USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 882 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 63 HIS : no HD1:sc= -0.704 K(o=-2.4,f=-4.7) USER MOD Set 1.2: A 65 ASN : amide:sc= -1.69 X(o=-2.4,f=-2.2!) USER MOD Set 1.3: A 66 ASN : amide:sc= 0 X(o=-2.4,f=-2.4) USER MOD Set 2.1: A 58 MET CE :methyl 165:sc= 0 (180deg=-0.415) USER MOD Set 2.2: A 89 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 56 TYR OH : rot 8:sc= 0.152 USER MOD Set 3.2: A 70 HIS : no HD1:sc= -0.158 K(o=-0.0057,f=-0.82) USER MOD Set 3.3: A 78 THR OG1 : rot 170:sc= 0 USER MOD Set 4.1: A 52 TYR OH : rot 127:sc= -0.699 USER MOD Set 4.2: A 76 GLN : amide:sc= -0.888 K(o=-1.6,f=-2.2) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.11 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 57:sc= 0.0224 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.316 USER MOD Single : A 12 GLN : amide:sc= -0.0389 X(o=-0.039,f=-0.039) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 19 SER OG : rot -53:sc= 0.205 USER MOD Single : A 20 SER OG : rot 60:sc= -0.112 USER MOD Single : A 26 GLN : amide:sc= -0.0923 X(o=-0.092,f=-0.0026) USER MOD Single : A 29 MET CE :methyl 161:sc= -5.96! (180deg=-6.87!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.0209 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.11 USER MOD Single : A 38 GLN : amide:sc= -0.0294 X(o=-0.029,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.181 X(o=-0.18,f=-0.15) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= -0.0241 K(o=-0.024,f=-1.5!) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.0762 USER MOD Single : A 57 THR OG1 : rot 180:sc= -0.0395 USER MOD Single : A 61 THR OG1 : rot -30:sc= 0.0737 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 68 MET CE :methyl 163:sc= 0 (180deg=-0.305) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 39:sc= 0.109 USER MOD Single : A 82 ASN : amide:sc=-0.000532 X(o=-0.00053,f=-0.053) USER MOD Single : A 86 GLN : amide:sc= -0.0218 K(o=-0.022,f=-0.69) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 150:sc= 0.338 (180deg=0.0373) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= -0.0443 USER MOD Single : A 106 SER OG : rot 180:sc= 0.0771 USER MOD Single : A 109 GLN : amide:sc= -0.155 K(o=-0.16,f=-2.3!) USER MOD Single : A 112 THR OG1 : rot 157:sc= 1.88 USER MOD Single : A 113 GLN : amide:sc= -0.13 X(o=-0.13,f=0.29) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= -0.0485 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.217 54.016 3.158 1.00 0.00 N ATOM 2 CA GLY A 1 -7.258 53.100 2.729 1.00 0.00 C ATOM 3 C GLY A 1 -7.212 51.781 3.475 1.00 0.00 C ATOM 4 O GLY A 1 -7.115 51.757 4.702 1.00 0.00 O ATOM 0 H1 GLY A 1 -6.291 54.902 2.619 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.328 54.217 4.172 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.285 53.586 2.991 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.232 53.565 2.880 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.156 52.913 1.660 1.00 0.00 H new ATOM 8 N SER A 2 -7.282 50.680 2.732 1.00 0.00 N ATOM 9 CA SER A 2 -7.254 49.352 3.331 1.00 0.00 C ATOM 10 C SER A 2 -8.447 49.148 4.259 1.00 0.00 C ATOM 11 O SER A 2 -9.172 50.092 4.572 1.00 0.00 O ATOM 12 CB SER A 2 -5.950 49.145 4.105 1.00 0.00 C ATOM 13 OG SER A 2 -5.817 47.799 4.529 1.00 0.00 O ATOM 0 H SER A 2 -7.358 50.683 1.715 1.00 0.00 H new ATOM 0 HA SER A 2 -7.312 48.618 2.527 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.103 49.417 3.475 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.929 49.806 4.971 1.00 0.00 H new ATOM 0 HG SER A 2 -4.975 47.692 5.020 1.00 0.00 H new ATOM 19 N SER A 3 -8.645 47.908 4.696 1.00 0.00 N ATOM 20 CA SER A 3 -9.752 47.579 5.585 1.00 0.00 C ATOM 21 C SER A 3 -9.345 46.499 6.584 1.00 0.00 C ATOM 22 O SER A 3 -9.560 46.638 7.787 1.00 0.00 O ATOM 23 CB SER A 3 -10.963 47.108 4.776 1.00 0.00 C ATOM 24 OG SER A 3 -10.580 46.717 3.468 1.00 0.00 O ATOM 0 H SER A 3 -8.053 47.115 4.448 1.00 0.00 H new ATOM 0 HA SER A 3 -10.020 48.480 6.137 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.441 46.271 5.284 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.700 47.909 4.719 1.00 0.00 H new ATOM 0 HG SER A 3 -11.370 46.419 2.971 1.00 0.00 H new ATOM 30 N GLY A 4 -8.753 45.423 6.075 1.00 0.00 N ATOM 31 CA GLY A 4 -8.324 44.336 6.934 1.00 0.00 C ATOM 32 C GLY A 4 -7.619 43.235 6.168 1.00 0.00 C ATOM 33 O GLY A 4 -7.574 43.255 4.937 1.00 0.00 O ATOM 0 H GLY A 4 -8.563 45.285 5.082 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.655 44.726 7.701 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.190 43.919 7.448 1.00 0.00 H new ATOM 37 N SER A 5 -7.065 42.270 6.896 1.00 0.00 N ATOM 38 CA SER A 5 -6.353 41.158 6.276 1.00 0.00 C ATOM 39 C SER A 5 -6.040 40.074 7.302 1.00 0.00 C ATOM 40 O SER A 5 -6.034 40.328 8.507 1.00 0.00 O ATOM 41 CB SER A 5 -5.058 41.651 5.628 1.00 0.00 C ATOM 42 OG SER A 5 -5.121 41.542 4.217 1.00 0.00 O ATOM 0 H SER A 5 -7.095 42.236 7.915 1.00 0.00 H new ATOM 0 HA SER A 5 -6.996 40.731 5.507 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.880 42.689 5.908 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.216 41.070 6.004 1.00 0.00 H new ATOM 0 HG SER A 5 -5.896 42.041 3.885 1.00 0.00 H new ATOM 48 N SER A 6 -5.780 38.864 6.817 1.00 0.00 N ATOM 49 CA SER A 6 -5.470 37.740 7.691 1.00 0.00 C ATOM 50 C SER A 6 -4.044 37.842 8.223 1.00 0.00 C ATOM 51 O SER A 6 -3.825 38.154 9.392 1.00 0.00 O ATOM 52 CB SER A 6 -5.655 36.418 6.943 1.00 0.00 C ATOM 53 OG SER A 6 -7.026 36.157 6.700 1.00 0.00 O ATOM 0 H SER A 6 -5.778 38.637 5.822 1.00 0.00 H new ATOM 0 HA SER A 6 -6.157 37.769 8.537 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.115 36.453 5.997 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.224 35.604 7.526 1.00 0.00 H new ATOM 0 HG SER A 6 -7.117 35.308 6.219 1.00 0.00 H new ATOM 59 N GLY A 7 -3.075 37.574 7.352 1.00 0.00 N ATOM 60 CA GLY A 7 -1.681 37.640 7.751 1.00 0.00 C ATOM 61 C GLY A 7 -1.128 36.289 8.156 1.00 0.00 C ATOM 62 O GLY A 7 -1.863 35.311 8.302 1.00 0.00 O ATOM 0 H GLY A 7 -3.231 37.313 6.378 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.089 38.039 6.927 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.577 38.336 8.584 1.00 0.00 H new ATOM 66 N PRO A 8 0.199 36.218 8.343 1.00 0.00 N ATOM 67 CA PRO A 8 0.879 34.980 8.734 1.00 0.00 C ATOM 68 C PRO A 8 0.556 34.571 10.167 1.00 0.00 C ATOM 69 O PRO A 8 0.100 35.384 10.970 1.00 0.00 O ATOM 70 CB PRO A 8 2.362 35.333 8.600 1.00 0.00 C ATOM 71 CG PRO A 8 2.417 36.811 8.768 1.00 0.00 C ATOM 72 CD PRO A 8 1.136 37.342 8.187 1.00 0.00 C ATOM 0 HA PRO A 8 0.571 34.134 8.120 1.00 0.00 H new ATOM 0 HB2 PRO A 8 2.959 34.826 9.358 1.00 0.00 H new ATOM 0 HB3 PRO A 8 2.755 35.030 7.629 1.00 0.00 H new ATOM 0 HG2 PRO A 8 2.510 37.081 9.820 1.00 0.00 H new ATOM 0 HG3 PRO A 8 3.282 37.230 8.254 1.00 0.00 H new ATOM 0 HD2 PRO A 8 0.791 38.229 8.718 1.00 0.00 H new ATOM 0 HD3 PRO A 8 1.256 37.623 7.141 1.00 0.00 H new ATOM 80 N VAL A 9 0.797 33.301 10.483 1.00 0.00 N ATOM 81 CA VAL A 9 0.533 32.783 11.820 1.00 0.00 C ATOM 82 C VAL A 9 1.415 31.579 12.127 1.00 0.00 C ATOM 83 O VAL A 9 1.091 30.760 12.988 1.00 0.00 O ATOM 84 CB VAL A 9 -0.944 32.379 11.985 1.00 0.00 C ATOM 85 CG1 VAL A 9 -1.225 31.073 11.256 1.00 0.00 C ATOM 86 CG2 VAL A 9 -1.304 32.265 13.459 1.00 0.00 C ATOM 0 H VAL A 9 1.174 32.613 9.831 1.00 0.00 H new ATOM 0 HA VAL A 9 0.762 33.586 12.521 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.567 33.156 11.542 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.273 30.803 11.384 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -1.008 31.195 10.195 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -0.595 30.284 11.667 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -2.351 31.979 13.557 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -0.676 31.509 13.930 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -1.143 33.226 13.948 1.00 0.00 H new ATOM 96 N LEU A 10 2.533 31.476 11.417 1.00 0.00 N ATOM 97 CA LEU A 10 3.465 30.371 11.613 1.00 0.00 C ATOM 98 C LEU A 10 2.779 29.029 11.370 1.00 0.00 C ATOM 99 O LEU A 10 2.139 28.476 12.264 1.00 0.00 O ATOM 100 CB LEU A 10 4.045 30.410 13.028 1.00 0.00 C ATOM 101 CG LEU A 10 5.324 31.228 13.207 1.00 0.00 C ATOM 102 CD1 LEU A 10 5.528 31.586 14.671 1.00 0.00 C ATOM 103 CD2 LEU A 10 6.526 30.461 12.670 1.00 0.00 C ATOM 0 H LEU A 10 2.816 32.144 10.700 1.00 0.00 H new ATOM 0 HA LEU A 10 4.275 30.481 10.892 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.285 30.810 13.700 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.245 29.387 13.346 1.00 0.00 H new ATOM 0 HG LEU A 10 5.224 32.153 12.639 1.00 0.00 H new ATOM 0 HD11 LEU A 10 6.443 32.168 14.779 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.680 32.174 15.023 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.607 30.673 15.261 1.00 0.00 H new ATOM 0 HD21 LEU A 10 7.428 31.058 12.805 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.629 29.520 13.211 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.382 30.256 11.609 1.00 0.00 H new ATOM 115 N THR A 11 2.918 28.511 10.153 1.00 0.00 N ATOM 116 CA THR A 11 2.313 27.235 9.792 1.00 0.00 C ATOM 117 C THR A 11 2.741 26.800 8.395 1.00 0.00 C ATOM 118 O THR A 11 3.471 27.515 7.710 1.00 0.00 O ATOM 119 CB THR A 11 0.775 27.307 9.847 1.00 0.00 C ATOM 120 OG1 THR A 11 0.351 28.674 9.901 1.00 0.00 O ATOM 121 CG2 THR A 11 0.242 26.557 11.058 1.00 0.00 C ATOM 0 H THR A 11 3.444 28.956 9.401 1.00 0.00 H new ATOM 0 HA THR A 11 2.661 26.502 10.520 1.00 0.00 H new ATOM 0 HB THR A 11 0.378 26.839 8.946 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.628 28.712 9.934 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.846 26.622 11.076 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.543 25.511 10.999 1.00 0.00 H new ATOM 0 HG23 THR A 11 0.647 27.000 11.968 1.00 0.00 H new ATOM 129 N GLN A 12 2.280 25.625 7.980 1.00 0.00 N ATOM 130 CA GLN A 12 2.615 25.094 6.664 1.00 0.00 C ATOM 131 C GLN A 12 2.195 26.065 5.564 1.00 0.00 C ATOM 132 O GLN A 12 1.536 27.072 5.826 1.00 0.00 O ATOM 133 CB GLN A 12 1.942 23.739 6.449 1.00 0.00 C ATOM 134 CG GLN A 12 2.208 22.744 7.568 1.00 0.00 C ATOM 135 CD GLN A 12 3.684 22.442 7.740 1.00 0.00 C ATOM 136 OE1 GLN A 12 4.352 23.023 8.598 1.00 0.00 O ATOM 137 NE2 GLN A 12 4.202 21.530 6.926 1.00 0.00 N ATOM 0 H GLN A 12 1.673 25.022 8.536 1.00 0.00 H new ATOM 0 HA GLN A 12 3.696 24.964 6.617 1.00 0.00 H new ATOM 0 HB2 GLN A 12 0.866 23.888 6.354 1.00 0.00 H new ATOM 0 HB3 GLN A 12 2.290 23.315 5.507 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.810 23.139 8.503 1.00 0.00 H new ATOM 0 HG3 GLN A 12 1.673 21.817 7.360 1.00 0.00 H new ATOM 0 HE21 GLN A 12 3.612 21.074 6.230 1.00 0.00 H new ATOM 0 HE22 GLN A 12 5.190 21.286 6.997 1.00 0.00 H new ATOM 146 N THR A 13 2.578 25.752 4.329 1.00 0.00 N ATOM 147 CA THR A 13 2.242 26.597 3.189 1.00 0.00 C ATOM 148 C THR A 13 0.976 26.106 2.496 1.00 0.00 C ATOM 149 O THR A 13 1.029 25.581 1.384 1.00 0.00 O ATOM 150 CB THR A 13 3.392 26.639 2.164 1.00 0.00 C ATOM 151 OG1 THR A 13 4.646 26.789 2.840 1.00 0.00 O ATOM 152 CG2 THR A 13 3.199 27.786 1.182 1.00 0.00 C ATOM 0 H THR A 13 3.120 24.921 4.093 1.00 0.00 H new ATOM 0 HA THR A 13 2.074 27.602 3.577 1.00 0.00 H new ATOM 0 HB THR A 13 3.389 25.701 1.609 1.00 0.00 H new ATOM 0 HG1 THR A 13 5.372 26.813 2.182 1.00 0.00 H new ATOM 0 HG21 THR A 13 4.023 27.796 0.468 1.00 0.00 H new ATOM 0 HG22 THR A 13 2.258 27.654 0.648 1.00 0.00 H new ATOM 0 HG23 THR A 13 3.178 28.731 1.725 1.00 0.00 H new ATOM 160 N SER A 14 -0.162 26.281 3.160 1.00 0.00 N ATOM 161 CA SER A 14 -1.442 25.853 2.609 1.00 0.00 C ATOM 162 C SER A 14 -1.490 24.334 2.465 1.00 0.00 C ATOM 163 O SER A 14 -0.757 23.752 1.665 1.00 0.00 O ATOM 164 CB SER A 14 -1.682 26.513 1.251 1.00 0.00 C ATOM 165 OG SER A 14 -2.644 27.550 1.352 1.00 0.00 O ATOM 0 H SER A 14 -0.223 26.716 4.080 1.00 0.00 H new ATOM 0 HA SER A 14 -2.228 26.161 3.298 1.00 0.00 H new ATOM 0 HB2 SER A 14 -0.745 26.918 0.869 1.00 0.00 H new ATOM 0 HB3 SER A 14 -2.022 25.765 0.534 1.00 0.00 H new ATOM 0 HG SER A 14 -2.779 27.958 0.471 1.00 0.00 H new ATOM 171 N GLU A 15 -2.359 23.699 3.245 1.00 0.00 N ATOM 172 CA GLU A 15 -2.503 22.248 3.204 1.00 0.00 C ATOM 173 C GLU A 15 -3.551 21.834 2.175 1.00 0.00 C ATOM 174 O GLU A 15 -4.697 22.279 2.229 1.00 0.00 O ATOM 175 CB GLU A 15 -2.888 21.713 4.586 1.00 0.00 C ATOM 176 CG GLU A 15 -1.800 21.887 5.631 1.00 0.00 C ATOM 177 CD GLU A 15 -1.941 23.180 6.410 1.00 0.00 C ATOM 178 OE1 GLU A 15 -1.481 24.227 5.911 1.00 0.00 O ATOM 179 OE2 GLU A 15 -2.513 23.143 7.522 1.00 0.00 O ATOM 0 H GLU A 15 -2.973 24.166 3.912 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.544 21.821 2.911 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.790 22.222 4.925 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.132 20.654 4.501 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -1.828 21.045 6.323 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.826 21.866 5.143 1.00 0.00 H new ATOM 186 N GLN A 16 -3.147 20.980 1.241 1.00 0.00 N ATOM 187 CA GLN A 16 -4.052 20.506 0.198 1.00 0.00 C ATOM 188 C GLN A 16 -4.114 18.982 0.184 1.00 0.00 C ATOM 189 O GLN A 16 -3.481 18.318 1.002 1.00 0.00 O ATOM 190 CB GLN A 16 -3.602 21.024 -1.168 1.00 0.00 C ATOM 191 CG GLN A 16 -4.461 22.160 -1.702 1.00 0.00 C ATOM 192 CD GLN A 16 -3.988 22.666 -3.050 1.00 0.00 C ATOM 193 OE1 GLN A 16 -3.551 21.888 -3.900 1.00 0.00 O ATOM 194 NE2 GLN A 16 -4.072 23.975 -3.255 1.00 0.00 N ATOM 0 H GLN A 16 -2.201 20.602 1.184 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.049 20.889 0.413 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.569 21.364 -1.096 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.618 20.201 -1.882 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -5.493 21.820 -1.788 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -4.454 22.983 -0.987 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -4.440 24.583 -2.524 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -3.768 24.373 -4.144 1.00 0.00 H new ATOM 203 N ALA A 17 -4.883 18.436 -0.753 1.00 0.00 N ATOM 204 CA ALA A 17 -5.027 16.991 -0.876 1.00 0.00 C ATOM 205 C ALA A 17 -3.692 16.334 -1.213 1.00 0.00 C ATOM 206 O ALA A 17 -2.764 16.974 -1.707 1.00 0.00 O ATOM 207 CB ALA A 17 -6.066 16.652 -1.934 1.00 0.00 C ATOM 0 H ALA A 17 -5.415 18.973 -1.438 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.363 16.601 0.085 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.163 15.569 -2.015 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -7.027 17.082 -1.651 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.754 17.061 -2.895 1.00 0.00 H new ATOM 213 N PRO A 18 -3.592 15.024 -0.940 1.00 0.00 N ATOM 214 CA PRO A 18 -2.375 14.251 -1.205 1.00 0.00 C ATOM 215 C PRO A 18 -2.125 14.059 -2.698 1.00 0.00 C ATOM 216 O PRO A 18 -2.960 13.501 -3.410 1.00 0.00 O ATOM 217 CB PRO A 18 -2.656 12.905 -0.533 1.00 0.00 C ATOM 218 CG PRO A 18 -4.142 12.795 -0.512 1.00 0.00 C ATOM 219 CD PRO A 18 -4.659 14.197 -0.350 1.00 0.00 C ATOM 0 HA PRO A 18 -1.483 14.752 -0.829 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.206 12.083 -1.090 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -2.242 12.872 0.475 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -4.513 12.346 -1.433 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -4.475 12.159 0.309 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -5.608 14.337 -0.867 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -4.827 14.445 0.698 1.00 0.00 H new ATOM 227 N SER A 19 -0.970 14.523 -3.163 1.00 0.00 N ATOM 228 CA SER A 19 -0.610 14.405 -4.572 1.00 0.00 C ATOM 229 C SER A 19 0.555 13.439 -4.755 1.00 0.00 C ATOM 230 O SER A 19 1.446 13.672 -5.574 1.00 0.00 O ATOM 231 CB SER A 19 -0.247 15.777 -5.143 1.00 0.00 C ATOM 232 OG SER A 19 -0.217 15.747 -6.561 1.00 0.00 O ATOM 0 H SER A 19 -0.267 14.984 -2.585 1.00 0.00 H new ATOM 0 HA SER A 19 -1.472 14.012 -5.111 1.00 0.00 H new ATOM 0 HB2 SER A 19 -0.972 16.518 -4.807 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.726 16.087 -4.762 1.00 0.00 H new ATOM 0 HG SER A 19 0.369 15.021 -6.861 1.00 0.00 H new ATOM 238 N SER A 20 0.542 12.352 -3.991 1.00 0.00 N ATOM 239 CA SER A 20 1.600 11.351 -4.065 1.00 0.00 C ATOM 240 C SER A 20 1.059 9.965 -3.729 1.00 0.00 C ATOM 241 O SER A 20 0.404 9.772 -2.706 1.00 0.00 O ATOM 242 CB SER A 20 2.740 11.712 -3.111 1.00 0.00 C ATOM 243 OG SER A 20 3.466 10.556 -2.724 1.00 0.00 O ATOM 0 H SER A 20 -0.190 12.142 -3.313 1.00 0.00 H new ATOM 0 HA SER A 20 1.982 11.335 -5.086 1.00 0.00 H new ATOM 0 HB2 SER A 20 3.411 12.422 -3.594 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.336 12.205 -2.227 1.00 0.00 H new ATOM 0 HG SER A 20 3.845 10.126 -3.519 1.00 0.00 H new ATOM 249 N ALA A 21 1.339 9.001 -4.601 1.00 0.00 N ATOM 250 CA ALA A 21 0.884 7.631 -4.398 1.00 0.00 C ATOM 251 C ALA A 21 1.619 6.975 -3.233 1.00 0.00 C ATOM 252 O ALA A 21 2.733 7.358 -2.878 1.00 0.00 O ATOM 253 CB ALA A 21 1.073 6.818 -5.670 1.00 0.00 C ATOM 0 H ALA A 21 1.879 9.144 -5.455 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.178 7.659 -4.153 1.00 0.00 H new ATOM 0 HB1 ALA A 21 0.729 5.797 -5.504 1.00 0.00 H new ATOM 0 HB2 ALA A 21 0.497 7.268 -6.478 1.00 0.00 H new ATOM 0 HB3 ALA A 21 2.129 6.806 -5.940 1.00 0.00 H new ATOM 259 N PRO A 22 0.982 5.965 -2.626 1.00 0.00 N ATOM 260 CA PRO A 22 1.557 5.234 -1.491 1.00 0.00 C ATOM 261 C PRO A 22 2.744 4.370 -1.902 1.00 0.00 C ATOM 262 O PRO A 22 2.774 3.822 -3.004 1.00 0.00 O ATOM 263 CB PRO A 22 0.398 4.359 -1.008 1.00 0.00 C ATOM 264 CG PRO A 22 -0.468 4.181 -2.208 1.00 0.00 C ATOM 265 CD PRO A 22 -0.350 5.456 -2.997 1.00 0.00 C ATOM 0 HA PRO A 22 1.946 5.907 -0.727 1.00 0.00 H new ATOM 0 HB2 PRO A 22 0.756 3.400 -0.632 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -0.147 4.837 -0.194 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.144 3.325 -2.799 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -1.502 3.995 -1.919 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -0.426 5.274 -4.069 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -1.137 6.164 -2.737 1.00 0.00 H new ATOM 273 N ARG A 23 3.720 4.250 -1.007 1.00 0.00 N ATOM 274 CA ARG A 23 4.909 3.451 -1.277 1.00 0.00 C ATOM 275 C ARG A 23 4.921 2.188 -0.422 1.00 0.00 C ATOM 276 O ARG A 23 4.099 2.029 0.481 1.00 0.00 O ATOM 277 CB ARG A 23 6.172 4.273 -1.008 1.00 0.00 C ATOM 278 CG ARG A 23 6.116 5.680 -1.582 1.00 0.00 C ATOM 279 CD ARG A 23 7.453 6.392 -1.440 1.00 0.00 C ATOM 280 NE ARG A 23 8.001 6.263 -0.093 1.00 0.00 N ATOM 281 CZ ARG A 23 9.276 6.486 0.205 1.00 0.00 C ATOM 282 NH1 ARG A 23 10.129 6.847 -0.742 1.00 0.00 N ATOM 283 NH2 ARG A 23 9.700 6.348 1.455 1.00 0.00 N ATOM 0 H ARG A 23 3.710 4.696 -0.090 1.00 0.00 H new ATOM 0 HA ARG A 23 4.889 3.158 -2.327 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.333 4.335 0.068 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.031 3.752 -1.429 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.837 5.634 -2.635 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.341 6.252 -1.071 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.161 5.981 -2.160 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.329 7.448 -1.681 1.00 0.00 H new ATOM 0 HE ARG A 23 7.371 5.987 0.660 1.00 0.00 H new ATOM 0 HH11 ARG A 23 9.807 6.955 -1.704 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.107 7.017 -0.509 1.00 0.00 H new ATOM 0 HH21 ARG A 23 9.047 6.071 2.187 1.00 0.00 H new ATOM 0 HH22 ARG A 23 10.679 6.519 1.683 1.00 0.00 H new ATOM 297 N ASP A 24 5.857 1.292 -0.714 1.00 0.00 N ATOM 298 CA ASP A 24 5.976 0.042 0.027 1.00 0.00 C ATOM 299 C ASP A 24 4.669 -0.741 -0.014 1.00 0.00 C ATOM 300 O ASP A 24 4.389 -1.551 0.871 1.00 0.00 O ATOM 301 CB ASP A 24 6.373 0.320 1.479 1.00 0.00 C ATOM 302 CG ASP A 24 7.629 -0.423 1.888 1.00 0.00 C ATOM 303 OD1 ASP A 24 8.654 -0.289 1.188 1.00 0.00 O ATOM 304 OD2 ASP A 24 7.587 -1.138 2.912 1.00 0.00 O ATOM 0 H ASP A 24 6.544 1.408 -1.459 1.00 0.00 H new ATOM 0 HA ASP A 24 6.753 -0.558 -0.446 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.528 1.391 1.611 1.00 0.00 H new ATOM 0 HB3 ASP A 24 5.554 0.033 2.138 1.00 0.00 H new ATOM 309 N VAL A 25 3.869 -0.495 -1.047 1.00 0.00 N ATOM 310 CA VAL A 25 2.590 -1.178 -1.203 1.00 0.00 C ATOM 311 C VAL A 25 2.784 -2.595 -1.730 1.00 0.00 C ATOM 312 O VAL A 25 3.012 -2.797 -2.923 1.00 0.00 O ATOM 313 CB VAL A 25 1.658 -0.409 -2.159 1.00 0.00 C ATOM 314 CG1 VAL A 25 0.269 -1.028 -2.161 1.00 0.00 C ATOM 315 CG2 VAL A 25 1.595 1.061 -1.773 1.00 0.00 C ATOM 0 H VAL A 25 4.084 0.172 -1.788 1.00 0.00 H new ATOM 0 HA VAL A 25 2.131 -1.221 -0.215 1.00 0.00 H new ATOM 0 HB VAL A 25 2.063 -0.479 -3.169 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.376 -0.472 -2.842 1.00 0.00 H new ATOM 0 HG12 VAL A 25 0.334 -2.066 -2.488 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.148 -0.990 -1.154 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.932 1.589 -2.459 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.214 1.154 -0.756 1.00 0.00 H new ATOM 0 HG23 VAL A 25 2.594 1.495 -1.827 1.00 0.00 H new ATOM 325 N GLN A 26 2.690 -3.571 -0.833 1.00 0.00 N ATOM 326 CA GLN A 26 2.856 -4.971 -1.209 1.00 0.00 C ATOM 327 C GLN A 26 1.949 -5.868 -0.376 1.00 0.00 C ATOM 328 O GLN A 26 1.706 -5.602 0.801 1.00 0.00 O ATOM 329 CB GLN A 26 4.314 -5.398 -1.036 1.00 0.00 C ATOM 330 CG GLN A 26 4.850 -5.179 0.370 1.00 0.00 C ATOM 331 CD GLN A 26 6.363 -5.086 0.410 1.00 0.00 C ATOM 332 OE1 GLN A 26 7.027 -5.879 1.079 1.00 0.00 O ATOM 333 NE2 GLN A 26 6.916 -4.116 -0.306 1.00 0.00 N ATOM 0 H GLN A 26 2.500 -3.419 0.158 1.00 0.00 H new ATOM 0 HA GLN A 26 2.577 -5.076 -2.257 1.00 0.00 H new ATOM 0 HB2 GLN A 26 4.407 -6.454 -1.291 1.00 0.00 H new ATOM 0 HB3 GLN A 26 4.932 -4.844 -1.742 1.00 0.00 H new ATOM 0 HG2 GLN A 26 4.423 -4.264 0.779 1.00 0.00 H new ATOM 0 HG3 GLN A 26 4.523 -5.998 1.011 1.00 0.00 H new ATOM 0 HE21 GLN A 26 6.327 -3.481 -0.846 1.00 0.00 H new ATOM 0 HE22 GLN A 26 7.930 -4.005 -0.317 1.00 0.00 H new ATOM 342 N ALA A 27 1.448 -6.934 -0.994 1.00 0.00 N ATOM 343 CA ALA A 27 0.568 -7.873 -0.308 1.00 0.00 C ATOM 344 C ALA A 27 1.263 -9.212 -0.085 1.00 0.00 C ATOM 345 O ALA A 27 1.698 -9.862 -1.036 1.00 0.00 O ATOM 346 CB ALA A 27 -0.716 -8.066 -1.100 1.00 0.00 C ATOM 0 H ALA A 27 1.637 -7.168 -1.969 1.00 0.00 H new ATOM 0 HA ALA A 27 0.320 -7.456 0.668 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -1.364 -8.769 -0.577 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -1.227 -7.109 -1.203 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -0.478 -8.458 -2.089 1.00 0.00 H new ATOM 352 N ARG A 28 1.361 -9.618 1.176 1.00 0.00 N ATOM 353 CA ARG A 28 2.003 -10.880 1.524 1.00 0.00 C ATOM 354 C ARG A 28 0.988 -11.871 2.085 1.00 0.00 C ATOM 355 O ARG A 28 0.282 -11.573 3.048 1.00 0.00 O ATOM 356 CB ARG A 28 3.121 -10.646 2.543 1.00 0.00 C ATOM 357 CG ARG A 28 2.670 -9.871 3.772 1.00 0.00 C ATOM 358 CD ARG A 28 3.843 -9.541 4.683 1.00 0.00 C ATOM 359 NE ARG A 28 4.369 -10.729 5.347 1.00 0.00 N ATOM 360 CZ ARG A 28 5.226 -10.684 6.362 1.00 0.00 C ATOM 361 NH1 ARG A 28 5.647 -9.516 6.827 1.00 0.00 N ATOM 362 NH2 ARG A 28 5.662 -11.808 6.916 1.00 0.00 N ATOM 0 H ARG A 28 1.004 -9.092 1.974 1.00 0.00 H new ATOM 0 HA ARG A 28 2.432 -11.302 0.615 1.00 0.00 H new ATOM 0 HB2 ARG A 28 3.522 -11.609 2.858 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.934 -10.104 2.060 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.178 -8.949 3.462 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.933 -10.456 4.323 1.00 0.00 H new ATOM 0 HD2 ARG A 28 4.635 -9.071 4.099 1.00 0.00 H new ATOM 0 HD3 ARG A 28 3.527 -8.816 5.433 1.00 0.00 H new ATOM 0 HE ARG A 28 4.063 -11.643 5.014 1.00 0.00 H new ATOM 0 HH11 ARG A 28 5.313 -8.649 6.406 1.00 0.00 H new ATOM 0 HH12 ARG A 28 6.305 -9.484 7.606 1.00 0.00 H new ATOM 0 HH21 ARG A 28 5.340 -12.709 6.563 1.00 0.00 H new ATOM 0 HH22 ARG A 28 6.320 -11.771 7.695 1.00 0.00 H new ATOM 376 N MET A 29 0.921 -13.051 1.477 1.00 0.00 N ATOM 377 CA MET A 29 -0.008 -14.086 1.917 1.00 0.00 C ATOM 378 C MET A 29 0.563 -14.860 3.100 1.00 0.00 C ATOM 379 O MET A 29 1.755 -15.170 3.136 1.00 0.00 O ATOM 380 CB MET A 29 -0.318 -15.045 0.765 1.00 0.00 C ATOM 381 CG MET A 29 -1.736 -14.917 0.234 1.00 0.00 C ATOM 382 SD MET A 29 -2.981 -15.320 1.474 1.00 0.00 S ATOM 383 CE MET A 29 -4.021 -16.452 0.553 1.00 0.00 C ATOM 0 H MET A 29 1.499 -13.314 0.679 1.00 0.00 H new ATOM 0 HA MET A 29 -0.931 -13.601 2.235 1.00 0.00 H new ATOM 0 HB2 MET A 29 0.384 -14.862 -0.049 1.00 0.00 H new ATOM 0 HB3 MET A 29 -0.156 -16.069 1.102 1.00 0.00 H new ATOM 0 HG2 MET A 29 -1.897 -13.898 -0.119 1.00 0.00 H new ATOM 0 HG3 MET A 29 -1.859 -15.576 -0.626 1.00 0.00 H new ATOM 0 HE1 MET A 29 -4.620 -17.042 1.247 1.00 0.00 H new ATOM 0 HE2 MET A 29 -4.680 -15.886 -0.105 1.00 0.00 H new ATOM 0 HE3 MET A 29 -3.396 -17.117 -0.043 1.00 0.00 H new ATOM 393 N LEU A 30 -0.294 -15.171 4.067 1.00 0.00 N ATOM 394 CA LEU A 30 0.125 -15.908 5.253 1.00 0.00 C ATOM 395 C LEU A 30 -0.690 -17.189 5.412 1.00 0.00 C ATOM 396 O LEU A 30 -0.179 -18.206 5.882 1.00 0.00 O ATOM 397 CB LEU A 30 -0.025 -15.037 6.501 1.00 0.00 C ATOM 398 CG LEU A 30 0.304 -13.554 6.327 1.00 0.00 C ATOM 399 CD1 LEU A 30 -0.139 -12.763 7.547 1.00 0.00 C ATOM 400 CD2 LEU A 30 1.793 -13.363 6.076 1.00 0.00 C ATOM 0 H LEU A 30 -1.283 -14.924 4.052 1.00 0.00 H new ATOM 0 HA LEU A 30 1.174 -16.177 5.131 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.052 -15.122 6.858 1.00 0.00 H new ATOM 0 HB3 LEU A 30 0.618 -15.442 7.282 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.240 -13.180 5.460 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.103 -11.710 7.405 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.215 -12.873 7.681 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.377 -13.138 8.431 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.008 -12.301 5.955 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.358 -13.753 6.923 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.081 -13.897 5.171 1.00 0.00 H new ATOM 412 N SER A 31 -1.956 -17.132 5.016 1.00 0.00 N ATOM 413 CA SER A 31 -2.841 -18.286 5.117 1.00 0.00 C ATOM 414 C SER A 31 -3.440 -18.632 3.756 1.00 0.00 C ATOM 415 O SER A 31 -2.991 -18.136 2.724 1.00 0.00 O ATOM 416 CB SER A 31 -3.959 -18.013 6.124 1.00 0.00 C ATOM 417 OG SER A 31 -4.219 -19.155 6.921 1.00 0.00 O ATOM 0 H SER A 31 -2.393 -16.299 4.622 1.00 0.00 H new ATOM 0 HA SER A 31 -2.251 -19.135 5.462 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.680 -17.176 6.763 1.00 0.00 H new ATOM 0 HB3 SER A 31 -4.866 -17.721 5.595 1.00 0.00 H new ATOM 0 HG SER A 31 -4.936 -18.953 7.557 1.00 0.00 H new ATOM 423 N SER A 32 -4.458 -19.487 3.765 1.00 0.00 N ATOM 424 CA SER A 32 -5.117 -19.903 2.533 1.00 0.00 C ATOM 425 C SER A 32 -6.351 -19.046 2.260 1.00 0.00 C ATOM 426 O SER A 32 -7.007 -19.190 1.228 1.00 0.00 O ATOM 427 CB SER A 32 -5.515 -21.378 2.613 1.00 0.00 C ATOM 428 OG SER A 32 -5.984 -21.708 3.910 1.00 0.00 O ATOM 0 H SER A 32 -4.844 -19.905 4.612 1.00 0.00 H new ATOM 0 HA SER A 32 -4.413 -19.769 1.712 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.291 -21.589 1.877 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.658 -22.004 2.362 1.00 0.00 H new ATOM 0 HG SER A 32 -6.234 -22.655 3.936 1.00 0.00 H new ATOM 434 N THR A 33 -6.662 -18.154 3.195 1.00 0.00 N ATOM 435 CA THR A 33 -7.816 -17.274 3.058 1.00 0.00 C ATOM 436 C THR A 33 -7.635 -16.000 3.874 1.00 0.00 C ATOM 437 O THR A 33 -8.608 -15.398 4.331 1.00 0.00 O ATOM 438 CB THR A 33 -9.113 -17.976 3.504 1.00 0.00 C ATOM 439 OG1 THR A 33 -8.873 -18.736 4.694 1.00 0.00 O ATOM 440 CG2 THR A 33 -9.635 -18.892 2.407 1.00 0.00 C ATOM 0 H THR A 33 -6.131 -18.022 4.056 1.00 0.00 H new ATOM 0 HA THR A 33 -7.895 -17.017 2.002 1.00 0.00 H new ATOM 0 HB THR A 33 -9.864 -17.213 3.706 1.00 0.00 H new ATOM 0 HG1 THR A 33 -9.702 -19.178 4.973 1.00 0.00 H new ATOM 0 HG21 THR A 33 -10.551 -19.377 2.744 1.00 0.00 H new ATOM 0 HG22 THR A 33 -9.843 -18.306 1.512 1.00 0.00 H new ATOM 0 HG23 THR A 33 -8.886 -19.650 2.179 1.00 0.00 H new ATOM 448 N THR A 34 -6.383 -15.590 4.058 1.00 0.00 N ATOM 449 CA THR A 34 -6.076 -14.387 4.819 1.00 0.00 C ATOM 450 C THR A 34 -4.830 -13.696 4.277 1.00 0.00 C ATOM 451 O THR A 34 -3.742 -14.273 4.270 1.00 0.00 O ATOM 452 CB THR A 34 -5.862 -14.706 6.312 1.00 0.00 C ATOM 453 OG1 THR A 34 -6.356 -16.017 6.607 1.00 0.00 O ATOM 454 CG2 THR A 34 -6.567 -13.682 7.189 1.00 0.00 C ATOM 0 H THR A 34 -5.565 -16.075 3.689 1.00 0.00 H new ATOM 0 HA THR A 34 -6.932 -13.721 4.715 1.00 0.00 H new ATOM 0 HB THR A 34 -4.793 -14.666 6.522 1.00 0.00 H new ATOM 0 HG1 THR A 34 -6.215 -16.214 7.557 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.402 -13.927 8.238 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.168 -12.689 6.981 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.636 -13.696 6.977 1.00 0.00 H new ATOM 462 N ILE A 35 -4.997 -12.459 3.821 1.00 0.00 N ATOM 463 CA ILE A 35 -3.884 -11.690 3.278 1.00 0.00 C ATOM 464 C ILE A 35 -3.542 -10.506 4.178 1.00 0.00 C ATOM 465 O ILE A 35 -4.243 -10.231 5.153 1.00 0.00 O ATOM 466 CB ILE A 35 -4.197 -11.169 1.862 1.00 0.00 C ATOM 467 CG1 ILE A 35 -5.384 -10.206 1.901 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.480 -12.332 0.923 1.00 0.00 C ATOM 469 CD1 ILE A 35 -5.639 -9.507 0.584 1.00 0.00 C ATOM 0 H ILE A 35 -5.891 -11.968 3.817 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.030 -12.365 3.228 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.328 -10.628 1.488 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.279 -10.757 2.190 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.208 -9.457 2.673 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.700 -11.950 -0.074 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.607 -12.984 0.878 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.336 -12.897 1.292 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.495 -8.840 0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.759 -8.928 0.303 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.847 -10.249 -0.187 1.00 0.00 H new ATOM 481 N LEU A 36 -2.461 -9.810 3.844 1.00 0.00 N ATOM 482 CA LEU A 36 -2.027 -8.653 4.622 1.00 0.00 C ATOM 483 C LEU A 36 -1.441 -7.577 3.714 1.00 0.00 C ATOM 484 O LEU A 36 -0.483 -7.822 2.979 1.00 0.00 O ATOM 485 CB LEU A 36 -0.992 -9.076 5.665 1.00 0.00 C ATOM 486 CG LEU A 36 -0.137 -7.953 6.255 1.00 0.00 C ATOM 487 CD1 LEU A 36 -1.018 -6.823 6.764 1.00 0.00 C ATOM 488 CD2 LEU A 36 0.746 -8.487 7.373 1.00 0.00 C ATOM 0 H LEU A 36 -1.869 -10.025 3.041 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.898 -8.239 5.130 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.512 -9.577 6.481 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.328 -9.811 5.211 1.00 0.00 H new ATOM 0 HG LEU A 36 0.505 -7.559 5.467 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.393 -6.033 7.180 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.608 -6.422 5.940 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.686 -7.202 7.537 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.347 -7.675 7.781 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.121 -8.907 8.161 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.403 -9.262 6.979 1.00 0.00 H new ATOM 500 N VAL A 37 -2.021 -6.381 3.771 1.00 0.00 N ATOM 501 CA VAL A 37 -1.554 -5.266 2.955 1.00 0.00 C ATOM 502 C VAL A 37 -0.878 -4.203 3.816 1.00 0.00 C ATOM 503 O VAL A 37 -1.503 -3.616 4.697 1.00 0.00 O ATOM 504 CB VAL A 37 -2.713 -4.618 2.174 1.00 0.00 C ATOM 505 CG1 VAL A 37 -2.182 -3.585 1.191 1.00 0.00 C ATOM 506 CG2 VAL A 37 -3.530 -5.681 1.456 1.00 0.00 C ATOM 0 H VAL A 37 -2.814 -6.160 4.373 1.00 0.00 H new ATOM 0 HA VAL A 37 -0.831 -5.671 2.247 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.366 -4.108 2.882 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -3.015 -3.138 0.648 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.644 -2.808 1.735 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.506 -4.068 0.485 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.345 -5.206 0.909 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -2.891 -6.221 0.758 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.941 -6.379 2.186 1.00 0.00 H new ATOM 516 N GLN A 38 0.402 -3.962 3.550 1.00 0.00 N ATOM 517 CA GLN A 38 1.163 -2.970 4.300 1.00 0.00 C ATOM 518 C GLN A 38 1.821 -1.965 3.362 1.00 0.00 C ATOM 519 O GLN A 38 2.396 -2.340 2.340 1.00 0.00 O ATOM 520 CB GLN A 38 2.226 -3.655 5.160 1.00 0.00 C ATOM 521 CG GLN A 38 3.131 -4.592 4.376 1.00 0.00 C ATOM 522 CD GLN A 38 4.480 -4.792 5.040 1.00 0.00 C ATOM 523 OE1 GLN A 38 5.521 -4.734 4.384 1.00 0.00 O ATOM 524 NE2 GLN A 38 4.468 -5.028 6.346 1.00 0.00 N ATOM 0 H GLN A 38 0.933 -4.440 2.822 1.00 0.00 H new ATOM 0 HA GLN A 38 0.471 -2.434 4.949 1.00 0.00 H new ATOM 0 HB2 GLN A 38 2.837 -2.893 5.643 1.00 0.00 H new ATOM 0 HB3 GLN A 38 1.733 -4.218 5.953 1.00 0.00 H new ATOM 0 HG2 GLN A 38 2.638 -5.558 4.265 1.00 0.00 H new ATOM 0 HG3 GLN A 38 3.280 -4.192 3.373 1.00 0.00 H new ATOM 0 HE21 GLN A 38 3.582 -5.067 6.849 1.00 0.00 H new ATOM 0 HE22 GLN A 38 5.345 -5.170 6.847 1.00 0.00 H new ATOM 533 N TRP A 39 1.733 -0.688 3.714 1.00 0.00 N ATOM 534 CA TRP A 39 2.320 0.371 2.902 1.00 0.00 C ATOM 535 C TRP A 39 2.808 1.520 3.776 1.00 0.00 C ATOM 536 O TRP A 39 2.618 1.513 4.993 1.00 0.00 O ATOM 537 CB TRP A 39 1.301 0.887 1.885 1.00 0.00 C ATOM 538 CG TRP A 39 0.059 1.442 2.516 1.00 0.00 C ATOM 539 CD1 TRP A 39 -0.158 2.735 2.897 1.00 0.00 C ATOM 540 CD2 TRP A 39 -1.132 0.719 2.843 1.00 0.00 C ATOM 541 NE1 TRP A 39 -1.415 2.860 3.440 1.00 0.00 N ATOM 542 CE2 TRP A 39 -2.032 1.638 3.418 1.00 0.00 C ATOM 543 CE3 TRP A 39 -1.528 -0.615 2.704 1.00 0.00 C ATOM 544 CZ2 TRP A 39 -3.301 1.264 3.852 1.00 0.00 C ATOM 545 CZ3 TRP A 39 -2.787 -0.984 3.136 1.00 0.00 C ATOM 546 CH2 TRP A 39 -3.662 -0.048 3.704 1.00 0.00 C ATOM 0 H TRP A 39 1.261 -0.361 4.557 1.00 0.00 H new ATOM 0 HA TRP A 39 3.175 -0.046 2.370 1.00 0.00 H new ATOM 0 HB2 TRP A 39 1.767 1.661 1.275 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.026 0.074 1.213 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.553 3.541 2.788 1.00 0.00 H new ATOM 0 HE1 TRP A 39 -1.822 3.723 3.801 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -0.861 -1.344 2.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -3.977 1.984 4.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -3.103 -2.012 3.034 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -4.640 -0.368 4.031 1.00 0.00 H new ATOM 557 N LYS A 40 3.440 2.508 3.151 1.00 0.00 N ATOM 558 CA LYS A 40 3.957 3.665 3.871 1.00 0.00 C ATOM 559 C LYS A 40 3.262 4.944 3.414 1.00 0.00 C ATOM 560 O LYS A 40 2.672 4.989 2.335 1.00 0.00 O ATOM 561 CB LYS A 40 5.467 3.789 3.664 1.00 0.00 C ATOM 562 CG LYS A 40 6.283 2.897 4.582 1.00 0.00 C ATOM 563 CD LYS A 40 7.772 3.019 4.301 1.00 0.00 C ATOM 564 CE LYS A 40 8.586 2.109 5.206 1.00 0.00 C ATOM 565 NZ LYS A 40 9.986 2.593 5.364 1.00 0.00 N ATOM 0 H LYS A 40 3.606 2.530 2.145 1.00 0.00 H new ATOM 0 HA LYS A 40 3.755 3.522 4.932 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.704 3.544 2.629 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.763 4.826 3.822 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.085 3.164 5.620 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.972 1.860 4.454 1.00 0.00 H new ATOM 0 HD2 LYS A 40 7.968 2.768 3.259 1.00 0.00 H new ATOM 0 HD3 LYS A 40 8.087 4.053 4.444 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.110 2.049 6.185 1.00 0.00 H new ATOM 0 HE3 LYS A 40 8.595 1.100 4.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.509 1.946 5.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 10.449 2.626 4.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 9.979 3.546 5.781 1.00 0.00 H new ATOM 579 N GLU A 41 3.339 5.983 4.241 1.00 0.00 N ATOM 580 CA GLU A 41 2.718 7.262 3.920 1.00 0.00 C ATOM 581 C GLU A 41 3.317 7.853 2.646 1.00 0.00 C ATOM 582 O GLU A 41 4.415 7.493 2.221 1.00 0.00 O ATOM 583 CB GLU A 41 2.890 8.244 5.080 1.00 0.00 C ATOM 584 CG GLU A 41 1.637 8.420 5.920 1.00 0.00 C ATOM 585 CD GLU A 41 1.796 9.483 6.989 1.00 0.00 C ATOM 586 OE1 GLU A 41 2.828 10.186 6.978 1.00 0.00 O ATOM 587 OE2 GLU A 41 0.888 9.614 7.836 1.00 0.00 O ATOM 0 H GLU A 41 3.825 5.963 5.137 1.00 0.00 H new ATOM 0 HA GLU A 41 1.655 7.089 3.755 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.701 7.898 5.721 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.190 9.214 4.683 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.803 8.685 5.270 1.00 0.00 H new ATOM 0 HG3 GLU A 41 1.384 7.471 6.392 1.00 0.00 H new ATOM 594 N PRO A 42 2.579 8.782 2.021 1.00 0.00 N ATOM 595 CA PRO A 42 3.017 9.443 0.789 1.00 0.00 C ATOM 596 C PRO A 42 4.188 10.389 1.022 1.00 0.00 C ATOM 597 O PRO A 42 4.575 10.643 2.162 1.00 0.00 O ATOM 598 CB PRO A 42 1.776 10.226 0.346 1.00 0.00 C ATOM 599 CG PRO A 42 1.011 10.462 1.602 1.00 0.00 C ATOM 600 CD PRO A 42 1.262 9.260 2.471 1.00 0.00 C ATOM 0 HA PRO A 42 3.374 8.728 0.048 1.00 0.00 H new ATOM 0 HB2 PRO A 42 2.051 11.166 -0.133 1.00 0.00 H new ATOM 0 HB3 PRO A 42 1.187 9.660 -0.376 1.00 0.00 H new ATOM 0 HG2 PRO A 42 1.342 11.376 2.095 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -0.053 10.579 1.395 1.00 0.00 H new ATOM 0 HD2 PRO A 42 1.270 9.524 3.529 1.00 0.00 H new ATOM 0 HD3 PRO A 42 0.492 8.500 2.338 1.00 0.00 H new ATOM 608 N GLU A 43 4.749 10.911 -0.065 1.00 0.00 N ATOM 609 CA GLU A 43 5.878 11.829 0.023 1.00 0.00 C ATOM 610 C GLU A 43 5.399 13.277 0.072 1.00 0.00 C ATOM 611 O GLU A 43 6.083 14.151 0.602 1.00 0.00 O ATOM 612 CB GLU A 43 6.819 11.632 -1.167 1.00 0.00 C ATOM 613 CG GLU A 43 6.121 11.705 -2.515 1.00 0.00 C ATOM 614 CD GLU A 43 6.946 12.425 -3.562 1.00 0.00 C ATOM 615 OE1 GLU A 43 8.064 11.955 -3.864 1.00 0.00 O ATOM 616 OE2 GLU A 43 6.475 13.459 -4.080 1.00 0.00 O ATOM 0 H GLU A 43 4.440 10.713 -1.017 1.00 0.00 H new ATOM 0 HA GLU A 43 6.419 11.611 0.944 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.601 12.391 -1.131 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.311 10.664 -1.074 1.00 0.00 H new ATOM 0 HG2 GLU A 43 5.903 10.695 -2.862 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.165 12.215 -2.397 1.00 0.00 H new ATOM 623 N GLU A 44 4.216 13.522 -0.485 1.00 0.00 N ATOM 624 CA GLU A 44 3.646 14.864 -0.507 1.00 0.00 C ATOM 625 C GLU A 44 2.258 14.875 0.127 1.00 0.00 C ATOM 626 O GLU A 44 1.238 14.985 -0.554 1.00 0.00 O ATOM 627 CB GLU A 44 3.567 15.385 -1.942 1.00 0.00 C ATOM 628 CG GLU A 44 4.912 15.807 -2.512 1.00 0.00 C ATOM 629 CD GLU A 44 4.918 15.842 -4.027 1.00 0.00 C ATOM 630 OE1 GLU A 44 4.168 15.057 -4.643 1.00 0.00 O ATOM 631 OE2 GLU A 44 5.675 16.656 -4.598 1.00 0.00 O ATOM 0 H GLU A 44 3.635 12.809 -0.926 1.00 0.00 H new ATOM 0 HA GLU A 44 4.297 15.518 0.073 1.00 0.00 H new ATOM 0 HB2 GLU A 44 3.140 14.610 -2.578 1.00 0.00 H new ATOM 0 HB3 GLU A 44 2.886 16.235 -1.974 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.171 16.794 -2.128 1.00 0.00 H new ATOM 0 HG3 GLU A 44 5.682 15.118 -2.165 1.00 0.00 H new ATOM 638 N PRO A 45 2.217 14.756 1.463 1.00 0.00 N ATOM 639 CA PRO A 45 0.960 14.750 2.218 1.00 0.00 C ATOM 640 C PRO A 45 0.192 16.060 2.077 1.00 0.00 C ATOM 641 O PRO A 45 -0.984 16.065 1.716 1.00 0.00 O ATOM 642 CB PRO A 45 1.417 14.551 3.665 1.00 0.00 C ATOM 643 CG PRO A 45 2.849 14.968 3.671 1.00 0.00 C ATOM 644 CD PRO A 45 3.393 14.621 2.338 1.00 0.00 C ATOM 0 HA PRO A 45 0.275 13.980 1.863 1.00 0.00 H new ATOM 0 HB2 PRO A 45 0.826 15.155 4.353 1.00 0.00 H new ATOM 0 HB3 PRO A 45 1.306 13.512 3.976 1.00 0.00 H new ATOM 0 HG2 PRO A 45 2.941 16.037 3.861 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.399 14.455 4.460 1.00 0.00 H new ATOM 0 HD2 PRO A 45 4.198 15.294 2.041 1.00 0.00 H new ATOM 0 HD3 PRO A 45 3.799 13.610 2.317 1.00 0.00 H new ATOM 652 N ASN A 46 0.866 17.169 2.365 1.00 0.00 N ATOM 653 CA ASN A 46 0.246 18.486 2.269 1.00 0.00 C ATOM 654 C ASN A 46 -0.903 18.619 3.265 1.00 0.00 C ATOM 655 O ASN A 46 -1.822 19.410 3.064 1.00 0.00 O ATOM 656 CB ASN A 46 -0.264 18.731 0.848 1.00 0.00 C ATOM 657 CG ASN A 46 0.708 18.243 -0.207 1.00 0.00 C ATOM 658 OD1 ASN A 46 1.896 18.565 -0.171 1.00 0.00 O ATOM 659 ND2 ASN A 46 0.206 17.462 -1.158 1.00 0.00 N ATOM 0 H ASN A 46 1.840 17.182 2.666 1.00 0.00 H new ATOM 0 HA ASN A 46 1.001 19.234 2.510 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -1.222 18.227 0.717 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -0.443 19.797 0.708 1.00 0.00 H new ATOM 0 HD21 ASN A 46 0.812 17.104 -1.897 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -0.785 17.220 -1.149 1.00 0.00 H new ATOM 666 N GLY A 47 -0.840 17.839 4.340 1.00 0.00 N ATOM 667 CA GLY A 47 -1.881 17.886 5.351 1.00 0.00 C ATOM 668 C GLY A 47 -1.951 16.613 6.169 1.00 0.00 C ATOM 669 O GLY A 47 -1.318 15.614 5.829 1.00 0.00 O ATOM 0 H GLY A 47 -0.088 17.176 4.529 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.701 18.732 6.015 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.844 18.058 4.869 1.00 0.00 H new ATOM 673 N GLN A 48 -2.722 16.647 7.251 1.00 0.00 N ATOM 674 CA GLN A 48 -2.869 15.487 8.121 1.00 0.00 C ATOM 675 C GLN A 48 -3.675 14.390 7.434 1.00 0.00 C ATOM 676 O GLN A 48 -4.771 14.635 6.930 1.00 0.00 O ATOM 677 CB GLN A 48 -3.547 15.889 9.432 1.00 0.00 C ATOM 678 CG GLN A 48 -2.647 15.757 10.649 1.00 0.00 C ATOM 679 CD GLN A 48 -3.288 16.299 11.912 1.00 0.00 C ATOM 680 OE1 GLN A 48 -2.831 17.293 12.476 1.00 0.00 O ATOM 681 NE2 GLN A 48 -4.353 15.646 12.363 1.00 0.00 N ATOM 0 H GLN A 48 -3.254 17.466 7.546 1.00 0.00 H new ATOM 0 HA GLN A 48 -1.874 15.099 8.339 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -3.888 16.921 9.353 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.433 15.271 9.577 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.394 14.707 10.797 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -1.713 16.287 10.464 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -4.698 14.826 11.864 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -4.826 15.964 13.209 1.00 0.00 H new ATOM 690 N ILE A 49 -3.124 13.181 7.416 1.00 0.00 N ATOM 691 CA ILE A 49 -3.793 12.047 6.791 1.00 0.00 C ATOM 692 C ILE A 49 -4.853 11.455 7.715 1.00 0.00 C ATOM 693 O ILE A 49 -4.581 11.165 8.879 1.00 0.00 O ATOM 694 CB ILE A 49 -2.789 10.943 6.407 1.00 0.00 C ATOM 695 CG1 ILE A 49 -1.734 11.495 5.445 1.00 0.00 C ATOM 696 CG2 ILE A 49 -3.514 9.761 5.783 1.00 0.00 C ATOM 697 CD1 ILE A 49 -2.302 11.940 4.116 1.00 0.00 C ATOM 0 H ILE A 49 -2.217 12.962 7.827 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.272 12.423 5.887 1.00 0.00 H new ATOM 0 HB ILE A 49 -2.286 10.600 7.311 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -1.230 12.339 5.916 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -0.978 10.730 5.270 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -2.791 8.990 5.517 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.231 9.356 6.497 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -4.040 10.089 4.887 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.498 12.319 3.485 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.781 11.094 3.623 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -3.037 12.728 4.280 1.00 0.00 H new ATOM 709 N GLN A 50 -6.059 11.279 7.185 1.00 0.00 N ATOM 710 CA GLN A 50 -7.159 10.720 7.963 1.00 0.00 C ATOM 711 C GLN A 50 -7.229 9.205 7.797 1.00 0.00 C ATOM 712 O GLN A 50 -7.728 8.497 8.670 1.00 0.00 O ATOM 713 CB GLN A 50 -8.485 11.353 7.538 1.00 0.00 C ATOM 714 CG GLN A 50 -8.627 12.807 7.956 1.00 0.00 C ATOM 715 CD GLN A 50 -8.932 12.963 9.432 1.00 0.00 C ATOM 716 OE1 GLN A 50 -9.308 12.002 10.105 1.00 0.00 O ATOM 717 NE2 GLN A 50 -8.772 14.177 9.946 1.00 0.00 N ATOM 0 H GLN A 50 -6.299 11.515 6.222 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.978 10.944 9.014 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.580 11.284 6.454 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -9.306 10.779 7.967 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -7.706 13.340 7.721 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -9.422 13.272 7.374 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -8.459 14.945 9.352 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -8.962 14.341 10.934 1.00 0.00 H new ATOM 726 N GLY A 51 -6.725 8.714 6.669 1.00 0.00 N ATOM 727 CA GLY A 51 -6.741 7.286 6.408 1.00 0.00 C ATOM 728 C GLY A 51 -6.333 6.951 4.987 1.00 0.00 C ATOM 729 O GLY A 51 -5.707 7.763 4.306 1.00 0.00 O ATOM 0 H GLY A 51 -6.306 9.280 5.931 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -6.068 6.785 7.104 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.741 6.897 6.597 1.00 0.00 H new ATOM 733 N TYR A 52 -6.687 5.752 4.540 1.00 0.00 N ATOM 734 CA TYR A 52 -6.350 5.310 3.192 1.00 0.00 C ATOM 735 C TYR A 52 -7.446 4.414 2.622 1.00 0.00 C ATOM 736 O TYR A 52 -8.015 3.583 3.331 1.00 0.00 O ATOM 737 CB TYR A 52 -5.016 4.563 3.196 1.00 0.00 C ATOM 738 CG TYR A 52 -3.935 5.258 3.993 1.00 0.00 C ATOM 739 CD1 TYR A 52 -3.178 6.279 3.434 1.00 0.00 C ATOM 740 CD2 TYR A 52 -3.672 4.893 5.308 1.00 0.00 C ATOM 741 CE1 TYR A 52 -2.190 6.916 4.159 1.00 0.00 C ATOM 742 CE2 TYR A 52 -2.686 5.525 6.041 1.00 0.00 C ATOM 743 CZ TYR A 52 -1.948 6.535 5.462 1.00 0.00 C ATOM 744 OH TYR A 52 -0.965 7.169 6.189 1.00 0.00 O ATOM 0 H TYR A 52 -7.207 5.069 5.091 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.262 6.193 2.559 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.170 3.564 3.603 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.675 4.440 2.168 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -3.365 6.580 2.414 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.248 4.102 5.765 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -1.610 7.708 3.708 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -2.495 5.229 7.062 1.00 0.00 H new ATOM 0 HH TYR A 52 -1.342 7.498 7.032 1.00 0.00 H new ATOM 754 N ARG A 53 -7.735 4.589 1.337 1.00 0.00 N ATOM 755 CA ARG A 53 -8.763 3.796 0.672 1.00 0.00 C ATOM 756 C ARG A 53 -8.148 2.596 -0.042 1.00 0.00 C ATOM 757 O ARG A 53 -7.168 2.731 -0.774 1.00 0.00 O ATOM 758 CB ARG A 53 -9.532 4.659 -0.331 1.00 0.00 C ATOM 759 CG ARG A 53 -10.591 5.541 0.311 1.00 0.00 C ATOM 760 CD ARG A 53 -10.643 6.914 -0.341 1.00 0.00 C ATOM 761 NE ARG A 53 -12.015 7.357 -0.577 1.00 0.00 N ATOM 762 CZ ARG A 53 -12.333 8.374 -1.368 1.00 0.00 C ATOM 763 NH1 ARG A 53 -11.383 9.050 -1.998 1.00 0.00 N ATOM 764 NH2 ARG A 53 -13.604 8.716 -1.531 1.00 0.00 N ATOM 0 H ARG A 53 -7.273 5.271 0.736 1.00 0.00 H new ATOM 0 HA ARG A 53 -9.453 3.430 1.433 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -8.826 5.289 -0.872 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.008 4.010 -1.066 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -11.566 5.060 0.228 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.379 5.650 1.375 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -10.133 7.637 0.296 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.103 6.886 -1.288 1.00 0.00 H new ATOM 0 HE ARG A 53 -12.770 6.857 -0.108 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -10.405 8.789 -1.876 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -11.630 9.831 -2.605 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -14.338 8.197 -1.048 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -13.848 9.498 -2.139 1.00 0.00 H new ATOM 778 N VAL A 54 -8.729 1.422 0.178 1.00 0.00 N ATOM 779 CA VAL A 54 -8.239 0.197 -0.443 1.00 0.00 C ATOM 780 C VAL A 54 -9.276 -0.391 -1.393 1.00 0.00 C ATOM 781 O VAL A 54 -10.480 -0.297 -1.150 1.00 0.00 O ATOM 782 CB VAL A 54 -7.871 -0.861 0.614 1.00 0.00 C ATOM 783 CG1 VAL A 54 -7.258 -2.087 -0.047 1.00 0.00 C ATOM 784 CG2 VAL A 54 -6.921 -0.272 1.647 1.00 0.00 C ATOM 0 H VAL A 54 -9.541 1.293 0.782 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.345 0.465 -1.006 1.00 0.00 H new ATOM 0 HB VAL A 54 -8.782 -1.171 1.125 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.005 -2.823 0.716 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.974 -2.520 -0.746 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.356 -1.797 -0.585 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.671 -1.033 2.387 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -6.011 0.067 1.153 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -7.400 0.572 2.143 1.00 0.00 H new ATOM 794 N TYR A 55 -8.802 -0.997 -2.476 1.00 0.00 N ATOM 795 CA TYR A 55 -9.688 -1.598 -3.465 1.00 0.00 C ATOM 796 C TYR A 55 -9.226 -3.008 -3.826 1.00 0.00 C ATOM 797 O TYR A 55 -8.103 -3.206 -4.285 1.00 0.00 O ATOM 798 CB TYR A 55 -9.745 -0.733 -4.724 1.00 0.00 C ATOM 799 CG TYR A 55 -9.980 0.735 -4.440 1.00 0.00 C ATOM 800 CD1 TYR A 55 -8.925 1.574 -4.101 1.00 0.00 C ATOM 801 CD2 TYR A 55 -11.255 1.281 -4.508 1.00 0.00 C ATOM 802 CE1 TYR A 55 -9.135 2.914 -3.840 1.00 0.00 C ATOM 803 CE2 TYR A 55 -11.473 2.620 -4.249 1.00 0.00 C ATOM 804 CZ TYR A 55 -10.410 3.433 -3.916 1.00 0.00 C ATOM 805 OH TYR A 55 -10.624 4.767 -3.657 1.00 0.00 O ATOM 0 H TYR A 55 -7.809 -1.085 -2.691 1.00 0.00 H new ATOM 0 HA TYR A 55 -10.685 -1.661 -3.029 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -8.810 -0.843 -5.273 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -10.540 -1.101 -5.372 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -7.925 1.172 -4.041 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -12.090 0.648 -4.768 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -8.304 3.552 -3.578 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -12.471 3.028 -4.307 1.00 0.00 H new ATOM 0 HH TYR A 55 -11.578 4.970 -3.755 1.00 0.00 H new ATOM 815 N TYR A 56 -10.103 -3.983 -3.611 1.00 0.00 N ATOM 816 CA TYR A 56 -9.787 -5.373 -3.911 1.00 0.00 C ATOM 817 C TYR A 56 -11.044 -6.147 -4.298 1.00 0.00 C ATOM 818 O TYR A 56 -12.057 -6.099 -3.599 1.00 0.00 O ATOM 819 CB TYR A 56 -9.117 -6.037 -2.706 1.00 0.00 C ATOM 820 CG TYR A 56 -10.046 -6.236 -1.530 1.00 0.00 C ATOM 821 CD1 TYR A 56 -10.263 -5.216 -0.610 1.00 0.00 C ATOM 822 CD2 TYR A 56 -10.707 -7.443 -1.338 1.00 0.00 C ATOM 823 CE1 TYR A 56 -11.111 -5.394 0.466 1.00 0.00 C ATOM 824 CE2 TYR A 56 -11.557 -7.628 -0.264 1.00 0.00 C ATOM 825 CZ TYR A 56 -11.755 -6.602 0.634 1.00 0.00 C ATOM 826 OH TYR A 56 -12.600 -6.784 1.705 1.00 0.00 O ATOM 0 H TYR A 56 -11.038 -3.835 -3.230 1.00 0.00 H new ATOM 0 HA TYR A 56 -9.099 -5.388 -4.756 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -8.718 -7.004 -3.010 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -8.270 -5.428 -2.390 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -9.760 -4.269 -0.739 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -10.554 -8.250 -2.039 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -11.269 -4.592 1.172 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -12.064 -8.572 -0.129 1.00 0.00 H new ATOM 0 HH TYR A 56 -12.728 -5.931 2.169 1.00 0.00 H new ATOM 836 N THR A 57 -10.970 -6.863 -5.415 1.00 0.00 N ATOM 837 CA THR A 57 -12.100 -7.647 -5.898 1.00 0.00 C ATOM 838 C THR A 57 -11.646 -8.718 -6.883 1.00 0.00 C ATOM 839 O THR A 57 -10.542 -8.651 -7.422 1.00 0.00 O ATOM 840 CB THR A 57 -13.154 -6.754 -6.577 1.00 0.00 C ATOM 841 OG1 THR A 57 -14.341 -7.512 -6.843 1.00 0.00 O ATOM 842 CG2 THR A 57 -12.616 -6.174 -7.877 1.00 0.00 C ATOM 0 H THR A 57 -10.138 -6.916 -6.003 1.00 0.00 H new ATOM 0 HA THR A 57 -12.547 -8.126 -5.027 1.00 0.00 H new ATOM 0 HB THR A 57 -13.391 -5.932 -5.901 1.00 0.00 H new ATOM 0 HG1 THR A 57 -15.007 -6.936 -7.273 1.00 0.00 H new ATOM 0 HG21 THR A 57 -13.379 -5.547 -8.339 1.00 0.00 H new ATOM 0 HG22 THR A 57 -11.730 -5.574 -7.669 1.00 0.00 H new ATOM 0 HG23 THR A 57 -12.354 -6.985 -8.556 1.00 0.00 H new ATOM 850 N MET A 58 -12.505 -9.706 -7.112 1.00 0.00 N ATOM 851 CA MET A 58 -12.191 -10.791 -8.035 1.00 0.00 C ATOM 852 C MET A 58 -12.628 -10.441 -9.454 1.00 0.00 C ATOM 853 O MET A 58 -12.109 -10.991 -10.426 1.00 0.00 O ATOM 854 CB MET A 58 -12.872 -12.085 -7.584 1.00 0.00 C ATOM 855 CG MET A 58 -14.389 -11.990 -7.541 1.00 0.00 C ATOM 856 SD MET A 58 -15.190 -13.598 -7.706 1.00 0.00 S ATOM 857 CE MET A 58 -14.221 -14.576 -6.560 1.00 0.00 C ATOM 0 H MET A 58 -13.422 -9.778 -6.672 1.00 0.00 H new ATOM 0 HA MET A 58 -11.111 -10.937 -8.032 1.00 0.00 H new ATOM 0 HB2 MET A 58 -12.586 -12.891 -8.259 1.00 0.00 H new ATOM 0 HB3 MET A 58 -12.505 -12.353 -6.593 1.00 0.00 H new ATOM 0 HG2 MET A 58 -14.694 -11.531 -6.601 1.00 0.00 H new ATOM 0 HG3 MET A 58 -14.731 -11.334 -8.341 1.00 0.00 H new ATOM 0 HE1 MET A 58 -14.743 -15.508 -6.345 1.00 0.00 H new ATOM 0 HE2 MET A 58 -13.250 -14.798 -7.002 1.00 0.00 H new ATOM 0 HE3 MET A 58 -14.079 -14.018 -5.635 1.00 0.00 H new ATOM 867 N ASP A 59 -13.581 -9.524 -9.566 1.00 0.00 N ATOM 868 CA ASP A 59 -14.086 -9.100 -10.867 1.00 0.00 C ATOM 869 C ASP A 59 -13.709 -7.650 -11.149 1.00 0.00 C ATOM 870 O ASP A 59 -14.528 -6.736 -11.040 1.00 0.00 O ATOM 871 CB ASP A 59 -15.606 -9.266 -10.927 1.00 0.00 C ATOM 872 CG ASP A 59 -16.021 -10.667 -11.330 1.00 0.00 C ATOM 873 OD1 ASP A 59 -15.227 -11.346 -12.017 1.00 0.00 O ATOM 874 OD2 ASP A 59 -17.136 -11.085 -10.960 1.00 0.00 O ATOM 0 H ASP A 59 -14.020 -9.059 -8.771 1.00 0.00 H new ATOM 0 HA ASP A 59 -13.629 -9.731 -11.630 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -16.033 -9.030 -9.952 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -16.019 -8.550 -11.637 1.00 0.00 H new ATOM 879 N PRO A 60 -12.439 -7.431 -11.522 1.00 0.00 N ATOM 880 CA PRO A 60 -11.923 -6.091 -11.827 1.00 0.00 C ATOM 881 C PRO A 60 -12.502 -5.529 -13.121 1.00 0.00 C ATOM 882 O PRO A 60 -12.299 -4.360 -13.447 1.00 0.00 O ATOM 883 CB PRO A 60 -10.416 -6.317 -11.969 1.00 0.00 C ATOM 884 CG PRO A 60 -10.282 -7.749 -12.357 1.00 0.00 C ATOM 885 CD PRO A 60 -11.409 -8.471 -11.673 1.00 0.00 C ATOM 0 HA PRO A 60 -12.189 -5.366 -11.058 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.987 -5.660 -12.726 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.895 -6.110 -11.034 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -10.342 -7.867 -13.439 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -9.317 -8.149 -12.046 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -11.769 -9.310 -12.269 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -11.101 -8.874 -10.708 1.00 0.00 H new ATOM 893 N THR A 61 -13.226 -6.370 -13.855 1.00 0.00 N ATOM 894 CA THR A 61 -13.833 -5.957 -15.113 1.00 0.00 C ATOM 895 C THR A 61 -14.831 -4.825 -14.896 1.00 0.00 C ATOM 896 O THR A 61 -15.200 -4.122 -15.837 1.00 0.00 O ATOM 897 CB THR A 61 -14.550 -7.132 -15.804 1.00 0.00 C ATOM 898 OG1 THR A 61 -15.035 -6.725 -17.087 1.00 0.00 O ATOM 899 CG2 THR A 61 -15.707 -7.635 -14.954 1.00 0.00 C ATOM 0 H THR A 61 -13.405 -7.341 -13.599 1.00 0.00 H new ATOM 0 HA THR A 61 -13.024 -5.607 -15.754 1.00 0.00 H new ATOM 0 HB THR A 61 -13.833 -7.943 -15.929 1.00 0.00 H new ATOM 0 HG1 THR A 61 -15.251 -5.769 -17.067 1.00 0.00 H new ATOM 0 HG21 THR A 61 -16.198 -8.465 -15.462 1.00 0.00 H new ATOM 0 HG22 THR A 61 -15.329 -7.973 -13.989 1.00 0.00 H new ATOM 0 HG23 THR A 61 -16.424 -6.828 -14.801 1.00 0.00 H new ATOM 907 N GLN A 62 -15.265 -4.654 -13.651 1.00 0.00 N ATOM 908 CA GLN A 62 -16.220 -3.607 -13.311 1.00 0.00 C ATOM 909 C GLN A 62 -15.501 -2.321 -12.917 1.00 0.00 C ATOM 910 O GLN A 62 -14.277 -2.227 -13.012 1.00 0.00 O ATOM 911 CB GLN A 62 -17.130 -4.068 -12.170 1.00 0.00 C ATOM 912 CG GLN A 62 -17.666 -5.478 -12.353 1.00 0.00 C ATOM 913 CD GLN A 62 -19.127 -5.600 -11.966 1.00 0.00 C ATOM 914 OE1 GLN A 62 -19.995 -4.960 -12.559 1.00 0.00 O ATOM 915 NE2 GLN A 62 -19.407 -6.426 -10.963 1.00 0.00 N ATOM 0 H GLN A 62 -14.970 -5.228 -12.861 1.00 0.00 H new ATOM 0 HA GLN A 62 -16.829 -3.405 -14.192 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -16.577 -4.017 -11.232 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -17.969 -3.377 -12.083 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -17.543 -5.777 -13.394 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -17.075 -6.168 -11.751 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -18.656 -6.937 -10.499 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -20.372 -6.548 -10.658 1.00 0.00 H new ATOM 924 N HIS A 63 -16.271 -1.331 -12.475 1.00 0.00 N ATOM 925 CA HIS A 63 -15.707 -0.050 -12.066 1.00 0.00 C ATOM 926 C HIS A 63 -15.128 -0.136 -10.656 1.00 0.00 C ATOM 927 O HIS A 63 -15.637 -0.870 -9.809 1.00 0.00 O ATOM 928 CB HIS A 63 -16.774 1.044 -12.125 1.00 0.00 C ATOM 929 CG HIS A 63 -16.222 2.405 -12.412 1.00 0.00 C ATOM 930 ND1 HIS A 63 -15.277 3.018 -11.616 1.00 0.00 N ATOM 931 CD2 HIS A 63 -16.484 3.273 -13.417 1.00 0.00 C ATOM 932 CE1 HIS A 63 -14.984 4.205 -12.118 1.00 0.00 C ATOM 933 NE2 HIS A 63 -15.704 4.383 -13.212 1.00 0.00 N ATOM 0 H HIS A 63 -17.286 -1.392 -12.391 1.00 0.00 H new ATOM 0 HA HIS A 63 -14.902 0.201 -12.756 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -17.503 0.787 -12.893 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -17.308 1.071 -11.175 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -17.179 3.120 -14.230 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -14.277 4.909 -11.705 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -15.683 5.211 -13.807 1.00 0.00 H new ATOM 941 N VAL A 64 -14.061 0.617 -10.413 1.00 0.00 N ATOM 942 CA VAL A 64 -13.412 0.626 -9.107 1.00 0.00 C ATOM 943 C VAL A 64 -14.417 0.910 -7.997 1.00 0.00 C ATOM 944 O VAL A 64 -14.303 0.382 -6.891 1.00 0.00 O ATOM 945 CB VAL A 64 -12.286 1.678 -9.046 1.00 0.00 C ATOM 946 CG1 VAL A 64 -11.645 1.692 -7.667 1.00 0.00 C ATOM 947 CG2 VAL A 64 -11.248 1.408 -10.125 1.00 0.00 C ATOM 0 H VAL A 64 -13.627 1.229 -11.104 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.982 -0.365 -8.960 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.718 2.662 -9.229 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -10.853 2.440 -7.642 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -12.398 1.936 -6.918 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.224 0.710 -7.451 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.460 2.159 -10.068 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.817 0.418 -9.975 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.722 1.453 -11.105 1.00 0.00 H new ATOM 957 N ASN A 65 -15.405 1.748 -8.299 1.00 0.00 N ATOM 958 CA ASN A 65 -16.432 2.102 -7.326 1.00 0.00 C ATOM 959 C ASN A 65 -17.331 0.908 -7.025 1.00 0.00 C ATOM 960 O ASN A 65 -17.873 0.786 -5.927 1.00 0.00 O ATOM 961 CB ASN A 65 -17.272 3.272 -7.842 1.00 0.00 C ATOM 962 CG ASN A 65 -18.318 2.831 -8.848 1.00 0.00 C ATOM 963 OD1 ASN A 65 -19.321 2.214 -8.487 1.00 0.00 O ATOM 964 ND2 ASN A 65 -18.089 3.145 -10.119 1.00 0.00 N ATOM 0 H ASN A 65 -15.515 2.194 -9.210 1.00 0.00 H new ATOM 0 HA ASN A 65 -15.935 2.401 -6.403 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -17.764 3.762 -7.001 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -16.617 4.011 -8.303 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -18.758 2.874 -10.840 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -17.245 3.657 -10.374 1.00 0.00 H new ATOM 971 N ASN A 66 -17.485 0.028 -8.009 1.00 0.00 N ATOM 972 CA ASN A 66 -18.319 -1.158 -7.850 1.00 0.00 C ATOM 973 C ASN A 66 -17.592 -2.231 -7.045 1.00 0.00 C ATOM 974 O ASN A 66 -18.221 -3.077 -6.409 1.00 0.00 O ATOM 975 CB ASN A 66 -18.717 -1.714 -9.219 1.00 0.00 C ATOM 976 CG ASN A 66 -20.165 -1.421 -9.564 1.00 0.00 C ATOM 977 OD1 ASN A 66 -20.491 -0.339 -10.052 1.00 0.00 O ATOM 978 ND2 ASN A 66 -21.041 -2.385 -9.308 1.00 0.00 N ATOM 0 H ASN A 66 -17.043 0.114 -8.924 1.00 0.00 H new ATOM 0 HA ASN A 66 -19.219 -0.869 -7.307 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -18.070 -1.285 -9.984 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -18.554 -2.792 -9.232 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -22.030 -2.244 -9.516 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -20.726 -3.266 -8.903 1.00 0.00 H new ATOM 985 N TRP A 67 -16.265 -2.190 -7.079 1.00 0.00 N ATOM 986 CA TRP A 67 -15.452 -3.158 -6.351 1.00 0.00 C ATOM 987 C TRP A 67 -15.866 -3.225 -4.886 1.00 0.00 C ATOM 988 O TRP A 67 -16.662 -2.410 -4.418 1.00 0.00 O ATOM 989 CB TRP A 67 -13.971 -2.794 -6.459 1.00 0.00 C ATOM 990 CG TRP A 67 -13.409 -2.989 -7.835 1.00 0.00 C ATOM 991 CD1 TRP A 67 -14.116 -3.171 -8.990 1.00 0.00 C ATOM 992 CD2 TRP A 67 -12.024 -3.026 -8.199 1.00 0.00 C ATOM 993 NE1 TRP A 67 -13.254 -3.318 -10.050 1.00 0.00 N ATOM 994 CE2 TRP A 67 -11.966 -3.232 -9.592 1.00 0.00 C ATOM 995 CE3 TRP A 67 -10.831 -2.903 -7.486 1.00 0.00 C ATOM 996 CZ2 TRP A 67 -10.759 -3.318 -10.280 1.00 0.00 C ATOM 997 CZ3 TRP A 67 -9.633 -2.988 -8.170 1.00 0.00 C ATOM 998 CH2 TRP A 67 -9.604 -3.193 -9.557 1.00 0.00 C ATOM 0 H TRP A 67 -15.729 -1.498 -7.602 1.00 0.00 H new ATOM 0 HA TRP A 67 -15.612 -4.139 -6.799 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.838 -1.753 -6.164 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -13.403 -3.400 -5.753 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -15.193 -3.196 -9.060 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -13.529 -3.467 -11.021 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -10.843 -2.744 -6.418 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -10.735 -3.478 -11.348 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -8.704 -2.895 -7.627 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -8.652 -3.253 -10.064 1.00 0.00 H new ATOM 1009 N MET A 68 -15.322 -4.200 -4.166 1.00 0.00 N ATOM 1010 CA MET A 68 -15.635 -4.371 -2.752 1.00 0.00 C ATOM 1011 C MET A 68 -15.131 -3.184 -1.936 1.00 0.00 C ATOM 1012 O MET A 68 -15.854 -2.638 -1.102 1.00 0.00 O ATOM 1013 CB MET A 68 -15.015 -5.667 -2.223 1.00 0.00 C ATOM 1014 CG MET A 68 -16.036 -6.759 -1.948 1.00 0.00 C ATOM 1015 SD MET A 68 -15.749 -8.241 -2.934 1.00 0.00 S ATOM 1016 CE MET A 68 -14.357 -8.960 -2.066 1.00 0.00 C ATOM 0 H MET A 68 -14.663 -4.884 -4.538 1.00 0.00 H new ATOM 0 HA MET A 68 -16.719 -4.426 -2.650 1.00 0.00 H new ATOM 0 HB2 MET A 68 -14.288 -6.034 -2.947 1.00 0.00 H new ATOM 0 HB3 MET A 68 -14.469 -5.451 -1.304 1.00 0.00 H new ATOM 0 HG2 MET A 68 -16.007 -7.020 -0.890 1.00 0.00 H new ATOM 0 HG3 MET A 68 -17.036 -6.377 -2.155 1.00 0.00 H new ATOM 0 HE1 MET A 68 -14.251 -10.006 -2.352 1.00 0.00 H new ATOM 0 HE2 MET A 68 -13.447 -8.418 -2.325 1.00 0.00 H new ATOM 0 HE3 MET A 68 -14.525 -8.893 -0.991 1.00 0.00 H new ATOM 1026 N LYS A 69 -13.886 -2.789 -2.180 1.00 0.00 N ATOM 1027 CA LYS A 69 -13.285 -1.667 -1.469 1.00 0.00 C ATOM 1028 C LYS A 69 -13.166 -1.967 0.022 1.00 0.00 C ATOM 1029 O LYS A 69 -13.857 -2.841 0.545 1.00 0.00 O ATOM 1030 CB LYS A 69 -14.117 -0.399 -1.680 1.00 0.00 C ATOM 1031 CG LYS A 69 -14.541 -0.183 -3.123 1.00 0.00 C ATOM 1032 CD LYS A 69 -15.471 1.011 -3.258 1.00 0.00 C ATOM 1033 CE LYS A 69 -14.708 2.324 -3.174 1.00 0.00 C ATOM 1034 NZ LYS A 69 -15.282 3.236 -2.146 1.00 0.00 N ATOM 0 H LYS A 69 -13.273 -3.230 -2.866 1.00 0.00 H new ATOM 0 HA LYS A 69 -12.284 -1.509 -1.870 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -15.007 -0.450 -1.052 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -13.540 0.464 -1.346 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -13.658 -0.030 -3.744 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -15.040 -1.078 -3.494 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -15.999 0.956 -4.210 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -16.226 0.977 -2.472 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -13.663 2.122 -2.937 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -14.725 2.817 -4.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -14.734 4.119 -2.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -16.271 3.450 -2.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -15.242 2.777 -1.214 1.00 0.00 H new ATOM 1048 N HIS A 70 -12.287 -1.237 0.699 1.00 0.00 N ATOM 1049 CA HIS A 70 -12.080 -1.424 2.130 1.00 0.00 C ATOM 1050 C HIS A 70 -11.956 -0.080 2.842 1.00 0.00 C ATOM 1051 O HIS A 70 -12.129 0.975 2.232 1.00 0.00 O ATOM 1052 CB HIS A 70 -10.825 -2.262 2.379 1.00 0.00 C ATOM 1053 CG HIS A 70 -11.010 -3.321 3.424 1.00 0.00 C ATOM 1054 ND1 HIS A 70 -12.128 -4.126 3.490 1.00 0.00 N ATOM 1055 CD2 HIS A 70 -10.211 -3.705 4.446 1.00 0.00 C ATOM 1056 CE1 HIS A 70 -12.008 -4.958 4.509 1.00 0.00 C ATOM 1057 NE2 HIS A 70 -10.853 -4.724 5.106 1.00 0.00 N ATOM 0 H HIS A 70 -11.706 -0.510 0.280 1.00 0.00 H new ATOM 0 HA HIS A 70 -12.946 -1.950 2.531 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -10.522 -2.734 1.444 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -10.012 -1.602 2.682 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -9.247 -3.288 4.696 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -12.732 -5.703 4.804 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -10.496 -5.219 5.923 1.00 0.00 H new ATOM 1065 N ASN A 71 -11.658 -0.126 4.136 1.00 0.00 N ATOM 1066 CA ASN A 71 -11.514 1.087 4.932 1.00 0.00 C ATOM 1067 C ASN A 71 -10.256 1.027 5.793 1.00 0.00 C ATOM 1068 O ASN A 71 -9.762 -0.053 6.117 1.00 0.00 O ATOM 1069 CB ASN A 71 -12.743 1.290 5.820 1.00 0.00 C ATOM 1070 CG ASN A 71 -13.355 2.668 5.655 1.00 0.00 C ATOM 1071 OD1 ASN A 71 -13.323 3.487 6.575 1.00 0.00 O ATOM 1072 ND2 ASN A 71 -13.914 2.931 4.481 1.00 0.00 N ATOM 0 H ASN A 71 -11.511 -0.991 4.656 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.425 1.931 4.248 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -13.490 0.533 5.581 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -12.463 1.143 6.863 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -14.340 3.842 4.312 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -13.917 2.222 3.748 1.00 0.00 H new ATOM 1079 N VAL A 72 -9.740 2.197 6.160 1.00 0.00 N ATOM 1080 CA VAL A 72 -8.541 2.277 6.986 1.00 0.00 C ATOM 1081 C VAL A 72 -8.558 3.528 7.858 1.00 0.00 C ATOM 1082 O VAL A 72 -9.041 4.581 7.444 1.00 0.00 O ATOM 1083 CB VAL A 72 -7.265 2.285 6.122 1.00 0.00 C ATOM 1084 CG1 VAL A 72 -6.027 2.399 6.999 1.00 0.00 C ATOM 1085 CG2 VAL A 72 -7.203 1.036 5.256 1.00 0.00 C ATOM 0 H VAL A 72 -10.133 3.101 5.898 1.00 0.00 H new ATOM 0 HA VAL A 72 -8.535 1.393 7.623 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.296 3.154 5.465 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.136 2.403 6.372 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -6.071 3.325 7.572 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -5.986 1.551 7.682 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.296 1.057 4.652 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.194 0.152 5.893 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.074 1.003 4.602 1.00 0.00 H new ATOM 1095 N ALA A 73 -8.027 3.403 9.071 1.00 0.00 N ATOM 1096 CA ALA A 73 -7.979 4.523 10.001 1.00 0.00 C ATOM 1097 C ALA A 73 -6.538 4.902 10.332 1.00 0.00 C ATOM 1098 O ALA A 73 -6.116 4.831 11.486 1.00 0.00 O ATOM 1099 CB ALA A 73 -8.743 4.187 11.273 1.00 0.00 C ATOM 0 H ALA A 73 -7.625 2.538 9.431 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.452 5.380 9.522 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.698 5.033 11.959 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.783 3.974 11.027 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.295 3.313 11.746 1.00 0.00 H new ATOM 1105 N ASP A 74 -5.788 5.303 9.311 1.00 0.00 N ATOM 1106 CA ASP A 74 -4.394 5.692 9.494 1.00 0.00 C ATOM 1107 C ASP A 74 -3.620 4.608 10.238 1.00 0.00 C ATOM 1108 O ASP A 74 -3.076 4.850 11.315 1.00 0.00 O ATOM 1109 CB ASP A 74 -4.307 7.014 10.257 1.00 0.00 C ATOM 1110 CG ASP A 74 -3.026 7.767 9.965 1.00 0.00 C ATOM 1111 OD1 ASP A 74 -2.805 8.131 8.792 1.00 0.00 O ATOM 1112 OD2 ASP A 74 -2.241 7.992 10.911 1.00 0.00 O ATOM 0 H ASP A 74 -6.121 5.367 8.349 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.946 5.821 8.509 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.160 7.639 9.994 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.374 6.818 11.327 1.00 0.00 H new ATOM 1117 N SER A 75 -3.579 3.413 9.657 1.00 0.00 N ATOM 1118 CA SER A 75 -2.875 2.291 10.267 1.00 0.00 C ATOM 1119 C SER A 75 -1.707 1.843 9.396 1.00 0.00 C ATOM 1120 O SER A 75 -0.744 1.252 9.886 1.00 0.00 O ATOM 1121 CB SER A 75 -3.836 1.123 10.494 1.00 0.00 C ATOM 1122 OG SER A 75 -3.667 0.565 11.786 1.00 0.00 O ATOM 0 H SER A 75 -4.025 3.197 8.765 1.00 0.00 H new ATOM 0 HA SER A 75 -2.481 2.620 11.228 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.864 1.466 10.374 1.00 0.00 H new ATOM 0 HB3 SER A 75 -3.666 0.356 9.738 1.00 0.00 H new ATOM 0 HG SER A 75 -4.294 -0.178 11.906 1.00 0.00 H new ATOM 1128 N GLN A 76 -1.799 2.127 8.101 1.00 0.00 N ATOM 1129 CA GLN A 76 -0.749 1.752 7.161 1.00 0.00 C ATOM 1130 C GLN A 76 -0.607 0.237 7.080 1.00 0.00 C ATOM 1131 O GLN A 76 0.413 -0.277 6.620 1.00 0.00 O ATOM 1132 CB GLN A 76 0.582 2.381 7.572 1.00 0.00 C ATOM 1133 CG GLN A 76 0.988 3.567 6.712 1.00 0.00 C ATOM 1134 CD GLN A 76 2.246 4.247 7.212 1.00 0.00 C ATOM 1135 OE1 GLN A 76 2.251 5.448 7.487 1.00 0.00 O ATOM 1136 NE2 GLN A 76 3.326 3.481 7.334 1.00 0.00 N ATOM 0 H GLN A 76 -2.589 2.615 7.679 1.00 0.00 H new ATOM 0 HA GLN A 76 -1.028 2.125 6.176 1.00 0.00 H new ATOM 0 HB2 GLN A 76 0.516 2.703 8.611 1.00 0.00 H new ATOM 0 HB3 GLN A 76 1.363 1.623 7.522 1.00 0.00 H new ATOM 0 HG2 GLN A 76 1.144 3.231 5.687 1.00 0.00 H new ATOM 0 HG3 GLN A 76 0.173 4.290 6.690 1.00 0.00 H new ATOM 0 HE21 GLN A 76 3.278 2.490 7.095 1.00 0.00 H new ATOM 0 HE22 GLN A 76 4.202 3.884 7.666 1.00 0.00 H new ATOM 1145 N ILE A 77 -1.637 -0.475 7.528 1.00 0.00 N ATOM 1146 CA ILE A 77 -1.625 -1.932 7.505 1.00 0.00 C ATOM 1147 C ILE A 77 -3.023 -2.496 7.737 1.00 0.00 C ATOM 1148 O ILE A 77 -3.738 -2.062 8.641 1.00 0.00 O ATOM 1149 CB ILE A 77 -0.670 -2.504 8.570 1.00 0.00 C ATOM 1150 CG1 ILE A 77 -0.534 -4.020 8.404 1.00 0.00 C ATOM 1151 CG2 ILE A 77 -1.166 -2.161 9.968 1.00 0.00 C ATOM 1152 CD1 ILE A 77 0.493 -4.638 9.325 1.00 0.00 C ATOM 0 H ILE A 77 -2.489 -0.066 7.911 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.274 -2.230 6.517 1.00 0.00 H new ATOM 0 HB ILE A 77 0.313 -2.053 8.434 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.502 -4.486 8.588 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.264 -4.242 7.371 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.480 -2.572 10.709 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.215 -1.078 10.081 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.158 -2.587 10.117 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.536 -5.713 9.153 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.471 -4.199 9.126 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.214 -4.447 10.361 1.00 0.00 H new ATOM 1164 N THR A 78 -3.406 -3.469 6.916 1.00 0.00 N ATOM 1165 CA THR A 78 -4.717 -4.094 7.032 1.00 0.00 C ATOM 1166 C THR A 78 -4.667 -5.559 6.617 1.00 0.00 C ATOM 1167 O THR A 78 -3.824 -5.960 5.813 1.00 0.00 O ATOM 1168 CB THR A 78 -5.765 -3.364 6.171 1.00 0.00 C ATOM 1169 OG1 THR A 78 -7.071 -3.885 6.442 1.00 0.00 O ATOM 1170 CG2 THR A 78 -5.451 -3.520 4.690 1.00 0.00 C ATOM 0 H THR A 78 -2.826 -3.841 6.164 1.00 0.00 H new ATOM 0 HA THR A 78 -5.007 -4.026 8.080 1.00 0.00 H new ATOM 0 HB THR A 78 -5.736 -2.304 6.424 1.00 0.00 H new ATOM 0 HG1 THR A 78 -7.745 -3.315 6.017 1.00 0.00 H new ATOM 0 HG21 THR A 78 -6.204 -2.996 4.101 1.00 0.00 H new ATOM 0 HG22 THR A 78 -4.468 -3.098 4.480 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.455 -4.578 4.427 1.00 0.00 H new ATOM 1178 N THR A 79 -5.575 -6.359 7.169 1.00 0.00 N ATOM 1179 CA THR A 79 -5.632 -7.781 6.856 1.00 0.00 C ATOM 1180 C THR A 79 -7.013 -8.176 6.344 1.00 0.00 C ATOM 1181 O THR A 79 -8.008 -8.056 7.059 1.00 0.00 O ATOM 1182 CB THR A 79 -5.290 -8.641 8.087 1.00 0.00 C ATOM 1183 OG1 THR A 79 -5.995 -8.157 9.236 1.00 0.00 O ATOM 1184 CG2 THR A 79 -3.793 -8.622 8.361 1.00 0.00 C ATOM 0 H THR A 79 -6.281 -6.045 7.835 1.00 0.00 H new ATOM 0 HA THR A 79 -4.892 -7.963 6.077 1.00 0.00 H new ATOM 0 HB THR A 79 -5.594 -9.667 7.880 1.00 0.00 H new ATOM 0 HG1 THR A 79 -6.901 -7.889 8.975 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.575 -9.236 9.235 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.260 -9.018 7.497 1.00 0.00 H new ATOM 0 HG23 THR A 79 -3.470 -7.598 8.548 1.00 0.00 H new ATOM 1192 N ILE A 80 -7.066 -8.646 5.102 1.00 0.00 N ATOM 1193 CA ILE A 80 -8.325 -9.059 4.496 1.00 0.00 C ATOM 1194 C ILE A 80 -8.445 -10.579 4.461 1.00 0.00 C ATOM 1195 O ILE A 80 -7.458 -11.286 4.263 1.00 0.00 O ATOM 1196 CB ILE A 80 -8.465 -8.511 3.063 1.00 0.00 C ATOM 1197 CG1 ILE A 80 -8.384 -6.984 3.066 1.00 0.00 C ATOM 1198 CG2 ILE A 80 -9.775 -8.976 2.444 1.00 0.00 C ATOM 1199 CD1 ILE A 80 -8.276 -6.380 1.685 1.00 0.00 C ATOM 0 H ILE A 80 -6.252 -8.750 4.496 1.00 0.00 H new ATOM 0 HA ILE A 80 -9.124 -8.648 5.114 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.643 -8.898 2.461 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -9.269 -6.583 3.560 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -7.521 -6.676 3.657 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.860 -8.581 1.432 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -9.795 -10.065 2.411 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.610 -8.615 3.045 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -8.223 -5.294 1.766 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -7.376 -6.752 1.195 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -9.151 -6.658 1.097 1.00 0.00 H new ATOM 1211 N GLY A 81 -9.664 -11.076 4.652 1.00 0.00 N ATOM 1212 CA GLY A 81 -9.892 -12.509 4.638 1.00 0.00 C ATOM 1213 C GLY A 81 -11.164 -12.884 3.905 1.00 0.00 C ATOM 1214 O GLY A 81 -11.752 -12.062 3.205 1.00 0.00 O ATOM 0 H GLY A 81 -10.497 -10.511 4.816 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -9.044 -13.005 4.165 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -9.945 -12.876 5.663 1.00 0.00 H new ATOM 1218 N ASN A 82 -11.589 -14.135 4.064 1.00 0.00 N ATOM 1219 CA ASN A 82 -12.799 -14.619 3.411 1.00 0.00 C ATOM 1220 C ASN A 82 -12.646 -14.588 1.893 1.00 0.00 C ATOM 1221 O ASN A 82 -13.585 -14.246 1.171 1.00 0.00 O ATOM 1222 CB ASN A 82 -14.005 -13.776 3.831 1.00 0.00 C ATOM 1223 CG ASN A 82 -15.310 -14.539 3.720 1.00 0.00 C ATOM 1224 OD1 ASN A 82 -15.484 -15.589 4.337 1.00 0.00 O ATOM 1225 ND2 ASN A 82 -16.237 -14.012 2.928 1.00 0.00 N ATOM 0 H ASN A 82 -11.113 -14.830 4.639 1.00 0.00 H new ATOM 0 HA ASN A 82 -12.961 -15.651 3.722 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -13.870 -13.440 4.859 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -14.055 -12.883 3.208 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -17.136 -14.480 2.813 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -16.050 -13.139 2.435 1.00 0.00 H new ATOM 1232 N LEU A 83 -11.460 -14.945 1.415 1.00 0.00 N ATOM 1233 CA LEU A 83 -11.184 -14.960 -0.017 1.00 0.00 C ATOM 1234 C LEU A 83 -11.071 -16.389 -0.537 1.00 0.00 C ATOM 1235 O LEU A 83 -11.030 -17.342 0.241 1.00 0.00 O ATOM 1236 CB LEU A 83 -9.896 -14.191 -0.317 1.00 0.00 C ATOM 1237 CG LEU A 83 -9.697 -12.887 0.458 1.00 0.00 C ATOM 1238 CD1 LEU A 83 -8.287 -12.353 0.248 1.00 0.00 C ATOM 1239 CD2 LEU A 83 -10.729 -11.854 0.035 1.00 0.00 C ATOM 0 H LEU A 83 -10.673 -15.228 1.999 1.00 0.00 H new ATOM 0 HA LEU A 83 -12.016 -14.474 -0.526 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.049 -14.846 -0.111 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -9.872 -13.964 -1.383 1.00 0.00 H new ATOM 0 HG LEU A 83 -9.832 -13.092 1.520 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -8.162 -11.425 0.806 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.563 -13.088 0.600 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -8.124 -12.163 -0.813 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -10.573 -10.933 0.596 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -10.625 -11.652 -1.031 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -11.730 -12.236 0.236 1.00 0.00 H new ATOM 1251 N VAL A 84 -11.016 -16.531 -1.857 1.00 0.00 N ATOM 1252 CA VAL A 84 -10.903 -17.844 -2.480 1.00 0.00 C ATOM 1253 C VAL A 84 -9.445 -18.277 -2.589 1.00 0.00 C ATOM 1254 O VAL A 84 -8.582 -17.526 -3.045 1.00 0.00 O ATOM 1255 CB VAL A 84 -11.536 -17.855 -3.885 1.00 0.00 C ATOM 1256 CG1 VAL A 84 -11.906 -19.273 -4.293 1.00 0.00 C ATOM 1257 CG2 VAL A 84 -12.756 -16.946 -3.926 1.00 0.00 C ATOM 0 H VAL A 84 -11.048 -15.753 -2.516 1.00 0.00 H new ATOM 0 HA VAL A 84 -11.441 -18.545 -1.841 1.00 0.00 H new ATOM 0 HB VAL A 84 -10.803 -17.476 -4.598 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.352 -19.261 -5.288 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -11.010 -19.894 -4.304 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -12.622 -19.682 -3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -13.191 -16.965 -4.925 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -13.493 -17.294 -3.203 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -12.459 -15.927 -3.679 1.00 0.00 H new ATOM 1267 N PRO A 85 -9.163 -19.516 -2.162 1.00 0.00 N ATOM 1268 CA PRO A 85 -7.810 -20.078 -2.202 1.00 0.00 C ATOM 1269 C PRO A 85 -7.339 -20.355 -3.626 1.00 0.00 C ATOM 1270 O PRO A 85 -8.053 -20.974 -4.415 1.00 0.00 O ATOM 1271 CB PRO A 85 -7.946 -21.385 -1.419 1.00 0.00 C ATOM 1272 CG PRO A 85 -9.381 -21.760 -1.551 1.00 0.00 C ATOM 1273 CD PRO A 85 -10.143 -20.465 -1.607 1.00 0.00 C ATOM 0 HA PRO A 85 -7.071 -19.392 -1.788 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -7.296 -22.159 -1.826 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.667 -21.251 -0.374 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.549 -22.351 -2.451 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -9.705 -22.367 -0.706 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -11.027 -20.546 -2.240 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -10.485 -20.157 -0.619 1.00 0.00 H new ATOM 1281 N GLN A 86 -6.134 -19.896 -3.946 1.00 0.00 N ATOM 1282 CA GLN A 86 -5.569 -20.097 -5.276 1.00 0.00 C ATOM 1283 C GLN A 86 -6.384 -19.353 -6.331 1.00 0.00 C ATOM 1284 O GLN A 86 -6.666 -19.888 -7.403 1.00 0.00 O ATOM 1285 CB GLN A 86 -5.520 -21.588 -5.613 1.00 0.00 C ATOM 1286 CG GLN A 86 -4.980 -22.448 -4.482 1.00 0.00 C ATOM 1287 CD GLN A 86 -4.592 -23.839 -4.940 1.00 0.00 C ATOM 1288 OE1 GLN A 86 -4.011 -24.014 -6.013 1.00 0.00 O ATOM 1289 NE2 GLN A 86 -4.910 -24.842 -4.130 1.00 0.00 N ATOM 0 H GLN A 86 -5.530 -19.383 -3.304 1.00 0.00 H new ATOM 0 HA GLN A 86 -4.555 -19.698 -5.276 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -6.523 -21.928 -5.870 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -4.899 -21.732 -6.497 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -4.111 -21.959 -4.042 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -5.733 -22.525 -3.698 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -5.391 -24.654 -3.250 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -4.673 -25.800 -4.387 1.00 0.00 H new ATOM 1298 N LYS A 87 -6.757 -18.116 -6.018 1.00 0.00 N ATOM 1299 CA LYS A 87 -7.538 -17.298 -6.939 1.00 0.00 C ATOM 1300 C LYS A 87 -6.956 -15.892 -7.043 1.00 0.00 C ATOM 1301 O LYS A 87 -6.785 -15.203 -6.036 1.00 0.00 O ATOM 1302 CB LYS A 87 -8.995 -17.225 -6.479 1.00 0.00 C ATOM 1303 CG LYS A 87 -9.817 -18.441 -6.870 1.00 0.00 C ATOM 1304 CD LYS A 87 -9.920 -18.583 -8.379 1.00 0.00 C ATOM 1305 CE LYS A 87 -11.246 -19.202 -8.791 1.00 0.00 C ATOM 1306 NZ LYS A 87 -11.593 -18.884 -10.205 1.00 0.00 N ATOM 0 H LYS A 87 -6.531 -17.659 -5.135 1.00 0.00 H new ATOM 0 HA LYS A 87 -7.498 -17.764 -7.924 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.020 -17.113 -5.395 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.457 -16.333 -6.902 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.363 -19.338 -6.449 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.816 -18.359 -6.442 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.814 -17.604 -8.846 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.100 -19.201 -8.744 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -11.197 -20.283 -8.664 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.036 -18.839 -8.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.504 -19.324 -10.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.665 -17.853 -10.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -10.852 -19.252 -10.835 1.00 0.00 H new ATOM 1320 N THR A 88 -6.655 -15.469 -8.267 1.00 0.00 N ATOM 1321 CA THR A 88 -6.093 -14.146 -8.502 1.00 0.00 C ATOM 1322 C THR A 88 -6.930 -13.065 -7.826 1.00 0.00 C ATOM 1323 O THR A 88 -8.155 -13.170 -7.751 1.00 0.00 O ATOM 1324 CB THR A 88 -5.997 -13.836 -10.008 1.00 0.00 C ATOM 1325 OG1 THR A 88 -5.366 -14.924 -10.693 1.00 0.00 O ATOM 1326 CG2 THR A 88 -5.212 -12.556 -10.248 1.00 0.00 C ATOM 0 H THR A 88 -6.792 -16.025 -9.111 1.00 0.00 H new ATOM 0 HA THR A 88 -5.091 -14.148 -8.073 1.00 0.00 H new ATOM 0 HB THR A 88 -7.008 -13.701 -10.394 1.00 0.00 H new ATOM 0 HG1 THR A 88 -5.310 -14.720 -11.650 1.00 0.00 H new ATOM 0 HG21 THR A 88 -5.158 -12.358 -11.318 1.00 0.00 H new ATOM 0 HG22 THR A 88 -5.711 -11.725 -9.750 1.00 0.00 H new ATOM 0 HG23 THR A 88 -4.204 -12.667 -9.848 1.00 0.00 H new ATOM 1334 N TYR A 89 -6.261 -12.028 -7.335 1.00 0.00 N ATOM 1335 CA TYR A 89 -6.944 -10.928 -6.663 1.00 0.00 C ATOM 1336 C TYR A 89 -6.173 -9.623 -6.834 1.00 0.00 C ATOM 1337 O TYR A 89 -4.957 -9.577 -6.645 1.00 0.00 O ATOM 1338 CB TYR A 89 -7.117 -11.241 -5.175 1.00 0.00 C ATOM 1339 CG TYR A 89 -8.542 -11.556 -4.786 1.00 0.00 C ATOM 1340 CD1 TYR A 89 -9.073 -12.825 -4.985 1.00 0.00 C ATOM 1341 CD2 TYR A 89 -9.359 -10.587 -4.215 1.00 0.00 C ATOM 1342 CE1 TYR A 89 -10.375 -13.118 -4.630 1.00 0.00 C ATOM 1343 CE2 TYR A 89 -10.662 -10.872 -3.856 1.00 0.00 C ATOM 1344 CZ TYR A 89 -11.166 -12.139 -4.066 1.00 0.00 C ATOM 1345 OH TYR A 89 -12.464 -12.428 -3.710 1.00 0.00 O ATOM 0 H TYR A 89 -5.248 -11.926 -7.389 1.00 0.00 H new ATOM 0 HA TYR A 89 -7.927 -10.810 -7.119 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -6.482 -12.088 -4.914 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -6.769 -10.390 -4.590 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -8.457 -13.595 -5.425 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -8.968 -9.594 -4.049 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -10.772 -14.109 -4.793 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -11.283 -10.107 -3.413 1.00 0.00 H new ATOM 0 HH TYR A 89 -12.883 -11.630 -3.326 1.00 0.00 H new ATOM 1355 N SER A 90 -6.890 -8.561 -7.191 1.00 0.00 N ATOM 1356 CA SER A 90 -6.275 -7.255 -7.391 1.00 0.00 C ATOM 1357 C SER A 90 -6.304 -6.438 -6.104 1.00 0.00 C ATOM 1358 O SER A 90 -7.156 -6.649 -5.241 1.00 0.00 O ATOM 1359 CB SER A 90 -6.993 -6.495 -8.507 1.00 0.00 C ATOM 1360 OG SER A 90 -6.070 -5.805 -9.331 1.00 0.00 O ATOM 0 H SER A 90 -7.898 -8.581 -7.347 1.00 0.00 H new ATOM 0 HA SER A 90 -5.235 -7.411 -7.678 1.00 0.00 H new ATOM 0 HB2 SER A 90 -7.573 -7.193 -9.111 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.698 -5.786 -8.073 1.00 0.00 H new ATOM 0 HG SER A 90 -6.554 -5.329 -10.037 1.00 0.00 H new ATOM 1366 N VAL A 91 -5.366 -5.504 -5.982 1.00 0.00 N ATOM 1367 CA VAL A 91 -5.283 -4.653 -4.799 1.00 0.00 C ATOM 1368 C VAL A 91 -4.818 -3.249 -5.165 1.00 0.00 C ATOM 1369 O VAL A 91 -4.050 -3.062 -6.109 1.00 0.00 O ATOM 1370 CB VAL A 91 -4.324 -5.243 -3.749 1.00 0.00 C ATOM 1371 CG1 VAL A 91 -4.396 -4.448 -2.454 1.00 0.00 C ATOM 1372 CG2 VAL A 91 -4.642 -6.710 -3.502 1.00 0.00 C ATOM 0 H VAL A 91 -4.653 -5.317 -6.687 1.00 0.00 H new ATOM 0 HA VAL A 91 -6.286 -4.602 -4.375 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.306 -5.175 -4.133 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.712 -4.880 -1.724 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -4.115 -3.412 -2.647 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -5.413 -4.482 -2.063 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -3.955 -7.111 -2.757 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.665 -6.804 -3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.534 -7.267 -4.433 1.00 0.00 H new ATOM 1382 N LYS A 92 -5.288 -2.261 -4.411 1.00 0.00 N ATOM 1383 CA LYS A 92 -4.919 -0.871 -4.652 1.00 0.00 C ATOM 1384 C LYS A 92 -4.977 -0.060 -3.362 1.00 0.00 C ATOM 1385 O LYS A 92 -5.726 -0.391 -2.443 1.00 0.00 O ATOM 1386 CB LYS A 92 -5.847 -0.250 -5.699 1.00 0.00 C ATOM 1387 CG LYS A 92 -5.718 -0.880 -7.076 1.00 0.00 C ATOM 1388 CD LYS A 92 -6.644 -0.214 -8.081 1.00 0.00 C ATOM 1389 CE LYS A 92 -5.925 0.873 -8.864 1.00 0.00 C ATOM 1390 NZ LYS A 92 -6.785 1.448 -9.933 1.00 0.00 N ATOM 0 H LYS A 92 -5.926 -2.397 -3.627 1.00 0.00 H new ATOM 0 HA LYS A 92 -3.895 -0.853 -5.025 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.879 -0.345 -5.360 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.634 0.816 -5.775 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.687 -0.798 -7.420 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -5.950 -1.943 -7.014 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -7.034 -0.963 -8.770 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -7.499 0.216 -7.560 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.614 1.665 -8.183 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -5.019 0.461 -9.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -6.522 2.441 -10.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -6.653 0.908 -10.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -7.782 1.397 -9.642 1.00 0.00 H new ATOM 1404 N VAL A 93 -4.181 1.003 -3.300 1.00 0.00 N ATOM 1405 CA VAL A 93 -4.144 1.863 -2.124 1.00 0.00 C ATOM 1406 C VAL A 93 -3.912 3.319 -2.513 1.00 0.00 C ATOM 1407 O VAL A 93 -3.243 3.608 -3.506 1.00 0.00 O ATOM 1408 CB VAL A 93 -3.042 1.424 -1.141 1.00 0.00 C ATOM 1409 CG1 VAL A 93 -3.130 2.220 0.151 1.00 0.00 C ATOM 1410 CG2 VAL A 93 -3.140 -0.069 -0.866 1.00 0.00 C ATOM 0 H VAL A 93 -3.553 1.289 -4.051 1.00 0.00 H new ATOM 0 HA VAL A 93 -5.114 1.771 -1.636 1.00 0.00 H new ATOM 0 HB VAL A 93 -2.072 1.624 -1.596 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -2.344 1.896 0.833 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -3.007 3.281 -0.066 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -4.103 2.055 0.615 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.355 -0.363 -0.170 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.114 -0.296 -0.431 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -3.022 -0.619 -1.799 1.00 0.00 H new ATOM 1420 N LEU A 94 -4.469 4.231 -1.725 1.00 0.00 N ATOM 1421 CA LEU A 94 -4.322 5.659 -1.986 1.00 0.00 C ATOM 1422 C LEU A 94 -4.381 6.460 -0.689 1.00 0.00 C ATOM 1423 O LEU A 94 -4.744 5.932 0.361 1.00 0.00 O ATOM 1424 CB LEU A 94 -5.416 6.137 -2.944 1.00 0.00 C ATOM 1425 CG LEU A 94 -6.777 6.434 -2.315 1.00 0.00 C ATOM 1426 CD1 LEU A 94 -6.858 7.889 -1.882 1.00 0.00 C ATOM 1427 CD2 LEU A 94 -7.899 6.101 -3.288 1.00 0.00 C ATOM 0 H LEU A 94 -5.026 4.008 -0.900 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.347 5.820 -2.446 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.064 7.040 -3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.552 5.379 -3.715 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.892 5.806 -1.431 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.834 8.082 -1.436 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.077 8.095 -1.149 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.721 8.535 -2.749 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.860 6.319 -2.823 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.788 6.702 -4.191 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.853 5.044 -3.548 1.00 0.00 H new ATOM 1439 N ALA A 95 -4.024 7.737 -0.771 1.00 0.00 N ATOM 1440 CA ALA A 95 -4.041 8.612 0.396 1.00 0.00 C ATOM 1441 C ALA A 95 -5.072 9.722 0.233 1.00 0.00 C ATOM 1442 O ALA A 95 -5.340 10.179 -0.878 1.00 0.00 O ATOM 1443 CB ALA A 95 -2.659 9.203 0.631 1.00 0.00 C ATOM 0 H ALA A 95 -3.719 8.189 -1.633 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.322 8.016 1.264 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.685 9.854 1.505 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.943 8.399 0.799 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -2.357 9.780 -0.243 1.00 0.00 H new ATOM 1449 N PHE A 96 -5.652 10.153 1.350 1.00 0.00 N ATOM 1450 CA PHE A 96 -6.657 11.209 1.332 1.00 0.00 C ATOM 1451 C PHE A 96 -6.644 11.994 2.639 1.00 0.00 C ATOM 1452 O PHE A 96 -6.464 11.427 3.718 1.00 0.00 O ATOM 1453 CB PHE A 96 -8.048 10.616 1.094 1.00 0.00 C ATOM 1454 CG PHE A 96 -8.534 9.755 2.226 1.00 0.00 C ATOM 1455 CD1 PHE A 96 -9.162 10.322 3.324 1.00 0.00 C ATOM 1456 CD2 PHE A 96 -8.361 8.382 2.194 1.00 0.00 C ATOM 1457 CE1 PHE A 96 -9.611 9.533 4.366 1.00 0.00 C ATOM 1458 CE2 PHE A 96 -8.808 7.587 3.233 1.00 0.00 C ATOM 1459 CZ PHE A 96 -9.432 8.165 4.321 1.00 0.00 C ATOM 0 H PHE A 96 -5.442 9.786 2.279 1.00 0.00 H new ATOM 0 HA PHE A 96 -6.416 11.891 0.516 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -8.758 11.428 0.935 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -8.030 10.024 0.179 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -9.302 11.392 3.366 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -7.871 7.926 1.347 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -10.101 9.986 5.215 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -8.670 6.517 3.194 1.00 0.00 H new ATOM 0 HZ PHE A 96 -9.780 7.547 5.136 1.00 0.00 H new ATOM 1469 N THR A 97 -6.834 13.306 2.537 1.00 0.00 N ATOM 1470 CA THR A 97 -6.843 14.172 3.711 1.00 0.00 C ATOM 1471 C THR A 97 -8.138 14.971 3.794 1.00 0.00 C ATOM 1472 O THR A 97 -9.006 14.856 2.930 1.00 0.00 O ATOM 1473 CB THR A 97 -5.650 15.147 3.697 1.00 0.00 C ATOM 1474 OG1 THR A 97 -5.783 16.068 2.609 1.00 0.00 O ATOM 1475 CG2 THR A 97 -4.335 14.393 3.571 1.00 0.00 C ATOM 0 H THR A 97 -6.984 13.793 1.653 1.00 0.00 H new ATOM 0 HA THR A 97 -6.763 13.524 4.584 1.00 0.00 H new ATOM 0 HB THR A 97 -5.647 15.695 4.639 1.00 0.00 H new ATOM 0 HG1 THR A 97 -5.022 16.685 2.608 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.508 15.103 3.563 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.223 13.714 4.416 1.00 0.00 H new ATOM 0 HG23 THR A 97 -4.331 13.821 2.643 1.00 0.00 H new ATOM 1483 N SER A 98 -8.260 15.783 4.840 1.00 0.00 N ATOM 1484 CA SER A 98 -9.452 16.600 5.038 1.00 0.00 C ATOM 1485 C SER A 98 -9.720 17.474 3.818 1.00 0.00 C ATOM 1486 O SER A 98 -10.860 17.858 3.555 1.00 0.00 O ATOM 1487 CB SER A 98 -9.292 17.476 6.281 1.00 0.00 C ATOM 1488 OG SER A 98 -8.876 18.786 5.933 1.00 0.00 O ATOM 0 H SER A 98 -7.549 15.892 5.563 1.00 0.00 H new ATOM 0 HA SER A 98 -10.302 15.932 5.178 1.00 0.00 H new ATOM 0 HB2 SER A 98 -10.238 17.523 6.821 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.563 17.027 6.955 1.00 0.00 H new ATOM 0 HG SER A 98 -8.783 19.326 6.745 1.00 0.00 H new ATOM 1494 N ILE A 99 -8.662 17.784 3.075 1.00 0.00 N ATOM 1495 CA ILE A 99 -8.784 18.610 1.881 1.00 0.00 C ATOM 1496 C ILE A 99 -9.454 17.844 0.746 1.00 0.00 C ATOM 1497 O ILE A 99 -10.461 18.285 0.193 1.00 0.00 O ATOM 1498 CB ILE A 99 -7.409 19.115 1.402 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -6.724 19.921 2.507 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -7.562 19.954 0.143 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -7.494 21.156 2.920 1.00 0.00 C ATOM 0 H ILE A 99 -7.712 17.475 3.279 1.00 0.00 H new ATOM 0 HA ILE A 99 -9.403 19.465 2.153 1.00 0.00 H new ATOM 0 HB ILE A 99 -6.784 18.254 1.167 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.584 19.282 3.379 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.732 20.218 2.167 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.582 20.303 -0.183 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.012 19.350 -0.645 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.202 20.811 0.353 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -6.949 21.678 3.707 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -7.611 21.816 2.060 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -8.477 20.865 3.291 1.00 0.00 H new ATOM 1513 N GLY A 100 -8.890 16.689 0.405 1.00 0.00 N ATOM 1514 CA GLY A 100 -9.447 15.877 -0.661 1.00 0.00 C ATOM 1515 C GLY A 100 -8.820 14.499 -0.728 1.00 0.00 C ATOM 1516 O GLY A 100 -8.371 13.964 0.285 1.00 0.00 O ATOM 0 H GLY A 100 -8.057 16.301 0.848 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.522 15.777 -0.513 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.302 16.385 -1.614 1.00 0.00 H new ATOM 1520 N ASP A 101 -8.793 13.921 -1.924 1.00 0.00 N ATOM 1521 CA ASP A 101 -8.218 12.596 -2.120 1.00 0.00 C ATOM 1522 C ASP A 101 -6.932 12.676 -2.937 1.00 0.00 C ATOM 1523 O ASP A 101 -6.558 13.743 -3.421 1.00 0.00 O ATOM 1524 CB ASP A 101 -9.223 11.677 -2.816 1.00 0.00 C ATOM 1525 CG ASP A 101 -9.903 12.350 -3.992 1.00 0.00 C ATOM 1526 OD1 ASP A 101 -9.259 12.485 -5.053 1.00 0.00 O ATOM 1527 OD2 ASP A 101 -11.081 12.741 -3.852 1.00 0.00 O ATOM 0 H ASP A 101 -9.163 14.350 -2.772 1.00 0.00 H new ATOM 0 HA ASP A 101 -7.979 12.183 -1.140 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -8.711 10.779 -3.161 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -9.978 11.358 -2.097 1.00 0.00 H new ATOM 1532 N GLY A 102 -6.258 11.539 -3.084 1.00 0.00 N ATOM 1533 CA GLY A 102 -5.022 11.502 -3.844 1.00 0.00 C ATOM 1534 C GLY A 102 -5.040 10.452 -4.935 1.00 0.00 C ATOM 1535 O GLY A 102 -5.976 9.658 -5.046 1.00 0.00 O ATOM 0 H GLY A 102 -6.546 10.643 -2.690 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.845 12.481 -4.290 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.190 11.304 -3.168 1.00 0.00 H new ATOM 1539 N PRO A 103 -3.989 10.439 -5.768 1.00 0.00 N ATOM 1540 CA PRO A 103 -3.866 9.483 -6.872 1.00 0.00 C ATOM 1541 C PRO A 103 -3.622 8.060 -6.383 1.00 0.00 C ATOM 1542 O PRO A 103 -2.988 7.848 -5.348 1.00 0.00 O ATOM 1543 CB PRO A 103 -2.653 9.995 -7.652 1.00 0.00 C ATOM 1544 CG PRO A 103 -1.848 10.747 -6.649 1.00 0.00 C ATOM 1545 CD PRO A 103 -2.839 11.355 -5.694 1.00 0.00 C ATOM 0 HA PRO A 103 -4.779 9.427 -7.465 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -2.082 9.172 -8.081 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -2.956 10.638 -8.479 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -1.158 10.084 -6.126 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -1.246 11.518 -7.130 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -2.438 11.415 -4.682 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -3.112 12.368 -5.989 1.00 0.00 H new ATOM 1553 N LEU A 104 -4.127 7.086 -7.132 1.00 0.00 N ATOM 1554 CA LEU A 104 -3.963 5.680 -6.774 1.00 0.00 C ATOM 1555 C LEU A 104 -2.583 5.174 -7.181 1.00 0.00 C ATOM 1556 O LEU A 104 -1.891 5.801 -7.984 1.00 0.00 O ATOM 1557 CB LEU A 104 -5.047 4.835 -7.442 1.00 0.00 C ATOM 1558 CG LEU A 104 -6.471 5.034 -6.920 1.00 0.00 C ATOM 1559 CD1 LEU A 104 -7.454 5.130 -8.077 1.00 0.00 C ATOM 1560 CD2 LEU A 104 -6.858 3.901 -5.981 1.00 0.00 C ATOM 0 H LEU A 104 -4.654 7.243 -7.991 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.058 5.591 -5.692 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.040 5.050 -8.511 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.783 3.784 -7.326 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.506 5.969 -6.361 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.462 5.271 -7.687 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.188 5.976 -8.711 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.417 4.212 -8.663 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.874 4.059 -5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.806 2.952 -6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.171 3.879 -5.135 1.00 0.00 H new ATOM 1572 N SER A 105 -2.191 4.032 -6.624 1.00 0.00 N ATOM 1573 CA SER A 105 -0.891 3.441 -6.928 1.00 0.00 C ATOM 1574 C SER A 105 -0.985 2.522 -8.142 1.00 0.00 C ATOM 1575 O SER A 105 -2.000 2.495 -8.838 1.00 0.00 O ATOM 1576 CB SER A 105 -0.370 2.660 -5.722 1.00 0.00 C ATOM 1577 OG SER A 105 -0.819 1.315 -5.750 1.00 0.00 O ATOM 0 H SER A 105 -2.753 3.498 -5.961 1.00 0.00 H new ATOM 0 HA SER A 105 -0.195 4.248 -7.157 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.720 2.682 -5.714 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.706 3.139 -4.802 1.00 0.00 H new ATOM 0 HG SER A 105 -0.470 0.837 -4.969 1.00 0.00 H new ATOM 1583 N SER A 106 0.083 1.769 -8.390 1.00 0.00 N ATOM 1584 CA SER A 106 0.125 0.852 -9.522 1.00 0.00 C ATOM 1585 C SER A 106 -0.680 -0.409 -9.228 1.00 0.00 C ATOM 1586 O SER A 106 -0.414 -1.118 -8.257 1.00 0.00 O ATOM 1587 CB SER A 106 1.572 0.481 -9.852 1.00 0.00 C ATOM 1588 OG SER A 106 2.366 0.432 -8.679 1.00 0.00 O ATOM 0 H SER A 106 0.930 1.777 -7.822 1.00 0.00 H new ATOM 0 HA SER A 106 -0.319 1.354 -10.382 1.00 0.00 H new ATOM 0 HB2 SER A 106 1.597 -0.487 -10.353 1.00 0.00 H new ATOM 0 HB3 SER A 106 1.988 1.210 -10.547 1.00 0.00 H new ATOM 0 HG SER A 106 3.286 0.191 -8.916 1.00 0.00 H new ATOM 1594 N ASP A 107 -1.666 -0.685 -10.075 1.00 0.00 N ATOM 1595 CA ASP A 107 -2.511 -1.861 -9.909 1.00 0.00 C ATOM 1596 C ASP A 107 -1.666 -3.121 -9.760 1.00 0.00 C ATOM 1597 O ASP A 107 -1.014 -3.560 -10.709 1.00 0.00 O ATOM 1598 CB ASP A 107 -3.460 -2.007 -11.100 1.00 0.00 C ATOM 1599 CG ASP A 107 -4.255 -0.744 -11.366 1.00 0.00 C ATOM 1600 OD1 ASP A 107 -3.638 0.279 -11.731 1.00 0.00 O ATOM 1601 OD2 ASP A 107 -5.494 -0.778 -11.208 1.00 0.00 O ATOM 0 H ASP A 107 -1.899 -0.109 -10.884 1.00 0.00 H new ATOM 0 HA ASP A 107 -3.098 -1.729 -9.000 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -2.885 -2.265 -11.989 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -4.147 -2.833 -10.914 1.00 0.00 H new ATOM 1606 N ILE A 108 -1.680 -3.699 -8.563 1.00 0.00 N ATOM 1607 CA ILE A 108 -0.913 -4.908 -8.290 1.00 0.00 C ATOM 1608 C ILE A 108 -1.832 -6.113 -8.114 1.00 0.00 C ATOM 1609 O ILE A 108 -2.979 -5.974 -7.690 1.00 0.00 O ATOM 1610 CB ILE A 108 -0.044 -4.751 -7.029 1.00 0.00 C ATOM 1611 CG1 ILE A 108 -0.888 -4.239 -5.861 1.00 0.00 C ATOM 1612 CG2 ILE A 108 1.119 -3.809 -7.302 1.00 0.00 C ATOM 1613 CD1 ILE A 108 -0.260 -4.484 -4.507 1.00 0.00 C ATOM 0 H ILE A 108 -2.214 -3.349 -7.767 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.264 -5.071 -9.150 1.00 0.00 H new ATOM 0 HB ILE A 108 0.359 -5.727 -6.760 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.056 -3.169 -5.986 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.865 -4.721 -5.891 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.724 -3.708 -6.401 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.732 -4.212 -8.108 1.00 0.00 H new ATOM 0 HG23 ILE A 108 0.735 -2.831 -7.593 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.914 -4.095 -3.727 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.117 -5.555 -4.360 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.705 -3.979 -4.457 1.00 0.00 H new ATOM 1625 N GLN A 109 -1.319 -7.294 -8.442 1.00 0.00 N ATOM 1626 CA GLN A 109 -2.092 -8.523 -8.319 1.00 0.00 C ATOM 1627 C GLN A 109 -1.335 -9.565 -7.501 1.00 0.00 C ATOM 1628 O GLN A 109 -0.135 -9.762 -7.688 1.00 0.00 O ATOM 1629 CB GLN A 109 -2.421 -9.085 -9.703 1.00 0.00 C ATOM 1630 CG GLN A 109 -3.329 -8.185 -10.525 1.00 0.00 C ATOM 1631 CD GLN A 109 -3.007 -8.226 -12.006 1.00 0.00 C ATOM 1632 OE1 GLN A 109 -2.143 -8.986 -12.443 1.00 0.00 O ATOM 1633 NE2 GLN A 109 -3.702 -7.406 -12.786 1.00 0.00 N ATOM 0 H GLN A 109 -0.371 -7.425 -8.795 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.021 -8.286 -7.800 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -1.492 -9.247 -10.250 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -2.897 -10.059 -9.587 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -4.366 -8.486 -10.374 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -3.239 -7.160 -10.166 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -4.409 -6.793 -12.380 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -3.529 -7.389 -13.791 1.00 0.00 H new ATOM 1642 N VAL A 110 -2.045 -10.229 -6.595 1.00 0.00 N ATOM 1643 CA VAL A 110 -1.439 -11.251 -5.749 1.00 0.00 C ATOM 1644 C VAL A 110 -2.303 -12.506 -5.700 1.00 0.00 C ATOM 1645 O VAL A 110 -3.514 -12.431 -5.485 1.00 0.00 O ATOM 1646 CB VAL A 110 -1.220 -10.735 -4.315 1.00 0.00 C ATOM 1647 CG1 VAL A 110 -2.527 -10.230 -3.723 1.00 0.00 C ATOM 1648 CG2 VAL A 110 -0.617 -11.827 -3.443 1.00 0.00 C ATOM 0 H VAL A 110 -3.040 -10.078 -6.428 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.473 -11.496 -6.190 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.519 -9.901 -4.351 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.352 -9.869 -2.709 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.914 -9.416 -4.336 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.253 -11.042 -3.699 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.469 -11.446 -2.433 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.292 -12.682 -3.412 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.342 -12.136 -3.858 1.00 0.00 H new ATOM 1658 N ILE A 111 -1.674 -13.660 -5.898 1.00 0.00 N ATOM 1659 CA ILE A 111 -2.385 -14.932 -5.875 1.00 0.00 C ATOM 1660 C ILE A 111 -2.457 -15.495 -4.459 1.00 0.00 C ATOM 1661 O ILE A 111 -1.447 -15.579 -3.759 1.00 0.00 O ATOM 1662 CB ILE A 111 -1.715 -15.969 -6.794 1.00 0.00 C ATOM 1663 CG1 ILE A 111 -1.727 -15.481 -8.244 1.00 0.00 C ATOM 1664 CG2 ILE A 111 -2.416 -17.313 -6.677 1.00 0.00 C ATOM 1665 CD1 ILE A 111 -0.412 -15.692 -8.964 1.00 0.00 C ATOM 0 H ILE A 111 -0.673 -13.740 -6.076 1.00 0.00 H new ATOM 0 HA ILE A 111 -3.394 -14.736 -6.238 1.00 0.00 H new ATOM 0 HB ILE A 111 -0.679 -16.094 -6.480 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -2.517 -16.000 -8.787 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -1.974 -14.420 -8.260 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -1.930 -18.035 -7.333 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.360 -17.664 -5.647 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.461 -17.205 -6.967 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -0.494 -15.323 -9.986 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.378 -15.150 -8.445 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -0.173 -16.755 -8.980 1.00 0.00 H new ATOM 1677 N THR A 112 -3.659 -15.883 -4.043 1.00 0.00 N ATOM 1678 CA THR A 112 -3.864 -16.439 -2.711 1.00 0.00 C ATOM 1679 C THR A 112 -3.218 -17.814 -2.585 1.00 0.00 C ATOM 1680 O THR A 112 -3.840 -18.832 -2.888 1.00 0.00 O ATOM 1681 CB THR A 112 -5.362 -16.556 -2.375 1.00 0.00 C ATOM 1682 OG1 THR A 112 -6.057 -17.197 -3.450 1.00 0.00 O ATOM 1683 CG2 THR A 112 -5.967 -15.184 -2.120 1.00 0.00 C ATOM 0 H THR A 112 -4.505 -15.822 -4.609 1.00 0.00 H new ATOM 0 HA THR A 112 -3.394 -15.753 -2.006 1.00 0.00 H new ATOM 0 HB THR A 112 -5.463 -17.155 -1.470 1.00 0.00 H new ATOM 0 HG1 THR A 112 -6.884 -17.599 -3.111 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.026 -15.291 -1.885 1.00 0.00 H new ATOM 0 HG22 THR A 112 -5.455 -14.711 -1.282 1.00 0.00 H new ATOM 0 HG23 THR A 112 -5.854 -14.565 -3.010 1.00 0.00 H new ATOM 1691 N GLN A 113 -1.967 -17.836 -2.134 1.00 0.00 N ATOM 1692 CA GLN A 113 -1.238 -19.087 -1.967 1.00 0.00 C ATOM 1693 C GLN A 113 -0.191 -18.965 -0.866 1.00 0.00 C ATOM 1694 O GLN A 113 0.421 -17.911 -0.691 1.00 0.00 O ATOM 1695 CB GLN A 113 -0.568 -19.490 -3.282 1.00 0.00 C ATOM 1696 CG GLN A 113 0.521 -18.530 -3.729 1.00 0.00 C ATOM 1697 CD GLN A 113 1.304 -19.048 -4.920 1.00 0.00 C ATOM 1698 OE1 GLN A 113 2.452 -19.472 -4.787 1.00 0.00 O ATOM 1699 NE2 GLN A 113 0.685 -19.016 -6.093 1.00 0.00 N ATOM 0 H GLN A 113 -1.438 -17.002 -1.878 1.00 0.00 H new ATOM 0 HA GLN A 113 -1.952 -19.859 -1.679 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -0.140 -20.486 -3.171 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -1.327 -19.554 -4.062 1.00 0.00 H new ATOM 0 HG2 GLN A 113 0.072 -17.570 -3.984 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.205 -18.351 -2.899 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -0.267 -18.656 -6.157 1.00 0.00 H new ATOM 0 HE22 GLN A 113 1.161 -19.351 -6.930 1.00 0.00 H new ATOM 1708 N THR A 114 0.012 -20.050 -0.125 1.00 0.00 N ATOM 1709 CA THR A 114 0.983 -20.064 0.961 1.00 0.00 C ATOM 1710 C THR A 114 2.278 -20.743 0.532 1.00 0.00 C ATOM 1711 O THR A 114 2.851 -21.539 1.274 1.00 0.00 O ATOM 1712 CB THR A 114 0.428 -20.786 2.204 1.00 0.00 C ATOM 1713 OG1 THR A 114 0.237 -22.176 1.919 1.00 0.00 O ATOM 1714 CG2 THR A 114 -0.891 -20.167 2.643 1.00 0.00 C ATOM 0 H THR A 114 -0.484 -20.931 -0.258 1.00 0.00 H new ATOM 0 HA THR A 114 1.186 -19.024 1.214 1.00 0.00 H new ATOM 0 HB THR A 114 1.150 -20.678 3.013 1.00 0.00 H new ATOM 0 HG1 THR A 114 -0.114 -22.628 2.715 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.265 -20.692 3.522 1.00 0.00 H new ATOM 0 HG22 THR A 114 -0.736 -19.116 2.887 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.618 -20.249 1.835 1.00 0.00 H new ATOM 1722 N GLY A 115 2.738 -20.421 -0.676 1.00 0.00 N ATOM 1723 CA GLY A 115 3.964 -21.008 -1.183 1.00 0.00 C ATOM 1724 C GLY A 115 4.896 -19.977 -1.786 1.00 0.00 C ATOM 1725 O GLY A 115 4.461 -19.093 -2.525 1.00 0.00 O ATOM 0 H GLY A 115 2.283 -19.765 -1.310 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.477 -21.526 -0.373 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.720 -21.757 -1.936 1.00 0.00 H new ATOM 1729 N SER A 116 6.182 -20.085 -1.467 1.00 0.00 N ATOM 1730 CA SER A 116 7.176 -19.148 -1.977 1.00 0.00 C ATOM 1731 C SER A 116 6.856 -17.723 -1.539 1.00 0.00 C ATOM 1732 O SER A 116 5.817 -17.466 -0.934 1.00 0.00 O ATOM 1733 CB SER A 116 7.242 -19.223 -3.504 1.00 0.00 C ATOM 1734 OG SER A 116 6.848 -20.502 -3.970 1.00 0.00 O ATOM 0 H SER A 116 6.560 -20.811 -0.858 1.00 0.00 H new ATOM 0 HA SER A 116 8.146 -19.426 -1.564 1.00 0.00 H new ATOM 0 HB2 SER A 116 6.595 -18.460 -3.937 1.00 0.00 H new ATOM 0 HB3 SER A 116 8.257 -19.008 -3.838 1.00 0.00 H new ATOM 0 HG SER A 116 6.897 -20.523 -4.949 1.00 0.00 H new ATOM 1740 N GLY A 117 7.762 -16.798 -1.850 1.00 0.00 N ATOM 1741 CA GLY A 117 7.559 -15.409 -1.480 1.00 0.00 C ATOM 1742 C GLY A 117 7.330 -14.517 -2.684 1.00 0.00 C ATOM 1743 O GLY A 117 7.210 -14.985 -3.816 1.00 0.00 O ATOM 0 H GLY A 117 8.631 -16.986 -2.350 1.00 0.00 H new ATOM 0 HA2 GLY A 117 6.703 -15.336 -0.809 1.00 0.00 H new ATOM 0 HA3 GLY A 117 8.428 -15.052 -0.927 1.00 0.00 H new ATOM 1747 N PRO A 118 7.262 -13.199 -2.444 1.00 0.00 N ATOM 1748 CA PRO A 118 7.045 -12.212 -3.505 1.00 0.00 C ATOM 1749 C PRO A 118 8.248 -12.082 -4.432 1.00 0.00 C ATOM 1750 O PRO A 118 9.233 -12.806 -4.291 1.00 0.00 O ATOM 1751 CB PRO A 118 6.820 -10.908 -2.736 1.00 0.00 C ATOM 1752 CG PRO A 118 7.523 -11.108 -1.438 1.00 0.00 C ATOM 1753 CD PRO A 118 7.396 -12.572 -1.119 1.00 0.00 C ATOM 0 HA PRO A 118 6.215 -12.489 -4.155 1.00 0.00 H new ATOM 0 HB2 PRO A 118 7.225 -10.054 -3.278 1.00 0.00 H new ATOM 0 HB3 PRO A 118 5.758 -10.715 -2.585 1.00 0.00 H new ATOM 0 HG2 PRO A 118 8.570 -10.814 -1.512 1.00 0.00 H new ATOM 0 HG3 PRO A 118 7.075 -10.498 -0.654 1.00 0.00 H new ATOM 0 HD2 PRO A 118 8.270 -12.944 -0.585 1.00 0.00 H new ATOM 0 HD3 PRO A 118 6.529 -12.773 -0.490 1.00 0.00 H new ATOM 1761 N SER A 119 8.161 -11.155 -5.381 1.00 0.00 N ATOM 1762 CA SER A 119 9.242 -10.933 -6.334 1.00 0.00 C ATOM 1763 C SER A 119 9.522 -12.196 -7.142 1.00 0.00 C ATOM 1764 O SER A 119 8.833 -13.205 -6.995 1.00 0.00 O ATOM 1765 CB SER A 119 10.511 -10.489 -5.604 1.00 0.00 C ATOM 1766 OG SER A 119 11.058 -9.323 -6.194 1.00 0.00 O ATOM 0 H SER A 119 7.353 -10.546 -5.510 1.00 0.00 H new ATOM 0 HA SER A 119 8.932 -10.145 -7.020 1.00 0.00 H new ATOM 0 HB2 SER A 119 10.283 -10.297 -4.556 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.248 -11.292 -5.628 1.00 0.00 H new ATOM 0 HG SER A 119 11.867 -9.059 -5.708 1.00 0.00 H new ATOM 1772 N SER A 120 10.537 -12.131 -7.997 1.00 0.00 N ATOM 1773 CA SER A 120 10.908 -13.268 -8.833 1.00 0.00 C ATOM 1774 C SER A 120 12.423 -13.433 -8.885 1.00 0.00 C ATOM 1775 O SER A 120 13.168 -12.606 -8.362 1.00 0.00 O ATOM 1776 CB SER A 120 10.354 -13.089 -10.248 1.00 0.00 C ATOM 1777 OG SER A 120 9.015 -12.623 -10.217 1.00 0.00 O ATOM 0 H SER A 120 11.118 -11.303 -8.130 1.00 0.00 H new ATOM 0 HA SER A 120 10.477 -14.167 -8.393 1.00 0.00 H new ATOM 0 HB2 SER A 120 10.975 -12.383 -10.798 1.00 0.00 H new ATOM 0 HB3 SER A 120 10.400 -14.038 -10.783 1.00 0.00 H new ATOM 0 HG SER A 120 8.685 -12.515 -11.133 1.00 0.00 H new ATOM 1783 N GLY A 121 12.873 -14.510 -9.522 1.00 0.00 N ATOM 1784 CA GLY A 121 14.297 -14.766 -9.631 1.00 0.00 C ATOM 1785 C GLY A 121 14.895 -14.191 -10.901 1.00 0.00 C ATOM 1786 O GLY A 121 14.379 -14.418 -11.994 1.00 0.00 O ATOM 0 H GLY A 121 12.277 -15.209 -9.964 1.00 0.00 H new ATOM 0 HA2 GLY A 121 14.807 -14.339 -8.767 1.00 0.00 H new ATOM 0 HA3 GLY A 121 14.473 -15.841 -9.605 1.00 0.00 H new TER 1790 GLY A 121