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 71 SER OG : rot 180:sc= -0.189 USER MOD Set 1.2: A 74 SER OG : rot 58:sc= 0.012 USER MOD Set 2.1: A 43 THR OG1 : rot -51:sc= 0.296 USER MOD Set 2.2: A 47 THR OG1 : rot 36:sc= 0.116 USER MOD Set 3.1: A 41 GLN : amide:sc= -1.48 K(o=-1.9,f=-0.57) USER MOD Set 3.2: A 49 GLN : amide:sc= -0.406 X(o=-1.9,f=-1.4) USER MOD Set 4.1: A 28 GLN : amide:sc= -1.49 K(o=-1.5,f=-2.1) USER MOD Set 4.2: A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN : amide:sc= -0.694 K(o=-0.69,f=-1.8) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot -140:sc= -0.683 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) 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) USER MOD Single : A 27 THR OG1 : rot 75:sc= 0.769 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -2.74! X(o=-2.7!,f=-2.5) USER MOD Single : A 51 GLN : amide:sc= -0.128 K(o=-0.13,f=-1.7!) USER MOD Single : A 53 GLN : amide:sc= -0.693 K(o=-0.69,f=-4!) USER MOD Single : A 57 SER OG : rot 180:sc=-0.00967 USER MOD Single : A 58 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0323) USER MOD Single : A 61 HIS : no HD1:sc= -0.0443 X(o=-0.044,f=-0.31) USER MOD Single : A 62 MET CE :methyl -156:sc= -2.19 (180deg=-3.24) USER MOD Single : A 63 GLN : amide:sc= -0.135 X(o=-0.13,f=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= -0.0928 X(o=-0.093,f=-0.5) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.697 K(o=-0.7,f=-5.1!) USER MOD Single : A 82 ASN : amide:sc= -0.463 X(o=-0.46,f=-0.53) USER MOD Single : A 83 ASN : amide:sc= -0.0218 K(o=-0.022,f=-1.3) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ -159:sc= -0.0441 (180deg=-0.305) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot -54:sc= 0.0394 USER MOD Single : A 96 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 99 LYS NZ :NH3+ -133:sc= -0.502 (180deg=-2.48!) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 10.467 1.654 -7.169 1.00 14.14 N ATOM 41 CA ASN A 5 9.953 0.465 -7.839 1.00 54.43 C ATOM 42 C ASN A 5 10.495 0.367 -9.262 1.00 75.41 C ATOM 43 O ASN A 5 9.736 0.398 -10.232 1.00 33.54 O ATOM 44 CB ASN A 5 8.423 0.490 -7.865 1.00 20.02 C ATOM 45 CG ASN A 5 7.876 1.708 -8.584 1.00 2.13 C ATOM 46 OD1 ASN A 5 8.632 2.576 -9.021 1.00 21.10 O ATOM 47 ND2 ASN A 5 6.556 1.778 -8.709 1.00 20.01 N ATOM 0 HA ASN A 5 10.286 -0.410 -7.280 1.00 54.43 H new ATOM 0 HB2 ASN A 5 8.056 -0.412 -8.354 1.00 20.02 H new ATOM 0 HB3 ASN A 5 8.045 0.475 -6.843 1.00 20.02 H new ATOM 0 HD21 ASN A 5 6.130 2.575 -9.183 1.00 20.01 H new ATOM 0 HD22 ASN A 5 5.968 1.035 -8.331 1.00 20.01 H new ATOM 54 N THR A 6 11.813 0.247 -9.380 1.00 63.23 N ATOM 55 CA THR A 6 12.458 0.144 -10.684 1.00 34.25 C ATOM 56 C THR A 6 12.718 -1.312 -11.054 1.00 44.55 C ATOM 57 O THR A 6 13.630 -1.945 -10.521 1.00 62.12 O ATOM 58 CB THR A 6 13.790 0.916 -10.714 1.00 50.21 C ATOM 59 OG1 THR A 6 13.646 2.168 -10.034 1.00 42.22 O ATOM 60 CG2 THR A 6 14.241 1.160 -12.146 1.00 64.02 C ATOM 0 H THR A 6 12.456 0.219 -8.588 1.00 63.23 H new ATOM 0 HA THR A 6 11.776 0.585 -11.411 1.00 34.25 H new ATOM 0 HB THR A 6 14.545 0.314 -10.209 1.00 50.21 H new ATOM 0 HG1 THR A 6 14.498 2.652 -10.056 1.00 42.22 H new ATOM 0 HG21 THR A 6 15.184 1.707 -12.142 1.00 64.02 H new ATOM 0 HG22 THR A 6 14.378 0.204 -12.652 1.00 64.02 H new ATOM 0 HG23 THR A 6 13.485 1.744 -12.671 1.00 64.02 H new ATOM 68 N LEU A 7 11.914 -1.837 -11.972 1.00 15.44 N ATOM 69 CA LEU A 7 12.058 -3.219 -12.415 1.00 51.11 C ATOM 70 C LEU A 7 13.309 -3.388 -13.270 1.00 64.44 C ATOM 71 O LEU A 7 13.456 -2.742 -14.308 1.00 41.11 O ATOM 72 CB LEU A 7 10.823 -3.653 -13.206 1.00 51.04 C ATOM 73 CG LEU A 7 9.667 -4.226 -12.386 1.00 22.34 C ATOM 74 CD1 LEU A 7 10.116 -5.463 -11.623 1.00 2.24 C ATOM 75 CD2 LEU A 7 9.120 -3.177 -11.429 1.00 41.43 C ATOM 0 H LEU A 7 11.156 -1.326 -12.424 1.00 15.44 H new ATOM 0 HA LEU A 7 12.156 -3.850 -11.532 1.00 51.11 H new ATOM 0 HB2 LEU A 7 10.454 -2.793 -13.765 1.00 51.04 H new ATOM 0 HB3 LEU A 7 11.129 -4.401 -13.937 1.00 51.04 H new ATOM 0 HG LEU A 7 8.870 -4.515 -13.071 1.00 22.34 H new ATOM 0 HD11 LEU A 7 9.280 -5.857 -11.045 1.00 2.24 H new ATOM 0 HD12 LEU A 7 10.459 -6.220 -12.328 1.00 2.24 H new ATOM 0 HD13 LEU A 7 10.931 -5.199 -10.949 1.00 2.24 H new ATOM 0 HD21 LEU A 7 8.298 -3.603 -10.854 1.00 41.43 H new ATOM 0 HD22 LEU A 7 9.910 -2.857 -10.750 1.00 41.43 H new ATOM 0 HD23 LEU A 7 8.760 -2.319 -11.997 1.00 41.43 H new ATOM 87 N ILE A 8 14.207 -4.263 -12.829 1.00 44.21 N ATOM 88 CA ILE A 8 15.444 -4.519 -13.556 1.00 63.51 C ATOM 89 C ILE A 8 15.594 -6.002 -13.881 1.00 55.11 C ATOM 90 O ILE A 8 14.707 -6.804 -13.590 1.00 34.15 O ATOM 91 CB ILE A 8 16.675 -4.055 -12.755 1.00 51.42 C ATOM 92 CG1 ILE A 8 16.755 -4.801 -11.422 1.00 35.11 C ATOM 93 CG2 ILE A 8 16.620 -2.552 -12.525 1.00 1.23 C ATOM 94 CD1 ILE A 8 17.592 -6.059 -11.483 1.00 32.41 C ATOM 0 H ILE A 8 14.101 -4.806 -11.972 1.00 44.21 H new ATOM 0 HA ILE A 8 15.388 -3.949 -14.483 1.00 63.51 H new ATOM 0 HB ILE A 8 17.572 -4.283 -13.331 1.00 51.42 H new ATOM 0 HG12 ILE A 8 17.170 -4.134 -10.666 1.00 35.11 H new ATOM 0 HG13 ILE A 8 15.747 -5.060 -11.099 1.00 35.11 H new ATOM 0 HG21 ILE A 8 17.496 -2.238 -11.958 1.00 1.23 H new ATOM 0 HG22 ILE A 8 16.606 -2.037 -13.486 1.00 1.23 H new ATOM 0 HG23 ILE A 8 15.718 -2.302 -11.967 1.00 1.23 H new ATOM 0 HD11 ILE A 8 17.604 -6.536 -10.503 1.00 32.41 H new ATOM 0 HD12 ILE A 8 17.165 -6.745 -12.215 1.00 32.41 H new ATOM 0 HD13 ILE A 8 18.611 -5.804 -11.775 1.00 32.41 H new ATOM 106 N SER A 9 16.722 -6.359 -14.485 1.00 43.02 N ATOM 107 CA SER A 9 16.988 -7.745 -14.852 1.00 34.22 C ATOM 108 C SER A 9 18.488 -8.022 -14.881 1.00 13.12 C ATOM 109 O SER A 9 19.289 -7.135 -15.178 1.00 33.51 O ATOM 110 CB SER A 9 16.373 -8.061 -16.217 1.00 10.51 C ATOM 111 OG SER A 9 16.907 -7.218 -17.223 1.00 54.24 O ATOM 0 H SER A 9 17.467 -5.707 -14.731 1.00 43.02 H new ATOM 0 HA SER A 9 16.532 -8.388 -14.099 1.00 34.22 H new ATOM 0 HB2 SER A 9 16.563 -9.103 -16.473 1.00 10.51 H new ATOM 0 HB3 SER A 9 15.291 -7.936 -16.170 1.00 10.51 H new ATOM 0 HG SER A 9 16.500 -7.440 -18.086 1.00 54.24 H new ATOM 117 N VAL A 10 18.861 -9.259 -14.570 1.00 20.24 N ATOM 118 CA VAL A 10 20.264 -9.655 -14.560 1.00 43.15 C ATOM 119 C VAL A 10 20.413 -11.148 -14.290 1.00 15.22 C ATOM 120 O VAL A 10 19.571 -11.756 -13.627 1.00 43.45 O ATOM 121 CB VAL A 10 21.062 -8.871 -13.502 1.00 13.45 C ATOM 122 CG1 VAL A 10 20.613 -9.257 -12.100 1.00 53.25 C ATOM 123 CG2 VAL A 10 22.554 -9.107 -13.676 1.00 63.01 C ATOM 0 H VAL A 10 18.211 -10.005 -14.322 1.00 20.24 H new ATOM 0 HA VAL A 10 20.663 -9.426 -15.548 1.00 43.15 H new ATOM 0 HB VAL A 10 20.867 -7.807 -13.641 1.00 13.45 H new ATOM 0 HG11 VAL A 10 21.188 -8.693 -11.366 1.00 53.25 H new ATOM 0 HG12 VAL A 10 19.553 -9.031 -11.982 1.00 53.25 H new ATOM 0 HG13 VAL A 10 20.776 -10.324 -11.947 1.00 53.25 H new ATOM 0 HG21 VAL A 10 23.102 -8.545 -12.920 1.00 63.01 H new ATOM 0 HG22 VAL A 10 22.770 -10.170 -13.565 1.00 63.01 H new ATOM 0 HG23 VAL A 10 22.862 -8.776 -14.668 1.00 63.01 H new ATOM 133 N ASP A 11 21.488 -11.733 -14.806 1.00 14.01 N ATOM 134 CA ASP A 11 21.748 -13.156 -14.619 1.00 11.43 C ATOM 135 C ASP A 11 22.917 -13.373 -13.663 1.00 71.11 C ATOM 136 O ASP A 11 23.477 -12.418 -13.124 1.00 63.33 O ATOM 137 CB ASP A 11 22.041 -13.823 -15.963 1.00 60.51 C ATOM 138 CG ASP A 11 23.084 -13.073 -16.767 1.00 50.44 C ATOM 139 OD1 ASP A 11 22.751 -12.002 -17.317 1.00 3.35 O ATOM 140 OD2 ASP A 11 24.233 -13.556 -16.848 1.00 73.34 O ATOM 0 H ASP A 11 22.194 -11.244 -15.357 1.00 14.01 H new ATOM 0 HA ASP A 11 20.857 -13.610 -14.184 1.00 11.43 H new ATOM 0 HB2 ASP A 11 22.383 -14.844 -15.792 1.00 60.51 H new ATOM 0 HB3 ASP A 11 21.119 -13.889 -16.541 1.00 60.51 H new ATOM 145 N TYR A 12 23.279 -14.634 -13.457 1.00 32.42 N ATOM 146 CA TYR A 12 24.379 -14.978 -12.563 1.00 53.43 C ATOM 147 C TYR A 12 25.157 -16.178 -13.093 1.00 75.41 C ATOM 148 O TYR A 12 24.676 -16.910 -13.957 1.00 74.25 O ATOM 149 CB TYR A 12 23.849 -15.278 -11.160 1.00 51.21 C ATOM 150 CG TYR A 12 22.960 -14.189 -10.603 1.00 2.03 C ATOM 151 CD1 TYR A 12 23.500 -13.105 -9.922 1.00 52.42 C ATOM 152 CD2 TYR A 12 21.580 -14.244 -10.758 1.00 24.35 C ATOM 153 CE1 TYR A 12 22.691 -12.108 -9.411 1.00 24.14 C ATOM 154 CE2 TYR A 12 20.764 -13.252 -10.251 1.00 3.44 C ATOM 155 CZ TYR A 12 21.324 -12.186 -9.578 1.00 5.15 C ATOM 156 OH TYR A 12 20.516 -11.195 -9.071 1.00 12.53 O ATOM 0 H TYR A 12 22.827 -15.436 -13.897 1.00 32.42 H new ATOM 0 HA TYR A 12 25.054 -14.124 -12.514 1.00 53.43 H new ATOM 0 HB2 TYR A 12 23.291 -16.214 -11.184 1.00 51.21 H new ATOM 0 HB3 TYR A 12 24.693 -15.427 -10.486 1.00 51.21 H new ATOM 0 HD1 TYR A 12 24.570 -13.041 -9.790 1.00 52.42 H new ATOM 0 HD2 TYR A 12 21.138 -15.077 -11.284 1.00 24.35 H new ATOM 0 HE1 TYR A 12 23.127 -11.272 -8.884 1.00 24.14 H new ATOM 0 HE2 TYR A 12 19.693 -13.310 -10.381 1.00 3.44 H new ATOM 0 HH TYR A 12 19.708 -11.596 -8.688 1.00 12.53 H new ATOM 166 N GLU A 13 26.362 -16.374 -12.567 1.00 14.33 N ATOM 167 CA GLU A 13 27.207 -17.485 -12.986 1.00 73.34 C ATOM 168 C GLU A 13 27.870 -18.149 -11.783 1.00 35.41 C ATOM 169 O GLU A 13 28.788 -17.592 -11.181 1.00 14.13 O ATOM 170 CB GLU A 13 28.276 -17.000 -13.968 1.00 34.21 C ATOM 171 CG GLU A 13 28.865 -18.109 -14.823 1.00 24.22 C ATOM 172 CD GLU A 13 29.485 -17.590 -16.106 1.00 23.15 C ATOM 173 OE1 GLU A 13 29.227 -16.420 -16.457 1.00 53.14 O ATOM 174 OE2 GLU A 13 30.228 -18.353 -16.757 1.00 62.14 O ATOM 0 H GLU A 13 26.775 -15.777 -11.850 1.00 14.33 H new ATOM 0 HA GLU A 13 26.575 -18.221 -13.482 1.00 73.34 H new ATOM 0 HB2 GLU A 13 27.841 -16.242 -14.620 1.00 34.21 H new ATOM 0 HB3 GLU A 13 29.079 -16.518 -13.410 1.00 34.21 H new ATOM 0 HG2 GLU A 13 29.622 -18.643 -14.248 1.00 24.22 H new ATOM 0 HG3 GLU A 13 28.084 -18.829 -15.067 1.00 24.22 H new ATOM 181 N ILE A 14 27.397 -19.343 -11.439 1.00 1.45 N ATOM 182 CA ILE A 14 27.944 -20.083 -10.308 1.00 53.20 C ATOM 183 C ILE A 14 29.040 -21.043 -10.758 1.00 12.12 C ATOM 184 O ILE A 14 28.948 -21.650 -11.825 1.00 25.42 O ATOM 185 CB ILE A 14 26.849 -20.879 -9.574 1.00 74.22 C ATOM 186 CG1 ILE A 14 25.651 -19.978 -9.267 1.00 41.31 C ATOM 187 CG2 ILE A 14 27.403 -21.487 -8.294 1.00 42.43 C ATOM 188 CD1 ILE A 14 26.005 -18.765 -8.436 1.00 3.32 C ATOM 0 H ILE A 14 26.637 -19.818 -11.927 1.00 1.45 H new ATOM 0 HA ILE A 14 28.367 -19.347 -9.624 1.00 53.20 H new ATOM 0 HB ILE A 14 26.514 -21.689 -10.222 1.00 74.22 H new ATOM 0 HG12 ILE A 14 25.205 -19.648 -10.205 1.00 41.31 H new ATOM 0 HG13 ILE A 14 24.894 -20.560 -8.741 1.00 41.31 H new ATOM 0 HG21 ILE A 14 26.617 -22.046 -7.787 1.00 42.43 H new ATOM 0 HG22 ILE A 14 28.227 -22.158 -8.537 1.00 42.43 H new ATOM 0 HG23 ILE A 14 27.763 -20.693 -7.640 1.00 42.43 H new ATOM 0 HD11 ILE A 14 25.108 -18.172 -8.257 1.00 3.32 H new ATOM 0 HD12 ILE A 14 26.423 -19.087 -7.482 1.00 3.32 H new ATOM 0 HD13 ILE A 14 26.739 -18.161 -8.969 1.00 3.32 H new ATOM 200 N PHE A 15 30.076 -21.176 -9.936 1.00 75.40 N ATOM 201 CA PHE A 15 31.190 -22.064 -10.248 1.00 52.24 C ATOM 202 C PHE A 15 31.613 -22.859 -9.017 1.00 62.41 C ATOM 203 O PHE A 15 31.738 -22.311 -7.923 1.00 32.22 O ATOM 204 CB PHE A 15 32.376 -21.259 -10.782 1.00 44.31 C ATOM 205 CG PHE A 15 33.450 -22.110 -11.397 1.00 43.11 C ATOM 206 CD1 PHE A 15 33.126 -23.130 -12.277 1.00 14.22 C ATOM 207 CD2 PHE A 15 34.785 -21.890 -11.095 1.00 34.42 C ATOM 208 CE1 PHE A 15 34.111 -23.915 -12.845 1.00 4.22 C ATOM 209 CE2 PHE A 15 35.775 -22.672 -11.660 1.00 13.20 C ATOM 210 CZ PHE A 15 35.438 -23.686 -12.535 1.00 14.00 C ATOM 0 H PHE A 15 30.167 -20.680 -9.049 1.00 75.40 H new ATOM 0 HA PHE A 15 30.860 -22.765 -11.015 1.00 52.24 H new ATOM 0 HB2 PHE A 15 32.017 -20.548 -11.526 1.00 44.31 H new ATOM 0 HB3 PHE A 15 32.807 -20.677 -9.967 1.00 44.31 H new ATOM 0 HD1 PHE A 15 32.090 -23.314 -12.522 1.00 14.22 H new ATOM 0 HD2 PHE A 15 35.055 -21.099 -10.411 1.00 34.42 H new ATOM 0 HE1 PHE A 15 33.844 -24.706 -13.530 1.00 4.22 H new ATOM 0 HE2 PHE A 15 36.812 -22.490 -11.417 1.00 13.20 H new ATOM 0 HZ PHE A 15 36.210 -24.299 -12.976 1.00 14.00 H new ATOM 220 N GLY A 16 31.832 -24.157 -9.205 1.00 24.41 N ATOM 221 CA GLY A 16 32.238 -25.008 -8.102 1.00 25.42 C ATOM 222 C GLY A 16 31.759 -26.437 -8.265 1.00 31.14 C ATOM 223 O GLY A 16 32.046 -27.086 -9.271 1.00 52.31 O ATOM 0 H GLY A 16 31.735 -24.634 -10.101 1.00 24.41 H new ATOM 0 HA2 GLY A 16 33.325 -24.999 -8.022 1.00 25.42 H new ATOM 0 HA3 GLY A 16 31.846 -24.601 -7.170 1.00 25.42 H new ATOM 227 N LYS A 17 31.027 -26.931 -7.271 1.00 43.34 N ATOM 228 CA LYS A 17 30.507 -28.292 -7.307 1.00 74.14 C ATOM 229 C LYS A 17 29.081 -28.315 -7.850 1.00 63.33 C ATOM 230 O LYS A 17 28.343 -29.279 -7.644 1.00 43.11 O ATOM 231 CB LYS A 17 30.541 -28.910 -5.908 1.00 33.40 C ATOM 232 CG LYS A 17 30.459 -30.427 -5.911 1.00 34.11 C ATOM 233 CD LYS A 17 31.838 -31.060 -5.987 1.00 31.11 C ATOM 234 CE LYS A 17 31.751 -32.576 -6.080 1.00 1.31 C ATOM 235 NZ LYS A 17 31.498 -33.199 -4.752 1.00 33.44 N ATOM 0 H LYS A 17 30.781 -26.408 -6.431 1.00 43.34 H new ATOM 0 HA LYS A 17 31.140 -28.879 -7.972 1.00 74.14 H new ATOM 0 HB2 LYS A 17 31.460 -28.605 -5.408 1.00 33.40 H new ATOM 0 HB3 LYS A 17 29.712 -28.511 -5.323 1.00 33.40 H new ATOM 0 HG2 LYS A 17 29.951 -30.767 -5.008 1.00 34.11 H new ATOM 0 HG3 LYS A 17 29.859 -30.758 -6.758 1.00 34.11 H new ATOM 0 HD2 LYS A 17 32.371 -30.671 -6.855 1.00 31.11 H new ATOM 0 HD3 LYS A 17 32.417 -30.781 -5.106 1.00 31.11 H new ATOM 0 HE2 LYS A 17 30.953 -32.852 -6.769 1.00 1.31 H new ATOM 0 HE3 LYS A 17 32.680 -32.968 -6.494 1.00 1.31 H new ATOM 0 HZ1 LYS A 17 31.445 -34.232 -4.858 1.00 33.44 H new ATOM 0 HZ2 LYS A 17 32.272 -32.956 -4.102 1.00 33.44 H new ATOM 0 HZ3 LYS A 17 30.599 -32.844 -4.368 1.00 33.44 H new ATOM 249 N VAL A 18 28.700 -27.249 -8.546 1.00 44.23 N ATOM 250 CA VAL A 18 27.364 -27.148 -9.121 1.00 63.22 C ATOM 251 C VAL A 18 27.217 -28.062 -10.332 1.00 71.33 C ATOM 252 O VAL A 18 26.111 -28.477 -10.678 1.00 11.04 O ATOM 253 CB VAL A 18 27.041 -25.702 -9.541 1.00 44.11 C ATOM 254 CG1 VAL A 18 26.882 -24.813 -8.317 1.00 20.21 C ATOM 255 CG2 VAL A 18 28.123 -25.162 -10.465 1.00 55.20 C ATOM 0 H VAL A 18 29.298 -26.442 -8.725 1.00 44.23 H new ATOM 0 HA VAL A 18 26.662 -27.459 -8.347 1.00 63.22 H new ATOM 0 HB VAL A 18 26.097 -25.702 -10.085 1.00 44.11 H new ATOM 0 HG11 VAL A 18 26.654 -23.795 -8.634 1.00 20.21 H new ATOM 0 HG12 VAL A 18 26.069 -25.190 -7.696 1.00 20.21 H new ATOM 0 HG13 VAL A 18 27.808 -24.815 -7.743 1.00 20.21 H new ATOM 0 HG21 VAL A 18 27.879 -24.139 -10.752 1.00 55.20 H new ATOM 0 HG22 VAL A 18 29.083 -25.175 -9.948 1.00 55.20 H new ATOM 0 HG23 VAL A 18 28.183 -25.785 -11.357 1.00 55.20 H new ATOM 265 N GLN A 19 28.339 -28.372 -10.973 1.00 25.52 N ATOM 266 CA GLN A 19 28.335 -29.238 -12.146 1.00 53.02 C ATOM 267 C GLN A 19 28.193 -30.702 -11.742 1.00 54.24 C ATOM 268 O GLN A 19 29.009 -31.231 -10.990 1.00 4.45 O ATOM 269 CB GLN A 19 29.618 -29.042 -12.956 1.00 33.23 C ATOM 270 CG GLN A 19 30.883 -29.365 -12.178 1.00 2.23 C ATOM 271 CD GLN A 19 32.143 -28.957 -12.916 1.00 55.34 C ATOM 272 OE1 GLN A 19 32.861 -28.052 -12.490 1.00 32.02 O ATOM 273 NE2 GLN A 19 32.418 -29.623 -14.031 1.00 75.43 N ATOM 0 H GLN A 19 29.263 -28.036 -10.700 1.00 25.52 H new ATOM 0 HA GLN A 19 27.479 -28.966 -12.764 1.00 53.02 H new ATOM 0 HB2 GLN A 19 29.577 -29.672 -13.844 1.00 33.23 H new ATOM 0 HB3 GLN A 19 29.667 -28.009 -13.300 1.00 33.23 H new ATOM 0 HG2 GLN A 19 30.851 -28.858 -11.214 1.00 2.23 H new ATOM 0 HG3 GLN A 19 30.916 -30.435 -11.974 1.00 2.23 H new ATOM 0 HE21 GLN A 19 31.795 -30.366 -14.348 1.00 75.43 H new ATOM 0 HE22 GLN A 19 33.252 -29.392 -14.571 1.00 75.43 H new ATOM 282 N GLY A 20 27.149 -31.352 -12.248 1.00 53.33 N ATOM 283 CA GLY A 20 26.918 -32.748 -11.928 1.00 64.44 C ATOM 284 C GLY A 20 26.005 -32.926 -10.732 1.00 30.21 C ATOM 285 O GLY A 20 25.981 -33.990 -10.113 1.00 11.15 O ATOM 0 H GLY A 20 26.459 -30.936 -12.874 1.00 53.33 H new ATOM 0 HA2 GLY A 20 26.481 -33.248 -12.792 1.00 64.44 H new ATOM 0 HA3 GLY A 20 27.873 -33.234 -11.728 1.00 64.44 H new ATOM 289 N VAL A 21 25.252 -31.881 -10.404 1.00 32.12 N ATOM 290 CA VAL A 21 24.333 -31.926 -9.273 1.00 32.12 C ATOM 291 C VAL A 21 22.986 -31.309 -9.634 1.00 23.11 C ATOM 292 O VAL A 21 22.921 -30.310 -10.351 1.00 22.22 O ATOM 293 CB VAL A 21 24.911 -31.190 -8.050 1.00 2.31 C ATOM 294 CG1 VAL A 21 24.014 -31.382 -6.837 1.00 13.11 C ATOM 295 CG2 VAL A 21 26.325 -31.670 -7.759 1.00 10.11 C ATOM 0 H VAL A 21 25.260 -30.993 -10.906 1.00 32.12 H new ATOM 0 HA VAL A 21 24.192 -32.977 -9.022 1.00 32.12 H new ATOM 0 HB VAL A 21 24.952 -30.124 -8.276 1.00 2.31 H new ATOM 0 HG11 VAL A 21 24.439 -30.855 -5.983 1.00 13.11 H new ATOM 0 HG12 VAL A 21 23.022 -30.985 -7.052 1.00 13.11 H new ATOM 0 HG13 VAL A 21 23.937 -32.444 -6.606 1.00 13.11 H new ATOM 0 HG21 VAL A 21 26.718 -31.139 -6.892 1.00 10.11 H new ATOM 0 HG22 VAL A 21 26.311 -32.740 -7.554 1.00 10.11 H new ATOM 0 HG23 VAL A 21 26.961 -31.474 -8.623 1.00 10.11 H new ATOM 305 N PHE A 22 21.913 -31.910 -9.132 1.00 75.33 N ATOM 306 CA PHE A 22 20.566 -31.420 -9.402 1.00 71.23 C ATOM 307 C PHE A 22 20.148 -30.379 -8.368 1.00 5.01 C ATOM 308 O PHE A 22 19.560 -30.711 -7.339 1.00 32.12 O ATOM 309 CB PHE A 22 19.569 -32.581 -9.405 1.00 51.11 C ATOM 310 CG PHE A 22 19.644 -33.433 -10.640 1.00 10.31 C ATOM 311 CD1 PHE A 22 19.569 -32.859 -11.899 1.00 31.01 C ATOM 312 CD2 PHE A 22 19.789 -34.807 -10.542 1.00 21.23 C ATOM 313 CE1 PHE A 22 19.638 -33.640 -13.037 1.00 41.13 C ATOM 314 CE2 PHE A 22 19.859 -35.593 -11.676 1.00 43.04 C ATOM 315 CZ PHE A 22 19.782 -35.009 -12.926 1.00 4.23 C ATOM 0 H PHE A 22 21.949 -32.737 -8.536 1.00 75.33 H new ATOM 0 HA PHE A 22 20.568 -30.949 -10.385 1.00 71.23 H new ATOM 0 HB2 PHE A 22 19.749 -33.206 -8.531 1.00 51.11 H new ATOM 0 HB3 PHE A 22 18.559 -32.182 -9.309 1.00 51.11 H new ATOM 0 HD1 PHE A 22 19.455 -31.789 -11.992 1.00 31.01 H new ATOM 0 HD2 PHE A 22 19.848 -35.269 -9.568 1.00 21.23 H new ATOM 0 HE1 PHE A 22 19.579 -33.180 -14.012 1.00 41.13 H new ATOM 0 HE2 PHE A 22 19.974 -36.663 -11.586 1.00 43.04 H new ATOM 0 HZ PHE A 22 19.834 -35.622 -13.814 1.00 4.23 H new ATOM 325 N PHE A 23 20.458 -29.118 -8.649 1.00 3.43 N ATOM 326 CA PHE A 23 20.117 -28.027 -7.743 1.00 4.22 C ATOM 327 C PHE A 23 19.242 -26.992 -8.443 1.00 42.43 C ATOM 328 O PHE A 23 19.232 -25.818 -8.071 1.00 70.03 O ATOM 329 CB PHE A 23 21.388 -27.361 -7.211 1.00 43.03 C ATOM 330 CG PHE A 23 22.146 -26.595 -8.258 1.00 3.04 C ATOM 331 CD1 PHE A 23 22.938 -27.257 -9.182 1.00 4.22 C ATOM 332 CD2 PHE A 23 22.067 -25.213 -8.316 1.00 41.14 C ATOM 333 CE1 PHE A 23 23.637 -26.555 -10.146 1.00 70.02 C ATOM 334 CE2 PHE A 23 22.763 -24.506 -9.279 1.00 11.23 C ATOM 335 CZ PHE A 23 23.550 -25.178 -10.194 1.00 12.51 C ATOM 0 H PHE A 23 20.945 -28.826 -9.497 1.00 3.43 H new ATOM 0 HA PHE A 23 19.557 -28.445 -6.907 1.00 4.22 H new ATOM 0 HB2 PHE A 23 21.122 -26.685 -6.399 1.00 43.03 H new ATOM 0 HB3 PHE A 23 22.040 -28.126 -6.788 1.00 43.03 H new ATOM 0 HD1 PHE A 23 23.010 -28.334 -9.149 1.00 4.22 H new ATOM 0 HD2 PHE A 23 21.455 -24.682 -7.601 1.00 41.14 H new ATOM 0 HE1 PHE A 23 24.251 -27.083 -10.861 1.00 70.02 H new ATOM 0 HE2 PHE A 23 22.691 -23.429 -9.316 1.00 11.23 H new ATOM 0 HZ PHE A 23 24.096 -24.627 -10.945 1.00 12.51 H new ATOM 345 N ARG A 24 18.510 -27.435 -9.459 1.00 75.25 N ATOM 346 CA ARG A 24 17.632 -26.548 -10.214 1.00 4.24 C ATOM 347 C ARG A 24 16.238 -26.507 -9.595 1.00 61.21 C ATOM 348 O ARG A 24 15.556 -25.483 -9.642 1.00 33.42 O ATOM 349 CB ARG A 24 17.542 -27.003 -11.671 1.00 63.13 C ATOM 350 CG ARG A 24 16.704 -28.256 -11.867 1.00 40.35 C ATOM 351 CD ARG A 24 17.192 -29.072 -13.054 1.00 72.20 C ATOM 352 NE ARG A 24 17.391 -28.246 -14.242 1.00 25.32 N ATOM 353 CZ ARG A 24 17.992 -28.679 -15.345 1.00 50.40 C ATOM 354 NH1 ARG A 24 18.449 -29.922 -15.412 1.00 13.54 N ATOM 355 NH2 ARG A 24 18.136 -27.867 -16.385 1.00 21.11 N ATOM 0 H ARG A 24 18.507 -28.403 -9.779 1.00 75.25 H new ATOM 0 HA ARG A 24 18.055 -25.544 -10.180 1.00 4.24 H new ATOM 0 HB2 ARG A 24 17.119 -26.196 -12.269 1.00 63.13 H new ATOM 0 HB3 ARG A 24 18.548 -27.186 -12.048 1.00 63.13 H new ATOM 0 HG2 ARG A 24 16.742 -28.866 -10.964 1.00 40.35 H new ATOM 0 HG3 ARG A 24 15.661 -27.978 -12.019 1.00 40.35 H new ATOM 0 HD2 ARG A 24 18.129 -29.565 -12.794 1.00 72.20 H new ATOM 0 HD3 ARG A 24 16.469 -29.857 -13.276 1.00 72.20 H new ATOM 0 HE ARG A 24 17.050 -27.285 -14.224 1.00 25.32 H new ATOM 0 HH11 ARG A 24 18.340 -30.549 -14.615 1.00 13.54 H new ATOM 0 HH12 ARG A 24 18.910 -30.251 -16.260 1.00 13.54 H new ATOM 0 HH21 ARG A 24 17.785 -26.910 -16.338 1.00 21.11 H new ATOM 0 HH22 ARG A 24 18.597 -28.200 -17.232 1.00 21.11 H new ATOM 369 N LYS A 25 15.820 -27.628 -9.016 1.00 44.13 N ATOM 370 CA LYS A 25 14.508 -27.722 -8.388 1.00 2.35 C ATOM 371 C LYS A 25 14.444 -26.859 -7.131 1.00 61.30 C ATOM 372 O LYS A 25 13.370 -26.414 -6.726 1.00 12.12 O ATOM 373 CB LYS A 25 14.191 -29.177 -8.037 1.00 30.23 C ATOM 374 CG LYS A 25 12.705 -29.492 -8.035 1.00 21.43 C ATOM 375 CD LYS A 25 12.453 -30.991 -8.059 1.00 11.43 C ATOM 376 CE LYS A 25 12.660 -31.568 -9.450 1.00 72.44 C ATOM 377 NZ LYS A 25 11.900 -32.835 -9.644 1.00 0.52 N ATOM 0 H LYS A 25 16.372 -28.485 -8.969 1.00 44.13 H new ATOM 0 HA LYS A 25 13.766 -27.356 -9.097 1.00 2.35 H new ATOM 0 HB2 LYS A 25 14.692 -29.832 -8.750 1.00 30.23 H new ATOM 0 HB3 LYS A 25 14.603 -29.403 -7.054 1.00 30.23 H new ATOM 0 HG2 LYS A 25 12.241 -29.058 -7.149 1.00 21.43 H new ATOM 0 HG3 LYS A 25 12.233 -29.029 -8.901 1.00 21.43 H new ATOM 0 HD2 LYS A 25 13.123 -31.485 -7.355 1.00 11.43 H new ATOM 0 HD3 LYS A 25 11.435 -31.195 -7.727 1.00 11.43 H new ATOM 0 HE2 LYS A 25 12.346 -30.838 -10.196 1.00 72.44 H new ATOM 0 HE3 LYS A 25 13.722 -31.753 -9.612 1.00 72.44 H new ATOM 0 HZ1 LYS A 25 12.067 -33.197 -10.605 1.00 0.52 H new ATOM 0 HZ2 LYS A 25 12.217 -33.540 -8.948 1.00 0.52 H new ATOM 0 HZ3 LYS A 25 10.884 -32.654 -9.515 1.00 0.52 H new ATOM 391 N HIS A 26 15.601 -26.626 -6.519 1.00 32.10 N ATOM 392 CA HIS A 26 15.676 -25.815 -5.309 1.00 53.43 C ATOM 393 C HIS A 26 15.738 -24.330 -5.654 1.00 43.32 C ATOM 394 O HIS A 26 15.336 -23.479 -4.860 1.00 2.13 O ATOM 395 CB HIS A 26 16.898 -26.209 -4.480 1.00 31.52 C ATOM 396 CG HIS A 26 16.610 -27.259 -3.451 1.00 13.34 C ATOM 397 ND1 HIS A 26 17.048 -28.562 -3.561 1.00 14.40 N ATOM 398 CD2 HIS A 26 15.925 -27.191 -2.285 1.00 74.12 C ATOM 399 CE1 HIS A 26 16.643 -29.250 -2.509 1.00 33.40 C ATOM 400 NE2 HIS A 26 15.960 -28.442 -1.719 1.00 55.32 N ATOM 0 H HIS A 26 16.499 -26.987 -6.841 1.00 32.10 H new ATOM 0 HA HIS A 26 14.775 -25.997 -4.723 1.00 53.43 H new ATOM 0 HB2 HIS A 26 17.679 -26.572 -5.149 1.00 31.52 H new ATOM 0 HB3 HIS A 26 17.291 -25.322 -3.982 1.00 31.52 H new ATOM 0 HD2 HIS A 26 15.441 -26.316 -1.876 1.00 74.12 H new ATOM 0 HE1 HIS A 26 16.838 -30.296 -2.326 1.00 33.40 H new ATOM 0 HE2 HIS A 26 15.529 -28.704 -0.833 1.00 55.32 H new ATOM 408 N THR A 27 16.246 -24.024 -6.844 1.00 62.33 N ATOM 409 CA THR A 27 16.363 -22.643 -7.294 1.00 5.25 C ATOM 410 C THR A 27 14.994 -22.046 -7.598 1.00 4.40 C ATOM 411 O THR A 27 14.679 -20.939 -7.161 1.00 23.34 O ATOM 412 CB THR A 27 17.249 -22.534 -8.549 1.00 3.41 C ATOM 413 OG1 THR A 27 18.548 -23.074 -8.281 1.00 10.03 O ATOM 414 CG2 THR A 27 17.379 -21.085 -8.995 1.00 64.11 C ATOM 0 H THR A 27 16.583 -24.715 -7.514 1.00 62.33 H new ATOM 0 HA THR A 27 16.827 -22.084 -6.481 1.00 5.25 H new ATOM 0 HB THR A 27 16.778 -23.104 -9.350 1.00 3.41 H new ATOM 0 HG1 THR A 27 18.498 -24.053 -8.262 1.00 10.03 H new ATOM 0 HG21 THR A 27 18.009 -21.033 -9.883 1.00 64.11 H new ATOM 0 HG22 THR A 27 16.392 -20.686 -9.227 1.00 64.11 H new ATOM 0 HG23 THR A 27 17.830 -20.497 -8.195 1.00 64.11 H new ATOM 422 N GLN A 28 14.185 -22.785 -8.349 1.00 61.14 N ATOM 423 CA GLN A 28 12.849 -22.327 -8.712 1.00 21.03 C ATOM 424 C GLN A 28 12.066 -21.900 -7.475 1.00 0.14 C ATOM 425 O GLN A 28 11.431 -20.846 -7.464 1.00 35.24 O ATOM 426 CB GLN A 28 12.092 -23.430 -9.453 1.00 63.32 C ATOM 427 CG GLN A 28 10.623 -23.114 -9.680 1.00 11.34 C ATOM 428 CD GLN A 28 9.752 -23.514 -8.505 1.00 72.33 C ATOM 429 OE1 GLN A 28 9.947 -24.572 -7.905 1.00 51.41 O ATOM 430 NE2 GLN A 28 8.784 -22.669 -8.171 1.00 34.43 N ATOM 0 H GLN A 28 14.431 -23.703 -8.718 1.00 61.14 H new ATOM 0 HA GLN A 28 12.954 -21.464 -9.370 1.00 21.03 H new ATOM 0 HB2 GLN A 28 12.571 -23.603 -10.417 1.00 63.32 H new ATOM 0 HB3 GLN A 28 12.172 -24.358 -8.886 1.00 63.32 H new ATOM 0 HG2 GLN A 28 10.509 -22.046 -9.865 1.00 11.34 H new ATOM 0 HG3 GLN A 28 10.278 -23.631 -10.576 1.00 11.34 H new ATOM 0 HE21 GLN A 28 8.659 -21.804 -8.696 1.00 34.43 H new ATOM 0 HE22 GLN A 28 8.166 -22.885 -7.389 1.00 34.43 H new ATOM 439 N ALA A 29 12.116 -22.726 -6.434 1.00 42.54 N ATOM 440 CA ALA A 29 11.413 -22.432 -5.192 1.00 31.32 C ATOM 441 C ALA A 29 11.949 -21.160 -4.545 1.00 22.05 C ATOM 442 O ALA A 29 11.182 -20.331 -4.057 1.00 1.32 O ATOM 443 CB ALA A 29 11.529 -23.606 -4.230 1.00 42.40 C ATOM 0 H ALA A 29 12.636 -23.603 -6.427 1.00 42.54 H new ATOM 0 HA ALA A 29 10.361 -22.272 -5.428 1.00 31.32 H new ATOM 0 HB1 ALA A 29 10.999 -23.373 -3.306 1.00 42.40 H new ATOM 0 HB2 ALA A 29 11.091 -24.494 -4.685 1.00 42.40 H new ATOM 0 HB3 ALA A 29 12.580 -23.793 -4.009 1.00 42.40 H new ATOM 449 N GLU A 30 13.270 -21.014 -4.543 1.00 45.44 N ATOM 450 CA GLU A 30 13.908 -19.842 -3.954 1.00 21.20 C ATOM 451 C GLU A 30 13.342 -18.557 -4.550 1.00 51.34 C ATOM 452 O GLU A 30 13.177 -17.556 -3.854 1.00 21.33 O ATOM 453 CB GLU A 30 15.422 -19.895 -4.171 1.00 12.50 C ATOM 454 CG GLU A 30 16.179 -18.794 -3.447 1.00 51.10 C ATOM 455 CD GLU A 30 15.867 -18.749 -1.964 1.00 32.42 C ATOM 456 OE1 GLU A 30 15.986 -19.800 -1.300 1.00 60.20 O ATOM 457 OE2 GLU A 30 15.503 -17.663 -1.467 1.00 43.41 O ATOM 0 H GLU A 30 13.919 -21.692 -4.942 1.00 45.44 H new ATOM 0 HA GLU A 30 13.701 -19.847 -2.884 1.00 21.20 H new ATOM 0 HB2 GLU A 30 15.795 -20.862 -3.835 1.00 12.50 H new ATOM 0 HB3 GLU A 30 15.630 -19.826 -5.239 1.00 12.50 H new ATOM 0 HG2 GLU A 30 17.250 -18.944 -3.585 1.00 51.10 H new ATOM 0 HG3 GLU A 30 15.931 -17.832 -3.896 1.00 51.10 H new ATOM 464 N GLY A 31 13.047 -18.592 -5.846 1.00 75.34 N ATOM 465 CA GLY A 31 12.503 -17.425 -6.516 1.00 10.04 C ATOM 466 C GLY A 31 11.135 -17.039 -5.989 1.00 71.31 C ATOM 467 O GLY A 31 10.690 -15.905 -6.165 1.00 42.24 O ATOM 0 H GLY A 31 13.175 -19.408 -6.444 1.00 75.34 H new ATOM 0 HA2 GLY A 31 13.187 -16.586 -6.391 1.00 10.04 H new ATOM 0 HA3 GLY A 31 12.434 -17.623 -7.586 1.00 10.04 H new ATOM 471 N LYS A 32 10.464 -17.986 -5.342 1.00 15.33 N ATOM 472 CA LYS A 32 9.137 -17.741 -4.788 1.00 3.24 C ATOM 473 C LYS A 32 9.232 -17.004 -3.455 1.00 52.35 C ATOM 474 O LYS A 32 8.331 -16.251 -3.085 1.00 53.23 O ATOM 475 CB LYS A 32 8.389 -19.062 -4.599 1.00 74.24 C ATOM 476 CG LYS A 32 6.880 -18.902 -4.535 1.00 35.42 C ATOM 477 CD LYS A 32 6.167 -20.204 -4.861 1.00 55.14 C ATOM 478 CE LYS A 32 6.105 -20.444 -6.362 1.00 33.20 C ATOM 479 NZ LYS A 32 5.702 -21.841 -6.684 1.00 23.42 N ATOM 0 H LYS A 32 10.817 -18.930 -5.188 1.00 15.33 H new ATOM 0 HA LYS A 32 8.587 -17.116 -5.491 1.00 3.24 H new ATOM 0 HB2 LYS A 32 8.640 -19.733 -5.420 1.00 74.24 H new ATOM 0 HB3 LYS A 32 8.735 -19.538 -3.681 1.00 74.24 H new ATOM 0 HG2 LYS A 32 6.591 -18.567 -3.539 1.00 35.42 H new ATOM 0 HG3 LYS A 32 6.565 -18.128 -5.235 1.00 35.42 H new ATOM 0 HD2 LYS A 32 6.684 -21.034 -4.380 1.00 55.14 H new ATOM 0 HD3 LYS A 32 5.156 -20.179 -4.453 1.00 55.14 H new ATOM 0 HE2 LYS A 32 5.396 -19.749 -6.812 1.00 33.20 H new ATOM 0 HE3 LYS A 32 7.080 -20.236 -6.804 1.00 33.20 H new ATOM 0 HZ1 LYS A 32 5.671 -21.964 -7.716 1.00 23.42 H new ATOM 0 HZ2 LYS A 32 6.392 -22.504 -6.276 1.00 23.42 H new ATOM 0 HZ3 LYS A 32 4.761 -22.032 -6.285 1.00 23.42 H new ATOM 493 N LYS A 33 10.329 -17.224 -2.739 1.00 50.02 N ATOM 494 CA LYS A 33 10.543 -16.579 -1.449 1.00 44.13 C ATOM 495 C LYS A 33 10.524 -15.060 -1.590 1.00 74.33 C ATOM 496 O LYS A 33 9.580 -14.398 -1.155 1.00 62.42 O ATOM 497 CB LYS A 33 11.876 -17.028 -0.847 1.00 24.45 C ATOM 498 CG LYS A 33 11.784 -18.328 -0.066 1.00 73.34 C ATOM 499 CD LYS A 33 13.044 -18.584 0.743 1.00 61.24 C ATOM 500 CE LYS A 33 12.948 -19.883 1.528 1.00 62.42 C ATOM 501 NZ LYS A 33 14.152 -20.109 2.375 1.00 33.43 N ATOM 0 H LYS A 33 11.084 -17.845 -3.030 1.00 50.02 H new ATOM 0 HA LYS A 33 9.732 -16.875 -0.784 1.00 44.13 H new ATOM 0 HB2 LYS A 33 12.605 -17.146 -1.648 1.00 24.45 H new ATOM 0 HB3 LYS A 33 12.250 -16.244 -0.189 1.00 24.45 H new ATOM 0 HG2 LYS A 33 10.923 -18.292 0.602 1.00 73.34 H new ATOM 0 HG3 LYS A 33 11.619 -19.156 -0.755 1.00 73.34 H new ATOM 0 HD2 LYS A 33 13.905 -18.624 0.075 1.00 61.24 H new ATOM 0 HD3 LYS A 33 13.212 -17.754 1.430 1.00 61.24 H new ATOM 0 HE2 LYS A 33 12.059 -19.862 2.159 1.00 62.42 H new ATOM 0 HE3 LYS A 33 12.828 -20.717 0.837 1.00 62.42 H new ATOM 0 HZ1 LYS A 33 14.048 -21.004 2.894 1.00 33.43 H new ATOM 0 HZ2 LYS A 33 14.998 -20.155 1.771 1.00 33.43 H new ATOM 0 HZ3 LYS A 33 14.252 -19.326 3.052 1.00 33.43 H new ATOM 515 N LEU A 34 11.569 -14.514 -2.202 1.00 13.13 N ATOM 516 CA LEU A 34 11.670 -13.072 -2.402 1.00 25.42 C ATOM 517 C LEU A 34 10.539 -12.565 -3.290 1.00 43.32 C ATOM 518 O LEU A 34 10.082 -11.432 -3.144 1.00 20.00 O ATOM 519 CB LEU A 34 13.022 -12.718 -3.025 1.00 72.30 C ATOM 520 CG LEU A 34 14.168 -12.468 -2.045 1.00 22.25 C ATOM 521 CD1 LEU A 34 13.833 -11.312 -1.115 1.00 33.53 C ATOM 522 CD2 LEU A 34 14.471 -13.727 -1.246 1.00 20.45 C ATOM 0 H LEU A 34 12.358 -15.047 -2.568 1.00 13.13 H new ATOM 0 HA LEU A 34 11.587 -12.588 -1.429 1.00 25.42 H new ATOM 0 HB2 LEU A 34 13.314 -13.527 -3.695 1.00 72.30 H new ATOM 0 HB3 LEU A 34 12.894 -11.826 -3.639 1.00 72.30 H new ATOM 0 HG LEU A 34 15.057 -12.202 -2.616 1.00 22.25 H new ATOM 0 HD11 LEU A 34 14.661 -11.149 -0.425 1.00 33.53 H new ATOM 0 HD12 LEU A 34 13.667 -10.409 -1.702 1.00 33.53 H new ATOM 0 HD13 LEU A 34 12.931 -11.549 -0.551 1.00 33.53 H new ATOM 0 HD21 LEU A 34 15.289 -13.530 -0.554 1.00 20.45 H new ATOM 0 HD22 LEU A 34 13.585 -14.024 -0.685 1.00 20.45 H new ATOM 0 HD23 LEU A 34 14.756 -14.530 -1.926 1.00 20.45 H new ATOM 534 N GLY A 35 10.091 -13.413 -4.211 1.00 54.41 N ATOM 535 CA GLY A 35 9.015 -13.032 -5.108 1.00 61.51 C ATOM 536 C GLY A 35 9.525 -12.504 -6.434 1.00 64.10 C ATOM 537 O GLY A 35 9.498 -11.298 -6.682 1.00 40.13 O ATOM 0 H GLY A 35 10.453 -14.356 -4.352 1.00 54.41 H new ATOM 0 HA2 GLY A 35 8.373 -13.894 -5.287 1.00 61.51 H new ATOM 0 HA3 GLY A 35 8.400 -12.270 -4.629 1.00 61.51 H new ATOM 541 N LEU A 36 9.994 -13.407 -7.288 1.00 71.30 N ATOM 542 CA LEU A 36 10.515 -13.026 -8.596 1.00 51.41 C ATOM 543 C LEU A 36 10.199 -14.092 -9.640 1.00 44.12 C ATOM 544 O LEU A 36 9.681 -15.160 -9.315 1.00 70.10 O ATOM 545 CB LEU A 36 12.026 -12.802 -8.520 1.00 1.34 C ATOM 546 CG LEU A 36 12.484 -11.576 -7.729 1.00 11.40 C ATOM 547 CD1 LEU A 36 12.565 -11.897 -6.245 1.00 24.32 C ATOM 548 CD2 LEU A 36 13.827 -11.080 -8.244 1.00 24.12 C ATOM 0 H LEU A 36 10.024 -14.409 -7.098 1.00 71.30 H new ATOM 0 HA LEU A 36 10.031 -12.096 -8.895 1.00 51.41 H new ATOM 0 HB2 LEU A 36 12.482 -13.687 -8.076 1.00 1.34 H new ATOM 0 HB3 LEU A 36 12.412 -12.719 -9.536 1.00 1.34 H new ATOM 0 HG LEU A 36 11.749 -10.783 -7.868 1.00 11.40 H new ATOM 0 HD11 LEU A 36 12.893 -11.012 -5.699 1.00 24.32 H new ATOM 0 HD12 LEU A 36 11.583 -12.203 -5.885 1.00 24.32 H new ATOM 0 HD13 LEU A 36 13.278 -12.706 -6.086 1.00 24.32 H new ATOM 0 HD21 LEU A 36 14.137 -10.207 -7.669 1.00 24.12 H new ATOM 0 HD22 LEU A 36 14.572 -11.869 -8.136 1.00 24.12 H new ATOM 0 HD23 LEU A 36 13.736 -10.808 -9.296 1.00 24.12 H new ATOM 560 N VAL A 37 10.518 -13.795 -10.896 1.00 72.43 N ATOM 561 CA VAL A 37 10.272 -14.730 -11.988 1.00 53.43 C ATOM 562 C VAL A 37 11.546 -14.996 -12.781 1.00 62.32 C ATOM 563 O VAL A 37 12.619 -14.501 -12.438 1.00 15.31 O ATOM 564 CB VAL A 37 9.186 -14.201 -12.945 1.00 21.52 C ATOM 565 CG1 VAL A 37 7.854 -14.074 -12.222 1.00 74.13 C ATOM 566 CG2 VAL A 37 9.607 -12.868 -13.543 1.00 40.14 C ATOM 0 H VAL A 37 10.947 -12.915 -11.182 1.00 72.43 H new ATOM 0 HA VAL A 37 9.927 -15.660 -11.537 1.00 53.43 H new ATOM 0 HB VAL A 37 9.064 -14.915 -13.759 1.00 21.52 H new ATOM 0 HG11 VAL A 37 7.099 -13.699 -12.913 1.00 74.13 H new ATOM 0 HG12 VAL A 37 7.549 -15.051 -11.847 1.00 74.13 H new ATOM 0 HG13 VAL A 37 7.958 -13.381 -11.387 1.00 74.13 H new ATOM 0 HG21 VAL A 37 8.828 -12.509 -14.216 1.00 40.14 H new ATOM 0 HG22 VAL A 37 9.759 -12.142 -12.744 1.00 40.14 H new ATOM 0 HG23 VAL A 37 10.536 -12.996 -14.098 1.00 40.14 H new ATOM 576 N GLY A 38 11.421 -15.783 -13.846 1.00 31.55 N ATOM 577 CA GLY A 38 12.571 -16.102 -14.672 1.00 34.54 C ATOM 578 C GLY A 38 12.636 -17.574 -15.030 1.00 44.24 C ATOM 579 O GLY A 38 11.607 -18.242 -15.128 1.00 62.02 O ATOM 0 H GLY A 38 10.544 -16.205 -14.151 1.00 31.55 H new ATOM 0 HA2 GLY A 38 12.533 -15.510 -15.586 1.00 34.54 H new ATOM 0 HA3 GLY A 38 13.483 -15.818 -14.146 1.00 34.54 H new ATOM 583 N TRP A 39 13.848 -18.079 -15.228 1.00 45.24 N ATOM 584 CA TRP A 39 14.044 -19.481 -15.580 1.00 50.35 C ATOM 585 C TRP A 39 15.475 -19.920 -15.292 1.00 43.14 C ATOM 586 O TRP A 39 16.315 -19.112 -14.896 1.00 1.31 O ATOM 587 CB TRP A 39 13.715 -19.708 -17.057 1.00 1.31 C ATOM 588 CG TRP A 39 14.706 -19.079 -17.990 1.00 32.24 C ATOM 589 CD1 TRP A 39 15.907 -19.598 -18.381 1.00 32.52 C ATOM 590 CD2 TRP A 39 14.581 -17.813 -18.646 1.00 11.10 C ATOM 591 NE1 TRP A 39 16.536 -18.731 -19.241 1.00 21.20 N ATOM 592 CE2 TRP A 39 15.743 -17.629 -19.420 1.00 41.25 C ATOM 593 CE3 TRP A 39 13.600 -16.818 -18.657 1.00 11.23 C ATOM 594 CZ2 TRP A 39 15.949 -16.490 -20.195 1.00 14.04 C ATOM 595 CZ3 TRP A 39 13.806 -15.688 -19.425 1.00 54.02 C ATOM 596 CH2 TRP A 39 14.972 -15.532 -20.186 1.00 53.32 C ATOM 0 H TRP A 39 14.710 -17.539 -15.151 1.00 45.24 H new ATOM 0 HA TRP A 39 13.370 -20.081 -14.968 1.00 50.35 H new ATOM 0 HB2 TRP A 39 13.673 -20.780 -17.252 1.00 1.31 H new ATOM 0 HB3 TRP A 39 12.724 -19.307 -17.267 1.00 1.31 H new ATOM 0 HD1 TRP A 39 16.304 -20.550 -18.061 1.00 32.52 H new ATOM 0 HE1 TRP A 39 17.446 -18.883 -19.676 1.00 21.20 H new ATOM 0 HE3 TRP A 39 12.697 -16.930 -18.076 1.00 11.23 H new ATOM 0 HZ2 TRP A 39 16.847 -16.367 -20.782 1.00 14.04 H new ATOM 0 HZ3 TRP A 39 13.055 -14.912 -19.439 1.00 54.02 H new ATOM 0 HH2 TRP A 39 15.102 -14.638 -20.777 1.00 53.32 H new ATOM 607 N VAL A 40 15.748 -21.205 -15.494 1.00 74.23 N ATOM 608 CA VAL A 40 17.079 -21.751 -15.257 1.00 74.23 C ATOM 609 C VAL A 40 17.535 -22.615 -16.428 1.00 12.21 C ATOM 610 O VAL A 40 16.738 -23.338 -17.025 1.00 22.53 O ATOM 611 CB VAL A 40 17.119 -22.592 -13.967 1.00 51.42 C ATOM 612 CG1 VAL A 40 18.510 -23.167 -13.748 1.00 32.11 C ATOM 613 CG2 VAL A 40 16.685 -21.755 -12.773 1.00 73.11 C ATOM 0 H VAL A 40 15.065 -21.888 -15.821 1.00 74.23 H new ATOM 0 HA VAL A 40 17.755 -20.903 -15.150 1.00 74.23 H new ATOM 0 HB VAL A 40 16.421 -23.423 -14.073 1.00 51.42 H new ATOM 0 HG11 VAL A 40 18.519 -23.758 -12.832 1.00 32.11 H new ATOM 0 HG12 VAL A 40 18.778 -23.802 -14.592 1.00 32.11 H new ATOM 0 HG13 VAL A 40 19.231 -22.354 -13.662 1.00 32.11 H new ATOM 0 HG21 VAL A 40 16.719 -22.364 -11.870 1.00 73.11 H new ATOM 0 HG22 VAL A 40 17.357 -20.904 -12.662 1.00 73.11 H new ATOM 0 HG23 VAL A 40 15.668 -21.396 -12.931 1.00 73.11 H new ATOM 623 N GLN A 41 18.822 -22.533 -16.750 1.00 73.21 N ATOM 624 CA GLN A 41 19.384 -23.308 -17.850 1.00 52.21 C ATOM 625 C GLN A 41 20.774 -23.826 -17.497 1.00 0.34 C ATOM 626 O GLN A 41 21.538 -23.157 -16.802 1.00 13.04 O ATOM 627 CB GLN A 41 19.451 -22.456 -19.119 1.00 62.41 C ATOM 628 CG GLN A 41 19.322 -23.263 -20.401 1.00 22.41 C ATOM 629 CD GLN A 41 20.609 -23.971 -20.777 1.00 30.32 C ATOM 630 OE1 GLN A 41 20.637 -25.193 -20.931 1.00 50.30 O ATOM 631 NE2 GLN A 41 21.684 -23.206 -20.927 1.00 32.12 N ATOM 0 H GLN A 41 19.494 -21.938 -16.265 1.00 73.21 H new ATOM 0 HA GLN A 41 18.733 -24.164 -18.029 1.00 52.21 H new ATOM 0 HB2 GLN A 41 18.657 -21.710 -19.088 1.00 62.41 H new ATOM 0 HB3 GLN A 41 20.397 -21.915 -19.134 1.00 62.41 H new ATOM 0 HG2 GLN A 41 18.527 -24.000 -20.284 1.00 22.41 H new ATOM 0 HG3 GLN A 41 19.025 -22.601 -21.214 1.00 22.41 H new ATOM 0 HE21 GLN A 41 21.616 -22.198 -20.790 1.00 32.12 H new ATOM 0 HE22 GLN A 41 22.578 -23.627 -21.180 1.00 32.12 H new ATOM 640 N ASN A 42 21.095 -25.021 -17.980 1.00 23.43 N ATOM 641 CA ASN A 42 22.394 -25.630 -17.714 1.00 12.43 C ATOM 642 C ASN A 42 23.227 -25.713 -18.989 1.00 71.51 C ATOM 643 O ASN A 42 22.832 -26.358 -19.961 1.00 52.24 O ATOM 644 CB ASN A 42 22.213 -27.027 -17.116 1.00 42.44 C ATOM 645 CG ASN A 42 23.535 -27.738 -16.899 1.00 51.20 C ATOM 646 OD1 ASN A 42 24.136 -28.256 -17.840 1.00 40.44 O ATOM 647 ND2 ASN A 42 23.993 -27.766 -15.653 1.00 63.21 N ATOM 0 H ASN A 42 20.474 -25.588 -18.558 1.00 23.43 H new ATOM 0 HA ASN A 42 22.922 -25.002 -16.997 1.00 12.43 H new ATOM 0 HB2 ASN A 42 21.686 -26.947 -16.165 1.00 42.44 H new ATOM 0 HB3 ASN A 42 21.586 -27.624 -17.778 1.00 42.44 H new ATOM 0 HD21 ASN A 42 24.877 -28.230 -15.445 1.00 63.21 H new ATOM 0 HD22 ASN A 42 23.461 -27.323 -14.904 1.00 63.21 H new ATOM 654 N THR A 43 24.383 -25.058 -18.978 1.00 44.13 N ATOM 655 CA THR A 43 25.272 -25.057 -20.133 1.00 64.32 C ATOM 656 C THR A 43 26.023 -26.379 -20.250 1.00 4.34 C ATOM 657 O THR A 43 26.024 -27.187 -19.321 1.00 5.01 O ATOM 658 CB THR A 43 26.292 -23.905 -20.057 1.00 22.44 C ATOM 659 OG1 THR A 43 27.274 -24.186 -19.052 1.00 72.05 O ATOM 660 CG2 THR A 43 25.599 -22.589 -19.741 1.00 14.31 C ATOM 0 H THR A 43 24.726 -24.521 -18.182 1.00 44.13 H new ATOM 0 HA THR A 43 24.645 -24.919 -21.014 1.00 64.32 H new ATOM 0 HB THR A 43 26.780 -23.817 -21.028 1.00 22.44 H new ATOM 0 HG1 THR A 43 26.825 -24.424 -18.214 1.00 72.05 H new ATOM 0 HG21 THR A 43 26.339 -21.790 -19.692 1.00 14.31 H new ATOM 0 HG22 THR A 43 24.873 -22.364 -20.522 1.00 14.31 H new ATOM 0 HG23 THR A 43 25.087 -22.668 -18.782 1.00 14.31 H new ATOM 668 N ASP A 44 26.662 -26.592 -21.395 1.00 32.01 N ATOM 669 CA ASP A 44 27.419 -27.816 -21.632 1.00 12.31 C ATOM 670 C ASP A 44 28.919 -27.550 -21.556 1.00 0.13 C ATOM 671 O ASP A 44 29.708 -28.187 -22.254 1.00 4.52 O ATOM 672 CB ASP A 44 27.061 -28.405 -22.997 1.00 64.51 C ATOM 673 CG ASP A 44 27.603 -29.810 -23.181 1.00 12.42 C ATOM 674 OD1 ASP A 44 27.231 -30.698 -22.386 1.00 34.23 O ATOM 675 OD2 ASP A 44 28.398 -30.020 -24.120 1.00 71.21 O ATOM 0 H ASP A 44 26.671 -25.933 -22.174 1.00 32.01 H new ATOM 0 HA ASP A 44 27.156 -28.534 -20.855 1.00 12.31 H new ATOM 0 HB2 ASP A 44 25.977 -28.419 -23.111 1.00 64.51 H new ATOM 0 HB3 ASP A 44 27.456 -27.761 -23.783 1.00 64.51 H new ATOM 680 N ARG A 45 29.305 -26.605 -20.704 1.00 70.24 N ATOM 681 CA ARG A 45 30.710 -26.254 -20.539 1.00 1.41 C ATOM 682 C ARG A 45 31.193 -26.592 -19.131 1.00 41.25 C ATOM 683 O ARG A 45 32.362 -26.914 -18.926 1.00 45.11 O ATOM 684 CB ARG A 45 30.922 -24.764 -20.818 1.00 74.41 C ATOM 685 CG ARG A 45 32.381 -24.379 -20.995 1.00 62.23 C ATOM 686 CD ARG A 45 32.874 -24.693 -22.399 1.00 73.33 C ATOM 687 NE ARG A 45 32.345 -23.756 -23.387 1.00 62.41 N ATOM 688 CZ ARG A 45 32.335 -23.994 -24.694 1.00 21.41 C ATOM 689 NH1 ARG A 45 32.822 -25.133 -25.168 1.00 32.15 N ATOM 690 NH2 ARG A 45 31.837 -23.092 -25.530 1.00 32.41 N ATOM 0 H ARG A 45 28.665 -26.069 -20.118 1.00 70.24 H new ATOM 0 HA ARG A 45 31.291 -26.837 -21.254 1.00 1.41 H new ATOM 0 HB2 ARG A 45 30.371 -24.490 -21.718 1.00 74.41 H new ATOM 0 HB3 ARG A 45 30.500 -24.186 -19.996 1.00 74.41 H new ATOM 0 HG2 ARG A 45 32.504 -23.315 -20.794 1.00 62.23 H new ATOM 0 HG3 ARG A 45 32.990 -24.913 -20.266 1.00 62.23 H new ATOM 0 HD2 ARG A 45 33.963 -24.661 -22.416 1.00 73.33 H new ATOM 0 HD3 ARG A 45 32.580 -25.708 -22.668 1.00 73.33 H new ATOM 0 HE ARG A 45 31.962 -22.871 -23.055 1.00 62.41 H new ATOM 0 HH11 ARG A 45 33.206 -25.829 -24.529 1.00 32.15 H new ATOM 0 HH12 ARG A 45 32.813 -25.313 -26.172 1.00 32.15 H new ATOM 0 HH21 ARG A 45 31.461 -22.215 -25.169 1.00 32.41 H new ATOM 0 HH22 ARG A 45 31.830 -23.276 -26.533 1.00 32.41 H new ATOM 704 N GLY A 46 30.283 -26.515 -18.165 1.00 24.43 N ATOM 705 CA GLY A 46 30.636 -26.815 -16.789 1.00 73.32 C ATOM 706 C GLY A 46 30.124 -25.770 -15.818 1.00 52.24 C ATOM 707 O GLY A 46 30.799 -25.431 -14.846 1.00 14.25 O ATOM 0 H GLY A 46 29.309 -26.251 -18.310 1.00 24.43 H new ATOM 0 HA2 GLY A 46 30.230 -27.789 -16.517 1.00 73.32 H new ATOM 0 HA3 GLY A 46 31.720 -26.886 -16.703 1.00 73.32 H new ATOM 711 N THR A 47 28.927 -25.255 -16.082 1.00 51.34 N ATOM 712 CA THR A 47 28.326 -24.240 -15.227 1.00 1.54 C ATOM 713 C THR A 47 26.810 -24.215 -15.384 1.00 41.42 C ATOM 714 O THR A 47 26.248 -24.950 -16.196 1.00 40.43 O ATOM 715 CB THR A 47 28.886 -22.839 -15.538 1.00 43.11 C ATOM 716 OG1 THR A 47 29.113 -22.704 -16.946 1.00 14.34 O ATOM 717 CG2 THR A 47 30.185 -22.596 -14.785 1.00 4.22 C ATOM 0 H THR A 47 28.355 -25.525 -16.882 1.00 51.34 H new ATOM 0 HA THR A 47 28.578 -24.504 -14.200 1.00 1.54 H new ATOM 0 HB THR A 47 28.153 -22.099 -15.215 1.00 43.11 H new ATOM 0 HG1 THR A 47 28.412 -23.181 -17.438 1.00 14.34 H new ATOM 0 HG21 THR A 47 30.561 -21.601 -15.021 1.00 4.22 H new ATOM 0 HG22 THR A 47 30.004 -22.671 -13.713 1.00 4.22 H new ATOM 0 HG23 THR A 47 30.922 -23.342 -15.081 1.00 4.22 H new ATOM 725 N VAL A 48 26.152 -23.364 -14.603 1.00 4.31 N ATOM 726 CA VAL A 48 24.700 -23.242 -14.657 1.00 45.33 C ATOM 727 C VAL A 48 24.272 -21.779 -14.673 1.00 2.34 C ATOM 728 O VAL A 48 24.334 -21.094 -13.652 1.00 50.42 O ATOM 729 CB VAL A 48 24.033 -23.948 -13.463 1.00 33.24 C ATOM 730 CG1 VAL A 48 22.519 -23.820 -13.544 1.00 3.42 C ATOM 731 CG2 VAL A 48 24.450 -25.410 -13.408 1.00 34.22 C ATOM 0 H VAL A 48 26.602 -22.749 -13.925 1.00 4.31 H new ATOM 0 HA VAL A 48 24.376 -23.722 -15.580 1.00 45.33 H new ATOM 0 HB VAL A 48 24.366 -23.464 -12.545 1.00 33.24 H new ATOM 0 HG11 VAL A 48 22.065 -24.325 -12.692 1.00 3.42 H new ATOM 0 HG12 VAL A 48 22.242 -22.766 -13.531 1.00 3.42 H new ATOM 0 HG13 VAL A 48 22.164 -24.277 -14.468 1.00 3.42 H new ATOM 0 HG21 VAL A 48 23.969 -25.894 -12.558 1.00 34.22 H new ATOM 0 HG22 VAL A 48 24.148 -25.909 -14.328 1.00 34.22 H new ATOM 0 HG23 VAL A 48 25.532 -25.476 -13.298 1.00 34.22 H new ATOM 741 N GLN A 49 23.838 -21.307 -15.837 1.00 34.22 N ATOM 742 CA GLN A 49 23.399 -19.925 -15.985 1.00 12.54 C ATOM 743 C GLN A 49 21.949 -19.763 -15.539 1.00 3.20 C ATOM 744 O GLN A 49 21.093 -20.584 -15.866 1.00 5.20 O ATOM 745 CB GLN A 49 23.552 -19.471 -17.438 1.00 33.44 C ATOM 746 CG GLN A 49 22.668 -20.236 -18.410 1.00 34.04 C ATOM 747 CD GLN A 49 22.983 -19.920 -19.858 1.00 42.32 C ATOM 748 OE1 GLN A 49 24.139 -19.699 -20.220 1.00 4.22 O ATOM 749 NE2 GLN A 49 21.954 -19.896 -20.697 1.00 61.31 N ATOM 0 H GLN A 49 23.781 -21.861 -16.691 1.00 34.22 H new ATOM 0 HA GLN A 49 24.027 -19.301 -15.349 1.00 12.54 H new ATOM 0 HB2 GLN A 49 23.317 -18.409 -17.505 1.00 33.44 H new ATOM 0 HB3 GLN A 49 24.593 -19.587 -17.738 1.00 33.44 H new ATOM 0 HG2 GLN A 49 22.790 -21.306 -18.241 1.00 34.04 H new ATOM 0 HG3 GLN A 49 21.623 -19.998 -18.209 1.00 34.04 H new ATOM 0 HE21 GLN A 49 21.012 -20.085 -20.354 1.00 61.31 H new ATOM 0 HE22 GLN A 49 22.106 -19.688 -21.684 1.00 61.31 H new ATOM 758 N GLY A 50 21.681 -18.698 -14.789 1.00 51.35 N ATOM 759 CA GLY A 50 20.334 -18.448 -14.311 1.00 31.04 C ATOM 760 C GLY A 50 19.951 -16.984 -14.393 1.00 44.41 C ATOM 761 O GLY A 50 20.529 -16.145 -13.701 1.00 71.54 O ATOM 0 H GLY A 50 22.373 -18.004 -14.504 1.00 51.35 H new ATOM 0 HA2 GLY A 50 19.629 -19.038 -14.897 1.00 31.04 H new ATOM 0 HA3 GLY A 50 20.250 -18.785 -13.278 1.00 31.04 H new ATOM 765 N GLN A 51 18.977 -16.675 -15.242 1.00 73.14 N ATOM 766 CA GLN A 51 18.520 -15.301 -15.414 1.00 41.01 C ATOM 767 C GLN A 51 17.399 -14.973 -14.433 1.00 70.34 C ATOM 768 O GLN A 51 16.373 -15.654 -14.397 1.00 21.22 O ATOM 769 CB GLN A 51 18.041 -15.076 -16.849 1.00 74.11 C ATOM 770 CG GLN A 51 19.049 -15.507 -17.902 1.00 75.51 C ATOM 771 CD GLN A 51 18.913 -14.726 -19.194 1.00 63.21 C ATOM 772 OE1 GLN A 51 18.010 -13.903 -19.344 1.00 0.24 O ATOM 773 NE2 GLN A 51 19.813 -14.980 -20.137 1.00 22.40 N ATOM 0 H GLN A 51 18.489 -17.358 -15.822 1.00 73.14 H new ATOM 0 HA GLN A 51 19.361 -14.637 -15.211 1.00 41.01 H new ATOM 0 HB2 GLN A 51 17.111 -15.623 -17.003 1.00 74.11 H new ATOM 0 HB3 GLN A 51 17.815 -14.019 -16.986 1.00 74.11 H new ATOM 0 HG2 GLN A 51 20.057 -15.378 -17.508 1.00 75.51 H new ATOM 0 HG3 GLN A 51 18.921 -16.569 -18.109 1.00 75.51 H new ATOM 0 HE21 GLN A 51 20.545 -15.670 -19.971 1.00 22.40 H new ATOM 0 HE22 GLN A 51 19.772 -14.485 -21.028 1.00 22.40 H new ATOM 782 N LEU A 52 17.601 -13.927 -13.640 1.00 30.42 N ATOM 783 CA LEU A 52 16.607 -13.509 -12.658 1.00 32.05 C ATOM 784 C LEU A 52 15.970 -12.182 -13.058 1.00 61.24 C ATOM 785 O LEU A 52 16.659 -11.260 -13.494 1.00 14.44 O ATOM 786 CB LEU A 52 17.249 -13.383 -11.275 1.00 11.41 C ATOM 787 CG LEU A 52 16.315 -12.970 -10.137 1.00 3.45 C ATOM 788 CD1 LEU A 52 15.547 -14.173 -9.613 1.00 20.21 C ATOM 789 CD2 LEU A 52 17.102 -12.308 -9.015 1.00 3.22 C ATOM 0 H LEU A 52 18.444 -13.353 -13.658 1.00 30.42 H new ATOM 0 HA LEU A 52 15.827 -14.269 -12.622 1.00 32.05 H new ATOM 0 HB2 LEU A 52 17.701 -14.341 -11.018 1.00 11.41 H new ATOM 0 HB3 LEU A 52 18.058 -12.655 -11.337 1.00 11.41 H new ATOM 0 HG LEU A 52 15.597 -12.248 -10.526 1.00 3.45 H new ATOM 0 HD11 LEU A 52 14.888 -13.859 -8.804 1.00 20.21 H new ATOM 0 HD12 LEU A 52 14.953 -14.604 -10.419 1.00 20.21 H new ATOM 0 HD13 LEU A 52 16.249 -14.919 -9.241 1.00 20.21 H new ATOM 0 HD21 LEU A 52 16.421 -12.021 -8.214 1.00 3.22 H new ATOM 0 HD22 LEU A 52 17.843 -13.008 -8.628 1.00 3.22 H new ATOM 0 HD23 LEU A 52 17.606 -11.421 -9.398 1.00 3.22 H new ATOM 801 N GLN A 53 14.653 -12.094 -12.906 1.00 53.02 N ATOM 802 CA GLN A 53 13.924 -10.879 -13.251 1.00 60.02 C ATOM 803 C GLN A 53 13.159 -10.343 -12.046 1.00 13.40 C ATOM 804 O GLN A 53 12.644 -11.109 -11.233 1.00 62.42 O ATOM 805 CB GLN A 53 12.957 -11.149 -14.405 1.00 61.32 C ATOM 806 CG GLN A 53 13.575 -11.947 -15.542 1.00 73.51 C ATOM 807 CD GLN A 53 14.680 -11.192 -16.252 1.00 43.35 C ATOM 808 OE1 GLN A 53 15.863 -11.397 -15.979 1.00 3.11 O ATOM 809 NE2 GLN A 53 14.300 -10.311 -17.171 1.00 64.30 N ATOM 0 H GLN A 53 14.069 -12.849 -12.546 1.00 53.02 H new ATOM 0 HA GLN A 53 14.649 -10.127 -13.562 1.00 60.02 H new ATOM 0 HB2 GLN A 53 12.090 -11.688 -14.023 1.00 61.32 H new ATOM 0 HB3 GLN A 53 12.595 -10.198 -14.795 1.00 61.32 H new ATOM 0 HG2 GLN A 53 13.974 -12.882 -15.149 1.00 73.51 H new ATOM 0 HG3 GLN A 53 12.799 -12.208 -16.261 1.00 73.51 H new ATOM 0 HE21 GLN A 53 13.308 -10.173 -17.366 1.00 64.30 H new ATOM 0 HE22 GLN A 53 15.000 -9.773 -17.682 1.00 64.30 H new ATOM 818 N GLY A 54 13.088 -9.019 -11.937 1.00 21.21 N ATOM 819 CA GLY A 54 12.384 -8.403 -10.828 1.00 2.14 C ATOM 820 C GLY A 54 12.957 -7.049 -10.458 1.00 23.35 C ATOM 821 O GLY A 54 13.891 -6.553 -11.088 1.00 25.41 O ATOM 0 H GLY A 54 13.506 -8.363 -12.597 1.00 21.21 H new ATOM 0 HA2 GLY A 54 11.331 -8.290 -11.088 1.00 2.14 H new ATOM 0 HA3 GLY A 54 12.430 -9.063 -9.961 1.00 2.14 H new ATOM 825 N PRO A 55 12.390 -6.428 -9.413 1.00 5.13 N ATOM 826 CA PRO A 55 12.834 -5.114 -8.937 1.00 23.31 C ATOM 827 C PRO A 55 14.211 -5.169 -8.283 1.00 34.32 C ATOM 828 O PRO A 55 14.549 -6.142 -7.608 1.00 32.11 O ATOM 829 CB PRO A 55 11.768 -4.731 -7.908 1.00 1.03 C ATOM 830 CG PRO A 55 11.214 -6.030 -7.435 1.00 32.44 C ATOM 831 CD PRO A 55 11.273 -6.960 -8.615 1.00 20.11 C ATOM 0 HA PRO A 55 12.936 -4.398 -9.753 1.00 23.31 H new ATOM 0 HB2 PRO A 55 12.199 -4.161 -7.085 1.00 1.03 H new ATOM 0 HB3 PRO A 55 10.992 -4.109 -8.354 1.00 1.03 H new ATOM 0 HG2 PRO A 55 11.796 -6.421 -6.600 1.00 32.44 H new ATOM 0 HG3 PRO A 55 10.189 -5.912 -7.082 1.00 32.44 H new ATOM 0 HD2 PRO A 55 11.454 -7.990 -8.306 1.00 20.11 H new ATOM 0 HD3 PRO A 55 10.339 -6.955 -9.177 1.00 20.11 H new ATOM 839 N ILE A 56 15.000 -4.120 -8.487 1.00 12.13 N ATOM 840 CA ILE A 56 16.339 -4.049 -7.915 1.00 33.20 C ATOM 841 C ILE A 56 16.304 -4.261 -6.405 1.00 73.12 C ATOM 842 O ILE A 56 17.261 -4.763 -5.816 1.00 51.02 O ATOM 843 CB ILE A 56 17.009 -2.696 -8.217 1.00 11.34 C ATOM 844 CG1 ILE A 56 18.481 -2.727 -7.801 1.00 62.15 C ATOM 845 CG2 ILE A 56 16.275 -1.571 -7.502 1.00 43.51 C ATOM 846 CD1 ILE A 56 19.217 -1.436 -8.086 1.00 32.33 C ATOM 0 H ILE A 56 14.735 -3.308 -9.044 1.00 12.13 H new ATOM 0 HA ILE A 56 16.922 -4.845 -8.378 1.00 33.20 H new ATOM 0 HB ILE A 56 16.958 -2.513 -9.290 1.00 11.34 H new ATOM 0 HG12 ILE A 56 18.544 -2.944 -6.735 1.00 62.15 H new ATOM 0 HG13 ILE A 56 18.981 -3.543 -8.323 1.00 62.15 H new ATOM 0 HG21 ILE A 56 16.760 -0.621 -7.725 1.00 43.51 H new ATOM 0 HG22 ILE A 56 15.240 -1.538 -7.842 1.00 43.51 H new ATOM 0 HG23 ILE A 56 16.299 -1.747 -6.427 1.00 43.51 H new ATOM 0 HD11 ILE A 56 20.255 -1.530 -7.765 1.00 32.33 H new ATOM 0 HD12 ILE A 56 19.185 -1.227 -9.155 1.00 32.33 H new ATOM 0 HD13 ILE A 56 18.742 -0.619 -7.543 1.00 32.33 H new ATOM 858 N SER A 57 15.193 -3.877 -5.785 1.00 12.32 N ATOM 859 CA SER A 57 15.033 -4.023 -4.343 1.00 1.42 C ATOM 860 C SER A 57 15.057 -5.494 -3.940 1.00 15.12 C ATOM 861 O SER A 57 15.421 -5.836 -2.815 1.00 33.25 O ATOM 862 CB SER A 57 13.723 -3.378 -3.886 1.00 2.34 C ATOM 863 OG SER A 57 12.618 -3.907 -4.598 1.00 4.11 O ATOM 0 H SER A 57 14.390 -3.462 -6.259 1.00 12.32 H new ATOM 0 HA SER A 57 15.867 -3.518 -3.857 1.00 1.42 H new ATOM 0 HB2 SER A 57 13.585 -3.545 -2.818 1.00 2.34 H new ATOM 0 HB3 SER A 57 13.773 -2.300 -4.036 1.00 2.34 H new ATOM 0 HG SER A 57 11.793 -3.480 -4.286 1.00 4.11 H new ATOM 869 N LYS A 58 14.665 -6.361 -4.867 1.00 62.13 N ATOM 870 CA LYS A 58 14.641 -7.796 -4.612 1.00 64.50 C ATOM 871 C LYS A 58 15.853 -8.480 -5.238 1.00 32.53 C ATOM 872 O LYS A 58 16.323 -9.505 -4.744 1.00 62.51 O ATOM 873 CB LYS A 58 13.353 -8.412 -5.163 1.00 64.14 C ATOM 874 CG LYS A 58 12.195 -8.379 -4.182 1.00 31.42 C ATOM 875 CD LYS A 58 11.874 -6.960 -3.744 1.00 43.05 C ATOM 876 CE LYS A 58 10.755 -6.933 -2.715 1.00 72.22 C ATOM 877 NZ LYS A 58 9.448 -7.335 -3.306 1.00 64.31 N ATOM 0 H LYS A 58 14.359 -6.094 -5.803 1.00 62.13 H new ATOM 0 HA LYS A 58 14.676 -7.949 -3.533 1.00 64.50 H new ATOM 0 HB2 LYS A 58 13.065 -7.880 -6.070 1.00 64.14 H new ATOM 0 HB3 LYS A 58 13.548 -9.446 -5.448 1.00 64.14 H new ATOM 0 HG2 LYS A 58 11.314 -8.826 -4.643 1.00 31.42 H new ATOM 0 HG3 LYS A 58 12.440 -8.984 -3.309 1.00 31.42 H new ATOM 0 HD2 LYS A 58 12.767 -6.497 -3.324 1.00 43.05 H new ATOM 0 HD3 LYS A 58 11.586 -6.367 -4.612 1.00 43.05 H new ATOM 0 HE2 LYS A 58 11.003 -7.603 -1.892 1.00 72.22 H new ATOM 0 HE3 LYS A 58 10.671 -5.930 -2.296 1.00 72.22 H new ATOM 0 HZ1 LYS A 58 8.692 -7.191 -2.607 1.00 64.31 H new ATOM 0 HZ2 LYS A 58 9.256 -6.757 -4.149 1.00 64.31 H new ATOM 0 HZ3 LYS A 58 9.483 -8.339 -3.576 1.00 64.31 H new ATOM 891 N VAL A 59 16.354 -7.906 -6.326 1.00 44.14 N ATOM 892 CA VAL A 59 17.513 -8.459 -7.018 1.00 12.11 C ATOM 893 C VAL A 59 18.798 -8.182 -6.245 1.00 73.43 C ATOM 894 O VAL A 59 19.763 -8.941 -6.335 1.00 2.04 O ATOM 895 CB VAL A 59 17.647 -7.881 -8.439 1.00 52.32 C ATOM 896 CG1 VAL A 59 18.821 -8.518 -9.166 1.00 42.44 C ATOM 897 CG2 VAL A 59 16.356 -8.079 -9.219 1.00 34.05 C ATOM 0 H VAL A 59 15.976 -7.058 -6.748 1.00 44.14 H new ATOM 0 HA VAL A 59 17.358 -9.536 -7.085 1.00 12.11 H new ATOM 0 HB VAL A 59 17.837 -6.810 -8.360 1.00 52.32 H new ATOM 0 HG11 VAL A 59 18.900 -8.097 -10.168 1.00 42.44 H new ATOM 0 HG12 VAL A 59 19.741 -8.320 -8.616 1.00 42.44 H new ATOM 0 HG13 VAL A 59 18.665 -9.595 -9.236 1.00 42.44 H new ATOM 0 HG21 VAL A 59 16.469 -7.665 -10.221 1.00 34.05 H new ATOM 0 HG22 VAL A 59 16.133 -9.144 -9.290 1.00 34.05 H new ATOM 0 HG23 VAL A 59 15.539 -7.571 -8.706 1.00 34.05 H new ATOM 907 N ARG A 60 18.802 -7.091 -5.486 1.00 61.35 N ATOM 908 CA ARG A 60 19.969 -6.714 -4.698 1.00 50.21 C ATOM 909 C ARG A 60 20.119 -7.621 -3.480 1.00 53.31 C ATOM 910 O ARG A 60 21.228 -7.851 -2.997 1.00 12.21 O ATOM 911 CB ARG A 60 19.858 -5.255 -4.251 1.00 24.13 C ATOM 912 CG ARG A 60 20.467 -4.269 -5.234 1.00 54.41 C ATOM 913 CD ARG A 60 21.977 -4.189 -5.081 1.00 4.12 C ATOM 914 NE ARG A 60 22.373 -3.252 -4.033 1.00 15.50 N ATOM 915 CZ ARG A 60 23.584 -3.227 -3.488 1.00 14.53 C ATOM 916 NH1 ARG A 60 24.513 -4.083 -3.889 1.00 51.45 N ATOM 917 NH2 ARG A 60 23.867 -2.343 -2.539 1.00 22.42 N ATOM 0 H ARG A 60 18.011 -6.453 -5.400 1.00 61.35 H new ATOM 0 HA ARG A 60 20.853 -6.829 -5.325 1.00 50.21 H new ATOM 0 HB2 ARG A 60 18.807 -5.007 -4.105 1.00 24.13 H new ATOM 0 HB3 ARG A 60 20.349 -5.142 -3.284 1.00 24.13 H new ATOM 0 HG2 ARG A 60 20.219 -4.569 -6.252 1.00 54.41 H new ATOM 0 HG3 ARG A 60 20.032 -3.282 -5.077 1.00 54.41 H new ATOM 0 HD2 ARG A 60 22.371 -5.179 -4.850 1.00 4.12 H new ATOM 0 HD3 ARG A 60 22.421 -3.882 -6.028 1.00 4.12 H new ATOM 0 HE ARG A 60 21.681 -2.580 -3.701 1.00 15.50 H new ATOM 0 HH11 ARG A 60 24.299 -4.763 -4.618 1.00 51.45 H new ATOM 0 HH12 ARG A 60 25.442 -4.061 -3.469 1.00 51.45 H new ATOM 0 HH21 ARG A 60 23.154 -1.683 -2.228 1.00 22.42 H new ATOM 0 HH22 ARG A 60 24.797 -2.324 -2.121 1.00 22.42 H new ATOM 931 N HIS A 61 18.995 -8.133 -2.988 1.00 51.40 N ATOM 932 CA HIS A 61 19.001 -9.014 -1.826 1.00 60.53 C ATOM 933 C HIS A 61 19.030 -10.478 -2.255 1.00 72.35 C ATOM 934 O HIS A 61 19.515 -11.340 -1.523 1.00 73.21 O ATOM 935 CB HIS A 61 17.774 -8.751 -0.953 1.00 51.01 C ATOM 936 CG HIS A 61 17.847 -7.464 -0.190 1.00 31.41 C ATOM 937 ND1 HIS A 61 19.034 -6.818 0.084 1.00 71.10 N ATOM 938 CD2 HIS A 61 16.871 -6.703 0.357 1.00 53.31 C ATOM 939 CE1 HIS A 61 18.785 -5.716 0.768 1.00 53.43 C ATOM 940 NE2 HIS A 61 17.479 -5.622 0.946 1.00 3.12 N ATOM 0 H HIS A 61 18.069 -7.953 -3.376 1.00 51.40 H new ATOM 0 HA HIS A 61 19.901 -8.805 -1.247 1.00 60.53 H new ATOM 0 HB2 HIS A 61 16.885 -8.740 -1.584 1.00 51.01 H new ATOM 0 HB3 HIS A 61 17.655 -9.575 -0.249 1.00 51.01 H new ATOM 0 HD2 HIS A 61 15.811 -6.908 0.334 1.00 53.31 H new ATOM 0 HE1 HIS A 61 19.523 -5.011 1.122 1.00 53.43 H new ATOM 0 HE2 HIS A 61 17.001 -4.869 1.440 1.00 3.12 H new ATOM 948 N MET A 62 18.507 -10.751 -3.446 1.00 74.13 N ATOM 949 CA MET A 62 18.473 -12.111 -3.973 1.00 2.25 C ATOM 950 C MET A 62 19.852 -12.537 -4.466 1.00 42.21 C ATOM 951 O MET A 62 20.273 -13.674 -4.253 1.00 52.52 O ATOM 952 CB MET A 62 17.456 -12.215 -5.111 1.00 25.01 C ATOM 953 CG MET A 62 17.278 -13.629 -5.639 1.00 20.33 C ATOM 954 SD MET A 62 16.596 -14.751 -4.403 1.00 21.14 S ATOM 955 CE MET A 62 14.971 -15.063 -5.088 1.00 62.24 C ATOM 0 H MET A 62 18.101 -10.049 -4.064 1.00 74.13 H new ATOM 0 HA MET A 62 18.173 -12.780 -3.166 1.00 2.25 H new ATOM 0 HB2 MET A 62 16.493 -11.842 -4.762 1.00 25.01 H new ATOM 0 HB3 MET A 62 17.771 -11.567 -5.929 1.00 25.01 H new ATOM 0 HG2 MET A 62 16.620 -13.608 -6.508 1.00 20.33 H new ATOM 0 HG3 MET A 62 18.241 -14.010 -5.978 1.00 20.33 H new ATOM 0 HE1 MET A 62 14.291 -15.363 -4.290 1.00 62.24 H new ATOM 0 HE2 MET A 62 14.596 -14.156 -5.562 1.00 62.24 H new ATOM 0 HE3 MET A 62 15.035 -15.860 -5.829 1.00 62.24 H new ATOM 965 N GLN A 63 20.550 -11.618 -5.126 1.00 13.42 N ATOM 966 CA GLN A 63 21.881 -11.900 -5.650 1.00 33.00 C ATOM 967 C GLN A 63 22.846 -12.254 -4.523 1.00 74.33 C ATOM 968 O GLN A 63 23.758 -13.059 -4.706 1.00 22.22 O ATOM 969 CB GLN A 63 22.410 -10.696 -6.431 1.00 61.33 C ATOM 970 CG GLN A 63 22.646 -9.467 -5.569 1.00 12.14 C ATOM 971 CD GLN A 63 23.128 -8.274 -6.371 1.00 75.42 C ATOM 972 OE1 GLN A 63 24.164 -7.684 -6.066 1.00 13.44 O ATOM 973 NE2 GLN A 63 22.376 -7.914 -7.405 1.00 43.20 N ATOM 0 H GLN A 63 20.216 -10.672 -5.310 1.00 13.42 H new ATOM 0 HA GLN A 63 21.806 -12.755 -6.321 1.00 33.00 H new ATOM 0 HB2 GLN A 63 23.345 -10.972 -6.919 1.00 61.33 H new ATOM 0 HB3 GLN A 63 21.701 -10.445 -7.220 1.00 61.33 H new ATOM 0 HG2 GLN A 63 21.721 -9.205 -5.056 1.00 12.14 H new ATOM 0 HG3 GLN A 63 23.381 -9.703 -4.800 1.00 12.14 H new ATOM 0 HE21 GLN A 63 21.525 -8.432 -7.621 1.00 43.20 H new ATOM 0 HE22 GLN A 63 22.650 -7.119 -7.983 1.00 43.20 H new ATOM 982 N GLU A 64 22.637 -11.647 -3.359 1.00 70.12 N ATOM 983 CA GLU A 64 23.490 -11.898 -2.204 1.00 21.54 C ATOM 984 C GLU A 64 22.988 -13.100 -1.408 1.00 0.23 C ATOM 985 O GLU A 64 23.499 -13.400 -0.329 1.00 13.14 O ATOM 986 CB GLU A 64 23.544 -10.663 -1.303 1.00 11.40 C ATOM 987 CG GLU A 64 22.208 -10.313 -0.669 1.00 0.00 C ATOM 988 CD GLU A 64 22.342 -9.302 0.453 1.00 53.40 C ATOM 989 OE1 GLU A 64 23.477 -8.855 0.717 1.00 2.54 O ATOM 990 OE2 GLU A 64 21.310 -8.957 1.066 1.00 33.34 O ATOM 0 H GLU A 64 21.885 -10.979 -3.191 1.00 70.12 H new ATOM 0 HA GLU A 64 24.494 -12.118 -2.567 1.00 21.54 H new ATOM 0 HB2 GLU A 64 24.278 -10.831 -0.515 1.00 11.40 H new ATOM 0 HB3 GLU A 64 23.893 -9.812 -1.888 1.00 11.40 H new ATOM 0 HG2 GLU A 64 21.540 -9.916 -1.433 1.00 0.00 H new ATOM 0 HG3 GLU A 64 21.745 -11.221 -0.282 1.00 0.00 H new ATOM 997 N TRP A 65 21.985 -13.782 -1.948 1.00 70.10 N ATOM 998 CA TRP A 65 21.413 -14.951 -1.289 1.00 11.55 C ATOM 999 C TRP A 65 21.976 -16.239 -1.879 1.00 13.23 C ATOM 1000 O TRP A 65 22.409 -17.131 -1.148 1.00 1.31 O ATOM 1001 CB TRP A 65 19.889 -14.939 -1.417 1.00 72.23 C ATOM 1002 CG TRP A 65 19.227 -16.101 -0.741 1.00 32.32 C ATOM 1003 CD1 TRP A 65 19.220 -17.400 -1.163 1.00 31.11 C ATOM 1004 CD2 TRP A 65 18.474 -16.069 0.476 1.00 12.14 C ATOM 1005 NE1 TRP A 65 18.508 -18.177 -0.281 1.00 71.13 N ATOM 1006 CE2 TRP A 65 18.041 -17.384 0.733 1.00 33.54 C ATOM 1007 CE3 TRP A 65 18.125 -15.057 1.375 1.00 21.54 C ATOM 1008 CZ2 TRP A 65 17.277 -17.711 1.850 1.00 34.45 C ATOM 1009 CZ3 TRP A 65 17.366 -15.384 2.483 1.00 4.54 C ATOM 1010 CH2 TRP A 65 16.950 -16.701 2.714 1.00 74.32 C ATOM 0 H TRP A 65 21.551 -13.546 -2.840 1.00 70.10 H new ATOM 0 HA TRP A 65 21.682 -14.910 -0.233 1.00 11.55 H new ATOM 0 HB2 TRP A 65 19.503 -14.013 -0.992 1.00 72.23 H new ATOM 0 HB3 TRP A 65 19.620 -14.941 -2.473 1.00 72.23 H new ATOM 0 HD1 TRP A 65 19.703 -17.763 -2.058 1.00 31.11 H new ATOM 0 HE1 TRP A 65 18.353 -19.181 -0.368 1.00 71.13 H new ATOM 0 HE3 TRP A 65 18.443 -14.038 1.207 1.00 21.54 H new ATOM 0 HZ2 TRP A 65 16.954 -18.726 2.028 1.00 34.45 H new ATOM 0 HZ3 TRP A 65 17.089 -14.610 3.183 1.00 4.54 H new ATOM 0 HH2 TRP A 65 16.360 -16.924 3.591 1.00 74.32 H new ATOM 1021 N LEU A 66 21.967 -16.331 -3.204 1.00 13.42 N ATOM 1022 CA LEU A 66 22.477 -17.511 -3.892 1.00 62.14 C ATOM 1023 C LEU A 66 24.002 -17.529 -3.885 1.00 4.03 C ATOM 1024 O LEU A 66 24.623 -18.500 -4.316 1.00 51.14 O ATOM 1025 CB LEU A 66 21.963 -17.548 -5.333 1.00 33.15 C ATOM 1026 CG LEU A 66 20.538 -18.070 -5.523 1.00 63.41 C ATOM 1027 CD1 LEU A 66 20.400 -19.469 -4.942 1.00 65.24 C ATOM 1028 CD2 LEU A 66 19.533 -17.124 -4.883 1.00 40.14 C ATOM 0 H LEU A 66 21.612 -15.602 -3.823 1.00 13.42 H new ATOM 0 HA LEU A 66 22.119 -18.393 -3.361 1.00 62.14 H new ATOM 0 HB2 LEU A 66 22.017 -16.540 -5.743 1.00 33.15 H new ATOM 0 HB3 LEU A 66 22.638 -18.169 -5.923 1.00 33.15 H new ATOM 0 HG LEU A 66 20.330 -18.120 -6.592 1.00 63.41 H new ATOM 0 HD11 LEU A 66 19.380 -19.824 -5.086 1.00 65.24 H new ATOM 0 HD12 LEU A 66 21.093 -20.142 -5.446 1.00 65.24 H new ATOM 0 HD13 LEU A 66 20.628 -19.445 -3.876 1.00 65.24 H new ATOM 0 HD21 LEU A 66 18.525 -17.512 -5.028 1.00 40.14 H new ATOM 0 HD22 LEU A 66 19.740 -17.041 -3.816 1.00 40.14 H new ATOM 0 HD23 LEU A 66 19.614 -16.140 -5.346 1.00 40.14 H new ATOM 1040 N GLU A 67 24.599 -16.450 -3.389 1.00 3.50 N ATOM 1041 CA GLU A 67 26.052 -16.343 -3.324 1.00 2.10 C ATOM 1042 C GLU A 67 26.606 -17.162 -2.162 1.00 24.11 C ATOM 1043 O GLU A 67 27.799 -17.465 -2.113 1.00 2.42 O ATOM 1044 CB GLU A 67 26.472 -14.879 -3.176 1.00 42.04 C ATOM 1045 CG GLU A 67 26.232 -14.314 -1.787 1.00 13.14 C ATOM 1046 CD GLU A 67 26.687 -12.874 -1.656 1.00 3.45 C ATOM 1047 OE1 GLU A 67 27.091 -12.284 -2.680 1.00 72.11 O ATOM 1048 OE2 GLU A 67 26.641 -12.336 -0.529 1.00 73.05 O ATOM 0 H GLU A 67 24.099 -15.638 -3.026 1.00 3.50 H new ATOM 0 HA GLU A 67 26.462 -16.739 -4.253 1.00 2.10 H new ATOM 0 HB2 GLU A 67 27.531 -14.787 -3.418 1.00 42.04 H new ATOM 0 HB3 GLU A 67 25.926 -14.278 -3.903 1.00 42.04 H new ATOM 0 HG2 GLU A 67 25.170 -14.378 -1.551 1.00 13.14 H new ATOM 0 HG3 GLU A 67 26.759 -14.925 -1.054 1.00 13.14 H new ATOM 1055 N THR A 68 25.732 -17.518 -1.226 1.00 74.22 N ATOM 1056 CA THR A 68 26.132 -18.300 -0.063 1.00 60.45 C ATOM 1057 C THR A 68 25.126 -19.408 0.227 1.00 61.31 C ATOM 1058 O THR A 68 25.505 -20.546 0.506 1.00 11.12 O ATOM 1059 CB THR A 68 26.277 -17.413 1.187 1.00 31.35 C ATOM 1060 OG1 THR A 68 26.338 -18.230 2.362 1.00 3.54 O ATOM 1061 CG2 THR A 68 25.112 -16.441 1.299 1.00 21.24 C ATOM 0 H THR A 68 24.741 -17.277 -1.251 1.00 74.22 H new ATOM 0 HA THR A 68 27.099 -18.744 -0.298 1.00 60.45 H new ATOM 0 HB THR A 68 27.200 -16.840 1.094 1.00 31.35 H new ATOM 0 HG1 THR A 68 26.432 -17.659 3.153 1.00 3.54 H new ATOM 0 HG21 THR A 68 25.236 -15.825 2.190 1.00 21.24 H new ATOM 0 HG22 THR A 68 25.085 -15.802 0.417 1.00 21.24 H new ATOM 0 HG23 THR A 68 24.178 -16.999 1.371 1.00 21.24 H new ATOM 1069 N ARG A 69 23.843 -19.069 0.158 1.00 30.04 N ATOM 1070 CA ARG A 69 22.782 -20.036 0.415 1.00 44.03 C ATOM 1071 C ARG A 69 22.781 -21.135 -0.644 1.00 41.20 C ATOM 1072 O ARG A 69 23.240 -20.930 -1.767 1.00 1.22 O ATOM 1073 CB ARG A 69 21.422 -19.337 0.442 1.00 73.35 C ATOM 1074 CG ARG A 69 21.351 -18.179 1.423 1.00 1.10 C ATOM 1075 CD ARG A 69 20.966 -18.652 2.816 1.00 5.22 C ATOM 1076 NE ARG A 69 19.670 -19.325 2.827 1.00 4.13 N ATOM 1077 CZ ARG A 69 19.095 -19.792 3.929 1.00 34.42 C ATOM 1078 NH1 ARG A 69 19.697 -19.660 5.103 1.00 34.21 N ATOM 1079 NH2 ARG A 69 17.914 -20.393 3.858 1.00 34.34 N ATOM 0 H ARG A 69 23.513 -18.132 -0.074 1.00 30.04 H new ATOM 0 HA ARG A 69 22.967 -20.492 1.387 1.00 44.03 H new ATOM 0 HB2 ARG A 69 21.192 -18.969 -0.558 1.00 73.35 H new ATOM 0 HB3 ARG A 69 20.653 -20.066 0.698 1.00 73.35 H new ATOM 0 HG2 ARG A 69 22.316 -17.675 1.463 1.00 1.10 H new ATOM 0 HG3 ARG A 69 20.623 -17.447 1.072 1.00 1.10 H new ATOM 0 HD2 ARG A 69 21.731 -19.332 3.192 1.00 5.22 H new ATOM 0 HD3 ARG A 69 20.937 -17.799 3.493 1.00 5.22 H new ATOM 0 HE ARG A 69 19.180 -19.443 1.940 1.00 4.13 H new ATOM 0 HH11 ARG A 69 20.605 -19.198 5.162 1.00 34.21 H new ATOM 0 HH12 ARG A 69 19.252 -20.020 5.947 1.00 34.21 H new ATOM 0 HH21 ARG A 69 17.448 -20.496 2.957 1.00 34.34 H new ATOM 0 HH22 ARG A 69 17.473 -20.752 4.705 1.00 34.34 H new ATOM 1093 N GLY A 70 22.262 -22.303 -0.277 1.00 52.31 N ATOM 1094 CA GLY A 70 22.211 -23.417 -1.206 1.00 2.42 C ATOM 1095 C GLY A 70 22.556 -24.737 -0.547 1.00 30.34 C ATOM 1096 O GLY A 70 22.616 -24.830 0.679 1.00 11.14 O ATOM 0 H GLY A 70 21.876 -22.498 0.647 1.00 52.31 H new ATOM 0 HA2 GLY A 70 21.212 -23.480 -1.638 1.00 2.42 H new ATOM 0 HA3 GLY A 70 22.903 -23.233 -2.028 1.00 2.42 H new ATOM 1100 N SER A 71 22.782 -25.763 -1.362 1.00 12.33 N ATOM 1101 CA SER A 71 23.117 -27.086 -0.850 1.00 71.50 C ATOM 1102 C SER A 71 24.629 -27.289 -0.815 1.00 53.23 C ATOM 1103 O SER A 71 25.389 -26.595 -1.491 1.00 62.30 O ATOM 1104 CB SER A 71 22.466 -28.170 -1.712 1.00 54.53 C ATOM 1105 OG SER A 71 23.390 -29.198 -2.023 1.00 52.24 O ATOM 0 H SER A 71 22.739 -25.703 -2.379 1.00 12.33 H new ATOM 0 HA SER A 71 22.734 -27.162 0.168 1.00 71.50 H new ATOM 0 HB2 SER A 71 21.611 -28.593 -1.185 1.00 54.53 H new ATOM 0 HB3 SER A 71 22.086 -27.727 -2.633 1.00 54.53 H new ATOM 0 HG SER A 71 22.949 -29.879 -2.573 1.00 52.24 H new ATOM 1111 N PRO A 72 25.076 -28.262 -0.008 1.00 61.34 N ATOM 1112 CA PRO A 72 26.500 -28.580 0.135 1.00 70.15 C ATOM 1113 C PRO A 72 27.080 -29.220 -1.122 1.00 20.40 C ATOM 1114 O PRO A 72 28.282 -29.138 -1.375 1.00 61.22 O ATOM 1115 CB PRO A 72 26.527 -29.571 1.301 1.00 71.01 C ATOM 1116 CG PRO A 72 25.174 -30.196 1.299 1.00 44.53 C ATOM 1117 CD PRO A 72 24.226 -29.128 0.826 1.00 23.30 C ATOM 0 HA PRO A 72 27.102 -27.687 0.303 1.00 70.15 H new ATOM 0 HB2 PRO A 72 27.309 -30.319 1.167 1.00 71.01 H new ATOM 0 HB3 PRO A 72 26.728 -29.066 2.246 1.00 71.01 H new ATOM 0 HG2 PRO A 72 25.146 -31.063 0.639 1.00 44.53 H new ATOM 0 HG3 PRO A 72 24.904 -30.545 2.296 1.00 44.53 H new ATOM 0 HD2 PRO A 72 23.399 -29.549 0.255 1.00 23.30 H new ATOM 0 HD3 PRO A 72 23.790 -28.579 1.661 1.00 23.30 H new ATOM 1125 N LYS A 73 26.218 -29.858 -1.907 1.00 65.21 N ATOM 1126 CA LYS A 73 26.644 -30.512 -3.139 1.00 42.30 C ATOM 1127 C LYS A 73 26.861 -29.489 -4.250 1.00 64.41 C ATOM 1128 O LYS A 73 27.619 -29.732 -5.190 1.00 14.40 O ATOM 1129 CB LYS A 73 25.604 -31.545 -3.578 1.00 42.13 C ATOM 1130 CG LYS A 73 25.194 -32.503 -2.473 1.00 65.13 C ATOM 1131 CD LYS A 73 24.245 -33.573 -2.986 1.00 51.44 C ATOM 1132 CE LYS A 73 23.809 -34.512 -1.872 1.00 64.24 C ATOM 1133 NZ LYS A 73 22.633 -33.983 -1.128 1.00 40.34 N ATOM 0 H LYS A 73 25.220 -29.936 -1.712 1.00 65.21 H new ATOM 0 HA LYS A 73 27.590 -31.018 -2.945 1.00 42.30 H new ATOM 0 HB2 LYS A 73 24.719 -31.024 -3.943 1.00 42.13 H new ATOM 0 HB3 LYS A 73 26.004 -32.118 -4.414 1.00 42.13 H new ATOM 0 HG2 LYS A 73 26.082 -32.975 -2.051 1.00 65.13 H new ATOM 0 HG3 LYS A 73 24.715 -31.947 -1.667 1.00 65.13 H new ATOM 0 HD2 LYS A 73 23.368 -33.101 -3.429 1.00 51.44 H new ATOM 0 HD3 LYS A 73 24.732 -34.145 -3.775 1.00 51.44 H new ATOM 0 HE2 LYS A 73 23.563 -35.486 -2.294 1.00 64.24 H new ATOM 0 HE3 LYS A 73 24.638 -34.664 -1.180 1.00 64.24 H new ATOM 0 HZ1 LYS A 73 22.367 -34.652 -0.378 1.00 40.34 H new ATOM 0 HZ2 LYS A 73 22.875 -33.065 -0.704 1.00 40.34 H new ATOM 0 HZ3 LYS A 73 21.834 -33.862 -1.783 1.00 40.34 H new ATOM 1147 N SER A 74 26.193 -28.346 -4.135 1.00 64.00 N ATOM 1148 CA SER A 74 26.312 -27.288 -5.131 1.00 50.23 C ATOM 1149 C SER A 74 26.919 -26.030 -4.518 1.00 2.31 C ATOM 1150 O SER A 74 26.256 -24.998 -4.405 1.00 24.01 O ATOM 1151 CB SER A 74 24.941 -26.966 -5.730 1.00 64.53 C ATOM 1152 OG SER A 74 23.961 -26.831 -4.716 1.00 73.45 O ATOM 0 H SER A 74 25.564 -28.129 -3.362 1.00 64.00 H new ATOM 0 HA SER A 74 26.973 -27.641 -5.922 1.00 50.23 H new ATOM 0 HB2 SER A 74 25.001 -26.044 -6.308 1.00 64.53 H new ATOM 0 HB3 SER A 74 24.648 -27.756 -6.421 1.00 64.53 H new ATOM 0 HG SER A 74 24.231 -26.125 -4.092 1.00 73.45 H new ATOM 1158 N HIS A 75 28.185 -26.123 -4.123 1.00 31.22 N ATOM 1159 CA HIS A 75 28.883 -24.993 -3.521 1.00 4.01 C ATOM 1160 C HIS A 75 29.024 -23.848 -4.519 1.00 5.41 C ATOM 1161 O HIS A 75 29.045 -24.067 -5.730 1.00 41.45 O ATOM 1162 CB HIS A 75 30.263 -25.425 -3.024 1.00 44.02 C ATOM 1163 CG HIS A 75 30.903 -24.437 -2.098 1.00 40.21 C ATOM 1164 ND1 HIS A 75 30.201 -23.746 -1.134 1.00 12.44 N ATOM 1165 CD2 HIS A 75 32.189 -24.027 -1.992 1.00 14.41 C ATOM 1166 CE1 HIS A 75 31.026 -22.952 -0.475 1.00 43.43 C ATOM 1167 NE2 HIS A 75 32.239 -23.104 -0.976 1.00 51.45 N ATOM 0 H HIS A 75 28.748 -26.969 -4.209 1.00 31.22 H new ATOM 0 HA HIS A 75 28.293 -24.643 -2.674 1.00 4.01 H new ATOM 0 HB2 HIS A 75 30.172 -26.383 -2.513 1.00 44.02 H new ATOM 0 HB3 HIS A 75 30.916 -25.582 -3.882 1.00 44.02 H new ATOM 0 HD2 HIS A 75 33.020 -24.363 -2.594 1.00 14.41 H new ATOM 0 HE1 HIS A 75 30.755 -22.291 0.335 1.00 43.43 H new ATOM 0 HE2 HIS A 75 33.077 -22.615 -0.660 1.00 51.45 H new ATOM 1175 N ILE A 76 29.120 -22.627 -4.002 1.00 23.31 N ATOM 1176 CA ILE A 76 29.260 -21.449 -4.848 1.00 14.40 C ATOM 1177 C ILE A 76 30.646 -20.829 -4.704 1.00 73.42 C ATOM 1178 O ILE A 76 30.809 -19.791 -4.064 1.00 4.23 O ATOM 1179 CB ILE A 76 28.197 -20.385 -4.512 1.00 23.54 C ATOM 1180 CG1 ILE A 76 26.796 -20.996 -4.575 1.00 54.43 C ATOM 1181 CG2 ILE A 76 28.310 -19.204 -5.463 1.00 44.03 C ATOM 1182 CD1 ILE A 76 26.263 -21.429 -3.227 1.00 42.33 C ATOM 0 H ILE A 76 29.103 -22.429 -3.002 1.00 23.31 H new ATOM 0 HA ILE A 76 29.118 -21.781 -5.876 1.00 14.40 H new ATOM 0 HB ILE A 76 28.371 -20.026 -3.498 1.00 23.54 H new ATOM 0 HG12 ILE A 76 26.111 -20.269 -5.011 1.00 54.43 H new ATOM 0 HG13 ILE A 76 26.814 -21.857 -5.243 1.00 54.43 H new ATOM 0 HG21 ILE A 76 27.552 -18.461 -5.213 1.00 44.03 H new ATOM 0 HG22 ILE A 76 29.300 -18.757 -5.372 1.00 44.03 H new ATOM 0 HG23 ILE A 76 28.159 -19.546 -6.487 1.00 44.03 H new ATOM 0 HD11 ILE A 76 25.266 -21.852 -3.349 1.00 42.33 H new ATOM 0 HD12 ILE A 76 26.926 -22.180 -2.798 1.00 42.33 H new ATOM 0 HD13 ILE A 76 26.212 -20.567 -2.562 1.00 42.33 H new ATOM 1194 N ASP A 77 31.640 -21.473 -5.306 1.00 1.33 N ATOM 1195 CA ASP A 77 33.013 -20.984 -5.248 1.00 11.14 C ATOM 1196 C ASP A 77 33.106 -19.561 -5.790 1.00 25.20 C ATOM 1197 O ASP A 77 33.943 -18.772 -5.351 1.00 41.43 O ATOM 1198 CB ASP A 77 33.940 -21.907 -6.040 1.00 75.21 C ATOM 1199 CG ASP A 77 35.368 -21.866 -5.535 1.00 44.52 C ATOM 1200 OD1 ASP A 77 35.600 -22.268 -4.376 1.00 3.44 O ATOM 1201 OD2 ASP A 77 36.255 -21.432 -6.300 1.00 0.31 O ATOM 0 H ASP A 77 31.521 -22.334 -5.839 1.00 1.33 H new ATOM 0 HA ASP A 77 33.326 -20.977 -4.204 1.00 11.14 H new ATOM 0 HB2 ASP A 77 33.566 -22.929 -5.982 1.00 75.21 H new ATOM 0 HB3 ASP A 77 33.921 -21.620 -7.091 1.00 75.21 H new ATOM 1206 N LYS A 78 32.243 -19.241 -6.748 1.00 0.44 N ATOM 1207 CA LYS A 78 32.227 -17.913 -7.351 1.00 70.30 C ATOM 1208 C LYS A 78 30.819 -17.537 -7.801 1.00 32.04 C ATOM 1209 O LYS A 78 30.145 -18.313 -8.477 1.00 71.40 O ATOM 1210 CB LYS A 78 33.185 -17.861 -8.543 1.00 4.20 C ATOM 1211 CG LYS A 78 33.367 -16.466 -9.116 1.00 71.25 C ATOM 1212 CD LYS A 78 34.034 -15.535 -8.118 1.00 31.00 C ATOM 1213 CE LYS A 78 34.752 -14.391 -8.817 1.00 2.34 C ATOM 1214 NZ LYS A 78 36.105 -14.793 -9.291 1.00 43.52 N ATOM 0 H LYS A 78 31.545 -19.883 -7.124 1.00 0.44 H new ATOM 0 HA LYS A 78 32.553 -17.195 -6.598 1.00 70.30 H new ATOM 0 HB2 LYS A 78 34.156 -18.248 -8.235 1.00 4.20 H new ATOM 0 HB3 LYS A 78 32.813 -18.521 -9.327 1.00 4.20 H new ATOM 0 HG2 LYS A 78 33.969 -16.520 -10.023 1.00 71.25 H new ATOM 0 HG3 LYS A 78 32.397 -16.060 -9.401 1.00 71.25 H new ATOM 0 HD2 LYS A 78 33.284 -15.133 -7.436 1.00 31.00 H new ATOM 0 HD3 LYS A 78 34.746 -16.097 -7.513 1.00 31.00 H new ATOM 0 HE2 LYS A 78 34.156 -14.052 -9.664 1.00 2.34 H new ATOM 0 HE3 LYS A 78 34.843 -13.547 -8.133 1.00 2.34 H new ATOM 0 HZ1 LYS A 78 36.562 -13.986 -9.762 1.00 43.52 H new ATOM 0 HZ2 LYS A 78 36.682 -15.093 -8.479 1.00 43.52 H new ATOM 0 HZ3 LYS A 78 36.017 -15.582 -9.963 1.00 43.52 H new ATOM 1228 N ALA A 79 30.381 -16.341 -7.421 1.00 43.24 N ATOM 1229 CA ALA A 79 29.055 -15.861 -7.789 1.00 10.33 C ATOM 1230 C ALA A 79 29.128 -14.475 -8.420 1.00 43.42 C ATOM 1231 O ALA A 79 29.333 -13.478 -7.729 1.00 50.43 O ATOM 1232 CB ALA A 79 28.145 -15.840 -6.570 1.00 11.14 C ATOM 0 H ALA A 79 30.925 -15.687 -6.859 1.00 43.24 H new ATOM 0 HA ALA A 79 28.640 -16.546 -8.528 1.00 10.33 H new ATOM 0 HB1 ALA A 79 27.158 -15.479 -6.859 1.00 11.14 H new ATOM 0 HB2 ALA A 79 28.059 -16.847 -6.163 1.00 11.14 H new ATOM 0 HB3 ALA A 79 28.566 -15.178 -5.813 1.00 11.14 H new ATOM 1238 N ASN A 80 28.960 -14.420 -9.738 1.00 4.04 N ATOM 1239 CA ASN A 80 29.009 -13.155 -10.462 1.00 71.44 C ATOM 1240 C ASN A 80 27.663 -12.849 -11.113 1.00 63.30 C ATOM 1241 O ASN A 80 26.693 -13.586 -10.934 1.00 10.55 O ATOM 1242 CB ASN A 80 30.106 -13.196 -11.528 1.00 71.43 C ATOM 1243 CG ASN A 80 31.352 -13.915 -11.048 1.00 41.30 C ATOM 1244 OD1 ASN A 80 31.956 -13.531 -10.046 1.00 41.23 O ATOM 1245 ND2 ASN A 80 31.743 -14.963 -11.763 1.00 20.31 N ATOM 0 H ASN A 80 28.789 -15.236 -10.325 1.00 4.04 H new ATOM 0 HA ASN A 80 29.236 -12.364 -9.747 1.00 71.44 H new ATOM 0 HB2 ASN A 80 29.724 -13.693 -12.420 1.00 71.43 H new ATOM 0 HB3 ASN A 80 30.366 -12.178 -11.817 1.00 71.43 H new ATOM 0 HD21 ASN A 80 32.575 -15.486 -11.489 1.00 20.31 H new ATOM 0 HD22 ASN A 80 31.211 -15.246 -12.586 1.00 20.31 H new ATOM 1252 N PHE A 81 27.613 -11.758 -11.870 1.00 31.20 N ATOM 1253 CA PHE A 81 26.387 -11.354 -12.548 1.00 15.25 C ATOM 1254 C PHE A 81 26.698 -10.493 -13.768 1.00 61.14 C ATOM 1255 O PHE A 81 27.718 -9.807 -13.813 1.00 64.33 O ATOM 1256 CB PHE A 81 25.477 -10.585 -11.586 1.00 63.44 C ATOM 1257 CG PHE A 81 26.173 -9.461 -10.873 1.00 74.12 C ATOM 1258 CD1 PHE A 81 26.255 -8.204 -11.449 1.00 51.40 C ATOM 1259 CD2 PHE A 81 26.744 -9.662 -9.627 1.00 64.02 C ATOM 1260 CE1 PHE A 81 26.894 -7.167 -10.795 1.00 53.33 C ATOM 1261 CE2 PHE A 81 27.384 -8.629 -8.969 1.00 10.14 C ATOM 1262 CZ PHE A 81 27.460 -7.380 -9.554 1.00 31.11 C ATOM 0 H PHE A 81 28.407 -11.138 -12.029 1.00 31.20 H new ATOM 0 HA PHE A 81 25.873 -12.255 -12.883 1.00 15.25 H new ATOM 0 HB2 PHE A 81 24.630 -10.183 -12.142 1.00 63.44 H new ATOM 0 HB3 PHE A 81 25.073 -11.278 -10.848 1.00 63.44 H new ATOM 0 HD1 PHE A 81 25.815 -8.032 -12.420 1.00 51.40 H new ATOM 0 HD2 PHE A 81 26.688 -10.637 -9.165 1.00 64.02 H new ATOM 0 HE1 PHE A 81 26.950 -6.191 -11.255 1.00 53.33 H new ATOM 0 HE2 PHE A 81 27.825 -8.798 -7.998 1.00 10.14 H new ATOM 0 HZ PHE A 81 27.961 -6.572 -9.042 1.00 31.11 H new ATOM 1272 N ASN A 82 25.811 -10.536 -14.757 1.00 51.11 N ATOM 1273 CA ASN A 82 25.991 -9.761 -15.980 1.00 30.34 C ATOM 1274 C ASN A 82 25.665 -8.290 -15.744 1.00 3.51 C ATOM 1275 O ASN A 82 25.259 -7.901 -14.650 1.00 13.11 O ATOM 1276 CB ASN A 82 25.106 -10.319 -17.096 1.00 52.42 C ATOM 1277 CG ASN A 82 25.705 -10.100 -18.472 1.00 54.22 C ATOM 1278 OD1 ASN A 82 26.818 -10.543 -18.754 1.00 41.45 O ATOM 1279 ND2 ASN A 82 24.966 -9.413 -19.336 1.00 70.33 N ATOM 0 H ASN A 82 24.961 -11.099 -14.736 1.00 51.11 H new ATOM 0 HA ASN A 82 27.036 -9.839 -16.281 1.00 30.34 H new ATOM 0 HB2 ASN A 82 24.952 -11.386 -16.935 1.00 52.42 H new ATOM 0 HB3 ASN A 82 24.125 -9.845 -17.050 1.00 52.42 H new ATOM 0 HD21 ASN A 82 25.316 -9.234 -20.277 1.00 70.33 H new ATOM 0 HD22 ASN A 82 24.048 -9.065 -19.058 1.00 70.33 H new ATOM 1286 N ASN A 83 25.847 -7.476 -16.779 1.00 54.11 N ATOM 1287 CA ASN A 83 25.572 -6.047 -16.685 1.00 41.42 C ATOM 1288 C ASN A 83 24.078 -5.790 -16.516 1.00 53.31 C ATOM 1289 O ASN A 83 23.353 -5.620 -17.496 1.00 31.31 O ATOM 1290 CB ASN A 83 26.087 -5.324 -17.932 1.00 24.24 C ATOM 1291 CG ASN A 83 26.410 -3.867 -17.663 1.00 54.23 C ATOM 1292 OD1 ASN A 83 26.107 -3.339 -16.593 1.00 33.41 O ATOM 1293 ND2 ASN A 83 27.027 -3.209 -18.637 1.00 41.54 N ATOM 0 H ASN A 83 26.184 -7.782 -17.692 1.00 54.11 H new ATOM 0 HA ASN A 83 26.091 -5.660 -15.808 1.00 41.42 H new ATOM 0 HB2 ASN A 83 26.980 -5.830 -18.299 1.00 24.24 H new ATOM 0 HB3 ASN A 83 25.338 -5.388 -18.721 1.00 24.24 H new ATOM 0 HD21 ASN A 83 27.269 -2.226 -18.515 1.00 41.54 H new ATOM 0 HD22 ASN A 83 27.259 -3.687 -19.508 1.00 41.54 H new ATOM 1300 N GLU A 84 23.625 -5.762 -15.266 1.00 42.14 N ATOM 1301 CA GLU A 84 22.217 -5.526 -14.970 1.00 2.23 C ATOM 1302 C GLU A 84 21.721 -4.258 -15.659 1.00 60.01 C ATOM 1303 O GLU A 84 22.445 -3.267 -15.758 1.00 12.15 O ATOM 1304 CB GLU A 84 22.003 -5.415 -13.459 1.00 1.03 C ATOM 1305 CG GLU A 84 20.607 -4.956 -13.074 1.00 33.12 C ATOM 1306 CD GLU A 84 20.483 -3.446 -13.021 1.00 53.31 C ATOM 1307 OE1 GLU A 84 21.088 -2.831 -12.118 1.00 71.31 O ATOM 1308 OE2 GLU A 84 19.780 -2.878 -13.884 1.00 22.31 O ATOM 0 H GLU A 84 24.212 -5.900 -14.443 1.00 42.14 H new ATOM 0 HA GLU A 84 21.645 -6.373 -15.350 1.00 2.23 H new ATOM 0 HB2 GLU A 84 22.197 -6.385 -13.001 1.00 1.03 H new ATOM 0 HB3 GLU A 84 22.732 -4.717 -13.048 1.00 1.03 H new ATOM 0 HG2 GLU A 84 19.888 -5.351 -13.792 1.00 33.12 H new ATOM 0 HG3 GLU A 84 20.347 -5.372 -12.101 1.00 33.12 H new ATOM 1315 N LYS A 85 20.481 -4.297 -16.136 1.00 24.33 N ATOM 1316 CA LYS A 85 19.886 -3.153 -16.816 1.00 31.24 C ATOM 1317 C LYS A 85 18.441 -2.948 -16.372 1.00 20.11 C ATOM 1318 O LYS A 85 17.891 -3.755 -15.622 1.00 0.52 O ATOM 1319 CB LYS A 85 19.942 -3.349 -18.332 1.00 72.43 C ATOM 1320 CG LYS A 85 19.484 -4.725 -18.785 1.00 33.00 C ATOM 1321 CD LYS A 85 19.156 -4.743 -20.269 1.00 33.45 C ATOM 1322 CE LYS A 85 20.391 -5.027 -21.109 1.00 63.10 C ATOM 1323 NZ LYS A 85 20.059 -5.165 -22.554 1.00 44.11 N ATOM 0 H LYS A 85 19.869 -5.109 -16.064 1.00 24.33 H new ATOM 0 HA LYS A 85 20.459 -2.265 -16.550 1.00 31.24 H new ATOM 0 HB2 LYS A 85 19.320 -2.593 -18.811 1.00 72.43 H new ATOM 0 HB3 LYS A 85 20.964 -3.185 -18.674 1.00 72.43 H new ATOM 0 HG2 LYS A 85 20.264 -5.457 -18.575 1.00 33.00 H new ATOM 0 HG3 LYS A 85 18.605 -5.023 -18.214 1.00 33.00 H new ATOM 0 HD2 LYS A 85 18.398 -5.501 -20.466 1.00 33.45 H new ATOM 0 HD3 LYS A 85 18.729 -3.783 -20.560 1.00 33.45 H new ATOM 0 HE2 LYS A 85 21.113 -4.221 -20.978 1.00 63.10 H new ATOM 0 HE3 LYS A 85 20.867 -5.942 -20.757 1.00 63.10 H new ATOM 0 HZ1 LYS A 85 20.927 -5.358 -23.093 1.00 44.11 H new ATOM 0 HZ2 LYS A 85 19.390 -5.950 -22.683 1.00 44.11 H new ATOM 0 HZ3 LYS A 85 19.628 -4.283 -22.897 1.00 44.11 H new ATOM 1337 N VAL A 86 17.831 -1.864 -16.841 1.00 73.42 N ATOM 1338 CA VAL A 86 16.449 -1.555 -16.495 1.00 13.03 C ATOM 1339 C VAL A 86 15.524 -1.754 -17.691 1.00 24.34 C ATOM 1340 O VAL A 86 15.880 -1.429 -18.824 1.00 23.32 O ATOM 1341 CB VAL A 86 16.308 -0.108 -15.987 1.00 10.33 C ATOM 1342 CG1 VAL A 86 14.877 0.168 -15.550 1.00 42.53 C ATOM 1343 CG2 VAL A 86 17.281 0.154 -14.847 1.00 64.53 C ATOM 0 H VAL A 86 18.272 -1.185 -17.462 1.00 73.42 H new ATOM 0 HA VAL A 86 16.161 -2.242 -15.699 1.00 13.03 H new ATOM 0 HB VAL A 86 16.550 0.570 -16.805 1.00 10.33 H new ATOM 0 HG11 VAL A 86 14.797 1.195 -15.194 1.00 42.53 H new ATOM 0 HG12 VAL A 86 14.204 0.023 -16.395 1.00 42.53 H new ATOM 0 HG13 VAL A 86 14.603 -0.516 -14.747 1.00 42.53 H new ATOM 0 HG21 VAL A 86 17.167 1.181 -14.501 1.00 64.53 H new ATOM 0 HG22 VAL A 86 17.072 -0.531 -14.026 1.00 64.53 H new ATOM 0 HG23 VAL A 86 18.302 -0.000 -15.197 1.00 64.53 H new ATOM 1353 N ILE A 87 14.337 -2.290 -17.431 1.00 14.15 N ATOM 1354 CA ILE A 87 13.360 -2.531 -18.486 1.00 3.03 C ATOM 1355 C ILE A 87 11.980 -2.022 -18.084 1.00 60.12 C ATOM 1356 O ILE A 87 11.739 -1.702 -16.919 1.00 52.25 O ATOM 1357 CB ILE A 87 13.263 -4.029 -18.831 1.00 14.23 C ATOM 1358 CG1 ILE A 87 12.864 -4.835 -17.593 1.00 1.33 C ATOM 1359 CG2 ILE A 87 14.584 -4.530 -19.393 1.00 24.10 C ATOM 1360 CD1 ILE A 87 14.042 -5.266 -16.748 1.00 21.52 C ATOM 0 H ILE A 87 14.028 -2.566 -16.499 1.00 14.15 H new ATOM 0 HA ILE A 87 13.703 -1.986 -19.365 1.00 3.03 H new ATOM 0 HB ILE A 87 12.494 -4.162 -19.592 1.00 14.23 H new ATOM 0 HG12 ILE A 87 12.188 -4.237 -16.982 1.00 1.33 H new ATOM 0 HG13 ILE A 87 12.310 -5.719 -17.908 1.00 1.33 H new ATOM 0 HG21 ILE A 87 14.499 -5.590 -19.632 1.00 24.10 H new ATOM 0 HG22 ILE A 87 14.829 -3.973 -20.297 1.00 24.10 H new ATOM 0 HG23 ILE A 87 15.372 -4.387 -18.653 1.00 24.10 H new ATOM 0 HD11 ILE A 87 13.685 -5.832 -15.888 1.00 21.52 H new ATOM 0 HD12 ILE A 87 14.707 -5.891 -17.343 1.00 21.52 H new ATOM 0 HD13 ILE A 87 14.584 -4.385 -16.403 1.00 21.52 H new ATOM 1372 N LEU A 88 11.076 -1.952 -19.055 1.00 42.31 N ATOM 1373 CA LEU A 88 9.718 -1.484 -18.803 1.00 54.43 C ATOM 1374 C LEU A 88 9.050 -2.312 -17.710 1.00 3.52 C ATOM 1375 O LEU A 88 8.544 -1.770 -16.727 1.00 40.50 O ATOM 1376 CB LEU A 88 8.888 -1.550 -20.087 1.00 2.21 C ATOM 1377 CG LEU A 88 9.364 -0.665 -21.240 1.00 32.22 C ATOM 1378 CD1 LEU A 88 8.464 -0.841 -22.454 1.00 5.25 C ATOM 1379 CD2 LEU A 88 9.405 0.794 -20.811 1.00 14.24 C ATOM 0 H LEU A 88 11.259 -2.213 -20.024 1.00 42.31 H new ATOM 0 HA LEU A 88 9.774 -0.449 -18.466 1.00 54.43 H new ATOM 0 HB2 LEU A 88 8.871 -2.584 -20.432 1.00 2.21 H new ATOM 0 HB3 LEU A 88 7.861 -1.277 -19.846 1.00 2.21 H new ATOM 0 HG LEU A 88 10.374 -0.970 -21.514 1.00 32.22 H new ATOM 0 HD11 LEU A 88 8.818 -0.204 -23.265 1.00 5.25 H new ATOM 0 HD12 LEU A 88 8.486 -1.882 -22.775 1.00 5.25 H new ATOM 0 HD13 LEU A 88 7.443 -0.563 -22.193 1.00 5.25 H new ATOM 0 HD21 LEU A 88 9.746 1.409 -21.644 1.00 14.24 H new ATOM 0 HD22 LEU A 88 8.407 1.113 -20.509 1.00 14.24 H new ATOM 0 HD23 LEU A 88 10.091 0.907 -19.972 1.00 14.24 H new ATOM 1391 N LYS A 89 9.055 -3.628 -17.886 1.00 71.51 N ATOM 1392 CA LYS A 89 8.454 -4.533 -16.914 1.00 34.25 C ATOM 1393 C LYS A 89 8.989 -5.951 -17.085 1.00 45.13 C ATOM 1394 O LYS A 89 9.854 -6.201 -17.926 1.00 62.11 O ATOM 1395 CB LYS A 89 6.930 -4.531 -17.058 1.00 61.45 C ATOM 1396 CG LYS A 89 6.453 -4.850 -18.465 1.00 15.13 C ATOM 1397 CD LYS A 89 5.035 -5.396 -18.462 1.00 34.12 C ATOM 1398 CE LYS A 89 4.372 -5.233 -19.821 1.00 71.52 C ATOM 1399 NZ LYS A 89 4.096 -3.804 -20.137 1.00 25.44 N ATOM 0 H LYS A 89 9.469 -4.093 -18.694 1.00 71.51 H new ATOM 0 HA LYS A 89 8.720 -4.182 -15.917 1.00 34.25 H new ATOM 0 HB2 LYS A 89 6.507 -5.259 -16.366 1.00 61.45 H new ATOM 0 HB3 LYS A 89 6.547 -3.553 -16.766 1.00 61.45 H new ATOM 0 HG2 LYS A 89 6.496 -3.950 -19.078 1.00 15.13 H new ATOM 0 HG3 LYS A 89 7.123 -5.578 -18.921 1.00 15.13 H new ATOM 0 HD2 LYS A 89 5.051 -6.451 -18.188 1.00 34.12 H new ATOM 0 HD3 LYS A 89 4.446 -4.879 -17.704 1.00 34.12 H new ATOM 0 HE2 LYS A 89 5.015 -5.657 -20.592 1.00 71.52 H new ATOM 0 HE3 LYS A 89 3.439 -5.796 -19.839 1.00 71.52 H new ATOM 0 HZ1 LYS A 89 3.354 -3.746 -20.863 1.00 25.44 H new ATOM 0 HZ2 LYS A 89 3.778 -3.313 -19.277 1.00 25.44 H new ATOM 0 HZ3 LYS A 89 4.963 -3.353 -20.492 1.00 25.44 H new ATOM 1413 N LEU A 90 8.470 -6.876 -16.285 1.00 43.43 N ATOM 1414 CA LEU A 90 8.896 -8.270 -16.350 1.00 14.50 C ATOM 1415 C LEU A 90 8.623 -8.858 -17.730 1.00 64.45 C ATOM 1416 O LEU A 90 7.843 -8.309 -18.508 1.00 10.31 O ATOM 1417 CB LEU A 90 8.176 -9.093 -15.281 1.00 33.13 C ATOM 1418 CG LEU A 90 8.306 -8.588 -13.843 1.00 43.24 C ATOM 1419 CD1 LEU A 90 7.529 -9.482 -12.890 1.00 73.24 C ATOM 1420 CD2 LEU A 90 9.770 -8.515 -13.435 1.00 2.04 C ATOM 0 H LEU A 90 7.754 -6.686 -15.584 1.00 43.43 H new ATOM 0 HA LEU A 90 9.970 -8.306 -16.166 1.00 14.50 H new ATOM 0 HB2 LEU A 90 7.117 -9.135 -15.536 1.00 33.13 H new ATOM 0 HB3 LEU A 90 8.554 -10.114 -15.322 1.00 33.13 H new ATOM 0 HG LEU A 90 7.884 -7.584 -13.791 1.00 43.24 H new ATOM 0 HD11 LEU A 90 7.634 -9.107 -11.872 1.00 73.24 H new ATOM 0 HD12 LEU A 90 6.476 -9.483 -13.170 1.00 73.24 H new ATOM 0 HD13 LEU A 90 7.920 -10.498 -12.944 1.00 73.24 H new ATOM 0 HD21 LEU A 90 9.844 -8.154 -12.409 1.00 2.04 H new ATOM 0 HD22 LEU A 90 10.217 -9.507 -13.504 1.00 2.04 H new ATOM 0 HD23 LEU A 90 10.299 -7.832 -14.099 1.00 2.04 H new ATOM 1432 N ASP A 91 9.270 -9.980 -18.027 1.00 61.14 N ATOM 1433 CA ASP A 91 9.096 -10.646 -19.313 1.00 35.01 C ATOM 1434 C ASP A 91 8.169 -11.851 -19.179 1.00 45.14 C ATOM 1435 O ASP A 91 7.412 -12.169 -20.096 1.00 55.32 O ATOM 1436 CB ASP A 91 10.449 -11.087 -19.871 1.00 65.10 C ATOM 1437 CG ASP A 91 11.017 -12.285 -19.135 1.00 74.10 C ATOM 1438 OD1 ASP A 91 10.994 -12.280 -17.886 1.00 53.02 O ATOM 1439 OD2 ASP A 91 11.482 -13.228 -19.808 1.00 24.22 O ATOM 0 H ASP A 91 9.920 -10.447 -17.395 1.00 61.14 H new ATOM 0 HA ASP A 91 8.642 -9.936 -20.004 1.00 35.01 H new ATOM 0 HB2 ASP A 91 10.341 -11.332 -20.928 1.00 65.10 H new ATOM 0 HB3 ASP A 91 11.153 -10.257 -19.806 1.00 65.10 H new ATOM 1444 N TYR A 92 8.237 -12.518 -18.033 1.00 30.11 N ATOM 1445 CA TYR A 92 7.407 -13.690 -17.781 1.00 23.33 C ATOM 1446 C TYR A 92 6.610 -13.526 -16.490 1.00 60.04 C ATOM 1447 O TYR A 92 6.884 -12.634 -15.688 1.00 32.05 O ATOM 1448 CB TYR A 92 8.275 -14.948 -17.701 1.00 11.53 C ATOM 1449 CG TYR A 92 8.471 -15.634 -19.034 1.00 0.34 C ATOM 1450 CD1 TYR A 92 7.383 -16.071 -19.779 1.00 42.12 C ATOM 1451 CD2 TYR A 92 9.745 -15.844 -19.548 1.00 53.10 C ATOM 1452 CE1 TYR A 92 7.558 -16.699 -20.997 1.00 40.10 C ATOM 1453 CE2 TYR A 92 9.929 -16.470 -20.766 1.00 11.22 C ATOM 1454 CZ TYR A 92 8.833 -16.896 -21.486 1.00 54.12 C ATOM 1455 OH TYR A 92 9.011 -17.520 -22.700 1.00 12.23 O ATOM 0 H TYR A 92 8.858 -12.267 -17.264 1.00 30.11 H new ATOM 0 HA TYR A 92 6.706 -13.792 -18.609 1.00 23.33 H new ATOM 0 HB2 TYR A 92 9.250 -14.681 -17.292 1.00 11.53 H new ATOM 0 HB3 TYR A 92 7.818 -15.651 -17.004 1.00 11.53 H new ATOM 0 HD1 TYR A 92 6.384 -15.917 -19.400 1.00 42.12 H new ATOM 0 HD2 TYR A 92 10.606 -15.512 -18.986 1.00 53.10 H new ATOM 0 HE1 TYR A 92 6.702 -17.034 -21.563 1.00 40.10 H new ATOM 0 HE2 TYR A 92 10.926 -16.625 -21.152 1.00 11.22 H new ATOM 0 HH TYR A 92 9.969 -17.580 -22.900 1.00 12.23 H new ATOM 1465 N SER A 93 5.622 -14.394 -16.298 1.00 61.43 N ATOM 1466 CA SER A 93 4.782 -14.345 -15.108 1.00 32.14 C ATOM 1467 C SER A 93 4.837 -15.667 -14.348 1.00 64.23 C ATOM 1468 O SER A 93 3.887 -16.041 -13.661 1.00 22.32 O ATOM 1469 CB SER A 93 3.336 -14.025 -15.491 1.00 52.40 C ATOM 1470 OG SER A 93 2.626 -13.478 -14.393 1.00 21.42 O ATOM 0 H SER A 93 5.384 -15.140 -16.952 1.00 61.43 H new ATOM 0 HA SER A 93 5.162 -13.556 -14.459 1.00 32.14 H new ATOM 0 HB2 SER A 93 3.324 -13.321 -16.323 1.00 52.40 H new ATOM 0 HB3 SER A 93 2.838 -14.932 -15.834 1.00 52.40 H new ATOM 0 HG SER A 93 2.694 -14.084 -13.625 1.00 21.42 H new ATOM 1476 N ASP A 94 5.957 -16.370 -14.478 1.00 42.13 N ATOM 1477 CA ASP A 94 6.139 -17.650 -13.804 1.00 61.22 C ATOM 1478 C ASP A 94 7.592 -18.108 -13.889 1.00 51.42 C ATOM 1479 O ASP A 94 8.290 -17.816 -14.861 1.00 12.44 O ATOM 1480 CB ASP A 94 5.221 -18.709 -14.418 1.00 4.20 C ATOM 1481 CG ASP A 94 5.632 -19.084 -15.828 1.00 42.33 C ATOM 1482 OD1 ASP A 94 5.852 -18.166 -16.646 1.00 44.23 O ATOM 1483 OD2 ASP A 94 5.734 -20.295 -16.114 1.00 3.11 O ATOM 0 H ASP A 94 6.752 -16.075 -15.044 1.00 42.13 H new ATOM 0 HA ASP A 94 5.879 -17.519 -12.754 1.00 61.22 H new ATOM 0 HB2 ASP A 94 5.229 -19.601 -13.791 1.00 4.20 H new ATOM 0 HB3 ASP A 94 4.197 -18.336 -14.428 1.00 4.20 H new ATOM 1488 N PHE A 95 8.042 -18.825 -12.865 1.00 72.44 N ATOM 1489 CA PHE A 95 9.412 -19.322 -12.823 1.00 44.52 C ATOM 1490 C PHE A 95 9.468 -20.799 -13.199 1.00 73.41 C ATOM 1491 O PHE A 95 9.211 -21.671 -12.369 1.00 4.11 O ATOM 1492 CB PHE A 95 10.009 -19.116 -11.429 1.00 42.54 C ATOM 1493 CG PHE A 95 11.500 -18.936 -11.436 1.00 64.32 C ATOM 1494 CD1 PHE A 95 12.322 -19.876 -12.038 1.00 34.44 C ATOM 1495 CD2 PHE A 95 12.081 -17.828 -10.842 1.00 11.51 C ATOM 1496 CE1 PHE A 95 13.694 -19.714 -12.045 1.00 21.24 C ATOM 1497 CE2 PHE A 95 13.453 -17.660 -10.846 1.00 51.31 C ATOM 1498 CZ PHE A 95 14.260 -18.604 -11.449 1.00 44.12 C ATOM 0 H PHE A 95 7.478 -19.075 -12.053 1.00 72.44 H new ATOM 0 HA PHE A 95 9.998 -18.759 -13.549 1.00 44.52 H new ATOM 0 HB2 PHE A 95 9.548 -18.241 -10.971 1.00 42.54 H new ATOM 0 HB3 PHE A 95 9.757 -19.973 -10.804 1.00 42.54 H new ATOM 0 HD1 PHE A 95 11.885 -20.745 -12.507 1.00 34.44 H new ATOM 0 HD2 PHE A 95 11.454 -17.086 -10.370 1.00 11.51 H new ATOM 0 HE1 PHE A 95 14.323 -20.455 -12.516 1.00 21.24 H new ATOM 0 HE2 PHE A 95 13.893 -16.792 -10.378 1.00 51.31 H new ATOM 0 HZ PHE A 95 15.332 -18.475 -11.455 1.00 44.12 H new ATOM 1508 N GLN A 96 9.803 -21.072 -14.456 1.00 4.11 N ATOM 1509 CA GLN A 96 9.891 -22.444 -14.942 1.00 40.33 C ATOM 1510 C GLN A 96 11.346 -22.877 -15.089 1.00 32.41 C ATOM 1511 O GLN A 96 12.229 -22.052 -15.323 1.00 11.21 O ATOM 1512 CB GLN A 96 9.169 -22.579 -16.284 1.00 15.42 C ATOM 1513 CG GLN A 96 8.575 -23.958 -16.519 1.00 72.10 C ATOM 1514 CD GLN A 96 7.862 -24.067 -17.852 1.00 53.04 C ATOM 1515 OE1 GLN A 96 7.359 -23.076 -18.383 1.00 74.30 O ATOM 1516 NE2 GLN A 96 7.815 -25.275 -18.402 1.00 14.10 N ATOM 0 H GLN A 96 10.018 -20.362 -15.156 1.00 4.11 H new ATOM 0 HA GLN A 96 9.409 -23.093 -14.211 1.00 40.33 H new ATOM 0 HB2 GLN A 96 8.373 -21.836 -16.335 1.00 15.42 H new ATOM 0 HB3 GLN A 96 9.869 -22.352 -17.088 1.00 15.42 H new ATOM 0 HG2 GLN A 96 9.369 -24.704 -16.474 1.00 72.10 H new ATOM 0 HG3 GLN A 96 7.874 -24.189 -15.717 1.00 72.10 H new ATOM 0 HE21 GLN A 96 8.245 -26.069 -17.927 1.00 14.10 H new ATOM 0 HE22 GLN A 96 7.349 -25.409 -19.299 1.00 14.10 H new ATOM 1525 N ILE A 97 11.588 -24.176 -14.950 1.00 34.54 N ATOM 1526 CA ILE A 97 12.935 -24.719 -15.067 1.00 63.14 C ATOM 1527 C ILE A 97 13.130 -25.420 -16.408 1.00 24.15 C ATOM 1528 O ILE A 97 12.645 -26.532 -16.615 1.00 70.22 O ATOM 1529 CB ILE A 97 13.244 -25.712 -13.932 1.00 34.45 C ATOM 1530 CG1 ILE A 97 12.966 -25.068 -12.572 1.00 35.22 C ATOM 1531 CG2 ILE A 97 14.688 -26.182 -14.016 1.00 3.31 C ATOM 1532 CD1 ILE A 97 13.064 -26.036 -11.413 1.00 43.33 C ATOM 0 H ILE A 97 10.868 -24.872 -14.756 1.00 34.54 H new ATOM 0 HA ILE A 97 13.622 -23.876 -14.996 1.00 63.14 H new ATOM 0 HB ILE A 97 12.594 -26.580 -14.042 1.00 34.45 H new ATOM 0 HG12 ILE A 97 13.672 -24.252 -12.414 1.00 35.22 H new ATOM 0 HG13 ILE A 97 11.969 -24.628 -12.584 1.00 35.22 H new ATOM 0 HG21 ILE A 97 14.890 -26.883 -13.206 1.00 3.31 H new ATOM 0 HG22 ILE A 97 14.855 -26.675 -14.974 1.00 3.31 H new ATOM 0 HG23 ILE A 97 15.355 -25.325 -13.928 1.00 3.31 H new ATOM 0 HD11 ILE A 97 12.855 -25.510 -10.481 1.00 43.33 H new ATOM 0 HD12 ILE A 97 12.339 -26.839 -11.547 1.00 43.33 H new ATOM 0 HD13 ILE A 97 14.069 -26.457 -11.374 1.00 43.33 H new ATOM 1544 N VAL A 98 13.846 -24.763 -17.314 1.00 43.34 N ATOM 1545 CA VAL A 98 14.109 -25.324 -18.634 1.00 51.33 C ATOM 1546 C VAL A 98 15.022 -26.541 -18.542 1.00 74.42 C ATOM 1547 O VAL A 98 16.059 -26.505 -17.880 1.00 33.43 O ATOM 1548 CB VAL A 98 14.753 -24.282 -19.569 1.00 22.44 C ATOM 1549 CG1 VAL A 98 15.047 -24.895 -20.930 1.00 34.04 C ATOM 1550 CG2 VAL A 98 13.855 -23.063 -19.706 1.00 52.43 C ATOM 0 H VAL A 98 14.255 -23.841 -17.158 1.00 43.34 H new ATOM 0 HA VAL A 98 13.146 -25.626 -19.047 1.00 51.33 H new ATOM 0 HB VAL A 98 15.698 -23.961 -19.131 1.00 22.44 H new ATOM 0 HG11 VAL A 98 15.501 -24.144 -21.577 1.00 34.04 H new ATOM 0 HG12 VAL A 98 15.732 -25.734 -20.811 1.00 34.04 H new ATOM 0 HG13 VAL A 98 14.118 -25.246 -21.379 1.00 34.04 H new ATOM 0 HG21 VAL A 98 14.325 -22.337 -20.370 1.00 52.43 H new ATOM 0 HG22 VAL A 98 12.893 -23.364 -20.121 1.00 52.43 H new ATOM 0 HG23 VAL A 98 13.702 -22.612 -18.726 1.00 52.43 H new ATOM 1560 N LYS A 99 14.629 -27.620 -19.212 1.00 3.21 N ATOM 1561 CA LYS A 99 15.412 -28.850 -19.208 1.00 40.03 C ATOM 1562 C LYS A 99 16.231 -28.977 -20.489 1.00 23.33 C ATOM 1563 O LYS A 99 17.459 -29.054 -20.446 1.00 44.12 O ATOM 1564 CB LYS A 99 14.492 -30.064 -19.056 1.00 42.40 C ATOM 1565 CG LYS A 99 13.396 -30.132 -20.105 1.00 42.54 C ATOM 1566 CD LYS A 99 12.697 -31.480 -20.095 1.00 33.45 C ATOM 1567 CE LYS A 99 11.778 -31.622 -18.890 1.00 62.34 C ATOM 1568 NZ LYS A 99 12.526 -32.022 -17.666 1.00 62.24 N ATOM 0 H LYS A 99 13.773 -27.667 -19.764 1.00 3.21 H new ATOM 0 HA LYS A 99 16.097 -28.813 -18.361 1.00 40.03 H new ATOM 0 HB2 LYS A 99 15.092 -30.973 -19.110 1.00 42.40 H new ATOM 0 HB3 LYS A 99 14.035 -30.042 -18.067 1.00 42.40 H new ATOM 0 HG2 LYS A 99 12.667 -29.342 -19.923 1.00 42.54 H new ATOM 0 HG3 LYS A 99 13.823 -29.950 -21.091 1.00 42.54 H new ATOM 0 HD2 LYS A 99 12.118 -31.598 -21.011 1.00 33.45 H new ATOM 0 HD3 LYS A 99 13.441 -32.277 -20.083 1.00 33.45 H new ATOM 0 HE2 LYS A 99 11.266 -30.677 -18.710 1.00 62.34 H new ATOM 0 HE3 LYS A 99 11.010 -32.365 -19.105 1.00 62.34 H new ATOM 0 HZ1 LYS A 99 12.026 -32.801 -17.192 1.00 62.24 H new ATOM 0 HZ2 LYS A 99 13.482 -32.334 -17.930 1.00 62.24 H new ATOM 0 HZ3 LYS A 99 12.593 -31.210 -17.019 1.00 62.24 H new