.714 -24.148 1.00 32.22 H new ATOM 680 N ARG A 45 29.157 -24.022 -21.488 1.00 61.33 N ATOM 681 CA ARG A 45 30.369 -24.346 -20.746 1.00 3.24 C ATOM 682 C ARG A 45 30.065 -25.308 -19.601 1.00 0.32 C ATOM 683 O ARG A 45 30.830 -26.234 -19.335 1.00 74.11 O ATOM 684 CB ARG A 45 31.012 -23.071 -20.197 1.00 44.32 C ATOM 685 CG ARG A 45 31.691 -22.224 -21.262 1.00 22.52 C ATOM 686 CD ARG A 45 33.030 -22.816 -21.674 1.00 72.53 C ATOM 687 NE ARG A 45 34.116 -22.371 -20.806 1.00 42.41 N ATOM 688 CZ ARG A 45 35.402 -22.542 -21.091 1.00 43.13 C ATOM 689 NH1 ARG A 45 35.761 -23.146 -22.216 1.00 54.30 N ATOM 690 NH2 ARG A 45 36.333 -22.108 -20.251 1.00 30.32 N ATOM 0 H ARG A 45 28.762 -23.106 -21.273 1.00 61.33 H new ATOM 0 HA ARG A 45 31.065 -24.831 -21.430 1.00 3.24 H new ATOM 0 HB2 ARG A 45 30.247 -22.473 -19.702 1.00 44.32 H new ATOM 0 HB3 ARG A 45 31.746 -23.342 -19.438 1.00 44.32 H new ATOM 0 HG2 ARG A 45 31.042 -22.146 -22.135 1.00 22.52 H new ATOM 0 HG3 ARG A 45 31.840 -21.213 -20.884 1.00 22.52 H new ATOM 0 HD2 ARG A 45 32.968 -23.904 -21.649 1.00 72.53 H new ATOM 0 HD3 ARG A 45 33.250 -22.533 -22.703 1.00 72.53 H new ATOM 0 HE ARG A 45 33.874 -21.903 -19.933 1.00 42.41 H new ATOM 0 HH11 ARG A 45 35.049 -23.481 -22.865 1.00 54.30 H new ATOM 0 HH12 ARG A 45 36.749 -23.276 -22.432 1.00 54.30 H new ATOM 0 HH21 ARG A 45 36.062 -21.642 -19.385 1.00 30.32 H new ATOM 0 HH22 ARG A 45 37.320 -22.240 -20.471 1.00 30.32 H new ATOM 704 N GLY A 46 28.942 -25.080 -18.926 1.00 24.14 N ATOM 705 CA GLY A 46 28.557 -25.934 -17.817 1.00 43.02 C ATOM 706 C GLY A 46 27.995 -25.149 -16.649 1.00 2.03 C ATOM 707 O GLY A 46 27.273 -25.695 -15.813 1.00 42.44 O ATOM 0 H GLY A 46 28.292 -24.320 -19.127 1.00 24.14 H new ATOM 0 HA2 GLY A 46 27.813 -26.654 -18.158 1.00 43.02 H new ATOM 0 HA3 GLY A 46 29.424 -26.505 -17.484 1.00 43.02 H new ATOM 711 N THR A 47 28.327 -23.863 -16.587 1.00 24.12 N ATOM 712 CA THR A 47 27.853 -23.002 -15.511 1.00 25.23 C ATOM 713 C THR A 47 26.338 -23.086 -15.366 1.00 43.13 C ATOM 714 O THR A 47 25.628 -23.371 -16.330 1.00 75.12 O ATOM 715 CB THR A 47 28.255 -21.534 -15.748 1.00 31.14 C ATOM 716 OG1 THR A 47 29.156 -21.445 -16.857 1.00 71.50 O ATOM 717 CG2 THR A 47 28.910 -20.945 -14.507 1.00 61.24 C ATOM 0 H THR A 47 28.923 -23.395 -17.270 1.00 24.12 H new ATOM 0 HA THR A 47 28.323 -23.356 -14.593 1.00 25.23 H new ATOM 0 HB THR A 47 27.352 -20.964 -15.968 1.00 31.14 H new ATOM 0 HG1 THR A 47 29.993 -21.904 -16.636 1.00 71.50 H new ATOM 0 HG21 THR A 47 29.185 -19.908 -14.698 1.00 61.24 H new ATOM 0 HG22 THR A 47 28.211 -20.987 -13.672 1.00 61.24 H new ATOM 0 HG23 THR A 47 29.804 -21.518 -14.261 1.00 61.24 H new ATOM 725 N VAL A 48 25.849 -22.835 -14.156 1.00 51.11 N ATOM 726 CA VAL A 48 24.417 -22.880 -13.886 1.00 72.21 C ATOM 727 C VAL A 48 23.809 -21.482 -13.906 1.00 5.04 C ATOM 728 O VAL A 48 23.556 -20.891 -12.856 1.00 52.25 O ATOM 729 CB VAL A 48 24.123 -23.537 -12.524 1.00 50.31 C ATOM 730 CG1 VAL A 48 22.623 -23.639 -12.293 1.00 0.10 C ATOM 731 CG2 VAL A 48 24.778 -24.907 -12.441 1.00 61.13 C ATOM 0 H VAL A 48 26.423 -22.598 -13.347 1.00 51.11 H new ATOM 0 HA VAL A 48 23.965 -23.480 -14.676 1.00 72.21 H new ATOM 0 HB VAL A 48 24.545 -22.910 -11.739 1.00 50.31 H new ATOM 0 HG11 VAL A 48 22.435 -24.106 -11.326 1.00 0.10 H new ATOM 0 HG12 VAL A 48 22.184 -22.641 -12.306 1.00 0.10 H new ATOM 0 HG13 VAL A 48 22.174 -24.243 -13.081 1.00 0.10 H new ATOM 0 HG21 VAL A 48 24.560 -25.356 -11.472 1.00 61.13 H new ATOM 0 HG22 VAL A 48 24.388 -25.546 -13.233 1.00 61.13 H new ATOM 0 HG23 VAL A 48 25.857 -24.802 -12.558 1.00 61.13 H new ATOM 741 N GLN A 49 23.579 -20.960 -15.106 1.00 14.22 N ATOM 742 CA GLN A 49 23.001 -19.630 -15.261 1.00 73.14 C ATOM 743 C GLN A 49 21.564 -19.597 -14.750 1.00 24.44 C ATOM 744 O GLN A 49 20.785 -20.516 -14.999 1.00 11.01 O ATOM 745 CB GLN A 49 23.041 -19.202 -16.729 1.00 44.14 C ATOM 746 CG GLN A 49 22.178 -20.062 -17.638 1.00 62.02 C ATOM 747 CD GLN A 49 22.114 -19.530 -19.056 1.00 72.44 C ATOM 748 OE1 GLN A 49 23.138 -19.390 -19.726 1.00 55.21 O ATOM 749 NE2 GLN A 49 20.907 -19.231 -19.523 1.00 31.54 N ATOM 0 H GLN A 49 23.784 -21.437 -15.984 1.00 14.22 H new ATOM 0 HA GLN A 49 23.594 -18.933 -14.669 1.00 73.14 H new ATOM 0 HB2 GLN A 49 22.713 -18.165 -16.805 1.00 44.14 H new ATOM 0 HB3 GLN A 49 24.072 -19.237 -17.081 1.00 44.14 H new ATOM 0 HG2 GLN A 49 22.573 -21.078 -17.653 1.00 62.02 H new ATOM 0 HG3 GLN A 49 21.169 -20.118 -17.229 1.00 62.02 H new ATOM 0 HE21 GLN A 49 20.085 -19.363 -18.933 1.00 31.54 H new ATOM 0 HE22 GLN A 49 20.802 -18.870 -20.471 1.00 31.54 H new ATOM 758 N GLY A 50 21.221 -18.532 -14.031 1.00 61.35 N ATOM 759 CA GLY A 50 19.879 -18.400 -13.495 1.00 60.24 C ATOM 760 C GLY A 50 19.306 -17.013 -13.703 1.00 54.52 C ATOM 761 O GLY A 50 19.458 -16.138 -12.851 1.00 43.33 O ATOM 0 H GLY A 50 21.849 -17.759 -13.810 1.00 61.35 H new ATOM 0 HA2 GLY A 50 19.228 -19.134 -13.970 1.00 60.24 H new ATOM 0 HA3 GLY A 50 19.893 -18.628 -12.429 1.00 60.24 H new ATOM 765 N GLN A 51 18.646 -16.811 -14.839 1.00 52.42 N ATOM 766 CA GLN A 51 18.050 -15.518 -15.157 1.00 21.24 C ATOM 767 C GLN A 51 17.165 -15.032 -14.014 1.00 55.42 C ATOM 768 O GLN A 51 16.529 -15.830 -13.324 1.00 52.32 O ATOM 769 CB GLN A 51 17.233 -15.612 -16.446 1.00 61.44 C ATOM 770 CG GLN A 51 18.085 -15.747 -17.698 1.00 24.31 C ATOM 771 CD GLN A 51 17.471 -15.056 -18.899 1.00 63.34 C ATOM 772 OE1 GLN A 51 16.721 -14.090 -18.758 1.00 61.12 O ATOM 773 NE2 GLN A 51 17.787 -15.549 -20.091 1.00 43.24 N ATOM 0 H GLN A 51 18.510 -17.525 -15.554 1.00 52.42 H new ATOM 0 HA GLN A 51 18.857 -14.799 -15.299 1.00 21.24 H new ATOM 0 HB2 GLN A 51 16.562 -16.468 -16.379 1.00 61.44 H new ATOM 0 HB3 GLN A 51 16.608 -14.723 -16.536 1.00 61.44 H new ATOM 0 HG2 GLN A 51 19.073 -15.327 -17.508 1.00 24.31 H new ATOM 0 HG3 GLN A 51 18.226 -16.804 -17.925 1.00 24.31 H new ATOM 0 HE21 GLN A 51 18.413 -16.351 -20.161 1.00 43.24 H new ATOM 0 HE22 GLN A 51 17.404 -15.125 -20.936 1.00 43.24 H new ATOM 782 N LEU A 52 17.128 -13.718 -13.819 1.00 74.13 N ATOM 783 CA LEU A 52 16.320 -13.124 -12.760 1.00 33.34 C ATOM 784 C LEU A 52 15.798 -11.753 -13.176 1.00 75.14 C ATOM 785 O LEU A 52 16.526 -10.954 -13.764 1.00 71.11 O ATOM 786 CB LEU A 52 17.140 -13.001 -11.474 1.00 72.32 C ATOM 787 CG LEU A 52 16.373 -12.555 -10.229 1.00 31.11 C ATOM 788 CD1 LEU A 52 15.423 -13.649 -9.766 1.00 62.24 C ATOM 789 CD2 LEU A 52 17.338 -12.178 -9.115 1.00 23.24 C ATOM 0 H LEU A 52 17.648 -13.044 -14.381 1.00 74.13 H new ATOM 0 HA LEU A 52 15.466 -13.777 -12.579 1.00 33.34 H new ATOM 0 HB2 LEU A 52 17.600 -13.967 -11.266 1.00 72.32 H new ATOM 0 HB3 LEU A 52 17.950 -12.294 -11.650 1.00 72.32 H new ATOM 0 HG LEU A 52 15.783 -11.675 -10.485 1.00 31.11 H new ATOM 0 HD11 LEU A 52 14.886 -13.313 -8.879 1.00 62.24 H new ATOM 0 HD12 LEU A 52 14.710 -13.871 -10.560 1.00 62.24 H new ATOM 0 HD13 LEU A 52 15.992 -14.548 -9.527 1.00 62.24 H new ATOM 0 HD21 LEU A 52 16.775 -11.863 -8.237 1.00 23.24 H new ATOM 0 HD22 LEU A 52 17.955 -13.040 -8.861 1.00 23.24 H new ATOM 0 HD23 LEU A 52 17.977 -11.360 -9.448 1.00 23.24 H new ATOM 801 N GLN A 53 14.533 -11.488 -12.866 1.00 13.11 N ATOM 802 CA GLN A 53 13.914 -10.212 -13.207 1.00 62.33 C ATOM 803 C GLN A 53 13.262 -9.579 -11.983 1.00 12.30 C ATOM 804 O GLN A 53 12.246 -10.064 -11.487 1.00 72.25 O ATOM 805 CB GLN A 53 12.874 -10.405 -14.312 1.00 32.31 C ATOM 806 CG GLN A 53 13.356 -11.283 -15.456 1.00 4.43 C ATOM 807 CD GLN A 53 14.490 -10.650 -16.239 1.00 11.45 C ATOM 808 OE1 GLN A 53 15.627 -11.121 -16.198 1.00 53.11 O ATOM 809 NE2 GLN A 53 14.186 -9.575 -16.957 1.00 74.32 N ATOM 0 H GLN A 53 13.917 -12.139 -12.380 1.00 13.11 H new ATOM 0 HA GLN A 53 14.695 -9.542 -13.566 1.00 62.33 H new ATOM 0 HB2 GLN A 53 11.975 -10.846 -13.880 1.00 32.31 H new ATOM 0 HB3 GLN A 53 12.592 -9.429 -14.708 1.00 32.31 H new ATOM 0 HG2 GLN A 53 13.685 -12.243 -15.058 1.00 4.43 H new ATOM 0 HG3 GLN A 53 12.523 -11.486 -16.129 1.00 4.43 H new ATOM 0 HE21 GLN A 53 13.230 -9.219 -16.962 1.00 74.32 H new ATOM 0 HE22 GLN A 53 14.908 -9.106 -17.503 1.00 74.32 H new ATOM 818 N GLY A 54 13.854 -8.491 -11.499 1.00 53.32 N ATOM 819 CA GLY A 54 13.316 -7.809 -10.336 1.00 43.24 C ATOM 820 C GLY A 54 14.076 -6.539 -10.006 1.00 74.14 C ATOM 821 O GLY A 54 15.058 -6.190 -10.661 1.00 40.13 O ATOM 0 H GLY A 54 14.696 -8.070 -11.891 1.00 53.32 H new ATOM 0 HA2 GLY A 54 12.268 -7.566 -10.513 1.00 43.24 H new ATOM 0 HA3 GLY A 54 13.347 -8.481 -9.478 1.00 43.24 H new ATOM 825 N PRO A 55 13.617 -5.823 -8.969 1.00 22.52 N ATOM 826 CA PRO A 55 14.245 -4.573 -8.530 1.00 72.35 C ATOM 827 C PRO A 55 15.612 -4.803 -7.895 1.00 14.35 C ATOM 828 O PRO A 55 15.940 -5.920 -7.493 1.00 42.53 O ATOM 829 CB PRO A 55 13.259 -4.025 -7.496 1.00 32.22 C ATOM 830 CG PRO A 55 12.540 -5.226 -6.984 1.00 50.34 C ATOM 831 CD PRO A 55 12.451 -6.180 -8.143 1.00 42.01 C ATOM 0 HA PRO A 55 14.430 -3.895 -9.363 1.00 72.35 H new ATOM 0 HB2 PRO A 55 13.778 -3.502 -6.693 1.00 32.22 H new ATOM 0 HB3 PRO A 55 12.568 -3.312 -7.947 1.00 32.22 H new ATOM 0 HG2 PRO A 55 13.077 -5.676 -6.149 1.00 50.34 H new ATOM 0 HG3 PRO A 55 11.548 -4.961 -6.620 1.00 50.34 H new ATOM 0 HD2 PRO A 55 12.495 -7.218 -7.813 1.00 42.01 H new ATOM 0 HD3 PRO A 55 11.517 -6.059 -8.692 1.00 42.01 H new ATOM 839 N ILE A 56 16.403 -3.739 -7.805 1.00 64.44 N ATOM 840 CA ILE A 56 17.734 -3.826 -7.217 1.00 10.35 C ATOM 841 C ILE A 56 17.658 -4.177 -5.735 1.00 15.24 C ATOM 842 O ILE A 56 18.624 -4.668 -5.152 1.00 21.21 O ATOM 843 CB ILE A 56 18.509 -2.505 -7.380 1.00 52.23 C ATOM 844 CG1 ILE A 56 19.963 -2.684 -6.940 1.00 44.44 C ATOM 845 CG2 ILE A 56 17.840 -1.396 -6.581 1.00 65.11 C ATOM 846 CD1 ILE A 56 20.868 -1.550 -7.370 1.00 62.11 C ATOM 0 H ILE A 56 16.146 -2.808 -8.131 1.00 64.44 H new ATOM 0 HA ILE A 56 18.263 -4.617 -7.749 1.00 10.35 H new ATOM 0 HB ILE A 56 18.500 -2.223 -8.433 1.00 52.23 H new ATOM 0 HG12 ILE A 56 19.997 -2.774 -5.854 1.00 44.44 H new ATOM 0 HG13 ILE A 56 20.346 -3.619 -7.349 1.00 44.44 H new ATOM 0 HG21 ILE A 56 18.399 -0.469 -6.706 1.00 65.11 H new ATOM 0 HG22 ILE A 56 16.820 -1.255 -6.938 1.00 65.11 H new ATOM 0 HG23 ILE A 56 17.821 -1.668 -5.526 1.00 65.11 H new ATOM 0 HD11 ILE A 56 21.883 -1.744 -7.024 1.00 62.11 H new ATOM 0 HD12 ILE A 56 20.864 -1.473 -8.457 1.00 62.11 H new ATOM 0 HD13 ILE A 56 20.510 -0.615 -6.939 1.00 62.11 H new ATOM 858 N SER A 57 16.501 -3.923 -5.131 1.00 10.13 N ATOM 859 CA SER A 57 16.298 -4.210 -3.716 1.00 22.34 C ATOM 860 C SER A 57 16.085 -5.704 -3.490 1.00 13.13 C ATOM 861 O SER A 57 16.320 -6.219 -2.396 1.00 52.33 O ATOM 862 CB SER A 57 15.099 -3.426 -3.181 1.00 13.51 C ATOM 863 OG SER A 57 13.903 -3.811 -3.837 1.00 24.41 O ATOM 0 H SER A 57 15.690 -3.519 -5.600 1.00 10.13 H new ATOM 0 HA SER A 57 17.194 -3.902 -3.176 1.00 22.34 H new ATOM 0 HB2 SER A 57 15.000 -3.595 -2.109 1.00 13.51 H new ATOM 0 HB3 SER A 57 15.267 -2.358 -3.322 1.00 13.51 H new ATOM 0 HG SER A 57 13.218 -3.124 -3.698 1.00 24.41 H new ATOM 869 N LYS A 58 15.637 -6.395 -4.532 1.00 62.43 N ATOM 870 CA LYS A 58 15.392 -7.830 -4.451 1.00 62.41 C ATOM 871 C LYS A 58 16.522 -8.614 -5.113 1.00 14.42 C ATOM 872 O LYS A 58 16.888 -9.698 -4.659 1.00 10.44 O ATOM 873 CB LYS A 58 14.058 -8.179 -5.115 1.00 62.32 C ATOM 874 CG LYS A 58 12.868 -8.083 -4.177 1.00 10.44 C ATOM 875 CD LYS A 58 12.762 -6.702 -3.550 1.00 63.33 C ATOM 876 CE LYS A 58 11.312 -6.295 -3.340 1.00 50.03 C ATOM 877 NZ LYS A 58 11.165 -4.820 -3.200 1.00 52.34 N ATOM 0 H LYS A 58 15.436 -5.984 -5.444 1.00 62.43 H new ATOM 0 HA LYS A 58 15.350 -8.107 -3.398 1.00 62.41 H new ATOM 0 HB2 LYS A 58 13.897 -7.511 -5.961 1.00 62.32 H new ATOM 0 HB3 LYS A 58 14.114 -9.192 -5.514 1.00 62.32 H new ATOM 0 HG2 LYS A 58 11.953 -8.306 -4.725 1.00 10.44 H new ATOM 0 HG3 LYS A 58 12.961 -8.834 -3.392 1.00 10.44 H new ATOM 0 HD2 LYS A 58 13.285 -6.694 -2.594 1.00 63.33 H new ATOM 0 HD3 LYS A 58 13.257 -5.972 -4.190 1.00 63.33 H new ATOM 0 HE2 LYS A 58 10.712 -6.642 -4.181 1.00 50.03 H new ATOM 0 HE3 LYS A 58 10.923 -6.785 -2.448 1.00 50.03 H new ATOM 0 HZ1 LYS A 58 10.341 -4.608 -2.602 1.00 52.34 H new ATOM 0 HZ2 LYS A 58 12.022 -4.426 -2.761 1.00 52.34 H new ATOM 0 HZ3 LYS A 58 11.030 -4.394 -4.139 1.00 52.34 H new ATOM 891 N VAL A 59 17.071 -8.057 -6.188 1.00 20.03 N ATOM 892 CA VAL A 59 18.161 -8.702 -6.910 1.00 72.22 C ATOM 893 C VAL A 59 19.422 -8.770 -6.056 1.00 71.13 C ATOM 894 O VAL A 59 20.281 -9.627 -6.266 1.00 54.13 O ATOM 895 CB VAL A 59 18.481 -7.961 -8.222 1.00 3.34 C ATOM 896 CG1 VAL A 59 19.660 -8.612 -8.929 1.00 0.30 C ATOM 897 CG2 VAL A 59 17.259 -7.926 -9.126 1.00 73.42 C ATOM 0 H VAL A 59 16.779 -7.161 -6.578 1.00 20.03 H new ATOM 0 HA VAL A 59 17.830 -9.714 -7.145 1.00 72.22 H new ATOM 0 HB VAL A 59 18.755 -6.934 -7.981 1.00 3.34 H new ATOM 0 HG11 VAL A 59 19.871 -8.075 -9.854 1.00 0.30 H new ATOM 0 HG12 VAL A 59 20.536 -8.579 -8.281 1.00 0.30 H new ATOM 0 HG13 VAL A 59 19.418 -9.650 -9.159 1.00 0.30 H new ATOM 0 HG21 VAL A 59 17.504 -7.399 -10.048 1.00 73.42 H new ATOM 0 HG22 VAL A 59 16.951 -8.945 -9.361 1.00 73.42 H new ATOM 0 HG23 VAL A 59 16.445 -7.409 -8.618 1.00 73.42 H new ATOM 907 N ARG A 60 19.527 -7.862 -5.092 1.00 54.40 N ATOM 908 CA ARG A 60 20.684 -7.818 -4.206 1.00 14.30 C ATOM 909 C ARG A 60 20.603 -8.918 -3.152 1.00 11.35 C ATOM 910 O ARG A 60 21.623 -9.367 -2.629 1.00 22.23 O ATOM 911 CB ARG A 60 20.780 -6.451 -3.526 1.00 45.20 C ATOM 912 CG ARG A 60 22.183 -6.103 -3.055 1.00 30.14 C ATOM 913 CD ARG A 60 22.939 -5.299 -4.101 1.00 0.04 C ATOM 914 NE ARG A 60 22.657 -3.869 -4.001 1.00 24.40 N ATOM 915 CZ ARG A 60 23.366 -2.935 -4.625 1.00 64.52 C ATOM 916 NH1 ARG A 60 24.393 -3.279 -5.390 1.00 42.24 N ATOM 917 NH2 ARG A 60 23.048 -1.655 -4.485 1.00 42.11 N ATOM 0 H ARG A 60 18.825 -7.146 -4.904 1.00 54.40 H new ATOM 0 HA ARG A 60 21.578 -7.980 -4.808 1.00 14.30 H new ATOM 0 HB2 ARG A 60 20.438 -5.684 -4.221 1.00 45.20 H new ATOM 0 HB3 ARG A 60 20.103 -6.431 -2.672 1.00 45.20 H new ATOM 0 HG2 ARG A 60 22.126 -5.533 -2.128 1.00 30.14 H new ATOM 0 HG3 ARG A 60 22.731 -7.019 -2.833 1.00 30.14 H new ATOM 0 HD2 ARG A 60 24.010 -5.467 -3.983 1.00 0.04 H new ATOM 0 HD3 ARG A 60 22.669 -5.653 -5.096 1.00 0.04 H new ATOM 0 HE ARG A 60 21.873 -3.572 -3.420 1.00 24.40 H new ATOM 0 HH11 ARG A 60 24.640 -4.263 -5.500 1.00 42.24 H new ATOM 0 HH12 ARG A 60 24.936 -2.560 -5.868 1.00 42.24 H new ATOM 0 HH21 ARG A 60 22.258 -1.387 -3.898 1.00 42.11 H new ATOM 0 HH22 ARG A 60 23.593 -0.939 -4.965 1.00 42.11 H new ATOM 931 N HIS A 61 19.383 -9.347 -2.843 1.00 50.53 N ATOM 932 CA HIS A 61 19.169 -10.394 -1.851 1.00 72.01 C ATOM 933 C HIS A 61 19.550 -11.760 -2.413 1.00 24.44 C ATOM 934 O HIS A 61 20.439 -12.431 -1.888 1.00 35.50 O ATOM 935 CB HIS A 61 17.709 -10.406 -1.398 1.00 13.43 C ATOM 936 CG HIS A 61 17.349 -9.256 -0.508 1.00 14.20 C ATOM 937 ND1 HIS A 61 17.998 -8.040 -0.550 1.00 15.12 N ATOM 938 CD2 HIS A 61 16.399 -9.141 0.450 1.00 23.31 C ATOM 939 CE1 HIS A 61 17.464 -7.228 0.345 1.00 1.32 C ATOM 940 NE2 HIS A 61 16.492 -7.872 0.965 1.00 12.32 N ATOM 0 H HIS A 61 18.528 -8.985 -3.266 1.00 50.53 H new ATOM 0 HA HIS A 61 19.806 -10.183 -0.992 1.00 72.01 H new ATOM 0 HB2 HIS A 61 17.064 -10.390 -2.277 1.00 13.43 H new ATOM 0 HB3 HIS A 61 17.508 -11.339 -0.872 1.00 13.43 H new ATOM 0 HD2 HIS A 61 15.699 -9.905 0.753 1.00 23.31 H new ATOM 0 HE1 HIS A 61 17.770 -6.210 0.537 1.00 1.32 H new ATOM 0 HE2 HIS A 61 15.906 -7.489 1.706 1.00 12.32 H new ATOM 948 N MET A 62 18.872 -12.166 -3.481 1.00 44.24 N ATOM 949 CA MET A 62 19.141 -13.452 -4.114 1.00 23.13 C ATOM 950 C MET A 62 20.627 -13.607 -4.421 1.00 44.21 C ATOM 951 O MET A 62 21.235 -14.626 -4.093 1.00 53.42 O ATOM 952 CB MET A 62 18.325 -13.593 -5.400 1.00 41.30 C ATOM 953 CG MET A 62 17.417 -14.812 -5.414 1.00 2.25 C ATOM 954 SD MET A 62 18.336 -16.362 -5.361 1.00 33.52 S ATOM 955 CE MET A 62 17.594 -17.147 -3.931 1.00 41.25 C ATOM 0 H MET A 62 18.132 -11.623 -3.926 1.00 44.24 H new ATOM 0 HA MET A 62 18.848 -14.239 -3.419 1.00 23.13 H new ATOM 0 HB2 MET A 62 17.719 -12.697 -5.536 1.00 41.30 H new ATOM 0 HB3 MET A 62 19.007 -13.648 -6.249 1.00 41.30 H new ATOM 0 HG2 MET A 62 16.740 -14.766 -4.561 1.00 2.25 H new ATOM 0 HG3 MET A 62 16.800 -14.790 -6.312 1.00 2.25 H new ATOM 0 HE1 MET A 62 18.375 -17.430 -3.225 1.00 41.25 H new ATOM 0 HE2 MET A 62 16.905 -16.452 -3.451 1.00 41.25 H new ATOM 0 HE3 MET A 62 17.050 -18.038 -4.246 1.00 41.25 H new ATOM 965 N GLN A 63 21.206 -12.590 -5.052 1.00 55.12 N ATOM 966 CA GLN A 63 22.620 -12.615 -5.404 1.00 43.01 C ATOM 967 C GLN A 63 23.489 -12.740 -4.157 1.00 3.40 C ATOM 968 O GLN A 63 24.608 -13.249 -4.217 1.00 52.05 O ATOM 969 CB GLN A 63 22.997 -11.351 -6.179 1.00 3.14 C ATOM 970 CG GLN A 63 23.082 -10.107 -5.309 1.00 23.12 C ATOM 971 CD GLN A 63 23.515 -8.880 -6.086 1.00 41.32 C ATOM 972 OE1 GLN A 63 22.784 -8.384 -6.944 1.00 33.11 O ATOM 973 NE2 GLN A 63 24.710 -8.382 -5.790 1.00 11.32 N ATOM 0 H GLN A 63 20.717 -11.739 -5.330 1.00 55.12 H new ATOM 0 HA GLN A 63 22.796 -13.486 -6.036 1.00 43.01 H new ATOM 0 HB2 GLN A 63 23.958 -11.508 -6.669 1.00 3.14 H new ATOM 0 HB3 GLN A 63 22.262 -11.184 -6.966 1.00 3.14 H new ATOM 0 HG2 GLN A 63 22.110 -9.920 -4.854 1.00 23.12 H new ATOM 0 HG3 GLN A 63 23.786 -10.284 -4.496 1.00 23.12 H new ATOM 0 HE21 GLN A 63 25.283 -8.825 -5.072 1.00 11.32 H new ATOM 0 HE22 GLN A 63 25.055 -7.557 -6.281 1.00 11.32 H new ATOM 982 N GLU A 64 22.967 -12.271 -3.028 1.00 52.52 N ATOM 983 CA GLU A 64 23.697 -12.329 -1.767 1.00 73.02 C ATOM 984 C GLU A 64 23.230 -13.511 -0.923 1.00 20.33 C ATOM 985 O GLU A 64 23.296 -13.474 0.306 1.00 54.00 O ATOM 986 CB GLU A 64 23.514 -11.026 -0.986 1.00 21.33 C ATOM 987 CG GLU A 64 24.319 -9.864 -1.543 1.00 73.21 C ATOM 988 CD GLU A 64 25.791 -10.194 -1.697 1.00 74.53 C ATOM 989 OE1 GLU A 64 26.373 -10.764 -0.750 1.00 55.12 O ATOM 990 OE2 GLU A 64 26.360 -9.884 -2.764 1.00 4.20 O ATOM 0 H GLU A 64 22.042 -11.847 -2.961 1.00 52.52 H new ATOM 0 HA GLU A 64 24.755 -12.462 -1.994 1.00 73.02 H new ATOM 0 HB2 GLU A 64 22.457 -10.758 -0.986 1.00 21.33 H new ATOM 0 HB3 GLU A 64 23.801 -11.191 0.052 1.00 21.33 H new ATOM 0 HG2 GLU A 64 23.912 -9.576 -2.512 1.00 73.21 H new ATOM 0 HG3 GLU A 64 24.211 -9.003 -0.884 1.00 73.21 H new ATOM 997 N TRP A 65 22.759 -14.558 -1.591 1.00 11.14 N ATOM 998 CA TRP A 65 22.280 -15.751 -0.902 1.00 63.41 C ATOM 999 C TRP A 65 22.841 -17.014 -1.547 1.00 44.22 C ATOM 1000 O TRP A 65 23.236 -17.953 -0.856 1.00 25.45 O ATOM 1001 CB TRP A 65 20.751 -15.794 -0.914 1.00 44.25 C ATOM 1002 CG TRP A 65 20.182 -16.915 -0.100 1.00 33.25 C ATOM 1003 CD1 TRP A 65 20.121 -18.234 -0.449 1.00 43.01 C ATOM 1004 CD2 TRP A 65 19.590 -16.815 1.201 1.00 63.24 C ATOM 1005 NE1 TRP A 65 19.528 -18.960 0.555 1.00 0.14 N ATOM 1006 CE2 TRP A 65 19.194 -18.113 1.579 1.00 50.02 C ATOM 1007 CE3 TRP A 65 19.359 -15.756 2.083 1.00 70.52 C ATOM 1008 CZ2 TRP A 65 18.579 -18.377 2.800 1.00 50.13 C ATOM 1009 CZ3 TRP A 65 18.748 -16.020 3.294 1.00 62.10 C ATOM 1010 CH2 TRP A 65 18.365 -17.322 3.644 1.00 54.50 C ATOM 0 H TRP A 65 22.699 -14.605 -2.608 1.00 11.14 H new ATOM 0 HA TRP A 65 22.627 -15.707 0.130 1.00 63.41 H new ATOM 0 HB2 TRP A 65 20.365 -14.847 -0.535 1.00 44.25 H new ATOM 0 HB3 TRP A 65 20.405 -15.890 -1.943 1.00 44.25 H new ATOM 0 HD1 TRP A 65 20.486 -18.646 -1.378 1.00 43.01 H new ATOM 0 HE1 TRP A 65 19.363 -19.966 0.541 1.00 0.14 H new ATOM 0 HE3 TRP A 65 19.653 -14.750 1.823 1.00 70.52 H new ATOM 0 HZ2 TRP A 65 18.281 -19.379 3.071 1.00 50.13 H new ATOM 0 HZ3 TRP A 65 18.562 -15.209 3.983 1.00 62.10 H new ATOM 0 HH2 TRP A 65 17.892 -17.496 4.599 1.00 54.50 H new ATOM 1021 N LEU A 66 22.874 -17.030 -2.875 1.00 43.10 N ATOM 1022 CA LEU A 66 23.388 -18.178 -3.614 1.00 30.22 C ATOM 1023 C LEU A 66 24.907 -18.263 -3.501 1.00 33.45 C ATOM 1024 O LEU A 66 25.485 -19.345 -3.595 1.00 25.12 O ATOM 1025 CB LEU A 66 22.979 -18.087 -5.085 1.00 62.50 C ATOM 1026 CG LEU A 66 21.478 -18.150 -5.370 1.00 1.44 C ATOM 1027 CD1 LEU A 66 21.179 -17.643 -6.772 1.00 2.31 C ATOM 1028 CD2 LEU A 66 20.960 -19.569 -5.192 1.00 31.31 C ATOM 0 H LEU A 66 22.551 -16.261 -3.462 1.00 43.10 H new ATOM 0 HA LEU A 66 22.959 -19.081 -3.179 1.00 30.22 H new ATOM 0 HB2 LEU A 66 23.367 -17.153 -5.492 1.00 62.50 H new ATOM 0 HB3 LEU A 66 23.466 -18.898 -5.627 1.00 62.50 H new ATOM 0 HG LEU A 66 20.965 -17.506 -4.656 1.00 1.44 H new ATOM 0 HD11 LEU A 66 20.106 -17.695 -6.957 1.00 2.31 H new ATOM 0 HD12 LEU A 66 21.513 -16.610 -6.864 1.00 2.31 H new ATOM 0 HD13 LEU A 66 21.703 -18.260 -7.502 1.00 2.31 H new ATOM 0 HD21 LEU A 66 19.890 -19.594 -5.399 1.00 31.31 H new ATOM 0 HD22 LEU A 66 21.479 -20.235 -5.881 1.00 31.31 H new ATOM 0 HD23 LEU A 66 21.139 -19.896 -4.168 1.00 31.31 H new ATOM 1040 N GLU A 67 25.545 -17.115 -3.296 1.00 21.42 N ATOM 1041 CA GLU A 67 26.997 -17.062 -3.168 1.00 53.42 C ATOM 1042 C GLU A 67 27.424 -17.271 -1.718 1.00 74.22 C ATOM 1043 O GLU A 67 28.480 -17.843 -1.446 1.00 12.24 O ATOM 1044 CB GLU A 67 27.526 -15.720 -3.678 1.00 44.14 C ATOM 1045 CG GLU A 67 27.195 -14.549 -2.768 1.00 42.05 C ATOM 1046 CD GLU A 67 27.698 -13.226 -3.313 1.00 72.24 C ATOM 1047 OE1 GLU A 67 28.014 -13.163 -4.520 1.00 3.44 O ATOM 1048 OE2 GLU A 67 27.774 -12.254 -2.533 1.00 23.32 O ATOM 0 H GLU A 67 25.080 -16.211 -3.215 1.00 21.42 H new ATOM 0 HA GLU A 67 27.419 -17.865 -3.772 1.00 53.42 H new ATOM 0 HB2 GLU A 67 28.608 -15.786 -3.793 1.00 44.14 H new ATOM 0 HB3 GLU A 67 27.112 -15.528 -4.668 1.00 44.14 H new ATOM 0 HG2 GLU A 67 26.115 -14.494 -2.631 1.00 42.05 H new ATOM 0 HG3 GLU A 67 27.633 -14.723 -1.785 1.00 42.05 H new ATOM 1055 N THR A 68 26.595 -16.804 -0.790 1.00 14.41 N ATOM 1056 CA THR A 68 26.886 -16.937 0.632 1.00 74.41 C ATOM 1057 C THR A 68 26.570 -18.344 1.128 1.00 52.22 C ATOM 1058 O THR A 68 27.474 -19.135 1.397 1.00 51.05 O ATOM 1059 CB THR A 68 26.086 -15.919 1.467 1.00 24.31 C ATOM 1060 OG1 THR A 68 24.709 -15.937 1.075 1.00 64.23 O ATOM 1061 CG2 THR A 68 26.650 -14.517 1.295 1.00 51.23 C ATOM 0 H THR A 68 25.716 -16.330 -0.998 1.00 14.41 H new ATOM 0 HA THR A 68 27.951 -16.741 0.757 1.00 74.41 H new ATOM 0 HB THR A 68 26.167 -16.200 2.517 1.00 24.31 H new ATOM 0 HG1 THR A 68 24.410 -15.022 0.889 1.00 64.23 H new ATOM 0 HG21 THR A 68 26.069 -13.815 1.894 1.00 51.23 H new ATOM 0 HG22 THR A 68 27.689 -14.500 1.623 1.00 51.23 H new ATOM 0 HG23 THR A 68 26.596 -14.229 0.245 1.00 51.23 H new ATOM 1069 N ARG A 69 25.282 -18.649 1.246 1.00 32.14 N ATOM 1070 CA ARG A 69 24.847 -19.961 1.711 1.00 62.03 C ATOM 1071 C ARG A 69 25.488 -21.071 0.882 1.00 11.32 C ATOM 1072 O ARG A 69 25.354 -21.103 -0.340 1.00 44.43 O ATOM 1073 CB ARG A 69 23.323 -20.072 1.639 1.00 1.22 C ATOM 1074 CG ARG A 69 22.609 -19.414 2.809 1.00 41.34 C ATOM 1075 CD ARG A 69 22.094 -20.446 3.799 1.00 74.11 C ATOM 1076 NE ARG A 69 21.680 -19.836 5.060 1.00 25.41 N ATOM 1077 CZ ARG A 69 22.533 -19.346 5.953 1.00 32.33 C ATOM 1078 NH1 ARG A 69 23.838 -19.394 5.725 1.00 51.32 N ATOM 1079 NH2 ARG A 69 22.080 -18.807 7.078 1.00 51.22 N ATOM 0 H ARG A 69 24.521 -18.006 1.026 1.00 32.14 H new ATOM 0 HA ARG A 69 25.164 -20.075 2.748 1.00 62.03 H new ATOM 0 HB2 ARG A 69 22.977 -19.617 0.711 1.00 1.22 H new ATOM 0 HB3 ARG A 69 23.045 -21.125 1.600 1.00 1.22 H new ATOM 0 HG2 ARG A 69 23.291 -18.731 3.315 1.00 41.34 H new ATOM 0 HG3 ARG A 69 21.776 -18.816 2.439 1.00 41.34 H new ATOM 0 HD2 ARG A 69 21.251 -20.980 3.361 1.00 74.11 H new ATOM 0 HD3 ARG A 69 22.873 -21.184 3.992 1.00 74.11 H new ATOM 0 HE ARG A 69 20.682 -19.783 5.266 1.00 25.41 H new ATOM 0 HH11 ARG A 69 24.190 -19.808 4.862 1.00 51.32 H new ATOM 0 HH12 ARG A 69 24.490 -19.017 6.413 1.00 51.32 H new ATOM 0 HH21 ARG A 69 21.077 -18.769 7.257 1.00 51.22 H new ATOM 0 HH22 ARG A 69 22.735 -18.431 7.763 1.00 51.22 H new ATOM 1093 N GLY A 70 26.185 -21.980 1.558 1.00 50.53 N ATOM 1094 CA GLY A 70 26.836 -23.078 0.868 1.00 5.31 C ATOM 1095 C GLY A 70 25.989 -24.334 0.848 1.00 74.04 C ATOM 1096 O GLY A 70 26.262 -25.287 1.577 1.00 71.43 O ATOM 0 H GLY A 70 26.310 -21.975 2.570 1.00 50.53 H new ATOM 0 HA2 GLY A 70 27.060 -22.778 -0.156 1.00 5.31 H new ATOM 0 HA3 GLY A 70 27.788 -23.294 1.352 1.00 5.31 H new ATOM 1100 N SER A 71 24.955 -24.335 0.011 1.00 25.33 N ATOM 1101 CA SER A 71 24.061 -25.482 -0.097 1.00 42.01 C ATOM 1102 C SER A 71 24.849 -26.763 -0.356 1.00 10.32 C ATOM 1103 O SER A 71 25.999 -26.737 -0.794 1.00 43.40 O ATOM 1104 CB SER A 71 23.045 -25.259 -1.219 1.00 65.13 C ATOM 1105 OG SER A 71 23.398 -24.138 -2.011 1.00 64.45 O ATOM 0 H SER A 71 24.716 -23.555 -0.601 1.00 25.33 H new ATOM 0 HA SER A 71 23.530 -25.588 0.849 1.00 42.01 H new ATOM 0 HB2 SER A 71 22.990 -26.149 -1.846 1.00 65.13 H new ATOM 0 HB3 SER A 71 22.054 -25.109 -0.792 1.00 65.13 H new ATOM 0 HG SER A 71 22.833 -24.112 -2.811 1.00 64.45 H new ATOM 1111 N PRO A 72 24.216 -27.912 -0.078 1.00 73.13 N ATOM 1112 CA PRO A 72 24.837 -29.225 -0.273 1.00 62.33 C ATOM 1113 C PRO A 72 25.019 -29.568 -1.748 1.00 52.41 C ATOM 1114 O PRO A 72 24.091 -29.432 -2.547 1.00 4.15 O ATOM 1115 CB PRO A 72 23.844 -30.189 0.381 1.00 54.42 C ATOM 1116 CG PRO A 72 22.533 -29.483 0.315 1.00 70.42 C ATOM 1117 CD PRO A 72 22.844 -28.018 0.447 1.00 60.14 C ATOM 0 HA PRO A 72 25.839 -29.268 0.154 1.00 62.33 H new ATOM 0 HB2 PRO A 72 23.808 -31.141 -0.149 1.00 54.42 H new ATOM 0 HB3 PRO A 72 24.125 -30.408 1.411 1.00 54.42 H new ATOM 0 HG2 PRO A 72 22.025 -29.691 -0.627 1.00 70.42 H new ATOM 0 HG3 PRO A 72 21.871 -29.815 1.114 1.00 70.42 H new ATOM 0 HD2 PRO A 72 22.146 -27.406 -0.125 1.00 60.14 H new ATOM 0 HD3 PRO A 72 22.784 -27.686 1.483 1.00 60.14 H new ATOM 1125 N LYS A 73 26.219 -30.012 -2.104 1.00 21.50 N ATOM 1126 CA LYS A 73 26.523 -30.376 -3.483 1.00 31.41 C ATOM 1127 C LYS A 73 26.377 -29.172 -4.408 1.00 60.50 C ATOM 1128 O LYS A 73 26.083 -29.321 -5.594 1.00 65.22 O ATOM 1129 CB LYS A 73 25.601 -31.506 -3.949 1.00 1.32 C ATOM 1130 CG LYS A 73 25.529 -32.672 -2.978 1.00 42.32 C ATOM 1131 CD LYS A 73 24.802 -33.859 -3.586 1.00 64.54 C ATOM 1132 CE LYS A 73 23.306 -33.793 -3.321 1.00 42.20 C ATOM 1133 NZ LYS A 73 22.678 -35.143 -3.344 1.00 1.23 N ATOM 0 H LYS A 73 26.998 -30.129 -1.456 1.00 21.50 H new ATOM 0 HA LYS A 73 27.557 -30.719 -3.523 1.00 31.41 H new ATOM 0 HB2 LYS A 73 24.598 -31.107 -4.099 1.00 1.32 H new ATOM 0 HB3 LYS A 73 25.947 -31.870 -4.916 1.00 1.32 H new ATOM 0 HG2 LYS A 73 26.537 -32.970 -2.690 1.00 42.32 H new ATOM 0 HG3 LYS A 73 25.018 -32.358 -2.068 1.00 42.32 H new ATOM 0 HD2 LYS A 73 24.981 -33.885 -4.661 1.00 64.54 H new ATOM 0 HD3 LYS A 73 25.205 -34.784 -3.173 1.00 64.54 H new ATOM 0 HE2 LYS A 73 23.129 -33.327 -2.352 1.00 42.20 H new ATOM 0 HE3 LYS A 73 22.832 -33.159 -4.071 1.00 42.20 H new ATOM 0 HZ1 LYS A 73 21.658 -35.055 -3.159 1.00 1.23 H new ATOM 0 HZ2 LYS A 73 22.824 -35.578 -4.277 1.00 1.23 H new ATOM 0 HZ3 LYS A 73 23.112 -35.740 -2.612 1.00 1.23 H new ATOM 1147 N SER A 74 26.585 -27.980 -3.858 1.00 64.50 N ATOM 1148 CA SER A 74 26.475 -26.751 -4.634 1.00 12.31 C ATOM 1149 C SER A 74 27.604 -25.785 -4.286 1.00 34.33 C ATOM 1150 O SER A 74 27.384 -24.583 -4.135 1.00 74.01 O ATOM 1151 CB SER A 74 25.121 -26.083 -4.381 1.00 65.32 C ATOM 1152 OG SER A 74 24.131 -27.044 -4.058 1.00 24.22 O ATOM 0 H SER A 74 26.831 -27.840 -2.878 1.00 64.50 H new ATOM 0 HA SER A 74 26.554 -27.009 -5.690 1.00 12.31 H new ATOM 0 HB2 SER A 74 25.213 -25.364 -3.567 1.00 65.32 H new ATOM 0 HB3 SER A 74 24.816 -25.525 -5.266 1.00 65.32 H new ATOM 0 HG SER A 74 23.251 -26.714 -4.336 1.00 24.22 H new ATOM 1158 N HIS A 75 28.814 -26.321 -4.159 1.00 53.30 N ATOM 1159 CA HIS A 75 29.979 -25.507 -3.829 1.00 32.40 C ATOM 1160 C HIS A 75 30.151 -24.372 -4.833 1.00 52.14 C ATOM 1161 O HIS A 75 30.392 -24.609 -6.017 1.00 63.23 O ATOM 1162 CB HIS A 75 31.239 -26.373 -3.799 1.00 0.41 C ATOM 1163 CG HIS A 75 32.448 -25.653 -3.286 1.00 12.54 C ATOM 1164 ND1 HIS A 75 32.374 -24.561 -2.446 1.00 33.54 N ATOM 1165 CD2 HIS A 75 33.766 -25.874 -3.497 1.00 23.14 C ATOM 1166 CE1 HIS A 75 33.594 -24.142 -2.164 1.00 22.04 C ATOM 1167 NE2 HIS A 75 34.458 -24.922 -2.789 1.00 13.04 N ATOM 0 H HIS A 75 29.013 -27.314 -4.279 1.00 53.30 H new ATOM 0 HA HIS A 75 29.821 -25.073 -2.842 1.00 32.40 H new ATOM 0 HB2 HIS A 75 31.054 -27.247 -3.174 1.00 0.41 H new ATOM 0 HB3 HIS A 75 31.443 -26.738 -4.806 1.00 0.41 H new ATOM 0 HD2 HIS A 75 34.194 -26.654 -4.109 1.00 23.14 H new ATOM 0 HE1 HIS A 75 33.843 -23.304 -1.530 1.00 22.04 H new ATOM 0 HE2 HIS A 75 35.473 -24.832 -2.752 1.00 13.04 H new ATOM 1175 N ILE A 76 30.024 -23.140 -4.353 1.00 42.51 N ATOM 1176 CA ILE A 76 30.166 -21.968 -5.209 1.00 61.31 C ATOM 1177 C ILE A 76 31.628 -21.722 -5.566 1.00 1.13 C ATOM 1178 O ILE A 76 32.292 -20.880 -4.960 1.00 70.15 O ATOM 1179 CB ILE A 76 29.594 -20.707 -4.536 1.00 52.44 C ATOM 1180 CG1 ILE A 76 28.118 -20.912 -4.191 1.00 15.45 C ATOM 1181 CG2 ILE A 76 29.768 -19.498 -5.443 1.00 41.52 C ATOM 1182 CD1 ILE A 76 27.878 -21.241 -2.734 1.00 2.24 C ATOM 0 H ILE A 76 29.823 -22.927 -3.376 1.00 42.51 H new ATOM 0 HA ILE A 76 29.602 -22.172 -6.119 1.00 61.31 H new ATOM 0 HB ILE A 76 30.142 -20.526 -3.612 1.00 52.44 H new ATOM 0 HG12 ILE A 76 27.565 -20.009 -4.447 1.00 15.45 H new ATOM 0 HG13 ILE A 76 27.717 -21.717 -4.808 1.00 15.45 H new ATOM 0 HG21 ILE A 76 29.359 -18.614 -4.954 1.00 41.52 H new ATOM 0 HG22 ILE A 76 30.828 -19.343 -5.644 1.00 41.52 H new ATOM 0 HG23 ILE A 76 29.242 -19.669 -6.382 1.00 41.52 H new ATOM 0 HD11 ILE A 76 26.810 -21.373 -2.562 1.00 2.24 H new ATOM 0 HD12 ILE A 76 28.403 -22.161 -2.477 1.00 2.24 H new ATOM 0 HD13 ILE A 76 28.248 -20.426 -2.111 1.00 2.24 H new ATOM 1194 N ASP A 77 32.123 -22.460 -6.553 1.00 30.42 N ATOM 1195 CA ASP A 77 33.506 -22.320 -6.993 1.00 62.40 C ATOM 1196 C ASP A 77 33.729 -20.969 -7.665 1.00 34.01 C ATOM 1197 O ASP A 77 34.843 -20.445 -7.677 1.00 14.03 O ATOM 1198 CB ASP A 77 33.874 -23.450 -7.957 1.00 11.23 C ATOM 1199 CG ASP A 77 35.370 -23.682 -8.033 1.00 2.13 C ATOM 1200 OD1 ASP A 77 36.115 -22.994 -7.304 1.00 45.51 O ATOM 1201 OD2 ASP A 77 35.796 -24.552 -8.820 1.00 32.50 O ATOM 0 H ASP A 77 31.587 -23.162 -7.064 1.00 30.42 H new ATOM 0 HA ASP A 77 34.148 -22.379 -6.114 1.00 62.40 H new ATOM 0 HB2 ASP A 77 33.382 -24.369 -7.639 1.00 11.23 H new ATOM 0 HB3 ASP A 77 33.495 -23.213 -8.951 1.00 11.23 H new ATOM 1206 N LYS A 78 32.661 -20.410 -8.225 1.00 3.21 N ATOM 1207 CA LYS A 78 32.738 -19.119 -8.899 1.00 62.33 C ATOM 1208 C LYS A 78 31.354 -18.495 -9.038 1.00 54.41 C ATOM 1209 O LYS A 78 30.454 -19.083 -9.638 1.00 4.31 O ATOM 1210 CB LYS A 78 33.378 -19.280 -10.280 1.00 52.33 C ATOM 1211 CG LYS A 78 34.162 -18.060 -10.733 1.00 32.11 C ATOM 1212 CD LYS A 78 33.253 -17.009 -11.348 1.00 73.40 C ATOM 1213 CE LYS A 78 33.007 -17.281 -12.824 1.00 52.43 C ATOM 1214 NZ LYS A 78 32.147 -16.235 -13.445 1.00 3.43 N ATOM 0 H LYS A 78 31.732 -20.831 -8.225 1.00 3.21 H new ATOM 0 HA LYS A 78 33.356 -18.457 -8.293 1.00 62.33 H new ATOM 0 HB2 LYS A 78 34.043 -20.144 -10.265 1.00 52.33 H new ATOM 0 HB3 LYS A 78 32.597 -19.492 -11.011 1.00 52.33 H new ATOM 0 HG2 LYS A 78 34.692 -17.631 -9.883 1.00 32.11 H new ATOM 0 HG3 LYS A 78 34.916 -18.361 -11.460 1.00 32.11 H new ATOM 0 HD2 LYS A 78 32.302 -16.993 -10.816 1.00 73.40 H new ATOM 0 HD3 LYS A 78 33.702 -16.023 -11.228 1.00 73.40 H new ATOM 0 HE2 LYS A 78 33.961 -17.325 -13.349 1.00 52.43 H new ATOM 0 HE3 LYS A 78 32.534 -18.256 -12.940 1.00 52.43 H new ATOM 0 HZ1 LYS A 78 32.003 -16.456 -14.451 1.00 3.43 H new ATOM 0 HZ2 LYS A 78 31.227 -16.209 -12.961 1.00 3.43 H new ATOM 0 HZ3 LYS A 78 32.610 -15.308 -13.357 1.00 3.43 H new ATOM 1228 N ALA A 79 31.190 -17.299 -8.481 1.00 23.11 N ATOM 1229 CA ALA A 79 29.916 -16.594 -8.546 1.00 5.40 C ATOM 1230 C ALA A 79 30.087 -15.207 -9.157 1.00 65.01 C ATOM 1231 O ALA A 79 31.070 -14.517 -8.888 1.00 72.04 O ATOM 1232 CB ALA A 79 29.300 -16.489 -7.159 1.00 13.20 C ATOM 0 H ALA A 79 31.924 -16.798 -7.980 1.00 23.11 H new ATOM 0 HA ALA A 79 29.245 -17.165 -9.188 1.00 5.40 H new ATOM 0 HB1 ALA A 79 28.349 -15.960 -7.222 1.00 13.20 H new ATOM 0 HB2 ALA A 79 29.133 -17.489 -6.758 1.00 13.20 H new ATOM 0 HB3 ALA A 79 29.976 -15.943 -6.501 1.00 13.20 H new ATOM 1238 N ASN A 80 29.125 -14.806 -9.981 1.00 52.30 N ATOM 1239 CA ASN A 80 29.170 -13.501 -10.632 1.00 22.24 C ATOM 1240 C ASN A 80 27.892 -13.244 -11.424 1.00 0.21 C ATOM 1241 O ASN A 80 27.169 -14.176 -11.777 1.00 2.22 O ATOM 1242 CB ASN A 80 30.385 -13.412 -11.558 1.00 75.11 C ATOM 1243 CG ASN A 80 30.868 -11.987 -11.743 1.00 14.54 C ATOM 1244 OD1 ASN A 80 30.685 -11.390 -12.804 1.00 24.00 O ATOM 1245 ND2 ASN A 80 31.488 -11.433 -10.707 1.00 32.53 N ATOM 0 H ASN A 80 28.305 -15.365 -10.214 1.00 52.30 H new ATOM 0 HA ASN A 80 29.255 -12.739 -9.858 1.00 22.24 H new ATOM 0 HB2 ASN A 80 31.195 -14.017 -11.150 1.00 75.11 H new ATOM 0 HB3 ASN A 80 30.130 -13.835 -12.530 1.00 75.11 H new ATOM 0 HD21 ASN A 80 31.834 -10.476 -10.772 1.00 32.53 H new ATOM 0 HD22 ASN A 80 31.618 -11.965 -9.846 1.00 32.53 H new ATOM 1252 N PHE A 81 27.620 -11.973 -11.701 1.00 11.25 N ATOM 1253 CA PHE A 81 26.429 -11.592 -12.451 1.00 11.21 C ATOM 1254 C PHE A 81 26.804 -10.801 -13.701 1.00 75.21 C ATOM 1255 O PHE A 81 27.889 -10.228 -13.784 1.00 13.35 O ATOM 1256 CB PHE A 81 25.490 -10.763 -11.572 1.00 31.10 C ATOM 1257 CG PHE A 81 26.189 -9.675 -10.808 1.00 54.21 C ATOM 1258 CD1 PHE A 81 26.719 -8.578 -11.468 1.00 23.11 C ATOM 1259 CD2 PHE A 81 26.315 -9.749 -9.430 1.00 41.23 C ATOM 1260 CE1 PHE A 81 27.363 -7.575 -10.768 1.00 14.40 C ATOM 1261 CE2 PHE A 81 26.957 -8.748 -8.725 1.00 71.41 C ATOM 1262 CZ PHE A 81 27.482 -7.661 -9.395 1.00 3.42 C ATOM 0 H PHE A 81 28.208 -11.190 -11.417 1.00 11.25 H new ATOM 0 HA PHE A 81 25.917 -12.504 -12.759 1.00 11.21 H new ATOM 0 HB2 PHE A 81 24.718 -10.317 -12.199 1.00 31.10 H new ATOM 0 HB3 PHE A 81 24.986 -11.425 -10.867 1.00 31.10 H new ATOM 0 HD1 PHE A 81 26.628 -8.506 -12.542 1.00 23.11 H new ATOM 0 HD2 PHE A 81 25.907 -10.598 -8.901 1.00 41.23 H new ATOM 0 HE1 PHE A 81 27.772 -6.725 -11.294 1.00 14.40 H new ATOM 0 HE2 PHE A 81 27.048 -8.816 -7.651 1.00 71.41 H new ATOM 0 HZ PHE A 81 27.985 -6.879 -8.846 1.00 3.42 H new ATOM 1272 N ASN A 82 25.897 -10.777 -14.672 1.00 54.33 N ATOM 1273 CA ASN A 82 26.131 -10.058 -15.919 1.00 44.14 C ATOM 1274 C ASN A 82 25.853 -8.568 -15.749 1.00 55.40 C ATOM 1275 O ASN A 82 25.430 -8.123 -14.683 1.00 11.13 O ATOM 1276 CB ASN A 82 25.253 -10.628 -17.034 1.00 74.44 C ATOM 1277 CG ASN A 82 25.890 -10.487 -18.403 1.00 4.21 C ATOM 1278 OD1 ASN A 82 26.909 -11.114 -18.693 1.00 71.52 O ATOM 1279 ND2 ASN A 82 25.292 -9.659 -19.251 1.00 43.34 N ATOM 0 H ASN A 82 24.993 -11.247 -14.619 1.00 54.33 H new ATOM 0 HA ASN A 82 27.179 -10.185 -16.190 1.00 44.14 H new ATOM 0 HB2 ASN A 82 25.056 -11.681 -16.835 1.00 74.44 H new ATOM 0 HB3 ASN A 82 24.290 -10.118 -17.031 1.00 74.44 H new ATOM 0 HD21 ASN A 82 25.676 -9.522 -20.186 1.00 43.34 H new ATOM 0 HD22 ASN A 82 24.449 -9.160 -18.967 1.00 43.34 H new ATOM 1286 N ASN A 83 26.092 -7.802 -16.808 1.00 50.54 N ATOM 1287 CA ASN A 83 25.867 -6.361 -16.776 1.00 53.05 C ATOM 1288 C ASN A 83 24.381 -6.046 -16.634 1.00 53.22 C ATOM 1289 O ASN A 83 23.668 -5.909 -17.628 1.00 11.53 O ATOM 1290 CB ASN A 83 26.418 -5.709 -18.046 1.00 64.20 C ATOM 1291 CG ASN A 83 27.930 -5.590 -18.025 1.00 21.13 C ATOM 1292 OD1 ASN A 83 28.562 -5.748 -16.980 1.00 34.41 O ATOM 1293 ND2 ASN A 83 28.518 -5.309 -19.182 1.00 74.41 N ATOM 0 H ASN A 83 26.441 -8.155 -17.699 1.00 50.54 H new ATOM 0 HA ASN A 83 26.391 -5.956 -15.911 1.00 53.05 H new ATOM 0 HB2 ASN A 83 26.114 -6.295 -18.913 1.00 64.20 H new ATOM 0 HB3 ASN A 83 25.980 -4.718 -18.162 1.00 64.20 H new ATOM 0 HD21 ASN A 83 29.533 -5.216 -19.229 1.00 74.41 H new ATOM 0 HD22 ASN A 83 27.955 -5.186 -20.024 1.00 74.41 H new ATOM 1300 N GLU A 84 23.922 -5.932 -15.392 1.00 33.23 N ATOM 1301 CA GLU A 84 22.521 -5.633 -15.120 1.00 75.40 C ATOM 1302 C GLU A 84 22.068 -4.397 -15.892 1.00 24.02 C ATOM 1303 O GLU A 84 22.889 -3.642 -16.413 1.00 50.50 O ATOM 1304 CB GLU A 84 22.303 -5.420 -13.621 1.00 10.14 C ATOM 1305 CG GLU A 84 22.838 -4.092 -13.111 1.00 34.10 C ATOM 1306 CD GLU A 84 23.388 -4.187 -11.701 1.00 63.33 C ATOM 1307 OE1 GLU A 84 22.934 -5.070 -10.945 1.00 31.34 O ATOM 1308 OE2 GLU A 84 24.275 -3.378 -11.355 1.00 75.04 O ATOM 0 H GLU A 84 24.500 -6.042 -14.558 1.00 33.23 H new ATOM 0 HA GLU A 84 21.925 -6.484 -15.449 1.00 75.40 H new ATOM 0 HB2 GLU A 84 21.236 -5.479 -13.405 1.00 10.14 H new ATOM 0 HB3 GLU A 84 22.784 -6.230 -13.074 1.00 10.14 H new ATOM 0 HG2 GLU A 84 23.623 -3.740 -13.780 1.00 34.10 H new ATOM 0 HG3 GLU A 84 22.040 -3.349 -13.137 1.00 34.10 H new ATOM 1315 N LYS A 85 20.757 -4.197 -15.961 1.00 74.32 N ATOM 1316 CA LYS A 85 20.193 -3.053 -16.668 1.00 32.30 C ATOM 1317 C LYS A 85 18.827 -2.681 -16.099 1.00 24.12 C ATOM 1318 O LYS A 85 18.187 -3.484 -15.419 1.00 42.34 O ATOM 1319 CB LYS A 85 20.068 -3.362 -18.162 1.00 15.33 C ATOM 1320 CG LYS A 85 19.161 -4.542 -18.465 1.00 53.22 C ATOM 1321 CD LYS A 85 19.514 -5.189 -19.794 1.00 33.12 C ATOM 1322 CE LYS A 85 20.816 -5.971 -19.705 1.00 15.53 C ATOM 1323 NZ LYS A 85 21.068 -6.770 -20.935 1.00 73.42 N ATOM 0 H LYS A 85 20.064 -4.813 -15.536 1.00 74.32 H new ATOM 0 HA LYS A 85 20.866 -2.206 -16.533 1.00 32.30 H new ATOM 0 HB2 LYS A 85 19.687 -2.480 -18.676 1.00 15.33 H new ATOM 0 HB3 LYS A 85 21.060 -3.563 -18.567 1.00 15.33 H new ATOM 0 HG2 LYS A 85 19.243 -5.280 -17.667 1.00 53.22 H new ATOM 0 HG3 LYS A 85 18.123 -4.209 -18.486 1.00 53.22 H new ATOM 0 HD2 LYS A 85 18.708 -5.856 -20.101 1.00 33.12 H new ATOM 0 HD3 LYS A 85 19.602 -4.421 -20.562 1.00 33.12 H new ATOM 0 HE2 LYS A 85 21.644 -5.281 -19.544 1.00 15.53 H new ATOM 0 HE3 LYS A 85 20.783 -6.635 -18.841 1.00 15.53 H new ATOM 0 HZ1 LYS A 85 21.964 -7.288 -20.835 1.00 73.42 H new ATOM 0 HZ2 LYS A 85 20.291 -7.447 -21.075 1.00 73.42 H new ATOM 0 HZ3 LYS A 85 21.125 -6.134 -21.756 1.00 73.42 H new ATOM 1337 N VAL A 86 18.386 -1.459 -16.382 1.00 24.44 N ATOM 1338 CA VAL A 86 17.096 -0.982 -15.900 1.00 33.11 C ATOM 1339 C VAL A 86 16.029 -1.093 -16.984 1.00 4.11 C ATOM 1340 O VAL A 86 16.306 -0.879 -18.165 1.00 12.14 O ATOM 1341 CB VAL A 86 17.180 0.481 -15.426 1.00 32.14 C ATOM 1342 CG1 VAL A 86 18.000 0.582 -14.148 1.00 73.04 C ATOM 1343 CG2 VAL A 86 17.768 1.362 -16.518 1.00 31.44 C ATOM 0 H VAL A 86 18.903 -0.782 -16.943 1.00 24.44 H new ATOM 0 HA VAL A 86 16.820 -1.614 -15.056 1.00 33.11 H new ATOM 0 HB VAL A 86 16.171 0.834 -15.211 1.00 32.14 H new ATOM 0 HG11 VAL A 86 18.048 1.623 -13.828 1.00 73.04 H new ATOM 0 HG12 VAL A 86 17.531 -0.016 -13.367 1.00 73.04 H new ATOM 0 HG13 VAL A 86 19.008 0.212 -14.333 1.00 73.04 H new ATOM 0 HG21 VAL A 86 17.820 2.392 -16.166 1.00 31.44 H new ATOM 0 HG22 VAL A 86 18.770 1.013 -16.767 1.00 31.44 H new ATOM 0 HG23 VAL A 86 17.136 1.313 -17.405 1.00 31.44 H new ATOM 1353 N ILE A 87 14.810 -1.428 -16.575 1.00 4.11 N ATOM 1354 CA ILE A 87 13.702 -1.565 -17.511 1.00 71.43 C ATOM 1355 C ILE A 87 12.417 -0.986 -16.931 1.00 14.44 C ATOM 1356 O ILE A 87 12.414 -0.432 -15.830 1.00 72.21 O ATOM 1357 CB ILE A 87 13.463 -3.039 -17.888 1.00 34.52 C ATOM 1358 CG1 ILE A 87 13.160 -3.866 -16.636 1.00 11.40 C ATOM 1359 CG2 ILE A 87 14.671 -3.602 -18.621 1.00 3.13 C ATOM 1360 CD1 ILE A 87 14.398 -4.401 -15.952 1.00 31.34 C ATOM 0 H ILE A 87 14.565 -1.609 -15.602 1.00 4.11 H new ATOM 0 HA ILE A 87 13.976 -1.009 -18.407 1.00 71.43 H new ATOM 0 HB ILE A 87 12.602 -3.093 -18.554 1.00 34.52 H new ATOM 0 HG12 ILE A 87 12.602 -3.251 -15.930 1.00 11.40 H new ATOM 0 HG13 ILE A 87 12.516 -4.702 -16.909 1.00 11.40 H new ATOM 0 HG21 ILE A 87 14.486 -4.644 -18.880 1.00 3.13 H new ATOM 0 HG22 ILE A 87 14.845 -3.027 -19.531 1.00 3.13 H new ATOM 0 HG23 ILE A 87 15.549 -3.538 -17.978 1.00 3.13 H new ATOM 0 HD11 ILE A 87 14.108 -4.977 -15.073 1.00 31.34 H new ATOM 0 HD12 ILE A 87 14.946 -5.043 -16.642 1.00 31.34 H new ATOM 0 HD13 ILE A 87 15.033 -3.569 -15.647 1.00 31.34 H new ATOM 1372 N LEU A 88 11.325 -1.117 -17.676 1.00 61.41 N ATOM 1373 CA LEU A 88 10.031 -0.608 -17.235 1.00 21.31 C ATOM 1374 C LEU A 88 9.498 -1.421 -16.059 1.00 43.12 C ATOM 1375 O LEU A 88 9.269 -0.886 -14.974 1.00 71.40 O ATOM 1376 CB LEU A 88 9.028 -0.641 -18.389 1.00 35.41 C ATOM 1377 CG LEU A 88 9.254 0.379 -19.505 1.00 65.43 C ATOM 1378 CD1 LEU A 88 8.176 0.254 -20.570 1.00 34.13 C ATOM 1379 CD2 LEU A 88 9.287 1.791 -18.939 1.00 32.30 C ATOM 0 H LEU A 88 11.310 -1.572 -18.589 1.00 61.41 H new ATOM 0 HA LEU A 88 10.166 0.423 -16.908 1.00 21.31 H new ATOM 0 HB2 LEU A 88 9.042 -1.639 -18.828 1.00 35.41 H new ATOM 0 HB3 LEU A 88 8.029 -0.487 -17.980 1.00 35.41 H new ATOM 0 HG LEU A 88 10.219 0.173 -19.969 1.00 65.43 H new ATOM 0 HD11 LEU A 88 8.354 0.988 -21.356 1.00 34.13 H new ATOM 0 HD12 LEU A 88 8.201 -0.748 -20.997 1.00 34.13 H new ATOM 0 HD13 LEU A 88 7.199 0.432 -20.121 1.00 34.13 H new ATOM 0 HD21 LEU A 88 9.449 2.504 -19.748 1.00 32.30 H new ATOM 0 HD22 LEU A 88 8.338 2.008 -18.448 1.00 32.30 H new ATOM 0 HD23 LEU A 88 10.098 1.874 -18.215 1.00 32.30 H new ATOM 1391 N LYS A 89 9.305 -2.717 -16.281 1.00 43.43 N ATOM 1392 CA LYS A 89 8.803 -3.605 -15.240 1.00 61.43 C ATOM 1393 C LYS A 89 9.303 -5.030 -15.454 1.00 22.53 C ATOM 1394 O LYS A 89 10.094 -5.292 -16.361 1.00 25.44 O ATOM 1395 CB LYS A 89 7.273 -3.588 -15.221 1.00 30.13 C ATOM 1396 CG LYS A 89 6.685 -2.259 -14.778 1.00 23.33 C ATOM 1397 CD LYS A 89 5.168 -2.311 -14.724 1.00 33.00 C ATOM 1398 CE LYS A 89 4.557 -2.216 -16.114 1.00 1.12 C ATOM 1399 NZ LYS A 89 3.240 -2.906 -16.189 1.00 55.32 N ATOM 0 H LYS A 89 9.489 -3.175 -17.173 1.00 43.43 H new ATOM 0 HA LYS A 89 9.176 -3.247 -14.280 1.00 61.43 H new ATOM 0 HB2 LYS A 89 6.903 -3.825 -16.218 1.00 30.13 H new ATOM 0 HB3 LYS A 89 6.917 -4.373 -14.554 1.00 30.13 H new ATOM 0 HG2 LYS A 89 7.076 -1.997 -13.795 1.00 23.33 H new ATOM 0 HG3 LYS A 89 6.999 -1.474 -15.466 1.00 23.33 H new ATOM 0 HD2 LYS A 89 4.851 -3.240 -14.249 1.00 33.00 H new ATOM 0 HD3 LYS A 89 4.797 -1.494 -14.106 1.00 33.00 H new ATOM 0 HE2 LYS A 89 4.434 -1.168 -16.386 1.00 1.12 H new ATOM 0 HE3 LYS A 89 5.239 -2.656 -16.841 1.00 1.12 H new ATOM 0 HZ1 LYS A 89 2.857 -2.819 -17.152 1.00 55.32 H new ATOM 0 HZ2 LYS A 89 3.361 -3.912 -15.955 1.00 55.32 H new ATOM 0 HZ3 LYS A 89 2.581 -2.470 -15.513 1.00 55.32 H new ATOM 1413 N LEU A 90 8.836 -5.948 -14.614 1.00 62.35 N ATOM 1414 CA LEU A 90 9.235 -7.348 -14.712 1.00 70.13 C ATOM 1415 C LEU A 90 8.925 -7.907 -16.097 1.00 72.12 C ATOM 1416 O LEU A 90 8.238 -7.269 -16.895 1.00 71.44 O ATOM 1417 CB LEU A 90 8.522 -8.178 -13.643 1.00 52.04 C ATOM 1418 CG LEU A 90 8.627 -7.658 -12.209 1.00 73.13 C ATOM 1419 CD1 LEU A 90 7.479 -8.189 -11.364 1.00 4.32 C ATOM 1420 CD2 LEU A 90 9.966 -8.045 -11.598 1.00 75.52 C ATOM 0 H LEU A 90 8.181 -5.748 -13.858 1.00 62.35 H new ATOM 0 HA LEU A 90 10.311 -7.406 -14.550 1.00 70.13 H new ATOM 0 HB2 LEU A 90 7.467 -8.245 -13.908 1.00 52.04 H new ATOM 0 HB3 LEU A 90 8.923 -9.191 -13.671 1.00 52.04 H new ATOM 0 HG LEU A 90 8.562 -6.570 -12.231 1.00 73.13 H new ATOM 0 HD11 LEU A 90 7.570 -7.809 -10.347 1.00 4.32 H new ATOM 0 HD12 LEU A 90 6.531 -7.861 -11.791 1.00 4.32 H new ATOM 0 HD13 LEU A 90 7.512 -9.278 -11.348 1.00 4.32 H new ATOM 0 HD21 LEU A 90 10.023 -7.667 -10.577 1.00 75.52 H new ATOM 0 HD22 LEU A 90 10.061 -9.131 -11.588 1.00 75.52 H new ATOM 0 HD23 LEU A 90 10.774 -7.615 -12.190 1.00 75.52 H new ATOM 1432 N ASP A 91 9.434 -9.102 -16.375 1.00 32.45 N ATOM 1433 CA ASP A 91 9.209 -9.749 -17.662 1.00 35.41 C ATOM 1434 C ASP A 91 8.375 -11.016 -17.495 1.00 53.10 C ATOM 1435 O ASP A 91 7.599 -11.381 -18.378 1.00 73.34 O ATOM 1436 CB ASP A 91 10.544 -10.087 -18.328 1.00 15.23 C ATOM 1437 CG ASP A 91 10.413 -10.267 -19.827 1.00 44.24 C ATOM 1438 OD1 ASP A 91 9.779 -11.254 -20.253 1.00 72.21 O ATOM 1439 OD2 ASP A 91 10.947 -9.421 -20.575 1.00 51.34 O ATOM 0 H ASP A 91 10.006 -9.643 -15.726 1.00 32.45 H new ATOM 0 HA ASP A 91 8.660 -9.055 -18.298 1.00 35.41 H new ATOM 0 HB2 ASP A 91 11.261 -9.293 -18.122 1.00 15.23 H new ATOM 0 HB3 ASP A 91 10.945 -11.000 -17.889 1.00 15.23 H new ATOM 1444 N TYR A 92 8.541 -11.682 -16.358 1.00 1.12 N ATOM 1445 CA TYR A 92 7.807 -12.910 -16.077 1.00 14.44 C ATOM 1446 C TYR A 92 7.050 -12.801 -14.756 1.00 75.35 C ATOM 1447 O TYR A 92 7.348 -11.944 -13.925 1.00 52.44 O ATOM 1448 CB TYR A 92 8.763 -14.102 -16.032 1.00 62.33 C ATOM 1449 CG TYR A 92 8.958 -14.772 -17.374 1.00 31.53 C ATOM 1450 CD1 TYR A 92 9.478 -14.071 -18.454 1.00 41.11 C ATOM 1451 CD2 TYR A 92 8.622 -16.108 -17.560 1.00 44.00 C ATOM 1452 CE1 TYR A 92 9.657 -14.679 -19.681 1.00 72.15 C ATOM 1453 CE2 TYR A 92 8.799 -16.725 -18.783 1.00 41.25 C ATOM 1454 CZ TYR A 92 9.316 -16.006 -19.841 1.00 61.11 C ATOM 1455 OH TYR A 92 9.494 -16.616 -21.062 1.00 20.02 O ATOM 0 H TYR A 92 9.178 -11.392 -15.616 1.00 1.12 H new ATOM 0 HA TYR A 92 7.084 -13.063 -16.879 1.00 14.44 H new ATOM 0 HB2 TYR A 92 9.731 -13.767 -15.658 1.00 62.33 H new ATOM 0 HB3 TYR A 92 8.383 -14.835 -15.321 1.00 62.33 H new ATOM 0 HD1 TYR A 92 9.747 -13.032 -18.332 1.00 41.11 H new ATOM 0 HD2 TYR A 92 8.216 -16.673 -16.734 1.00 44.00 H new ATOM 0 HE1 TYR A 92 10.062 -14.119 -20.511 1.00 72.15 H new ATOM 0 HE2 TYR A 92 8.534 -17.764 -18.910 1.00 41.25 H new ATOM 0 HH TYR A 92 9.206 -17.551 -21.006 1.00 20.02 H new ATOM 1465 N SER A 93 6.068 -13.678 -14.571 1.00 22.41 N ATOM 1466 CA SER A 93 5.265 -13.681 -13.354 1.00 1.22 C ATOM 1467 C SER A 93 5.216 -15.076 -12.738 1.00 4.32 C ATOM 1468 O SER A 93 4.248 -15.438 -12.069 1.00 42.40 O ATOM 1469 CB SER A 93 3.846 -13.193 -13.653 1.00 21.21 C ATOM 1470 OG SER A 93 3.841 -11.819 -14.000 1.00 25.31 O ATOM 0 H SER A 93 5.810 -14.395 -15.248 1.00 22.41 H new ATOM 0 HA SER A 93 5.732 -13.004 -12.639 1.00 1.22 H new ATOM 0 HB2 SER A 93 3.421 -13.779 -14.468 1.00 21.21 H new ATOM 0 HB3 SER A 93 3.212 -13.353 -12.781 1.00 21.21 H new ATOM 0 HG SER A 93 2.923 -11.532 -14.188 1.00 25.31 H new ATOM 1476 N ASP A 94 6.268 -15.854 -12.969 1.00 33.34 N ATOM 1477 CA ASP A 94 6.347 -17.210 -12.436 1.00 40.42 C ATOM 1478 C ASP A 94 7.735 -17.801 -12.661 1.00 21.24 C ATOM 1479 O ASP A 94 8.504 -17.311 -13.487 1.00 43.44 O ATOM 1480 CB ASP A 94 5.288 -18.100 -13.089 1.00 1.41 C ATOM 1481 CG ASP A 94 5.102 -17.793 -14.562 1.00 23.10 C ATOM 1482 OD1 ASP A 94 5.885 -18.320 -15.380 1.00 52.53 O ATOM 1483 OD2 ASP A 94 4.175 -17.026 -14.896 1.00 70.15 O ATOM 0 H ASP A 94 7.077 -15.570 -13.521 1.00 33.34 H new ATOM 0 HA ASP A 94 6.160 -17.164 -11.363 1.00 40.42 H new ATOM 0 HB2 ASP A 94 5.574 -19.145 -12.972 1.00 1.41 H new ATOM 0 HB3 ASP A 94 4.338 -17.969 -12.571 1.00 1.41 H new ATOM 1488 N PHE A 95 8.050 -18.858 -11.918 1.00 55.33 N ATOM 1489 CA PHE A 95 9.346 -19.515 -12.035 1.00 31.24 C ATOM 1490 C PHE A 95 9.210 -20.867 -12.729 1.00 33.21 C ATOM 1491 O PHE A 95 8.185 -21.538 -12.606 1.00 65.33 O ATOM 1492 CB PHE A 95 9.974 -19.700 -10.652 1.00 35.45 C ATOM 1493 CG PHE A 95 9.111 -20.481 -9.701 1.00 53.43 C ATOM 1494 CD1 PHE A 95 9.039 -21.862 -9.784 1.00 43.23 C ATOM 1495 CD2 PHE A 95 8.371 -19.833 -8.725 1.00 53.34 C ATOM 1496 CE1 PHE A 95 8.247 -22.583 -8.911 1.00 54.12 C ATOM 1497 CE2 PHE A 95 7.577 -20.548 -7.849 1.00 73.44 C ATOM 1498 CZ PHE A 95 7.514 -21.925 -7.943 1.00 74.02 C ATOM 0 H PHE A 95 7.425 -19.277 -11.229 1.00 55.33 H new ATOM 0 HA PHE A 95 9.994 -18.880 -12.639 1.00 31.24 H new ATOM 0 HB2 PHE A 95 10.932 -20.208 -10.762 1.00 35.45 H new ATOM 0 HB3 PHE A 95 10.181 -18.720 -10.222 1.00 35.45 H new ATOM 0 HD1 PHE A 95 9.609 -22.381 -10.540 1.00 43.23 H new ATOM 0 HD2 PHE A 95 8.415 -18.757 -8.648 1.00 53.34 H new ATOM 0 HE1 PHE A 95 8.201 -23.659 -8.986 1.00 54.12 H new ATOM 0 HE2 PHE A 95 7.006 -20.031 -7.092 1.00 73.44 H new ATOM 0 HZ PHE A 95 6.893 -22.486 -7.261 1.00 74.02 H new ATOM 1508 N GLN A 96 10.250 -21.259 -13.458 1.00 12.22 N ATOM 1509 CA GLN A 96 10.246 -22.530 -14.173 1.00 12.42 C ATOM 1510 C GLN A 96 11.661 -22.934 -14.572 1.00 21.11 C ATOM 1511 O GLN A 96 12.506 -22.082 -14.848 1.00 11.23 O ATOM 1512 CB GLN A 96 9.359 -22.437 -15.416 1.00 4.30 C ATOM 1513 CG GLN A 96 7.924 -22.874 -15.174 1.00 13.54 C ATOM 1514 CD GLN A 96 7.208 -23.261 -16.452 1.00 71.53 C ATOM 1515 OE1 GLN A 96 7.266 -24.413 -16.885 1.00 14.11 O ATOM 1516 NE2 GLN A 96 6.527 -22.300 -17.065 1.00 43.02 N ATOM 0 H GLN A 96 11.106 -20.715 -13.569 1.00 12.22 H new ATOM 0 HA GLN A 96 9.845 -23.293 -13.506 1.00 12.42 H new ATOM 0 HB2 GLN A 96 9.361 -21.409 -15.777 1.00 4.30 H new ATOM 0 HB3 GLN A 96 9.789 -23.053 -16.206 1.00 4.30 H new ATOM 0 HG2 GLN A 96 7.917 -23.721 -14.488 1.00 13.54 H new ATOM 0 HG3 GLN A 96 7.379 -22.065 -14.688 1.00 13.54 H new ATOM 0 HE21 GLN A 96 6.506 -21.359 -16.671 1.00 43.02 H new ATOM 0 HE22 GLN A 96 6.025 -22.502 -17.930 1.00 43.02 H new ATOM 1525 N ILE A 97 11.913 -24.238 -14.600 1.00 75.51 N ATOM 1526 CA ILE A 97 13.225 -24.755 -14.966 1.00 64.12 C ATOM 1527 C ILE A 97 13.306 -25.043 -16.462 1.00 14.44 C ATOM 1528 O ILE A 97 12.389 -25.623 -17.043 1.00 61.42 O ATOM 1529 CB ILE A 97 13.561 -26.042 -14.189 1.00 11.41 C ATOM 1530 CG1 ILE A 97 13.414 -25.807 -12.684 1.00 72.30 C ATOM 1531 CG2 ILE A 97 14.970 -26.510 -14.522 1.00 54.33 C ATOM 1532 CD1 ILE A 97 13.520 -27.073 -11.862 1.00 52.22 C ATOM 0 H ILE A 97 11.225 -24.956 -14.373 1.00 75.51 H new ATOM 0 HA ILE A 97 13.950 -23.984 -14.707 1.00 64.12 H new ATOM 0 HB ILE A 97 12.861 -26.822 -14.487 1.00 11.41 H new ATOM 0 HG12 ILE A 97 14.182 -25.106 -12.357 1.00 72.30 H new ATOM 0 HG13 ILE A 97 12.450 -25.337 -12.490 1.00 72.30 H new ATOM 0 HG21 ILE A 97 15.192 -27.420 -13.965 1.00 54.33 H new ATOM 0 HG22 ILE A 97 15.043 -26.711 -15.591 1.00 54.33 H new ATOM 0 HG23 ILE A 97 15.685 -25.734 -14.249 1.00 54.33 H new ATOM 0 HD11 ILE A 97 13.407 -26.831 -10.805 1.00 52.22 H new ATOM 0 HD12 ILE A 97 12.736 -27.768 -12.161 1.00 52.22 H new ATOM 0 HD13 ILE A 97 14.494 -27.533 -12.026 1.00 52.22 H new ATOM 1544 N VAL A 98 14.409 -24.633 -17.079 1.00 64.30 N ATOM 1545 CA VAL A 98 14.612 -24.849 -18.507 1.00 35.33 C ATOM 1546 C VAL A 98 15.159 -26.246 -18.779 1.00 54.02 C ATOM 1547 O VAL A 98 16.095 -26.698 -18.120 1.00 0.11 O ATOM 1548 CB VAL A 98 15.577 -23.807 -19.101 1.00 2.31 C ATOM 1549 CG1 VAL A 98 15.746 -24.026 -20.596 1.00 61.45 C ATOM 1550 CG2 VAL A 98 15.082 -22.397 -18.813 1.00 73.53 C ATOM 0 H VAL A 98 15.176 -24.149 -16.613 1.00 64.30 H new ATOM 0 HA VAL A 98 13.638 -24.744 -18.985 1.00 35.33 H new ATOM 0 HB VAL A 98 16.551 -23.929 -18.628 1.00 2.31 H new ATOM 0 HG11 VAL A 98 16.432 -23.280 -20.998 1.00 61.45 H new ATOM 0 HG12 VAL A 98 16.149 -25.023 -20.774 1.00 61.45 H new ATOM 0 HG13 VAL A 98 14.778 -23.933 -21.089 1.00 61.45 H new ATOM 0 HG21 VAL A 98 15.776 -21.673 -19.240 1.00 73.53 H new ATOM 0 HG22 VAL A 98 14.096 -22.260 -19.257 1.00 73.53 H new ATOM 0 HG23 VAL A 98 15.019 -22.247 -17.735 1.00 73.53 H new ATOM 1560 N LYS A 99 14.568 -26.926 -19.756 1.00 23.30 N ATOM 1561 CA LYS A 99 14.997 -28.272 -20.119 1.00 35.12 C ATOM 1562 C LYS A 99 16.179 -28.226 -21.081 1.00 42.20 C ATOM 1563 O LYS A 99 16.614 -29.257 -21.595 1.00 41.54 O ATOM 1564 CB LYS A 99 13.838 -29.044 -20.755 1.00 21.05 C ATOM 1565 CG LYS A 99 13.252 -28.362 -21.978 1.00 54.13 C ATOM 1566 CD LYS A 99 12.139 -29.190 -22.599 1.00 30.22 C ATOM 1567 CE LYS A 99 12.692 -30.384 -23.362 1.00 1.10 C ATOM 1568 NZ LYS A 99 13.507 -29.963 -24.536 1.00 35.15 N ATOM 0 H LYS A 99 13.791 -26.567 -20.311 1.00 23.30 H new ATOM 0 HA LYS A 99 15.312 -28.784 -19.209 1.00 35.12 H new ATOM 0 HB2 LYS A 99 14.185 -30.038 -21.035 1.00 21.05 H new ATOM 0 HB3 LYS A 99 13.051 -29.179 -20.013 1.00 21.05 H new ATOM 0 HG2 LYS A 99 12.865 -27.382 -21.699 1.00 54.13 H new ATOM 0 HG3 LYS A 99 14.038 -28.196 -22.715 1.00 54.13 H new ATOM 0 HD2 LYS A 99 11.463 -29.537 -21.818 1.00 30.22 H new ATOM 0 HD3 LYS A 99 11.553 -28.566 -23.273 1.00 30.22 H new ATOM 0 HE2 LYS A 99 13.304 -30.990 -22.694 1.00 1.10 H new ATOM 0 HE3 LYS A 99 11.868 -31.013 -23.699 1.00 1.10 H new ATOM 0 HZ1 LYS A 99 13.567 -30.747 -25.216 1.00 35.15 H new ATOM 0 HZ2 LYS A 99 13.060 -29.142 -24.992 1.00 35.15 H new ATOM 0 HZ3 LYS A 99 14.464 -29.705 -24.220 1.00 35.15 H new