USER MOD reduce.3.24.130724 H: found=0, std=0, add=937, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 939 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 100 SER OG : rot -64:sc= 0.00568 USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= 0.00561 USER MOD Set 1.3: A 111 ASN : amide:sc= -0.0943 X(o=-0.083,f=-0.39) USER MOD Set 1.4: A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 81 THR OG1 : rot -115:sc= 1.17 USER MOD Set 2.2: A 93 THR OG1 : rot 110:sc= 0.983 USER MOD Set 3.1: A 47 HIS : no HD1:sc=-0.00275 X(o=-0.0027,f=0) USER MOD Set 3.2: A 64 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 51 THR OG1 : rot 180:sc= 0.00145 USER MOD Set 4.2: A 60 GLN : amide:sc= 0.00182 X(o=0.0033,f=-0.14) USER MOD Set 5.1: A 30 GLN : amide:sc= 0.036 X(o=0.16,f=-0.11) USER MOD Set 5.2: A 33 LYS NZ :NH3+ 148:sc= 0.129 (180deg=0) USER MOD Set 6.1: A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 6.2: A 10 GLN : amide:sc= 0 X(o=0,f=0.029) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.0094) USER MOD Single : A 7 TYR OH : rot 180:sc= -0.0177 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 14 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0.141 X(o=0.14,f=-0.19) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -129:sc= 0.00769 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 69 CYS SG : rot 63:sc= 1.4 USER MOD Single : A 78 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.047) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.62) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.0378) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.699) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 27:sc= -0.0864 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 12 N PHE A 3 9.543 -9.575 -1.628 1.00 0.00 N ATOM 13 CA PHE A 3 8.437 -8.663 -1.207 1.00 0.00 C ATOM 14 C PHE A 3 8.307 -8.336 0.318 1.00 0.00 C ATOM 15 O PHE A 3 7.567 -7.403 0.641 1.00 0.00 O ATOM 16 CB PHE A 3 7.088 -9.220 -1.736 1.00 0.00 C ATOM 17 CG PHE A 3 6.802 -9.015 -3.231 1.00 0.00 C ATOM 18 CD1 PHE A 3 6.185 -7.838 -3.672 1.00 0.00 C ATOM 19 CD2 PHE A 3 7.078 -10.034 -4.150 1.00 0.00 C ATOM 20 CE1 PHE A 3 5.849 -7.688 -5.015 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.734 -9.879 -5.488 1.00 0.00 C ATOM 22 CZ PHE A 3 6.117 -8.708 -5.919 1.00 0.00 C ATOM 0 HA PHE A 3 8.704 -7.704 -1.651 1.00 0.00 H new ATOM 0 HB2 PHE A 3 7.054 -10.289 -1.525 1.00 0.00 H new ATOM 0 HB3 PHE A 3 6.281 -8.757 -1.168 1.00 0.00 H new ATOM 0 HD1 PHE A 3 5.970 -7.046 -2.970 1.00 0.00 H new ATOM 0 HD2 PHE A 3 7.559 -10.942 -3.819 1.00 0.00 H new ATOM 0 HE1 PHE A 3 5.379 -6.777 -5.354 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.946 -10.668 -6.194 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.846 -8.592 -6.958 1.00 0.00 H new ATOM 32 N SER A 4 8.990 -9.045 1.244 1.00 0.00 N ATOM 33 CA SER A 4 8.913 -8.759 2.701 1.00 0.00 C ATOM 34 C SER A 4 9.758 -7.504 3.072 1.00 0.00 C ATOM 35 O SER A 4 10.988 -7.514 2.941 1.00 0.00 O ATOM 36 CB SER A 4 9.367 -9.995 3.510 1.00 0.00 C ATOM 37 OG SER A 4 8.504 -11.106 3.291 1.00 0.00 O ATOM 0 H SER A 4 9.605 -9.824 1.010 1.00 0.00 H new ATOM 0 HA SER A 4 7.876 -8.541 2.956 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.385 -10.262 3.228 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.385 -9.750 4.572 1.00 0.00 H new ATOM 0 HG SER A 4 8.818 -11.872 3.815 1.00 0.00 H new ATOM 43 N GLY A 5 9.079 -6.432 3.519 1.00 0.00 N ATOM 44 CA GLY A 5 9.751 -5.176 3.912 1.00 0.00 C ATOM 45 C GLY A 5 8.796 -3.979 4.116 1.00 0.00 C ATOM 46 O GLY A 5 7.619 -3.990 3.741 1.00 0.00 O ATOM 0 H GLY A 5 8.064 -6.409 3.618 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.303 -5.347 4.837 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.483 -4.915 3.148 1.00 0.00 H new ATOM 50 N LYS A 6 9.379 -2.914 4.689 1.00 0.00 N ATOM 51 CA LYS A 6 8.727 -1.581 4.814 1.00 0.00 C ATOM 52 C LYS A 6 9.114 -0.730 3.575 1.00 0.00 C ATOM 53 O LYS A 6 10.303 -0.527 3.319 1.00 0.00 O ATOM 54 CB LYS A 6 9.213 -0.862 6.104 1.00 0.00 C ATOM 55 CG LYS A 6 8.675 -1.435 7.431 1.00 0.00 C ATOM 56 CD LYS A 6 9.201 -0.673 8.665 1.00 0.00 C ATOM 57 CE LYS A 6 8.640 -1.170 10.011 1.00 0.00 C ATOM 58 NZ LYS A 6 7.215 -0.836 10.205 1.00 0.00 N ATOM 0 H LYS A 6 10.319 -2.943 5.083 1.00 0.00 H new ATOM 0 HA LYS A 6 7.646 -1.706 4.871 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.302 -0.897 6.129 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.929 0.189 6.041 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.586 -1.398 7.423 1.00 0.00 H new ATOM 0 HG3 LYS A 6 8.957 -2.485 7.510 1.00 0.00 H new ATOM 0 HD2 LYS A 6 10.288 -0.751 8.688 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.960 0.384 8.553 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.765 -2.251 10.073 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.223 -0.735 10.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.987 -0.863 11.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.028 0.117 9.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 6.625 -1.527 9.699 1.00 0.00 H new ATOM 72 N TYR A 7 8.123 -0.235 2.812 1.00 0.00 N ATOM 73 CA TYR A 7 8.387 0.516 1.552 1.00 0.00 C ATOM 74 C TYR A 7 7.869 1.962 1.756 1.00 0.00 C ATOM 75 O TYR A 7 6.673 2.233 1.618 1.00 0.00 O ATOM 76 CB TYR A 7 7.775 -0.175 0.300 1.00 0.00 C ATOM 77 CG TYR A 7 8.277 -1.599 -0.017 1.00 0.00 C ATOM 78 CD1 TYR A 7 7.681 -2.711 0.588 1.00 0.00 C ATOM 79 CD2 TYR A 7 9.308 -1.798 -0.944 1.00 0.00 C ATOM 80 CE1 TYR A 7 8.120 -3.998 0.288 1.00 0.00 C ATOM 81 CE2 TYR A 7 9.717 -3.087 -1.271 1.00 0.00 C ATOM 82 CZ TYR A 7 9.135 -4.186 -0.647 1.00 0.00 C ATOM 83 OH TYR A 7 9.579 -5.448 -0.938 1.00 0.00 O ATOM 0 H TYR A 7 7.133 -0.336 3.037 1.00 0.00 H new ATOM 0 HA TYR A 7 9.458 0.534 1.348 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.693 -0.216 0.428 1.00 0.00 H new ATOM 0 HB3 TYR A 7 7.970 0.456 -0.567 1.00 0.00 H new ATOM 0 HD1 TYR A 7 6.875 -2.570 1.293 1.00 0.00 H new ATOM 0 HD2 TYR A 7 9.787 -0.948 -1.407 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.674 -4.850 0.780 1.00 0.00 H new ATOM 0 HE2 TYR A 7 10.489 -3.235 -2.012 1.00 0.00 H new ATOM 0 HH TYR A 7 10.289 -5.398 -1.612 1.00 0.00 H new ATOM 93 N GLN A 8 8.785 2.884 2.106 1.00 0.00 N ATOM 94 CA GLN A 8 8.424 4.264 2.533 1.00 0.00 C ATOM 95 C GLN A 8 8.416 5.224 1.310 1.00 0.00 C ATOM 96 O GLN A 8 9.410 5.327 0.589 1.00 0.00 O ATOM 97 CB GLN A 8 9.396 4.682 3.672 1.00 0.00 C ATOM 98 CG GLN A 8 9.064 5.991 4.430 1.00 0.00 C ATOM 99 CD GLN A 8 9.608 7.273 3.778 1.00 0.00 C ATOM 100 OE1 GLN A 8 10.818 7.473 3.666 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.736 8.172 3.354 1.00 0.00 N ATOM 0 H GLN A 8 9.789 2.704 2.104 1.00 0.00 H new ATOM 0 HA GLN A 8 7.411 4.312 2.933 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.437 3.870 4.398 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.395 4.780 3.247 1.00 0.00 H new ATOM 0 HG2 GLN A 8 7.981 6.077 4.519 1.00 0.00 H new ATOM 0 HG3 GLN A 8 9.462 5.918 5.442 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.736 7.998 3.451 1.00 0.00 H new ATOM 0 HE22 GLN A 8 9.064 9.040 2.930 1.00 0.00 H new ATOM 110 N LEU A 9 7.282 5.926 1.106 1.00 0.00 N ATOM 111 CA LEU A 9 7.000 6.713 -0.127 1.00 0.00 C ATOM 112 C LEU A 9 7.955 7.926 -0.331 1.00 0.00 C ATOM 113 O LEU A 9 7.956 8.887 0.443 1.00 0.00 O ATOM 114 CB LEU A 9 5.498 7.126 -0.103 1.00 0.00 C ATOM 115 CG LEU A 9 4.915 7.845 -1.357 1.00 0.00 C ATOM 116 CD1 LEU A 9 5.053 7.028 -2.654 1.00 0.00 C ATOM 117 CD2 LEU A 9 3.431 8.195 -1.116 1.00 0.00 C ATOM 0 H LEU A 9 6.528 5.967 1.792 1.00 0.00 H new ATOM 0 HA LEU A 9 7.197 6.084 -0.995 1.00 0.00 H new ATOM 0 HB2 LEU A 9 4.907 6.226 0.070 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.345 7.778 0.757 1.00 0.00 H new ATOM 0 HG LEU A 9 5.504 8.751 -1.497 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.626 7.590 -3.485 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.107 6.833 -2.851 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.523 6.081 -2.546 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.028 8.697 -1.995 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.867 7.281 -0.930 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.348 8.854 -0.252 1.00 0.00 H new ATOM 129 N GLN A 10 8.751 7.838 -1.406 1.00 0.00 N ATOM 130 CA GLN A 10 9.794 8.837 -1.759 1.00 0.00 C ATOM 131 C GLN A 10 9.215 9.894 -2.745 1.00 0.00 C ATOM 132 O GLN A 10 9.107 11.067 -2.377 1.00 0.00 O ATOM 133 CB GLN A 10 11.076 8.158 -2.327 1.00 0.00 C ATOM 134 CG GLN A 10 11.688 6.996 -1.523 1.00 0.00 C ATOM 135 CD GLN A 10 12.314 7.368 -0.170 1.00 0.00 C ATOM 136 OE1 GLN A 10 11.614 7.588 0.818 1.00 0.00 O ATOM 137 NE2 GLN A 10 13.635 7.416 -0.092 1.00 0.00 N ATOM 0 H GLN A 10 8.695 7.065 -2.069 1.00 0.00 H new ATOM 0 HA GLN A 10 10.095 9.352 -0.846 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.845 7.789 -3.326 1.00 0.00 H new ATOM 0 HB3 GLN A 10 11.840 8.927 -2.440 1.00 0.00 H new ATOM 0 HG2 GLN A 10 10.911 6.252 -1.349 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.453 6.520 -2.136 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.202 7.231 -0.920 1.00 0.00 H new ATOM 0 HE22 GLN A 10 14.086 7.638 0.796 1.00 0.00 H new ATOM 146 N SER A 11 8.855 9.469 -3.978 1.00 0.00 N ATOM 147 CA SER A 11 8.348 10.364 -5.047 1.00 0.00 C ATOM 148 C SER A 11 6.937 9.876 -5.469 1.00 0.00 C ATOM 149 O SER A 11 6.766 8.765 -5.981 1.00 0.00 O ATOM 150 CB SER A 11 9.324 10.379 -6.245 1.00 0.00 C ATOM 151 OG SER A 11 10.568 10.967 -5.882 1.00 0.00 O ATOM 0 H SER A 11 8.908 8.491 -4.262 1.00 0.00 H new ATOM 0 HA SER A 11 8.276 11.387 -4.679 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.488 9.361 -6.598 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.882 10.935 -7.072 1.00 0.00 H new ATOM 0 HG SER A 11 11.170 10.964 -6.656 1.00 0.00 H new ATOM 157 N GLN A 12 5.940 10.746 -5.247 1.00 0.00 N ATOM 158 CA GLN A 12 4.527 10.513 -5.635 1.00 0.00 C ATOM 159 C GLN A 12 4.200 11.357 -6.898 1.00 0.00 C ATOM 160 O GLN A 12 4.464 12.564 -6.965 1.00 0.00 O ATOM 161 CB GLN A 12 3.567 10.813 -4.450 1.00 0.00 C ATOM 162 CG GLN A 12 3.600 12.247 -3.859 1.00 0.00 C ATOM 163 CD GLN A 12 2.829 12.470 -2.547 1.00 0.00 C ATOM 164 OE1 GLN A 12 1.904 13.278 -2.487 1.00 0.00 O ATOM 165 NE2 GLN A 12 3.197 11.802 -1.463 1.00 0.00 N ATOM 0 H GLN A 12 6.087 11.645 -4.788 1.00 0.00 H new ATOM 0 HA GLN A 12 4.381 9.462 -5.883 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.549 10.606 -4.779 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.791 10.111 -3.647 1.00 0.00 H new ATOM 0 HG2 GLN A 12 4.641 12.523 -3.693 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.204 12.933 -4.608 1.00 0.00 H new ATOM 0 HE21 GLN A 12 3.964 11.132 -1.513 1.00 0.00 H new ATOM 0 HE22 GLN A 12 2.713 11.958 -0.579 1.00 0.00 H new ATOM 174 N GLU A 13 3.610 10.681 -7.888 1.00 0.00 N ATOM 175 CA GLU A 13 3.265 11.280 -9.207 1.00 0.00 C ATOM 176 C GLU A 13 1.816 11.846 -9.182 1.00 0.00 C ATOM 177 O GLU A 13 1.656 13.070 -9.219 1.00 0.00 O ATOM 178 CB GLU A 13 3.578 10.254 -10.338 1.00 0.00 C ATOM 179 CG GLU A 13 3.700 10.813 -11.775 1.00 0.00 C ATOM 180 CD GLU A 13 2.376 11.146 -12.471 1.00 0.00 C ATOM 181 OE1 GLU A 13 1.764 10.234 -13.070 1.00 0.00 O ATOM 182 OE2 GLU A 13 1.948 12.319 -12.430 1.00 0.00 O ATOM 0 H GLU A 13 3.352 9.697 -7.810 1.00 0.00 H new ATOM 0 HA GLU A 13 3.887 12.148 -9.427 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.512 9.750 -10.090 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.795 9.495 -10.334 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.310 11.716 -11.744 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.237 10.086 -12.384 1.00 0.00 H new ATOM 189 N ASN A 14 0.786 10.977 -9.113 1.00 0.00 N ATOM 190 CA ASN A 14 -0.638 11.403 -9.055 1.00 0.00 C ATOM 191 C ASN A 14 -1.276 10.991 -7.696 1.00 0.00 C ATOM 192 O ASN A 14 -2.166 10.138 -7.641 1.00 0.00 O ATOM 193 CB ASN A 14 -1.372 10.832 -10.306 1.00 0.00 C ATOM 194 CG ASN A 14 -1.291 11.674 -11.599 1.00 0.00 C ATOM 195 OD1 ASN A 14 -1.128 12.894 -11.585 1.00 0.00 O ATOM 196 ND2 ASN A 14 -1.439 11.038 -12.750 1.00 0.00 N ATOM 0 H ASN A 14 0.911 9.965 -9.096 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.729 12.489 -9.092 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.966 9.843 -10.517 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.423 10.697 -10.052 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.418 11.559 -13.627 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.574 10.027 -12.760 1.00 0.00 H new ATOM 203 N PHE A 15 -0.855 11.650 -6.596 1.00 0.00 N ATOM 204 CA PHE A 15 -1.490 11.503 -5.254 1.00 0.00 C ATOM 205 C PHE A 15 -2.840 12.275 -5.172 1.00 0.00 C ATOM 206 O PHE A 15 -3.880 11.651 -4.958 1.00 0.00 O ATOM 207 CB PHE A 15 -0.447 11.920 -4.177 1.00 0.00 C ATOM 208 CG PHE A 15 -0.789 11.617 -2.705 1.00 0.00 C ATOM 209 CD1 PHE A 15 -1.583 12.500 -1.962 1.00 0.00 C ATOM 210 CD2 PHE A 15 -0.208 10.516 -2.064 1.00 0.00 C ATOM 211 CE1 PHE A 15 -1.797 12.275 -0.604 1.00 0.00 C ATOM 212 CE2 PHE A 15 -0.417 10.302 -0.702 1.00 0.00 C ATOM 213 CZ PHE A 15 -1.212 11.182 0.026 1.00 0.00 C ATOM 0 H PHE A 15 -0.068 12.299 -6.605 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.766 10.465 -5.068 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.496 11.427 -4.412 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.277 12.993 -4.270 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.030 13.357 -2.443 1.00 0.00 H new ATOM 0 HD2 PHE A 15 0.405 9.829 -2.628 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -2.420 12.952 -0.038 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.038 9.454 -0.212 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.375 11.016 1.081 1.00 0.00 H new ATOM 223 N GLU A 16 -2.814 13.611 -5.356 1.00 0.00 N ATOM 224 CA GLU A 16 -4.028 14.470 -5.373 1.00 0.00 C ATOM 225 C GLU A 16 -5.024 14.276 -6.560 1.00 0.00 C ATOM 226 O GLU A 16 -6.227 14.436 -6.343 1.00 0.00 O ATOM 227 CB GLU A 16 -3.628 15.955 -5.125 1.00 0.00 C ATOM 228 CG GLU A 16 -2.575 16.630 -6.042 1.00 0.00 C ATOM 229 CD GLU A 16 -3.047 16.954 -7.462 1.00 0.00 C ATOM 230 OE1 GLU A 16 -3.944 17.811 -7.625 1.00 0.00 O ATOM 231 OE2 GLU A 16 -2.521 16.351 -8.425 1.00 0.00 O ATOM 0 H GLU A 16 -1.949 14.132 -5.498 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.640 14.116 -4.544 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -4.539 16.551 -5.181 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -3.262 16.027 -4.101 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.245 17.554 -5.568 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -1.704 15.977 -6.107 1.00 0.00 H new ATOM 238 N ALA A 17 -4.562 13.905 -7.773 1.00 0.00 N ATOM 239 CA ALA A 17 -5.459 13.490 -8.890 1.00 0.00 C ATOM 240 C ALA A 17 -6.217 12.146 -8.662 1.00 0.00 C ATOM 241 O ALA A 17 -7.419 12.085 -8.928 1.00 0.00 O ATOM 242 CB ALA A 17 -4.650 13.455 -10.201 1.00 0.00 C ATOM 0 H ALA A 17 -3.570 13.882 -8.011 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.250 14.238 -8.945 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.300 13.152 -11.022 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.245 14.446 -10.405 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.831 12.742 -10.104 1.00 0.00 H new ATOM 248 N PHE A 18 -5.531 11.095 -8.162 1.00 0.00 N ATOM 249 CA PHE A 18 -6.156 9.787 -7.820 1.00 0.00 C ATOM 250 C PHE A 18 -7.137 9.865 -6.610 1.00 0.00 C ATOM 251 O PHE A 18 -8.297 9.480 -6.763 1.00 0.00 O ATOM 252 CB PHE A 18 -5.004 8.760 -7.624 1.00 0.00 C ATOM 253 CG PHE A 18 -5.400 7.293 -7.376 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.700 6.858 -6.078 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.390 6.366 -8.424 1.00 0.00 C ATOM 256 CE1 PHE A 18 -5.990 5.520 -5.835 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.673 5.026 -8.174 1.00 0.00 C ATOM 258 CZ PHE A 18 -5.976 4.605 -6.882 1.00 0.00 C ATOM 0 H PHE A 18 -4.527 11.124 -7.982 1.00 0.00 H new ATOM 0 HA PHE A 18 -6.801 9.462 -8.636 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.369 8.793 -8.509 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.396 9.092 -6.783 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.706 7.566 -5.262 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.162 6.691 -9.429 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.226 5.192 -4.834 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.657 4.312 -8.984 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.201 3.566 -6.693 1.00 0.00 H new ATOM 268 N MET A 19 -6.663 10.341 -5.439 1.00 0.00 N ATOM 269 CA MET A 19 -7.457 10.429 -4.179 1.00 0.00 C ATOM 270 C MET A 19 -8.741 11.304 -4.278 1.00 0.00 C ATOM 271 O MET A 19 -9.812 10.821 -3.903 1.00 0.00 O ATOM 272 CB MET A 19 -6.526 10.855 -3.013 1.00 0.00 C ATOM 273 CG MET A 19 -5.529 9.769 -2.567 1.00 0.00 C ATOM 274 SD MET A 19 -4.695 10.290 -1.056 1.00 0.00 S ATOM 275 CE MET A 19 -3.797 8.777 -0.660 1.00 0.00 C ATOM 0 H MET A 19 -5.707 10.681 -5.333 1.00 0.00 H new ATOM 0 HA MET A 19 -7.851 9.433 -3.978 1.00 0.00 H new ATOM 0 HB2 MET A 19 -5.968 11.742 -3.315 1.00 0.00 H new ATOM 0 HB3 MET A 19 -7.140 11.140 -2.159 1.00 0.00 H new ATOM 0 HG2 MET A 19 -6.053 8.828 -2.398 1.00 0.00 H new ATOM 0 HG3 MET A 19 -4.797 9.589 -3.354 1.00 0.00 H new ATOM 0 HE1 MET A 19 -3.223 8.924 0.255 1.00 0.00 H new ATOM 0 HE2 MET A 19 -4.505 7.961 -0.517 1.00 0.00 H new ATOM 0 HE3 MET A 19 -3.120 8.531 -1.478 1.00 0.00 H new ATOM 285 N LYS A 20 -8.663 12.536 -4.826 1.00 0.00 N ATOM 286 CA LYS A 20 -9.858 13.361 -5.162 1.00 0.00 C ATOM 287 C LYS A 20 -10.874 12.692 -6.145 1.00 0.00 C ATOM 288 O LYS A 20 -12.079 12.748 -5.878 1.00 0.00 O ATOM 289 CB LYS A 20 -9.355 14.749 -5.657 1.00 0.00 C ATOM 290 CG LYS A 20 -10.379 15.906 -5.665 1.00 0.00 C ATOM 291 CD LYS A 20 -11.266 16.004 -6.924 1.00 0.00 C ATOM 292 CE LYS A 20 -12.160 17.256 -6.916 1.00 0.00 C ATOM 293 NZ LYS A 20 -13.025 17.311 -8.108 1.00 0.00 N ATOM 0 H LYS A 20 -7.778 12.990 -5.049 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.455 13.474 -4.257 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.513 15.047 -5.032 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.972 14.629 -6.671 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.026 15.800 -4.794 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -9.839 16.846 -5.549 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.633 16.019 -7.811 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -11.892 15.114 -6.994 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.777 17.258 -6.017 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -11.536 18.149 -6.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -13.614 18.167 -8.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -12.435 17.334 -8.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -13.637 16.471 -8.132 1.00 0.00 H new ATOM 307 N ALA A 21 -10.409 12.053 -7.243 1.00 0.00 N ATOM 308 CA ALA A 21 -11.295 11.318 -8.191 1.00 0.00 C ATOM 309 C ALA A 21 -12.054 10.067 -7.641 1.00 0.00 C ATOM 310 O ALA A 21 -13.154 9.788 -8.129 1.00 0.00 O ATOM 311 CB ALA A 21 -10.464 10.943 -9.432 1.00 0.00 C ATOM 0 H ALA A 21 -9.422 12.029 -7.500 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.107 12.008 -8.419 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.092 10.403 -10.141 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.082 11.849 -9.902 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.628 10.310 -9.133 1.00 0.00 H new ATOM 317 N ILE A 22 -11.505 9.340 -6.645 1.00 0.00 N ATOM 318 CA ILE A 22 -12.217 8.220 -5.950 1.00 0.00 C ATOM 319 C ILE A 22 -13.196 8.730 -4.839 1.00 0.00 C ATOM 320 O ILE A 22 -14.357 8.310 -4.831 1.00 0.00 O ATOM 321 CB ILE A 22 -11.247 7.073 -5.483 1.00 0.00 C ATOM 322 CG1 ILE A 22 -10.118 7.519 -4.505 1.00 0.00 C ATOM 323 CG2 ILE A 22 -10.661 6.317 -6.701 1.00 0.00 C ATOM 324 CD1 ILE A 22 -9.263 6.411 -3.878 1.00 0.00 C ATOM 0 H ILE A 22 -10.561 9.503 -6.293 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.858 7.748 -6.695 1.00 0.00 H new ATOM 0 HB ILE A 22 -11.870 6.397 -4.898 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -9.454 8.197 -5.041 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.575 8.092 -3.698 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -9.993 5.529 -6.353 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -11.472 5.876 -7.280 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -10.104 7.013 -7.328 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.517 6.856 -3.220 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -9.901 5.741 -3.302 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.762 5.848 -4.666 1.00 0.00 H new ATOM 336 N GLY A 23 -12.744 9.623 -3.935 1.00 0.00 N ATOM 337 CA GLY A 23 -13.606 10.276 -2.925 1.00 0.00 C ATOM 338 C GLY A 23 -12.908 10.419 -1.559 1.00 0.00 C ATOM 339 O GLY A 23 -13.336 9.787 -0.588 1.00 0.00 O ATOM 0 H GLY A 23 -11.768 9.913 -3.884 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.899 11.262 -3.285 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.521 9.696 -2.803 1.00 0.00 H new ATOM 343 N LEU A 24 -11.859 11.261 -1.493 1.00 0.00 N ATOM 344 CA LEU A 24 -11.101 11.548 -0.246 1.00 0.00 C ATOM 345 C LEU A 24 -11.300 13.040 0.193 1.00 0.00 C ATOM 346 O LEU A 24 -11.496 13.909 -0.667 1.00 0.00 O ATOM 347 CB LEU A 24 -9.588 11.232 -0.462 1.00 0.00 C ATOM 348 CG LEU A 24 -9.034 9.828 -0.082 1.00 0.00 C ATOM 349 CD1 LEU A 24 -8.576 9.722 1.378 1.00 0.00 C ATOM 350 CD2 LEU A 24 -9.950 8.648 -0.441 1.00 0.00 C ATOM 0 H LEU A 24 -11.506 11.768 -2.305 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.482 10.911 0.552 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.368 11.395 -1.517 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.017 11.971 0.100 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.155 9.741 -0.720 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.202 8.716 1.570 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.782 10.446 1.564 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.417 9.929 2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.477 7.714 -0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.903 8.757 0.076 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -10.121 8.634 -1.517 1.00 0.00 H new ATOM 362 N PRO A 25 -11.205 13.397 1.511 1.00 0.00 N ATOM 363 CA PRO A 25 -11.293 14.803 1.981 1.00 0.00 C ATOM 364 C PRO A 25 -10.025 15.645 1.653 1.00 0.00 C ATOM 365 O PRO A 25 -8.916 15.111 1.566 1.00 0.00 O ATOM 366 CB PRO A 25 -11.478 14.621 3.502 1.00 0.00 C ATOM 367 CG PRO A 25 -10.811 13.292 3.858 1.00 0.00 C ATOM 368 CD PRO A 25 -10.892 12.439 2.591 1.00 0.00 C ATOM 0 HA PRO A 25 -12.094 15.360 1.494 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.021 15.445 4.051 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.535 14.609 3.767 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -9.776 13.443 4.164 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.322 12.807 4.690 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -9.951 11.922 2.401 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -11.664 11.674 2.678 1.00 0.00 H new ATOM 376 N GLU A 26 -10.192 16.976 1.557 1.00 0.00 N ATOM 377 CA GLU A 26 -9.042 17.929 1.480 1.00 0.00 C ATOM 378 C GLU A 26 -8.025 17.852 2.673 1.00 0.00 C ATOM 379 O GLU A 26 -6.829 18.036 2.439 1.00 0.00 O ATOM 380 CB GLU A 26 -9.582 19.369 1.261 1.00 0.00 C ATOM 381 CG GLU A 26 -8.518 20.403 0.822 1.00 0.00 C ATOM 382 CD GLU A 26 -9.101 21.804 0.612 1.00 0.00 C ATOM 383 OE1 GLU A 26 -9.154 22.589 1.586 1.00 0.00 O ATOM 384 OE2 GLU A 26 -9.508 22.127 -0.526 1.00 0.00 O ATOM 0 H GLU A 26 -11.106 17.427 1.530 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.443 17.621 0.623 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.368 19.336 0.507 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.042 19.714 2.187 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.732 20.451 1.576 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.051 20.066 -0.104 1.00 0.00 H new ATOM 391 N GLU A 27 -8.472 17.543 3.912 1.00 0.00 N ATOM 392 CA GLU A 27 -7.570 17.256 5.059 1.00 0.00 C ATOM 393 C GLU A 27 -6.632 16.029 4.836 1.00 0.00 C ATOM 394 O GLU A 27 -5.422 16.220 4.939 1.00 0.00 O ATOM 395 CB GLU A 27 -8.418 17.154 6.356 1.00 0.00 C ATOM 396 CG GLU A 27 -7.597 17.122 7.665 1.00 0.00 C ATOM 397 CD GLU A 27 -8.479 17.038 8.913 1.00 0.00 C ATOM 398 OE1 GLU A 27 -8.818 15.911 9.338 1.00 0.00 O ATOM 399 OE2 GLU A 27 -8.838 18.097 9.473 1.00 0.00 O ATOM 0 H GLU A 27 -9.463 17.485 4.148 1.00 0.00 H new ATOM 0 HA GLU A 27 -6.873 18.088 5.159 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.103 18.001 6.393 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.029 16.253 6.304 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -6.921 16.267 7.644 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -6.977 18.017 7.722 1.00 0.00 H new ATOM 406 N LEU A 28 -7.130 14.812 4.519 1.00 0.00 N ATOM 407 CA LEU A 28 -6.237 13.634 4.262 1.00 0.00 C ATOM 408 C LEU A 28 -5.381 13.653 2.951 1.00 0.00 C ATOM 409 O LEU A 28 -4.355 12.968 2.906 1.00 0.00 O ATOM 410 CB LEU A 28 -7.027 12.296 4.360 1.00 0.00 C ATOM 411 CG LEU A 28 -7.647 11.922 5.738 1.00 0.00 C ATOM 412 CD1 LEU A 28 -8.551 10.682 5.602 1.00 0.00 C ATOM 413 CD2 LEU A 28 -6.586 11.670 6.831 1.00 0.00 C ATOM 0 H LEU A 28 -8.126 14.610 4.433 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.500 13.716 5.061 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.833 12.328 3.627 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.358 11.489 4.063 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.237 12.783 6.052 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -8.977 10.434 6.574 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.355 10.893 4.897 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.962 9.840 5.238 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.082 11.414 7.767 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.938 10.848 6.527 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.988 12.570 6.972 1.00 0.00 H new ATOM 425 N ILE A 29 -5.757 14.429 1.916 1.00 0.00 N ATOM 426 CA ILE A 29 -4.922 14.656 0.699 1.00 0.00 C ATOM 427 C ILE A 29 -3.757 15.660 1.011 1.00 0.00 C ATOM 428 O ILE A 29 -2.594 15.342 0.758 1.00 0.00 O ATOM 429 CB ILE A 29 -5.800 15.088 -0.534 1.00 0.00 C ATOM 430 CG1 ILE A 29 -6.962 14.100 -0.853 1.00 0.00 C ATOM 431 CG2 ILE A 29 -4.933 15.273 -1.806 1.00 0.00 C ATOM 432 CD1 ILE A 29 -8.045 14.628 -1.808 1.00 0.00 C ATOM 0 H ILE A 29 -6.650 14.922 1.891 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.458 13.712 0.413 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.247 16.038 -0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.536 13.194 -1.283 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.439 13.814 0.085 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.569 15.571 -2.640 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.184 16.044 -1.627 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.436 14.334 -2.047 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.803 13.859 -1.960 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.509 15.515 -1.377 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.592 14.885 -2.766 1.00 0.00 H new ATOM 444 N GLN A 30 -4.080 16.863 1.520 1.00 0.00 N ATOM 445 CA GLN A 30 -3.085 17.939 1.793 1.00 0.00 C ATOM 446 C GLN A 30 -2.203 17.748 3.070 1.00 0.00 C ATOM 447 O GLN A 30 -1.063 18.220 3.090 1.00 0.00 O ATOM 448 CB GLN A 30 -3.819 19.313 1.844 1.00 0.00 C ATOM 449 CG GLN A 30 -4.615 19.760 0.590 1.00 0.00 C ATOM 450 CD GLN A 30 -3.792 19.942 -0.698 1.00 0.00 C ATOM 451 OE1 GLN A 30 -3.133 20.963 -0.896 1.00 0.00 O ATOM 452 NE2 GLN A 30 -3.820 18.973 -1.601 1.00 0.00 N ATOM 0 H GLN A 30 -5.037 17.126 1.757 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.374 17.892 0.968 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.509 19.292 2.688 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -3.076 20.081 2.059 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -5.396 19.025 0.398 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -5.113 20.703 0.816 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -4.369 18.131 -1.428 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -3.293 19.069 -2.469 1.00 0.00 H new ATOM 461 N LYS A 31 -2.709 17.061 4.112 1.00 0.00 N ATOM 462 CA LYS A 31 -1.890 16.596 5.266 1.00 0.00 C ATOM 463 C LYS A 31 -1.096 15.291 4.938 1.00 0.00 C ATOM 464 O LYS A 31 0.098 15.232 5.242 1.00 0.00 O ATOM 465 CB LYS A 31 -2.807 16.438 6.509 1.00 0.00 C ATOM 466 CG LYS A 31 -2.076 16.436 7.867 1.00 0.00 C ATOM 467 CD LYS A 31 -3.023 16.106 9.038 1.00 0.00 C ATOM 468 CE LYS A 31 -2.320 16.159 10.405 1.00 0.00 C ATOM 469 NZ LYS A 31 -3.253 15.840 11.500 1.00 0.00 N ATOM 0 H LYS A 31 -3.695 16.809 4.185 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.131 17.346 5.487 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.536 17.248 6.508 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.365 15.507 6.413 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -1.266 15.707 7.841 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.621 17.412 8.034 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.856 16.809 9.035 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -3.445 15.112 8.889 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -1.488 15.454 10.416 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.899 17.152 10.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.750 15.884 12.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -4.033 16.528 11.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -3.636 14.883 11.362 1.00 0.00 H new ATOM 483 N GLY A 32 -1.736 14.276 4.313 1.00 0.00 N ATOM 484 CA GLY A 32 -1.058 13.040 3.858 1.00 0.00 C ATOM 485 C GLY A 32 0.083 13.131 2.818 1.00 0.00 C ATOM 486 O GLY A 32 0.962 12.266 2.843 1.00 0.00 O ATOM 0 H GLY A 32 -2.736 14.291 4.110 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.655 12.546 4.742 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.823 12.382 3.446 1.00 0.00 H new ATOM 490 N LYS A 33 0.096 14.150 1.931 1.00 0.00 N ATOM 491 CA LYS A 33 1.251 14.423 1.031 1.00 0.00 C ATOM 492 C LYS A 33 2.587 14.795 1.763 1.00 0.00 C ATOM 493 O LYS A 33 3.648 14.294 1.383 1.00 0.00 O ATOM 494 CB LYS A 33 0.814 15.417 -0.081 1.00 0.00 C ATOM 495 CG LYS A 33 0.676 16.905 0.301 1.00 0.00 C ATOM 496 CD LYS A 33 0.121 17.767 -0.853 1.00 0.00 C ATOM 497 CE LYS A 33 0.380 19.283 -0.738 1.00 0.00 C ATOM 498 NZ LYS A 33 -0.293 19.926 0.405 1.00 0.00 N ATOM 0 H LYS A 33 -0.680 14.802 1.815 1.00 0.00 H new ATOM 0 HA LYS A 33 1.528 13.485 0.550 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.534 15.346 -0.896 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -0.146 15.081 -0.473 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.018 16.995 1.165 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.650 17.291 0.601 1.00 0.00 H new ATOM 0 HD2 LYS A 33 0.555 17.413 -1.788 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.955 17.605 -0.919 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.454 19.451 -0.655 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.052 19.767 -1.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.288 20.717 0.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.222 20.284 0.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.420 19.231 1.169 1.00 0.00 H new ATOM 512 N ASP A 34 2.517 15.621 2.832 1.00 0.00 N ATOM 513 CA ASP A 34 3.642 15.860 3.777 1.00 0.00 C ATOM 514 C ASP A 34 4.028 14.639 4.684 1.00 0.00 C ATOM 515 O ASP A 34 5.221 14.456 4.944 1.00 0.00 O ATOM 516 CB ASP A 34 3.281 17.123 4.609 1.00 0.00 C ATOM 517 CG ASP A 34 4.429 17.701 5.450 1.00 0.00 C ATOM 518 OD1 ASP A 34 5.252 18.470 4.906 1.00 0.00 O ATOM 519 OD2 ASP A 34 4.512 17.383 6.658 1.00 0.00 O ATOM 0 H ASP A 34 1.675 16.146 3.068 1.00 0.00 H new ATOM 0 HA ASP A 34 4.549 16.014 3.192 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.924 17.897 3.929 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.453 16.876 5.274 1.00 0.00 H new ATOM 524 N ILE A 35 3.056 13.828 5.165 1.00 0.00 N ATOM 525 CA ILE A 35 3.314 12.648 6.047 1.00 0.00 C ATOM 526 C ILE A 35 4.062 11.531 5.245 1.00 0.00 C ATOM 527 O ILE A 35 3.730 11.233 4.090 1.00 0.00 O ATOM 528 CB ILE A 35 1.968 12.153 6.709 1.00 0.00 C ATOM 529 CG1 ILE A 35 1.360 13.206 7.689 1.00 0.00 C ATOM 530 CG2 ILE A 35 2.092 10.796 7.458 1.00 0.00 C ATOM 531 CD1 ILE A 35 -0.118 12.989 8.057 1.00 0.00 C ATOM 0 H ILE A 35 2.067 13.968 4.956 1.00 0.00 H new ATOM 0 HA ILE A 35 3.971 12.934 6.868 1.00 0.00 H new ATOM 0 HB ILE A 35 1.300 12.011 5.859 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.949 13.206 8.606 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.464 14.195 7.243 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.126 10.526 7.884 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.409 10.022 6.759 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.828 10.887 8.257 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.442 13.773 8.741 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.727 13.022 7.153 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.234 12.018 8.538 1.00 0.00 H new ATOM 543 N LYS A 36 5.041 10.896 5.917 1.00 0.00 N ATOM 544 CA LYS A 36 5.789 9.729 5.377 1.00 0.00 C ATOM 545 C LYS A 36 4.881 8.465 5.370 1.00 0.00 C ATOM 546 O LYS A 36 4.542 7.923 6.427 1.00 0.00 O ATOM 547 CB LYS A 36 7.068 9.477 6.225 1.00 0.00 C ATOM 548 CG LYS A 36 8.161 10.567 6.114 1.00 0.00 C ATOM 549 CD LYS A 36 9.486 10.235 6.835 1.00 0.00 C ATOM 550 CE LYS A 36 9.443 10.145 8.376 1.00 0.00 C ATOM 551 NZ LYS A 36 9.167 11.439 9.030 1.00 0.00 N ATOM 0 H LYS A 36 5.341 11.173 6.852 1.00 0.00 H new ATOM 0 HA LYS A 36 6.088 9.944 4.351 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.777 9.383 7.271 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.499 8.522 5.926 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.372 10.743 5.059 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.767 11.499 6.520 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.851 9.283 6.450 1.00 0.00 H new ATOM 0 HD3 LYS A 36 10.220 10.993 6.560 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.677 9.427 8.670 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.397 9.760 8.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.151 11.310 10.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.910 12.121 8.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 8.244 11.799 8.712 1.00 0.00 H new ATOM 565 N GLY A 37 4.475 8.036 4.162 1.00 0.00 N ATOM 566 CA GLY A 37 3.510 6.928 3.994 1.00 0.00 C ATOM 567 C GLY A 37 4.205 5.570 3.858 1.00 0.00 C ATOM 568 O GLY A 37 4.710 5.228 2.785 1.00 0.00 O ATOM 0 H GLY A 37 4.800 8.439 3.283 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.834 6.904 4.849 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.899 7.112 3.110 1.00 0.00 H new ATOM 572 N VAL A 38 4.207 4.807 4.962 1.00 0.00 N ATOM 573 CA VAL A 38 4.892 3.486 5.037 1.00 0.00 C ATOM 574 C VAL A 38 3.895 2.416 4.500 1.00 0.00 C ATOM 575 O VAL A 38 2.913 2.052 5.155 1.00 0.00 O ATOM 576 CB VAL A 38 5.432 3.163 6.470 1.00 0.00 C ATOM 577 CG1 VAL A 38 6.173 1.804 6.543 1.00 0.00 C ATOM 578 CG2 VAL A 38 6.381 4.249 7.039 1.00 0.00 C ATOM 0 H VAL A 38 3.740 5.077 5.828 1.00 0.00 H new ATOM 0 HA VAL A 38 5.789 3.494 4.418 1.00 0.00 H new ATOM 0 HB VAL A 38 4.528 3.127 7.078 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.524 1.635 7.561 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.492 1.002 6.257 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.025 1.817 5.863 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.714 3.956 8.034 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.245 4.356 6.384 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.851 5.200 7.099 1.00 0.00 H new ATOM 588 N SER A 39 4.205 1.933 3.292 1.00 0.00 N ATOM 589 CA SER A 39 3.410 0.899 2.589 1.00 0.00 C ATOM 590 C SER A 39 4.119 -0.461 2.805 1.00 0.00 C ATOM 591 O SER A 39 5.057 -0.825 2.091 1.00 0.00 O ATOM 592 CB SER A 39 3.289 1.237 1.087 1.00 0.00 C ATOM 593 OG SER A 39 2.774 2.545 0.861 1.00 0.00 O ATOM 0 H SER A 39 5.020 2.246 2.764 1.00 0.00 H new ATOM 0 HA SER A 39 2.396 0.856 2.986 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.269 1.150 0.619 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.640 0.506 0.605 1.00 0.00 H new ATOM 0 HG SER A 39 2.718 2.712 -0.103 1.00 0.00 H new ATOM 599 N GLU A 40 3.664 -1.199 3.821 1.00 0.00 N ATOM 600 CA GLU A 40 4.220 -2.530 4.170 1.00 0.00 C ATOM 601 C GLU A 40 3.644 -3.632 3.251 1.00 0.00 C ATOM 602 O GLU A 40 2.507 -3.558 2.779 1.00 0.00 O ATOM 603 CB GLU A 40 3.928 -2.839 5.664 1.00 0.00 C ATOM 604 CG GLU A 40 5.088 -2.450 6.595 1.00 0.00 C ATOM 605 CD GLU A 40 4.690 -2.452 8.071 1.00 0.00 C ATOM 606 OE1 GLU A 40 4.152 -1.430 8.552 1.00 0.00 O ATOM 607 OE2 GLU A 40 4.910 -3.475 8.758 1.00 0.00 O ATOM 0 H GLU A 40 2.902 -0.901 4.430 1.00 0.00 H new ATOM 0 HA GLU A 40 5.299 -2.513 4.017 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.028 -2.305 5.971 1.00 0.00 H new ATOM 0 HB3 GLU A 40 3.721 -3.903 5.776 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.916 -3.143 6.446 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.450 -1.459 6.322 1.00 0.00 H new ATOM 614 N ILE A 41 4.479 -4.650 3.015 1.00 0.00 N ATOM 615 CA ILE A 41 4.087 -5.882 2.277 1.00 0.00 C ATOM 616 C ILE A 41 4.801 -7.024 3.056 1.00 0.00 C ATOM 617 O ILE A 41 6.029 -7.015 3.189 1.00 0.00 O ATOM 618 CB ILE A 41 4.450 -5.857 0.746 1.00 0.00 C ATOM 619 CG1 ILE A 41 3.825 -4.654 -0.028 1.00 0.00 C ATOM 620 CG2 ILE A 41 4.049 -7.184 0.051 1.00 0.00 C ATOM 621 CD1 ILE A 41 4.354 -4.423 -1.449 1.00 0.00 C ATOM 0 H ILE A 41 5.450 -4.654 3.326 1.00 0.00 H new ATOM 0 HA ILE A 41 3.004 -6.006 2.250 1.00 0.00 H new ATOM 0 HB ILE A 41 5.532 -5.734 0.711 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.747 -4.803 -0.083 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.992 -3.747 0.553 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.313 -7.136 -1.006 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.578 -8.014 0.519 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.974 -7.336 0.150 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.850 -3.563 -1.890 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.427 -4.235 -1.412 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.162 -5.307 -2.057 1.00 0.00 H new ATOM 633 N VAL A 42 4.023 -8.002 3.551 1.00 0.00 N ATOM 634 CA VAL A 42 4.556 -9.147 4.344 1.00 0.00 C ATOM 635 C VAL A 42 4.208 -10.421 3.522 1.00 0.00 C ATOM 636 O VAL A 42 3.077 -10.917 3.566 1.00 0.00 O ATOM 637 CB VAL A 42 3.997 -9.152 5.812 1.00 0.00 C ATOM 638 CG1 VAL A 42 4.521 -10.344 6.647 1.00 0.00 C ATOM 639 CG2 VAL A 42 4.296 -7.853 6.601 1.00 0.00 C ATOM 0 H VAL A 42 3.012 -8.031 3.419 1.00 0.00 H new ATOM 0 HA VAL A 42 5.635 -9.084 4.489 1.00 0.00 H new ATOM 0 HB VAL A 42 2.919 -9.238 5.673 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.102 -10.296 7.652 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.222 -11.279 6.173 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.608 -10.298 6.705 1.00 0.00 H new ATOM 0 HG21 VAL A 42 3.879 -7.933 7.605 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.374 -7.707 6.667 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.846 -7.004 6.087 1.00 0.00 H new ATOM 649 N GLN A 43 5.206 -10.949 2.789 1.00 0.00 N ATOM 650 CA GLN A 43 5.044 -12.166 1.953 1.00 0.00 C ATOM 651 C GLN A 43 5.214 -13.448 2.814 1.00 0.00 C ATOM 652 O GLN A 43 6.243 -13.627 3.477 1.00 0.00 O ATOM 653 CB GLN A 43 6.071 -12.103 0.789 1.00 0.00 C ATOM 654 CG GLN A 43 5.963 -13.248 -0.249 1.00 0.00 C ATOM 655 CD GLN A 43 6.978 -13.173 -1.408 1.00 0.00 C ATOM 656 OE1 GLN A 43 8.104 -12.695 -1.274 1.00 0.00 O ATOM 657 NE2 GLN A 43 6.607 -13.683 -2.571 1.00 0.00 N ATOM 0 H GLN A 43 6.145 -10.551 2.756 1.00 0.00 H new ATOM 0 HA GLN A 43 4.039 -12.206 1.533 1.00 0.00 H new ATOM 0 HB2 GLN A 43 5.951 -11.152 0.271 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.076 -12.111 1.211 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.092 -14.199 0.267 1.00 0.00 H new ATOM 0 HG3 GLN A 43 4.956 -13.246 -0.667 1.00 0.00 H new ATOM 0 HE21 GLN A 43 5.673 -14.079 -2.680 1.00 0.00 H new ATOM 0 HE22 GLN A 43 7.255 -13.681 -3.359 1.00 0.00 H new ATOM 666 N ASN A 44 4.218 -14.350 2.747 1.00 0.00 N ATOM 667 CA ASN A 44 4.347 -15.733 3.285 1.00 0.00 C ATOM 668 C ASN A 44 4.036 -16.713 2.114 1.00 0.00 C ATOM 669 O ASN A 44 2.930 -17.257 2.014 1.00 0.00 O ATOM 670 CB ASN A 44 3.432 -15.934 4.529 1.00 0.00 C ATOM 671 CG ASN A 44 3.792 -15.078 5.763 1.00 0.00 C ATOM 672 OD1 ASN A 44 4.800 -15.310 6.429 1.00 0.00 O ATOM 673 ND2 ASN A 44 2.987 -14.075 6.083 1.00 0.00 N ATOM 0 H ASN A 44 3.310 -14.153 2.326 1.00 0.00 H new ATOM 0 HA ASN A 44 5.356 -15.930 3.647 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.404 -15.713 4.242 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.464 -16.985 4.816 1.00 0.00 H new ATOM 0 HD21 ASN A 44 3.201 -13.487 6.888 1.00 0.00 H new ATOM 0 HD22 ASN A 44 2.154 -13.891 5.524 1.00 0.00 H new ATOM 680 N GLY A 45 5.019 -16.899 1.206 1.00 0.00 N ATOM 681 CA GLY A 45 4.837 -17.693 -0.033 1.00 0.00 C ATOM 682 C GLY A 45 3.983 -16.969 -1.099 1.00 0.00 C ATOM 683 O GLY A 45 4.330 -15.871 -1.546 1.00 0.00 O ATOM 0 H GLY A 45 5.955 -16.507 1.308 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.815 -17.924 -0.456 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.365 -18.643 0.218 1.00 0.00 H new ATOM 687 N LYS A 46 2.845 -17.583 -1.459 1.00 0.00 N ATOM 688 CA LYS A 46 1.774 -16.910 -2.257 1.00 0.00 C ATOM 689 C LYS A 46 0.851 -15.897 -1.494 1.00 0.00 C ATOM 690 O LYS A 46 0.176 -15.099 -2.150 1.00 0.00 O ATOM 691 CB LYS A 46 0.984 -17.969 -3.068 1.00 0.00 C ATOM 692 CG LYS A 46 0.095 -18.919 -2.242 1.00 0.00 C ATOM 693 CD LYS A 46 -0.812 -19.853 -3.068 1.00 0.00 C ATOM 694 CE LYS A 46 -0.056 -20.937 -3.861 1.00 0.00 C ATOM 695 NZ LYS A 46 -0.983 -21.811 -4.598 1.00 0.00 N ATOM 0 H LYS A 46 2.630 -18.550 -1.215 1.00 0.00 H new ATOM 0 HA LYS A 46 2.298 -16.241 -2.939 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.355 -17.450 -3.791 1.00 0.00 H new ATOM 0 HB3 LYS A 46 1.695 -18.569 -3.636 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.736 -19.530 -1.607 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.532 -18.321 -1.581 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.520 -20.339 -2.397 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -1.395 -19.251 -3.765 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.633 -20.464 -4.560 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.545 -21.537 -3.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -0.442 -22.529 -5.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.624 -22.281 -3.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.539 -21.241 -5.267 1.00 0.00 H new ATOM 709 N HIS A 47 0.815 -15.922 -0.144 1.00 0.00 N ATOM 710 CA HIS A 47 0.033 -14.970 0.681 1.00 0.00 C ATOM 711 C HIS A 47 0.758 -13.599 0.815 1.00 0.00 C ATOM 712 O HIS A 47 1.991 -13.520 0.810 1.00 0.00 O ATOM 713 CB HIS A 47 -0.213 -15.619 2.073 1.00 0.00 C ATOM 714 CG HIS A 47 -1.370 -15.005 2.869 1.00 0.00 C ATOM 715 ND1 HIS A 47 -1.230 -14.328 4.064 1.00 0.00 N ATOM 716 CD2 HIS A 47 -2.723 -15.010 2.481 1.00 0.00 C ATOM 717 CE1 HIS A 47 -2.535 -13.975 4.287 1.00 0.00 C ATOM 718 NE2 HIS A 47 -3.514 -14.330 3.394 1.00 0.00 N ATOM 0 H HIS A 47 1.330 -16.607 0.409 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.921 -14.766 0.196 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.409 -16.682 1.934 1.00 0.00 H new ATOM 0 HB3 HIS A 47 0.700 -15.538 2.663 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.097 -15.484 1.585 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.795 -13.413 5.172 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.518 -14.149 3.400 1.00 0.00 H new ATOM 726 N PHE A 48 -0.041 -12.527 0.926 1.00 0.00 N ATOM 727 CA PHE A 48 0.475 -11.134 0.999 1.00 0.00 C ATOM 728 C PHE A 48 -0.410 -10.343 1.993 1.00 0.00 C ATOM 729 O PHE A 48 -1.562 -10.024 1.686 1.00 0.00 O ATOM 730 CB PHE A 48 0.479 -10.458 -0.402 1.00 0.00 C ATOM 731 CG PHE A 48 1.541 -10.990 -1.379 1.00 0.00 C ATOM 732 CD1 PHE A 48 2.853 -10.515 -1.307 1.00 0.00 C ATOM 733 CD2 PHE A 48 1.223 -11.985 -2.312 1.00 0.00 C ATOM 734 CE1 PHE A 48 3.825 -11.015 -2.164 1.00 0.00 C ATOM 735 CE2 PHE A 48 2.208 -12.495 -3.157 1.00 0.00 C ATOM 736 CZ PHE A 48 3.504 -12.000 -3.090 1.00 0.00 C ATOM 0 H PHE A 48 -1.058 -12.591 0.968 1.00 0.00 H new ATOM 0 HA PHE A 48 1.508 -11.144 1.346 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.505 -10.587 -0.853 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.632 -9.387 -0.271 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.112 -9.757 -0.583 1.00 0.00 H new ATOM 0 HD2 PHE A 48 0.212 -12.358 -2.377 1.00 0.00 H new ATOM 0 HE1 PHE A 48 4.835 -10.636 -2.110 1.00 0.00 H new ATOM 0 HE2 PHE A 48 1.963 -13.275 -3.863 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.263 -12.381 -3.758 1.00 0.00 H new ATOM 746 N LYS A 49 0.157 -10.009 3.167 1.00 0.00 N ATOM 747 CA LYS A 49 -0.500 -9.137 4.179 1.00 0.00 C ATOM 748 C LYS A 49 0.114 -7.723 4.058 1.00 0.00 C ATOM 749 O LYS A 49 1.171 -7.435 4.632 1.00 0.00 O ATOM 750 CB LYS A 49 -0.303 -9.712 5.607 1.00 0.00 C ATOM 751 CG LYS A 49 -1.215 -10.909 5.921 1.00 0.00 C ATOM 752 CD LYS A 49 -0.916 -11.637 7.251 1.00 0.00 C ATOM 753 CE LYS A 49 -1.155 -10.841 8.552 1.00 0.00 C ATOM 754 NZ LYS A 49 -2.582 -10.576 8.814 1.00 0.00 N ATOM 0 H LYS A 49 1.083 -10.332 3.448 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.574 -9.090 3.999 1.00 0.00 H new ATOM 0 HB2 LYS A 49 0.737 -10.017 5.726 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.489 -8.923 6.336 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.248 -10.562 5.940 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.135 -11.629 5.106 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.526 -12.539 7.288 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.126 -11.957 7.236 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.734 -11.394 9.392 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.620 -9.893 8.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.718 -9.563 9.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -3.144 -10.851 7.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.892 -11.127 9.640 1.00 0.00 H new ATOM 768 N PHE A 50 -0.566 -6.848 3.297 1.00 0.00 N ATOM 769 CA PHE A 50 -0.102 -5.453 3.077 1.00 0.00 C ATOM 770 C PHE A 50 -0.768 -4.484 4.088 1.00 0.00 C ATOM 771 O PHE A 50 -1.993 -4.480 4.234 1.00 0.00 O ATOM 772 CB PHE A 50 -0.201 -5.000 1.593 1.00 0.00 C ATOM 773 CG PHE A 50 -1.575 -4.653 0.984 1.00 0.00 C ATOM 774 CD1 PHE A 50 -2.094 -3.359 1.113 1.00 0.00 C ATOM 775 CD2 PHE A 50 -2.265 -5.595 0.218 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.285 -3.013 0.481 1.00 0.00 C ATOM 777 CE2 PHE A 50 -3.450 -5.243 -0.423 1.00 0.00 C ATOM 778 CZ PHE A 50 -3.959 -3.954 -0.292 1.00 0.00 C ATOM 0 H PHE A 50 -1.439 -7.075 2.821 1.00 0.00 H new ATOM 0 HA PHE A 50 0.968 -5.424 3.282 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.436 -4.123 1.478 1.00 0.00 H new ATOM 0 HB3 PHE A 50 0.234 -5.791 0.983 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -1.568 -2.626 1.706 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.879 -6.599 0.123 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.685 -2.016 0.590 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -3.975 -5.971 -1.023 1.00 0.00 H new ATOM 0 HZ PHE A 50 -4.878 -3.684 -0.791 1.00 0.00 H new ATOM 788 N THR A 51 0.055 -3.661 4.761 1.00 0.00 N ATOM 789 CA THR A 51 -0.431 -2.675 5.764 1.00 0.00 C ATOM 790 C THR A 51 -0.147 -1.261 5.183 1.00 0.00 C ATOM 791 O THR A 51 0.940 -0.701 5.358 1.00 0.00 O ATOM 792 CB THR A 51 0.182 -2.987 7.163 1.00 0.00 C ATOM 793 OG1 THR A 51 -0.134 -4.321 7.553 1.00 0.00 O ATOM 794 CG2 THR A 51 -0.321 -2.065 8.281 1.00 0.00 C ATOM 0 H THR A 51 1.067 -3.653 4.633 1.00 0.00 H new ATOM 0 HA THR A 51 -1.505 -2.731 5.943 1.00 0.00 H new ATOM 0 HB THR A 51 1.255 -2.834 7.043 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.257 -4.506 8.432 1.00 0.00 H new ATOM 0 HG21 THR A 51 0.151 -2.345 9.223 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.069 -1.032 8.042 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.403 -2.162 8.374 1.00 0.00 H new ATOM 802 N ILE A 52 -1.153 -0.707 4.477 1.00 0.00 N ATOM 803 CA ILE A 52 -1.046 0.596 3.766 1.00 0.00 C ATOM 804 C ILE A 52 -1.348 1.767 4.747 1.00 0.00 C ATOM 805 O ILE A 52 -2.445 1.867 5.303 1.00 0.00 O ATOM 806 CB ILE A 52 -1.907 0.618 2.447 1.00 0.00 C ATOM 807 CG1 ILE A 52 -1.776 1.918 1.598 1.00 0.00 C ATOM 808 CG2 ILE A 52 -3.417 0.310 2.632 1.00 0.00 C ATOM 809 CD1 ILE A 52 -0.366 2.243 1.092 1.00 0.00 C ATOM 0 H ILE A 52 -2.068 -1.147 4.380 1.00 0.00 H new ATOM 0 HA ILE A 52 -0.020 0.734 3.425 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.452 -0.208 1.900 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.441 1.837 0.738 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.130 2.758 2.196 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.918 0.351 1.665 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.536 -0.685 3.061 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -3.860 1.048 3.301 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.391 3.167 0.514 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.306 2.364 1.941 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -0.009 1.429 0.461 1.00 0.00 H new ATOM 821 N THR A 53 -0.359 2.664 4.899 1.00 0.00 N ATOM 822 CA THR A 53 -0.523 3.937 5.651 1.00 0.00 C ATOM 823 C THR A 53 -0.730 5.056 4.591 1.00 0.00 C ATOM 824 O THR A 53 0.238 5.551 4.000 1.00 0.00 O ATOM 825 CB THR A 53 0.688 4.186 6.598 1.00 0.00 C ATOM 826 OG1 THR A 53 0.865 3.075 7.472 1.00 0.00 O ATOM 827 CG2 THR A 53 0.544 5.442 7.478 1.00 0.00 C ATOM 0 H THR A 53 0.575 2.536 4.509 1.00 0.00 H new ATOM 0 HA THR A 53 -1.388 3.910 6.314 1.00 0.00 H new ATOM 0 HB THR A 53 1.543 4.328 5.938 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.630 3.241 8.062 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.426 5.547 8.109 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.445 6.322 6.843 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.342 5.347 8.106 1.00 0.00 H new ATOM 901 N ILE A 59 -4.335 0.813 7.510 1.00 0.00 N ATOM 902 CA ILE A 59 -5.386 -0.149 7.067 1.00 0.00 C ATOM 903 C ILE A 59 -4.640 -1.446 6.627 1.00 0.00 C ATOM 904 O ILE A 59 -3.895 -1.427 5.642 1.00 0.00 O ATOM 905 CB ILE A 59 -6.275 0.453 5.914 1.00 0.00 C ATOM 906 CG1 ILE A 59 -6.945 1.832 6.205 1.00 0.00 C ATOM 907 CG2 ILE A 59 -7.343 -0.542 5.392 1.00 0.00 C ATOM 908 CD1 ILE A 59 -7.973 1.890 7.349 1.00 0.00 C ATOM 0 HA ILE A 59 -6.083 -0.369 7.875 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.534 0.641 5.137 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -6.156 2.551 6.424 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.437 2.167 5.292 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.924 -0.070 4.599 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.850 -1.432 5.000 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -8.007 -0.825 6.209 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -8.358 2.906 7.441 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -8.796 1.208 7.134 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -7.494 1.598 8.284 1.00 0.00 H new ATOM 920 N GLN A 60 -4.892 -2.576 7.318 1.00 0.00 N ATOM 921 CA GLN A 60 -4.364 -3.907 6.907 1.00 0.00 C ATOM 922 C GLN A 60 -5.396 -4.635 5.994 1.00 0.00 C ATOM 923 O GLN A 60 -6.567 -4.801 6.350 1.00 0.00 O ATOM 924 CB GLN A 60 -3.967 -4.737 8.157 1.00 0.00 C ATOM 925 CG GLN A 60 -3.200 -6.043 7.838 1.00 0.00 C ATOM 926 CD GLN A 60 -2.725 -6.793 9.094 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.516 -7.416 9.801 1.00 0.00 O ATOM 928 NE2 GLN A 60 -1.435 -6.761 9.392 1.00 0.00 N ATOM 0 H GLN A 60 -5.458 -2.601 8.166 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.457 -3.778 6.316 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -3.351 -4.118 8.809 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -4.870 -4.987 8.714 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -3.843 -6.700 7.253 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -2.336 -5.806 7.217 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -0.787 -6.242 8.799 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -1.089 -7.256 10.214 1.00 0.00 H new ATOM 937 N ASN A 61 -4.913 -5.064 4.818 1.00 0.00 N ATOM 938 CA ASN A 61 -5.722 -5.763 3.782 1.00 0.00 C ATOM 939 C ASN A 61 -4.863 -6.920 3.199 1.00 0.00 C ATOM 940 O ASN A 61 -3.697 -6.719 2.838 1.00 0.00 O ATOM 941 CB ASN A 61 -6.137 -4.786 2.648 1.00 0.00 C ATOM 942 CG ASN A 61 -7.183 -3.716 3.008 1.00 0.00 C ATOM 943 OD1 ASN A 61 -8.085 -3.932 3.816 1.00 0.00 O ATOM 944 ND2 ASN A 61 -7.094 -2.547 2.393 1.00 0.00 N ATOM 0 H ASN A 61 -3.938 -4.938 4.547 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.635 -6.153 4.233 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.241 -4.279 2.290 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.524 -5.374 1.816 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -7.777 -1.815 2.587 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.342 -2.378 1.725 1.00 0.00 H new ATOM 951 N GLU A 62 -5.450 -8.130 3.105 1.00 0.00 N ATOM 952 CA GLU A 62 -4.712 -9.372 2.750 1.00 0.00 C ATOM 953 C GLU A 62 -5.359 -10.130 1.554 1.00 0.00 C ATOM 954 O GLU A 62 -6.576 -10.103 1.341 1.00 0.00 O ATOM 955 CB GLU A 62 -4.514 -10.260 4.011 1.00 0.00 C ATOM 956 CG GLU A 62 -5.777 -10.889 4.644 1.00 0.00 C ATOM 957 CD GLU A 62 -5.468 -11.702 5.903 1.00 0.00 C ATOM 958 OE1 GLU A 62 -5.254 -11.095 6.975 1.00 0.00 O ATOM 959 OE2 GLU A 62 -5.444 -12.950 5.830 1.00 0.00 O ATOM 0 H GLU A 62 -6.445 -8.280 3.271 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.721 -9.090 2.395 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.830 -11.068 3.750 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.020 -9.657 4.773 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.485 -10.099 4.892 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.263 -11.533 3.911 1.00 0.00 H new ATOM 966 N PHE A 63 -4.495 -10.830 0.797 1.00 0.00 N ATOM 967 CA PHE A 63 -4.893 -11.628 -0.394 1.00 0.00 C ATOM 968 C PHE A 63 -4.005 -12.894 -0.582 1.00 0.00 C ATOM 969 O PHE A 63 -2.830 -12.923 -0.205 1.00 0.00 O ATOM 970 CB PHE A 63 -4.932 -10.760 -1.690 1.00 0.00 C ATOM 971 CG PHE A 63 -3.602 -10.171 -2.210 1.00 0.00 C ATOM 972 CD1 PHE A 63 -2.789 -10.919 -3.072 1.00 0.00 C ATOM 973 CD2 PHE A 63 -3.217 -8.872 -1.862 1.00 0.00 C ATOM 974 CE1 PHE A 63 -1.629 -10.361 -3.600 1.00 0.00 C ATOM 975 CE2 PHE A 63 -2.061 -8.314 -2.403 1.00 0.00 C ATOM 976 CZ PHE A 63 -1.273 -9.056 -3.276 1.00 0.00 C ATOM 0 H PHE A 63 -3.494 -10.863 0.989 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.908 -11.978 -0.206 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.361 -11.368 -2.486 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.619 -9.931 -1.516 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.064 -11.932 -3.327 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.818 -8.300 -1.171 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -1.004 -10.942 -4.262 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.777 -7.305 -2.144 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.383 -8.618 -3.703 1.00 0.00 H new ATOM 986 N THR A 64 -4.579 -13.901 -1.265 1.00 0.00 N ATOM 987 CA THR A 64 -3.830 -15.064 -1.814 1.00 0.00 C ATOM 988 C THR A 64 -3.758 -14.904 -3.369 1.00 0.00 C ATOM 989 O THR A 64 -4.757 -14.592 -4.028 1.00 0.00 O ATOM 990 CB THR A 64 -4.538 -16.400 -1.415 1.00 0.00 C ATOM 991 OG1 THR A 64 -4.811 -16.443 -0.018 1.00 0.00 O ATOM 992 CG2 THR A 64 -3.721 -17.663 -1.739 1.00 0.00 C ATOM 0 H THR A 64 -5.580 -13.938 -1.457 1.00 0.00 H new ATOM 0 HA THR A 64 -2.821 -15.097 -1.404 1.00 0.00 H new ATOM 0 HB THR A 64 -5.452 -16.404 -2.009 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.255 -17.288 0.203 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.280 -18.547 -1.432 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.531 -17.708 -2.811 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.772 -17.630 -1.203 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.577 -15.193 -3.952 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.389 -15.284 -5.435 1.00 0.00 C ATOM 1002 C VAL A 65 -3.014 -16.626 -5.935 1.00 0.00 C ATOM 1003 O VAL A 65 -2.697 -17.706 -5.423 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.873 -15.116 -5.803 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.473 -15.492 -7.250 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -0.366 -13.680 -5.543 1.00 0.00 C ATOM 0 H VAL A 65 -1.724 -15.371 -3.421 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.907 -14.473 -5.947 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.399 -15.839 -5.139 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.597 -15.334 -7.384 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.711 -16.540 -7.433 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.023 -14.867 -7.954 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.688 -13.612 -5.812 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.941 -12.977 -6.146 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.487 -13.437 -4.487 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.913 -16.515 -6.925 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.796 -17.632 -7.340 1.00 0.00 C ATOM 1018 C GLY A 66 -6.297 -17.402 -7.045 1.00 0.00 C ATOM 1019 O GLY A 66 -7.126 -17.548 -7.947 1.00 0.00 O ATOM 0 H GLY A 66 -4.053 -15.658 -7.461 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.670 -17.801 -8.409 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.474 -18.542 -6.833 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.639 -17.095 -5.779 1.00 0.00 N ATOM 1024 CA GLU A 67 -8.048 -16.975 -5.312 1.00 0.00 C ATOM 1025 C GLU A 67 -8.614 -15.535 -5.495 1.00 0.00 C ATOM 1026 O GLU A 67 -7.874 -14.544 -5.447 1.00 0.00 O ATOM 1027 CB GLU A 67 -8.123 -17.369 -3.807 1.00 0.00 C ATOM 1028 CG GLU A 67 -7.828 -18.851 -3.480 1.00 0.00 C ATOM 1029 CD GLU A 67 -7.964 -19.160 -1.987 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -9.088 -19.467 -1.533 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -6.948 -19.094 -1.258 1.00 0.00 O ATOM 0 H GLU A 67 -5.952 -16.922 -5.045 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.655 -17.646 -5.920 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.419 -16.748 -3.254 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -9.120 -17.127 -3.438 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -8.511 -19.487 -4.043 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.819 -19.098 -3.808 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.959 -15.432 -5.618 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.683 -14.139 -5.468 1.00 0.00 C ATOM 1040 C GLU A 68 -10.813 -13.775 -3.958 1.00 0.00 C ATOM 1041 O GLU A 68 -11.552 -14.419 -3.207 1.00 0.00 O ATOM 1042 CB GLU A 68 -12.014 -14.075 -6.266 1.00 0.00 C ATOM 1043 CG GLU A 68 -13.128 -15.058 -5.863 1.00 0.00 C ATOM 1044 CD GLU A 68 -14.435 -14.824 -6.625 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -15.266 -14.010 -6.164 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -14.637 -15.452 -7.688 1.00 0.00 O ATOM 0 H GLU A 68 -10.567 -16.226 -5.820 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.084 -13.357 -5.935 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.410 -13.063 -6.180 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.784 -14.239 -7.319 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.787 -16.078 -6.041 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -13.316 -14.967 -4.793 1.00 0.00 H new ATOM 1053 N CYS A 69 -10.025 -12.779 -3.522 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.860 -12.453 -2.083 1.00 0.00 C ATOM 1055 C CYS A 69 -10.533 -11.106 -1.738 1.00 0.00 C ATOM 1056 O CYS A 69 -10.464 -10.133 -2.494 1.00 0.00 O ATOM 1057 CB CYS A 69 -8.362 -12.412 -1.745 1.00 0.00 C ATOM 1058 SG CYS A 69 -7.583 -14.013 -2.137 1.00 0.00 S ATOM 0 H CYS A 69 -9.486 -12.178 -4.145 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.346 -13.224 -1.486 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -7.876 -11.615 -2.309 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.227 -12.183 -0.688 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.665 -14.234 -3.415 1.00 0.00 H new ATOM 1064 N GLU A 70 -11.168 -11.073 -0.557 1.00 0.00 N ATOM 1065 CA GLU A 70 -11.923 -9.891 -0.063 1.00 0.00 C ATOM 1066 C GLU A 70 -10.976 -8.835 0.570 1.00 0.00 C ATOM 1067 O GLU A 70 -10.185 -9.146 1.468 1.00 0.00 O ATOM 1068 CB GLU A 70 -13.114 -10.280 0.862 1.00 0.00 C ATOM 1069 CG GLU A 70 -12.946 -11.357 1.946 1.00 0.00 C ATOM 1070 CD GLU A 70 -12.049 -10.991 3.132 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -12.477 -10.187 3.990 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -10.911 -11.503 3.211 1.00 0.00 O ATOM 0 H GLU A 70 -11.178 -11.861 0.090 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.381 -9.418 -0.932 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.442 -9.369 1.363 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.931 -10.600 0.215 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.933 -11.613 2.330 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.544 -12.255 1.477 1.00 0.00 H new ATOM 1079 N LEU A 71 -11.059 -7.591 0.066 1.00 0.00 N ATOM 1080 CA LEU A 71 -10.227 -6.454 0.556 1.00 0.00 C ATOM 1081 C LEU A 71 -11.120 -5.190 0.747 1.00 0.00 C ATOM 1082 O LEU A 71 -12.194 -5.048 0.151 1.00 0.00 O ATOM 1083 CB LEU A 71 -9.022 -6.125 -0.385 1.00 0.00 C ATOM 1084 CG LEU A 71 -8.118 -7.298 -0.879 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -8.400 -7.644 -2.353 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -6.621 -7.004 -0.705 1.00 0.00 C ATOM 0 H LEU A 71 -11.697 -7.336 -0.688 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.801 -6.760 1.512 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.418 -5.619 -1.265 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.383 -5.410 0.133 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.371 -8.153 -0.252 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.753 -8.464 -2.664 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -9.443 -7.942 -2.464 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.204 -6.771 -2.976 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.039 -7.853 -1.065 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.356 -6.114 -1.276 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.403 -6.836 0.350 1.00 0.00 H new ATOM 1180 N LYS A 78 -15.600 -3.309 -0.159 1.00 0.00 N ATOM 1181 CA LYS A 78 -15.538 -4.691 -0.695 1.00 0.00 C ATOM 1182 C LYS A 78 -14.857 -4.669 -2.093 1.00 0.00 C ATOM 1183 O LYS A 78 -15.142 -3.805 -2.930 1.00 0.00 O ATOM 1184 CB LYS A 78 -16.985 -5.262 -0.738 1.00 0.00 C ATOM 1185 CG LYS A 78 -17.098 -6.781 -1.008 1.00 0.00 C ATOM 1186 CD LYS A 78 -17.117 -7.724 0.218 1.00 0.00 C ATOM 1187 CE LYS A 78 -15.857 -7.768 1.110 1.00 0.00 C ATOM 1188 NZ LYS A 78 -15.855 -6.742 2.169 1.00 0.00 N ATOM 0 HA LYS A 78 -14.938 -5.342 -0.059 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -17.471 -5.043 0.213 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -17.543 -4.732 -1.510 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -18.010 -6.954 -1.580 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -16.262 -7.073 -1.644 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -17.962 -7.441 0.845 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -17.310 -8.735 -0.140 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -15.780 -8.754 1.569 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -14.973 -7.637 0.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -14.883 -6.408 2.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -16.453 -5.942 1.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -16.228 -7.151 3.049 1.00 0.00 H new ATOM 1202 N VAL A 79 -13.968 -5.653 -2.330 1.00 0.00 N ATOM 1203 CA VAL A 79 -13.213 -5.787 -3.607 1.00 0.00 C ATOM 1204 C VAL A 79 -13.609 -7.145 -4.267 1.00 0.00 C ATOM 1205 O VAL A 79 -14.362 -7.122 -5.245 1.00 0.00 O ATOM 1206 CB VAL A 79 -11.679 -5.515 -3.403 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -10.850 -5.798 -4.670 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -11.363 -4.063 -2.980 1.00 0.00 C ATOM 0 H VAL A 79 -13.748 -6.379 -1.648 1.00 0.00 H new ATOM 0 HA VAL A 79 -13.488 -5.015 -4.325 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.404 -6.202 -2.603 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.798 -5.593 -4.470 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.968 -6.843 -4.956 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -11.196 -5.159 -5.482 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.286 -3.946 -2.857 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.717 -3.375 -3.748 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.862 -3.842 -2.036 1.00 0.00 H new ATOM 1218 N LYS A 80 -13.067 -8.296 -3.794 1.00 0.00 N ATOM 1219 CA LYS A 80 -13.087 -9.600 -4.524 1.00 0.00 C ATOM 1220 C LYS A 80 -12.333 -9.519 -5.889 1.00 0.00 C ATOM 1221 O LYS A 80 -12.931 -9.162 -6.908 1.00 0.00 O ATOM 1222 CB LYS A 80 -14.492 -10.259 -4.637 1.00 0.00 C ATOM 1223 CG LYS A 80 -15.089 -10.847 -3.339 1.00 0.00 C ATOM 1224 CD LYS A 80 -14.388 -12.127 -2.834 1.00 0.00 C ATOM 1225 CE LYS A 80 -15.158 -12.821 -1.696 1.00 0.00 C ATOM 1226 NZ LYS A 80 -14.429 -14.001 -1.200 1.00 0.00 N ATOM 0 H LYS A 80 -12.599 -8.351 -2.889 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.527 -10.290 -3.893 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.187 -9.514 -5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -14.435 -11.057 -5.377 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.042 -10.089 -2.557 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -16.143 -11.067 -3.506 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -14.271 -12.823 -3.664 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -13.386 -11.874 -2.487 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -15.315 -12.118 -0.878 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.143 -13.122 -2.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -14.972 -14.448 -0.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -14.301 -14.681 -1.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -13.499 -13.708 -0.839 1.00 0.00 H new ATOM 1240 N THR A 81 -11.017 -9.818 -5.882 1.00 0.00 N ATOM 1241 CA THR A 81 -10.147 -9.693 -7.088 1.00 0.00 C ATOM 1242 C THR A 81 -9.094 -10.843 -7.126 1.00 0.00 C ATOM 1243 O THR A 81 -8.561 -11.267 -6.093 1.00 0.00 O ATOM 1244 CB THR A 81 -9.515 -8.270 -7.197 1.00 0.00 C ATOM 1245 OG1 THR A 81 -8.935 -8.120 -8.487 1.00 0.00 O ATOM 1246 CG2 THR A 81 -8.450 -7.922 -6.139 1.00 0.00 C ATOM 0 H THR A 81 -10.524 -10.150 -5.053 1.00 0.00 H new ATOM 0 HA THR A 81 -10.766 -9.806 -7.978 1.00 0.00 H new ATOM 0 HB THR A 81 -10.340 -7.580 -7.018 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.964 -8.024 -8.400 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.082 -6.911 -6.313 1.00 0.00 H new ATOM 0 HG22 THR A 81 -8.892 -7.981 -5.144 1.00 0.00 H new ATOM 0 HG23 THR A 81 -7.622 -8.627 -6.211 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.776 -11.302 -8.351 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.814 -12.414 -8.588 1.00 0.00 C ATOM 1256 C VAL A 82 -6.440 -11.765 -8.948 1.00 0.00 C ATOM 1257 O VAL A 82 -6.342 -10.970 -9.892 1.00 0.00 O ATOM 1258 CB VAL A 82 -8.332 -13.402 -9.692 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -7.367 -14.588 -9.912 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -9.730 -14.000 -9.404 1.00 0.00 C ATOM 0 H VAL A 82 -9.174 -10.918 -9.208 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.703 -13.028 -7.694 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.393 -12.777 -10.583 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.767 -15.244 -10.685 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -6.393 -14.211 -10.225 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.259 -15.146 -8.982 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.013 -14.671 -10.215 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.702 -14.555 -8.466 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.461 -13.195 -9.327 1.00 0.00 H new ATOM 1270 N VAL A 83 -5.391 -12.140 -8.194 1.00 0.00 N ATOM 1271 CA VAL A 83 -4.015 -11.589 -8.371 1.00 0.00 C ATOM 1272 C VAL A 83 -3.129 -12.701 -9.021 1.00 0.00 C ATOM 1273 O VAL A 83 -3.175 -13.864 -8.607 1.00 0.00 O ATOM 1274 CB VAL A 83 -3.399 -11.047 -7.028 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -2.131 -10.197 -7.294 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -4.375 -10.231 -6.140 1.00 0.00 C ATOM 0 H VAL A 83 -5.462 -12.829 -7.446 1.00 0.00 H new ATOM 0 HA VAL A 83 -4.058 -10.720 -9.028 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.149 -11.949 -6.469 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.729 -9.837 -6.347 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.382 -10.808 -7.797 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.389 -9.347 -7.925 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.858 -9.902 -5.239 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.730 -9.361 -6.693 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.224 -10.856 -5.863 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.312 -12.316 -10.021 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.288 -13.210 -10.639 1.00 0.00 C ATOM 1288 C GLN A 84 0.120 -12.589 -10.431 1.00 0.00 C ATOM 1289 O GLN A 84 0.333 -11.387 -10.627 1.00 0.00 O ATOM 1290 CB GLN A 84 -1.555 -13.435 -12.156 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.455 -14.636 -12.531 1.00 0.00 C ATOM 1292 CD GLN A 84 -3.911 -14.594 -12.033 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -4.600 -13.577 -12.121 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -4.409 -15.707 -11.515 1.00 0.00 N ATOM 0 H GLN A 84 -2.336 -11.381 -10.429 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.344 -14.184 -10.152 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -2.009 -12.530 -12.560 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.595 -13.560 -12.656 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -2.470 -14.723 -13.617 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -1.990 -15.543 -12.145 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -3.828 -16.543 -11.448 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -5.373 -15.728 -11.184 1.00 0.00 H new ATOM 1303 N LEU A 85 1.084 -13.459 -10.086 1.00 0.00 N ATOM 1304 CA LEU A 85 2.503 -13.087 -9.892 1.00 0.00 C ATOM 1305 C LEU A 85 3.325 -13.572 -11.119 1.00 0.00 C ATOM 1306 O LEU A 85 3.426 -14.778 -11.373 1.00 0.00 O ATOM 1307 CB LEU A 85 2.994 -13.701 -8.548 1.00 0.00 C ATOM 1308 CG LEU A 85 4.481 -13.459 -8.178 1.00 0.00 C ATOM 1309 CD1 LEU A 85 4.862 -11.970 -8.059 1.00 0.00 C ATOM 1310 CD2 LEU A 85 4.862 -14.201 -6.881 1.00 0.00 C ATOM 0 H LEU A 85 0.902 -14.451 -9.932 1.00 0.00 H new ATOM 0 HA LEU A 85 2.633 -12.007 -9.827 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.374 -13.304 -7.745 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.822 -14.777 -8.581 1.00 0.00 H new ATOM 0 HG LEU A 85 5.052 -13.863 -9.014 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.917 -11.884 -7.798 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.682 -11.471 -9.011 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.257 -11.500 -7.283 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.910 -14.012 -6.648 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.238 -13.845 -6.061 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.708 -15.272 -7.016 1.00 0.00 H new ATOM 1322 N GLU A 86 3.960 -12.620 -11.827 1.00 0.00 N ATOM 1323 CA GLU A 86 4.996 -12.919 -12.850 1.00 0.00 C ATOM 1324 C GLU A 86 6.388 -12.742 -12.180 1.00 0.00 C ATOM 1325 O GLU A 86 6.726 -11.679 -11.646 1.00 0.00 O ATOM 1326 CB GLU A 86 4.815 -11.999 -14.085 1.00 0.00 C ATOM 1327 CG GLU A 86 5.555 -12.407 -15.381 1.00 0.00 C ATOM 1328 CD GLU A 86 7.059 -12.105 -15.402 1.00 0.00 C ATOM 1329 OE1 GLU A 86 7.439 -10.914 -15.366 1.00 0.00 O ATOM 1330 OE2 GLU A 86 7.867 -13.059 -15.451 1.00 0.00 O ATOM 0 H GLU A 86 3.775 -11.624 -11.712 1.00 0.00 H new ATOM 0 HA GLU A 86 4.904 -13.942 -13.214 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.750 -11.938 -14.308 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.141 -10.996 -13.810 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.414 -13.476 -15.539 1.00 0.00 H new ATOM 0 HG3 GLU A 86 5.087 -11.896 -16.223 1.00 0.00 H new ATOM 1337 N GLY A 87 7.174 -13.826 -12.229 1.00 0.00 N ATOM 1338 CA GLY A 87 8.532 -13.877 -11.640 1.00 0.00 C ATOM 1339 C GLY A 87 8.532 -13.915 -10.096 1.00 0.00 C ATOM 1340 O GLY A 87 7.854 -14.741 -9.478 1.00 0.00 O ATOM 0 H GLY A 87 6.892 -14.697 -12.678 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.050 -14.758 -12.017 1.00 0.00 H new ATOM 0 HA3 GLY A 87 9.097 -13.007 -11.974 1.00 0.00 H new ATOM 1344 N ASP A 88 9.265 -12.966 -9.501 1.00 0.00 N ATOM 1345 CA ASP A 88 8.986 -12.500 -8.117 1.00 0.00 C ATOM 1346 C ASP A 88 9.131 -10.947 -8.108 1.00 0.00 C ATOM 1347 O ASP A 88 9.992 -10.389 -7.420 1.00 0.00 O ATOM 1348 CB ASP A 88 9.861 -13.252 -7.074 1.00 0.00 C ATOM 1349 CG ASP A 88 9.412 -13.038 -5.618 1.00 0.00 C ATOM 1350 OD1 ASP A 88 8.502 -13.763 -5.160 1.00 0.00 O ATOM 1351 OD2 ASP A 88 9.955 -12.142 -4.935 1.00 0.00 O ATOM 0 H ASP A 88 10.056 -12.501 -9.946 1.00 0.00 H new ATOM 0 HA ASP A 88 7.968 -12.740 -7.810 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.841 -14.319 -7.298 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.895 -12.924 -7.177 1.00 0.00 H new ATOM 1356 N ASN A 89 8.267 -10.254 -8.881 1.00 0.00 N ATOM 1357 CA ASN A 89 8.294 -8.774 -8.998 1.00 0.00 C ATOM 1358 C ASN A 89 6.919 -8.141 -9.342 1.00 0.00 C ATOM 1359 O ASN A 89 6.601 -7.121 -8.732 1.00 0.00 O ATOM 1360 CB ASN A 89 9.446 -8.236 -9.894 1.00 0.00 C ATOM 1361 CG ASN A 89 9.327 -8.417 -11.422 1.00 0.00 C ATOM 1362 OD1 ASN A 89 9.283 -9.534 -11.937 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.274 -7.321 -12.167 1.00 0.00 N ATOM 0 H ASN A 89 7.536 -10.697 -9.438 1.00 0.00 H new ATOM 0 HA ASN A 89 8.523 -8.433 -7.989 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.555 -7.170 -9.692 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.370 -8.717 -9.573 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.196 -7.397 -13.181 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.312 -6.402 -11.726 1.00 0.00 H new ATOM 1370 N LYS A 90 6.134 -8.683 -10.298 1.00 0.00 N ATOM 1371 CA LYS A 90 4.934 -7.996 -10.839 1.00 0.00 C ATOM 1372 C LYS A 90 3.620 -8.676 -10.352 1.00 0.00 C ATOM 1373 O LYS A 90 3.293 -9.784 -10.785 1.00 0.00 O ATOM 1374 CB LYS A 90 5.065 -7.998 -12.387 1.00 0.00 C ATOM 1375 CG LYS A 90 4.141 -6.985 -13.089 1.00 0.00 C ATOM 1376 CD LYS A 90 4.050 -7.138 -14.624 1.00 0.00 C ATOM 1377 CE LYS A 90 5.334 -6.862 -15.434 1.00 0.00 C ATOM 1378 NZ LYS A 90 5.753 -5.447 -15.402 1.00 0.00 N ATOM 0 H LYS A 90 6.308 -9.598 -10.714 1.00 0.00 H new ATOM 0 HA LYS A 90 4.878 -6.970 -10.475 1.00 0.00 H new ATOM 0 HB2 LYS A 90 6.099 -7.780 -12.655 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.843 -8.998 -12.760 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.139 -7.079 -12.670 1.00 0.00 H new ATOM 0 HG3 LYS A 90 4.490 -5.978 -12.859 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.723 -8.154 -14.844 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.271 -6.467 -14.986 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.141 -7.481 -15.044 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.174 -7.163 -16.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 6.415 -5.263 -16.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.918 -4.835 -15.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 6.222 -5.244 -14.496 1.00 0.00 H new ATOM 1392 N LEU A 91 2.853 -7.978 -9.492 1.00 0.00 N ATOM 1393 CA LEU A 91 1.508 -8.430 -9.033 1.00 0.00 C ATOM 1394 C LEU A 91 0.439 -7.543 -9.735 1.00 0.00 C ATOM 1395 O LEU A 91 0.318 -6.356 -9.418 1.00 0.00 O ATOM 1396 CB LEU A 91 1.392 -8.333 -7.483 1.00 0.00 C ATOM 1397 CG LEU A 91 2.236 -9.340 -6.653 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.480 -8.824 -5.223 1.00 0.00 C ATOM 1399 CD2 LEU A 91 1.588 -10.737 -6.601 1.00 0.00 C ATOM 0 H LEU A 91 3.140 -7.085 -9.092 1.00 0.00 H new ATOM 0 HA LEU A 91 1.351 -9.476 -9.297 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.676 -7.324 -7.184 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.344 -8.463 -7.212 1.00 0.00 H new ATOM 0 HG LEU A 91 3.195 -9.431 -7.163 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.073 -9.552 -4.670 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.016 -7.876 -5.265 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.524 -8.678 -4.721 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.213 -11.406 -6.010 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.602 -10.664 -6.143 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.490 -11.131 -7.613 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.319 -8.119 -10.691 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.301 -7.361 -11.530 1.00 0.00 C ATOM 1413 C VAL A 92 -2.725 -7.719 -11.013 1.00 0.00 C ATOM 1414 O VAL A 92 -3.113 -8.894 -11.033 1.00 0.00 O ATOM 1415 CB VAL A 92 -1.130 -7.670 -13.060 1.00 0.00 C ATOM 1416 CG1 VAL A 92 -2.142 -6.912 -13.957 1.00 0.00 C ATOM 1417 CG2 VAL A 92 0.289 -7.370 -13.599 1.00 0.00 C ATOM 0 H VAL A 92 -0.277 -9.114 -10.911 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.128 -6.289 -11.436 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.319 -8.742 -13.118 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.968 -7.171 -15.001 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.157 -7.193 -13.678 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.013 -5.838 -13.824 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.332 -7.607 -14.662 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.518 -6.314 -13.453 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.018 -7.977 -13.062 1.00 0.00 H new ATOM 1427 N THR A 93 -3.503 -6.702 -10.582 1.00 0.00 N ATOM 1428 CA THR A 93 -4.885 -6.925 -10.058 1.00 0.00 C ATOM 1429 C THR A 93 -5.775 -5.653 -10.175 1.00 0.00 C ATOM 1430 O THR A 93 -5.347 -4.557 -9.804 1.00 0.00 O ATOM 1431 CB THR A 93 -4.858 -7.508 -8.615 1.00 0.00 C ATOM 1432 OG1 THR A 93 -6.171 -7.896 -8.249 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.279 -6.611 -7.504 1.00 0.00 C ATOM 0 H THR A 93 -3.209 -5.725 -10.583 1.00 0.00 H new ATOM 0 HA THR A 93 -5.355 -7.675 -10.694 1.00 0.00 H new ATOM 0 HB THR A 93 -4.162 -8.345 -8.679 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.224 -8.874 -8.207 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.321 -7.139 -6.551 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.243 -6.365 -7.738 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.863 -5.693 -7.436 1.00 0.00 H new ATOM 1441 N THR A 94 -7.030 -5.822 -10.636 1.00 0.00 N ATOM 1442 CA THR A 94 -7.990 -4.695 -10.826 1.00 0.00 C ATOM 1443 C THR A 94 -9.014 -4.706 -9.654 1.00 0.00 C ATOM 1444 O THR A 94 -9.830 -5.628 -9.546 1.00 0.00 O ATOM 1445 CB THR A 94 -8.651 -4.770 -12.236 1.00 0.00 C ATOM 1446 OG1 THR A 94 -7.646 -4.814 -13.246 1.00 0.00 O ATOM 1447 CG2 THR A 94 -9.554 -3.570 -12.571 1.00 0.00 C ATOM 0 H THR A 94 -7.413 -6.733 -10.888 1.00 0.00 H new ATOM 0 HA THR A 94 -7.471 -3.737 -10.798 1.00 0.00 H new ATOM 0 HB THR A 94 -9.264 -5.671 -12.211 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.070 -4.863 -14.128 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.975 -3.699 -13.568 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.361 -3.507 -11.841 1.00 0.00 H new ATOM 0 HG23 THR A 94 -8.966 -2.653 -12.541 1.00 0.00 H new ATOM 1455 N PHE A 95 -8.981 -3.663 -8.797 1.00 0.00 N ATOM 1456 CA PHE A 95 -9.872 -3.555 -7.608 1.00 0.00 C ATOM 1457 C PHE A 95 -11.322 -3.151 -8.023 1.00 0.00 C ATOM 1458 O PHE A 95 -12.182 -4.023 -8.175 1.00 0.00 O ATOM 1459 CB PHE A 95 -9.246 -2.653 -6.491 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.197 -3.210 -5.503 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -7.304 -4.242 -5.821 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -8.147 -2.643 -4.221 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -6.414 -4.721 -4.864 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -7.251 -3.120 -3.268 1.00 0.00 C ATOM 1465 CZ PHE A 95 -6.385 -4.160 -3.592 1.00 0.00 C ATOM 0 H PHE A 95 -8.343 -2.874 -8.903 1.00 0.00 H new ATOM 0 HA PHE A 95 -9.961 -4.542 -7.154 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -8.789 -1.799 -6.991 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.072 -2.268 -5.893 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.306 -4.668 -6.814 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -8.810 -1.828 -3.971 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.744 -5.531 -5.110 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -7.228 -2.684 -2.280 1.00 0.00 H new ATOM 0 HZ PHE A 95 -5.689 -4.532 -2.854 1.00 0.00 H new ATOM 1475 N LYS A 96 -11.565 -1.843 -8.204 1.00 0.00 N ATOM 1476 CA LYS A 96 -12.848 -1.298 -8.728 1.00 0.00 C ATOM 1477 C LYS A 96 -12.468 -0.255 -9.816 1.00 0.00 C ATOM 1478 O LYS A 96 -12.368 0.948 -9.545 1.00 0.00 O ATOM 1479 CB LYS A 96 -13.718 -0.693 -7.582 1.00 0.00 C ATOM 1480 CG LYS A 96 -14.334 -1.684 -6.564 1.00 0.00 C ATOM 1481 CD LYS A 96 -15.452 -2.576 -7.143 1.00 0.00 C ATOM 1482 CE LYS A 96 -16.046 -3.549 -6.109 1.00 0.00 C ATOM 1483 NZ LYS A 96 -17.081 -4.410 -6.710 1.00 0.00 N ATOM 0 H LYS A 96 -10.877 -1.120 -7.992 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.468 -2.081 -9.164 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -13.104 0.019 -7.031 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -14.531 -0.127 -8.037 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -13.542 -2.322 -6.172 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.735 -1.120 -5.722 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.247 -1.942 -7.535 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.055 -3.146 -7.983 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -15.252 -4.169 -5.693 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.476 -2.985 -5.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.460 -5.053 -5.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.850 -3.819 -7.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.664 -4.966 -7.483 1.00 0.00 H new ATOM 1497 N ASN A 97 -12.180 -0.750 -11.042 1.00 0.00 N ATOM 1498 CA ASN A 97 -11.456 0.014 -12.108 1.00 0.00 C ATOM 1499 C ASN A 97 -10.116 0.707 -11.660 1.00 0.00 C ATOM 1500 O ASN A 97 -9.868 1.871 -11.984 1.00 0.00 O ATOM 1501 CB ASN A 97 -12.459 0.922 -12.886 1.00 0.00 C ATOM 1502 CG ASN A 97 -11.961 1.434 -14.255 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -11.630 0.655 -15.150 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -11.900 2.743 -14.452 1.00 0.00 N ATOM 0 H ASN A 97 -12.440 -1.693 -11.330 1.00 0.00 H new ATOM 0 HA ASN A 97 -11.065 -0.716 -12.817 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -13.384 0.365 -13.039 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.704 1.782 -12.262 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -11.578 3.109 -15.348 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -12.175 3.384 -13.708 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.269 -0.021 -10.905 1.00 0.00 N ATOM 1512 CA ILE A 98 -7.990 0.500 -10.346 1.00 0.00 C ATOM 1513 C ILE A 98 -6.996 -0.667 -10.595 1.00 0.00 C ATOM 1514 O ILE A 98 -6.909 -1.585 -9.771 1.00 0.00 O ATOM 1515 CB ILE A 98 -8.130 0.912 -8.831 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -9.036 2.159 -8.606 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.759 1.166 -8.151 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -9.623 2.297 -7.191 1.00 0.00 C ATOM 0 H ILE A 98 -9.448 -0.995 -10.660 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.652 1.424 -10.814 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.609 0.050 -8.367 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.456 3.054 -8.830 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -9.858 2.124 -9.321 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.916 1.446 -7.109 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.157 0.258 -8.196 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.240 1.972 -8.669 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -10.238 3.196 -7.138 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -10.236 1.424 -6.965 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -8.812 2.369 -6.466 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.239 -0.624 -11.711 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.281 -1.713 -12.053 1.00 0.00 C ATOM 1532 C LYS A 99 -3.924 -1.461 -11.337 1.00 0.00 C ATOM 1533 O LYS A 99 -3.088 -0.680 -11.800 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.162 -1.909 -13.586 1.00 0.00 C ATOM 1535 CG LYS A 99 -4.483 -3.240 -13.996 1.00 0.00 C ATOM 1536 CD LYS A 99 -4.337 -3.471 -15.518 1.00 0.00 C ATOM 1537 CE LYS A 99 -5.584 -3.994 -16.262 1.00 0.00 C ATOM 1538 NZ LYS A 99 -6.632 -2.976 -16.464 1.00 0.00 N ATOM 0 H LYS A 99 -6.266 0.139 -12.387 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.662 -2.665 -11.682 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.158 -1.870 -14.026 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.595 -1.078 -14.006 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.492 -3.277 -13.544 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.056 -4.065 -13.574 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.036 -2.530 -15.978 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.523 -4.178 -15.678 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.278 -4.384 -17.233 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.005 -4.829 -15.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.222 -3.242 -17.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.225 -2.914 -15.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.189 -2.053 -16.645 1.00 0.00 H new ATOM 1552 N SER A 100 -3.745 -2.151 -10.197 1.00 0.00 N ATOM 1553 CA SER A 100 -2.533 -2.063 -9.353 1.00 0.00 C ATOM 1554 C SER A 100 -1.436 -2.993 -9.924 1.00 0.00 C ATOM 1555 O SER A 100 -1.493 -4.216 -9.761 1.00 0.00 O ATOM 1556 CB SER A 100 -2.934 -2.448 -7.911 1.00 0.00 C ATOM 1557 OG SER A 100 -1.866 -2.189 -7.007 1.00 0.00 O ATOM 0 H SER A 100 -4.445 -2.795 -9.828 1.00 0.00 H new ATOM 0 HA SER A 100 -2.123 -1.053 -9.346 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.817 -1.884 -7.610 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.202 -3.504 -7.872 1.00 0.00 H new ATOM 0 HG SER A 100 -1.103 -2.762 -7.229 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.457 -2.382 -10.610 1.00 0.00 N ATOM 1564 CA VAL A 101 0.673 -3.109 -11.251 1.00 0.00 C ATOM 1565 C VAL A 101 1.885 -2.872 -10.300 1.00 0.00 C ATOM 1566 O VAL A 101 2.594 -1.864 -10.399 1.00 0.00 O ATOM 1567 CB VAL A 101 0.865 -2.614 -12.728 1.00 0.00 C ATOM 1568 CG1 VAL A 101 2.130 -3.184 -13.404 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.346 -2.929 -13.637 1.00 0.00 C ATOM 0 H VAL A 101 -0.418 -1.371 -10.741 1.00 0.00 H new ATOM 0 HA VAL A 101 0.515 -4.182 -11.363 1.00 0.00 H new ATOM 0 HB VAL A 101 0.969 -1.534 -12.625 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.202 -2.802 -14.422 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.012 -2.881 -12.840 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.071 -4.272 -13.428 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.150 -2.561 -14.644 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.506 -4.007 -13.669 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.236 -2.441 -13.239 1.00 0.00 H new ATOM 1579 N THR A 102 2.072 -3.808 -9.354 1.00 0.00 N ATOM 1580 CA THR A 102 2.976 -3.626 -8.189 1.00 0.00 C ATOM 1581 C THR A 102 4.341 -4.280 -8.538 1.00 0.00 C ATOM 1582 O THR A 102 4.502 -5.495 -8.420 1.00 0.00 O ATOM 1583 CB THR A 102 2.253 -4.180 -6.926 1.00 0.00 C ATOM 1584 OG1 THR A 102 1.089 -3.402 -6.655 1.00 0.00 O ATOM 1585 CG2 THR A 102 3.102 -4.201 -5.647 1.00 0.00 C ATOM 0 H THR A 102 1.604 -4.714 -9.369 1.00 0.00 H new ATOM 0 HA THR A 102 3.201 -2.584 -7.960 1.00 0.00 H new ATOM 0 HB THR A 102 2.018 -5.215 -7.173 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.637 -3.755 -5.860 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.511 -4.603 -4.824 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.980 -4.828 -5.803 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.419 -3.187 -5.404 1.00 0.00 H new ATOM 1593 N GLU A 103 5.286 -3.441 -8.994 1.00 0.00 N ATOM 1594 CA GLU A 103 6.536 -3.874 -9.673 1.00 0.00 C ATOM 1595 C GLU A 103 7.753 -3.692 -8.742 1.00 0.00 C ATOM 1596 O GLU A 103 8.030 -2.576 -8.301 1.00 0.00 O ATOM 1597 CB GLU A 103 6.740 -2.962 -10.916 1.00 0.00 C ATOM 1598 CG GLU A 103 5.942 -3.395 -12.159 1.00 0.00 C ATOM 1599 CD GLU A 103 5.995 -2.351 -13.277 1.00 0.00 C ATOM 1600 OE1 GLU A 103 5.265 -1.338 -13.190 1.00 0.00 O ATOM 1601 OE2 GLU A 103 6.766 -2.535 -14.244 1.00 0.00 O ATOM 0 H GLU A 103 5.210 -2.428 -8.904 1.00 0.00 H new ATOM 0 HA GLU A 103 6.452 -4.925 -9.948 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.457 -1.943 -10.654 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.800 -2.943 -11.168 1.00 0.00 H new ATOM 0 HG2 GLU A 103 6.336 -4.341 -12.530 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.904 -3.571 -11.878 1.00 0.00 H new ATOM 1608 N LEU A 104 8.519 -4.766 -8.499 1.00 0.00 N ATOM 1609 CA LEU A 104 9.680 -4.728 -7.574 1.00 0.00 C ATOM 1610 C LEU A 104 10.995 -4.668 -8.401 1.00 0.00 C ATOM 1611 O LEU A 104 11.409 -5.660 -9.010 1.00 0.00 O ATOM 1612 CB LEU A 104 9.598 -5.941 -6.602 1.00 0.00 C ATOM 1613 CG LEU A 104 10.144 -5.700 -5.171 1.00 0.00 C ATOM 1614 CD1 LEU A 104 10.049 -7.004 -4.366 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.574 -5.134 -5.099 1.00 0.00 C ATOM 0 H LEU A 104 8.361 -5.678 -8.928 1.00 0.00 H new ATOM 0 HA LEU A 104 9.667 -3.832 -6.954 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.556 -6.250 -6.525 1.00 0.00 H new ATOM 0 HB3 LEU A 104 10.146 -6.773 -7.044 1.00 0.00 H new ATOM 0 HG LEU A 104 9.515 -4.921 -4.741 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.432 -6.839 -3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.008 -7.322 -4.311 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.639 -7.778 -4.856 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.861 -5.002 -4.056 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.264 -5.827 -5.580 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.611 -4.172 -5.610 1.00 0.00 H new ATOM 1627 N ASN A 105 11.651 -3.490 -8.412 1.00 0.00 N ATOM 1628 CA ASN A 105 12.856 -3.239 -9.253 1.00 0.00 C ATOM 1629 C ASN A 105 14.136 -3.624 -8.447 1.00 0.00 C ATOM 1630 O ASN A 105 14.409 -4.822 -8.321 1.00 0.00 O ATOM 1631 CB ASN A 105 12.781 -1.802 -9.859 1.00 0.00 C ATOM 1632 CG ASN A 105 11.789 -1.577 -11.025 1.00 0.00 C ATOM 1633 OD1 ASN A 105 12.193 -1.364 -12.168 1.00 0.00 O ATOM 1634 ND2 ASN A 105 10.487 -1.590 -10.775 1.00 0.00 N ATOM 0 H ASN A 105 11.370 -2.689 -7.847 1.00 0.00 H new ATOM 0 HA ASN A 105 12.902 -3.881 -10.133 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.522 -1.110 -9.057 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.778 -1.529 -10.206 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.821 -1.424 -11.530 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.151 -1.766 -9.828 1.00 0.00 H new ATOM 1641 N GLY A 106 14.903 -2.659 -7.901 1.00 0.00 N ATOM 1642 CA GLY A 106 16.133 -2.949 -7.121 1.00 0.00 C ATOM 1643 C GLY A 106 15.833 -3.111 -5.619 1.00 0.00 C ATOM 1644 O GLY A 106 15.240 -4.116 -5.214 1.00 0.00 O ATOM 0 H GLY A 106 14.694 -1.664 -7.984 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.597 -3.860 -7.499 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.852 -2.142 -7.263 1.00 0.00 H new ATOM 1648 N ASP A 107 16.213 -2.101 -4.816 1.00 0.00 N ATOM 1649 CA ASP A 107 15.717 -1.958 -3.414 1.00 0.00 C ATOM 1650 C ASP A 107 14.613 -0.851 -3.335 1.00 0.00 C ATOM 1651 O ASP A 107 14.721 0.102 -2.560 1.00 0.00 O ATOM 1652 CB ASP A 107 16.915 -1.702 -2.451 1.00 0.00 C ATOM 1653 CG ASP A 107 17.818 -2.914 -2.183 1.00 0.00 C ATOM 1654 OD1 ASP A 107 18.647 -3.258 -3.055 1.00 0.00 O ATOM 1655 OD2 ASP A 107 17.702 -3.526 -1.098 1.00 0.00 O ATOM 0 H ASP A 107 16.861 -1.367 -5.103 1.00 0.00 H new ATOM 0 HA ASP A 107 15.244 -2.885 -3.091 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.526 -0.900 -2.865 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.523 -1.345 -1.499 1.00 0.00 H new ATOM 1660 N ILE A 108 13.532 -1.003 -4.129 1.00 0.00 N ATOM 1661 CA ILE A 108 12.360 -0.086 -4.144 1.00 0.00 C ATOM 1662 C ILE A 108 11.051 -0.936 -4.344 1.00 0.00 C ATOM 1663 O ILE A 108 11.060 -2.171 -4.332 1.00 0.00 O ATOM 1664 CB ILE A 108 12.527 1.087 -5.183 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.575 0.636 -6.670 1.00 0.00 C ATOM 1666 CG2 ILE A 108 13.668 2.087 -4.876 1.00 0.00 C ATOM 1667 CD1 ILE A 108 12.005 1.680 -7.640 1.00 0.00 C ATOM 0 H ILE A 108 13.442 -1.775 -4.789 1.00 0.00 H new ATOM 0 HA ILE A 108 12.284 0.424 -3.184 1.00 0.00 H new ATOM 0 HB ILE A 108 11.595 1.634 -5.044 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.608 0.421 -6.944 1.00 0.00 H new ATOM 0 HG13 ILE A 108 12.017 -0.294 -6.779 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.698 2.854 -5.650 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.491 2.555 -3.908 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.620 1.557 -4.854 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.069 1.302 -8.660 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.962 1.877 -7.391 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.578 2.603 -7.559 1.00 0.00 H new ATOM 1679 N ILE A 109 9.909 -0.263 -4.576 1.00 0.00 N ATOM 1680 CA ILE A 109 8.751 -0.863 -5.291 1.00 0.00 C ATOM 1681 C ILE A 109 8.019 0.278 -6.058 1.00 0.00 C ATOM 1682 O ILE A 109 7.606 1.275 -5.457 1.00 0.00 O ATOM 1683 CB ILE A 109 7.839 -1.745 -4.364 1.00 0.00 C ATOM 1684 CG1 ILE A 109 6.997 -2.759 -5.181 1.00 0.00 C ATOM 1685 CG2 ILE A 109 6.959 -0.948 -3.366 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.370 -3.890 -4.366 1.00 0.00 C ATOM 0 H ILE A 109 9.756 0.701 -4.280 1.00 0.00 H new ATOM 0 HA ILE A 109 9.096 -1.592 -6.024 1.00 0.00 H new ATOM 0 HB ILE A 109 8.538 -2.301 -3.739 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.202 -2.217 -5.693 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.632 -3.197 -5.952 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.365 -1.641 -2.770 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.598 -0.359 -2.708 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.295 -0.283 -3.918 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.802 -4.544 -5.028 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.156 -4.464 -3.875 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.704 -3.470 -3.613 1.00 0.00 H new ATOM 1698 N THR A 110 7.841 0.104 -7.383 1.00 0.00 N ATOM 1699 CA THR A 110 7.065 1.051 -8.230 1.00 0.00 C ATOM 1700 C THR A 110 5.597 0.529 -8.295 1.00 0.00 C ATOM 1701 O THR A 110 5.273 -0.349 -9.100 1.00 0.00 O ATOM 1702 CB THR A 110 7.746 1.189 -9.623 1.00 0.00 C ATOM 1703 OG1 THR A 110 9.108 1.583 -9.479 1.00 0.00 O ATOM 1704 CG2 THR A 110 7.080 2.221 -10.547 1.00 0.00 C ATOM 0 H THR A 110 8.225 -0.688 -7.899 1.00 0.00 H new ATOM 0 HA THR A 110 7.045 2.057 -7.811 1.00 0.00 H new ATOM 0 HB THR A 110 7.649 0.202 -10.076 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.521 1.663 -10.364 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.614 2.257 -11.497 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.043 1.935 -10.724 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.110 3.204 -10.076 1.00 0.00 H new ATOM 1712 N ASN A 111 4.724 1.072 -7.428 1.00 0.00 N ATOM 1713 CA ASN A 111 3.320 0.598 -7.281 1.00 0.00 C ATOM 1714 C ASN A 111 2.405 1.514 -8.136 1.00 0.00 C ATOM 1715 O ASN A 111 2.099 2.646 -7.747 1.00 0.00 O ATOM 1716 CB ASN A 111 2.932 0.548 -5.773 1.00 0.00 C ATOM 1717 CG ASN A 111 1.757 -0.373 -5.386 1.00 0.00 C ATOM 1718 OD1 ASN A 111 1.924 -1.322 -4.621 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.547 -0.116 -5.858 1.00 0.00 N ATOM 0 H ASN A 111 4.961 1.847 -6.809 1.00 0.00 H new ATOM 0 HA ASN A 111 3.199 -0.420 -7.651 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.809 0.235 -5.207 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.690 1.561 -5.451 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.242 -0.704 -5.587 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.403 0.670 -6.492 1.00 0.00 H new ATOM 1726 N THR A 112 2.008 1.014 -9.321 1.00 0.00 N ATOM 1727 CA THR A 112 1.396 1.853 -10.384 1.00 0.00 C ATOM 1728 C THR A 112 -0.134 1.565 -10.424 1.00 0.00 C ATOM 1729 O THR A 112 -0.589 0.650 -11.115 1.00 0.00 O ATOM 1730 CB THR A 112 2.138 1.574 -11.726 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.547 1.737 -11.574 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.718 2.497 -12.878 1.00 0.00 C ATOM 0 H THR A 112 2.098 0.030 -9.573 1.00 0.00 H new ATOM 0 HA THR A 112 1.505 2.920 -10.187 1.00 0.00 H new ATOM 0 HB THR A 112 1.865 0.548 -11.975 1.00 0.00 H new ATOM 0 HG1 THR A 112 3.991 1.555 -12.428 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.280 2.238 -13.775 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.652 2.377 -13.070 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.923 3.533 -12.608 1.00 0.00 H new ATOM 1740 N MET A 113 -0.910 2.365 -9.670 1.00 0.00 N ATOM 1741 CA MET A 113 -2.385 2.202 -9.549 1.00 0.00 C ATOM 1742 C MET A 113 -3.092 3.075 -10.619 1.00 0.00 C ATOM 1743 O MET A 113 -3.199 4.297 -10.474 1.00 0.00 O ATOM 1744 CB MET A 113 -2.891 2.558 -8.124 1.00 0.00 C ATOM 1745 CG MET A 113 -2.365 1.687 -6.976 1.00 0.00 C ATOM 1746 SD MET A 113 -3.236 2.138 -5.457 1.00 0.00 S ATOM 1747 CE MET A 113 -4.175 0.637 -5.107 1.00 0.00 C ATOM 0 H MET A 113 -0.540 3.144 -9.125 1.00 0.00 H new ATOM 0 HA MET A 113 -2.628 1.153 -9.719 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.625 3.594 -7.916 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.980 2.502 -8.124 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.520 0.632 -7.201 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.292 1.832 -6.853 1.00 0.00 H new ATOM 0 HE1 MET A 113 -4.758 0.776 -4.196 1.00 0.00 H new ATOM 0 HE2 MET A 113 -4.847 0.426 -5.939 1.00 0.00 H new ATOM 0 HE3 MET A 113 -3.488 -0.199 -4.974 1.00 0.00 H new ATOM 1757 N THR A 114 -3.559 2.429 -11.704 1.00 0.00 N ATOM 1758 CA THR A 114 -4.098 3.137 -12.896 1.00 0.00 C ATOM 1759 C THR A 114 -5.648 3.196 -12.801 1.00 0.00 C ATOM 1760 O THR A 114 -6.338 2.203 -13.053 1.00 0.00 O ATOM 1761 CB THR A 114 -3.594 2.516 -14.234 1.00 0.00 C ATOM 1762 OG1 THR A 114 -4.022 1.173 -14.383 1.00 0.00 O ATOM 1763 CG2 THR A 114 -2.068 2.546 -14.423 1.00 0.00 C ATOM 0 H THR A 114 -3.577 1.412 -11.786 1.00 0.00 H new ATOM 0 HA THR A 114 -3.717 4.158 -12.901 1.00 0.00 H new ATOM 0 HB THR A 114 -4.038 3.156 -14.996 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.856 1.039 -13.887 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.811 2.093 -15.381 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.719 3.579 -14.405 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.591 1.988 -13.618 1.00 0.00 H new ATOM 1771 N LEU A 115 -6.178 4.381 -12.448 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.640 4.641 -12.381 1.00 0.00 C ATOM 1773 C LEU A 115 -8.114 5.176 -13.767 1.00 0.00 C ATOM 1774 O LEU A 115 -8.238 6.390 -13.965 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.854 5.639 -11.201 1.00 0.00 C ATOM 1776 CG LEU A 115 -9.273 6.218 -10.940 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -10.265 5.174 -10.398 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -9.176 7.421 -9.981 1.00 0.00 C ATOM 0 H LEU A 115 -5.610 5.191 -12.200 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.238 3.751 -12.185 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.531 5.140 -10.287 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -7.181 6.482 -11.359 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.668 6.541 -11.903 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -11.236 5.643 -10.238 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -10.369 4.362 -11.118 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.894 4.776 -9.454 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.173 7.824 -9.801 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.738 7.099 -9.036 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.548 8.192 -10.427 1.00 0.00 H new ATOM 1790 N GLY A 116 -8.331 4.262 -14.735 1.00 0.00 N ATOM 1791 CA GLY A 116 -8.611 4.638 -16.142 1.00 0.00 C ATOM 1792 C GLY A 116 -7.374 5.207 -16.874 1.00 0.00 C ATOM 1793 O GLY A 116 -6.519 4.451 -17.341 1.00 0.00 O ATOM 0 H GLY A 116 -8.318 3.255 -14.570 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.974 3.763 -16.681 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.410 5.379 -16.162 1.00 0.00 H new ATOM 1797 N ASP A 117 -7.303 6.547 -16.924 1.00 0.00 N ATOM 1798 CA ASP A 117 -6.109 7.296 -17.422 1.00 0.00 C ATOM 1799 C ASP A 117 -5.189 7.915 -16.312 1.00 0.00 C ATOM 1800 O ASP A 117 -4.080 8.341 -16.650 1.00 0.00 O ATOM 1801 CB ASP A 117 -6.575 8.406 -18.408 1.00 0.00 C ATOM 1802 CG ASP A 117 -7.161 7.905 -19.739 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -6.378 7.572 -20.656 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -8.403 7.840 -19.867 1.00 0.00 O ATOM 0 H ASP A 117 -8.066 7.154 -16.623 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.484 6.555 -17.919 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -7.325 9.020 -17.909 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.726 9.054 -18.626 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.603 7.982 -15.025 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.830 8.642 -13.930 1.00 0.00 C ATOM 1811 C ILE A 118 -3.822 7.591 -13.369 1.00 0.00 C ATOM 1812 O ILE A 118 -4.210 6.669 -12.646 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.803 9.237 -12.845 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.744 10.348 -13.414 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -5.043 9.789 -11.608 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.891 10.806 -12.497 1.00 0.00 C ATOM 0 H ILE A 118 -6.486 7.580 -14.709 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.262 9.497 -14.296 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.421 8.396 -12.531 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.136 11.218 -13.661 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -7.176 9.986 -14.347 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.759 10.188 -10.889 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.472 8.985 -11.143 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.364 10.582 -11.922 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.473 11.578 -13.000 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.535 9.957 -12.268 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.479 11.208 -11.572 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.530 7.766 -13.700 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.459 6.786 -13.366 1.00 0.00 C ATOM 1830 C VAL A 119 -0.803 7.252 -12.030 1.00 0.00 C ATOM 1831 O VAL A 119 0.070 8.126 -12.039 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.447 6.662 -14.564 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.719 5.685 -14.281 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -1.099 6.229 -15.903 1.00 0.00 C ATOM 0 H VAL A 119 -2.191 8.585 -14.205 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.854 5.781 -13.218 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.068 7.679 -14.663 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.380 5.646 -15.147 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.280 6.030 -13.412 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.320 4.690 -14.084 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.334 6.167 -16.677 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.570 5.254 -15.780 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.852 6.961 -16.195 1.00 0.00 H new ATOM 1844 N PHE A 120 -1.212 6.647 -10.894 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.623 6.948 -9.558 1.00 0.00 C ATOM 1846 C PHE A 120 0.655 6.099 -9.352 1.00 0.00 C ATOM 1847 O PHE A 120 0.597 4.950 -8.906 1.00 0.00 O ATOM 1848 CB PHE A 120 -1.688 6.742 -8.446 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.318 7.021 -6.966 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -0.267 7.866 -6.578 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -2.118 6.442 -5.975 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -0.036 8.138 -5.232 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -1.893 6.723 -4.629 1.00 0.00 C ATOM 1854 CZ PHE A 120 -0.857 7.574 -4.261 1.00 0.00 C ATOM 0 H PHE A 120 -1.950 5.944 -10.869 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.321 7.994 -9.502 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.542 7.373 -8.692 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.027 5.708 -8.507 1.00 0.00 H new ATOM 0 HD1 PHE A 120 0.369 8.309 -7.330 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.917 5.772 -6.256 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.779 8.785 -4.943 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -2.523 6.280 -3.872 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.689 7.798 -3.218 1.00 0.00 H new ATOM 1864 N LYS A 121 1.803 6.714 -9.677 1.00 0.00 N ATOM 1865 CA LYS A 121 3.121 6.027 -9.637 1.00 0.00 C ATOM 1866 C LYS A 121 3.808 6.341 -8.279 1.00 0.00 C ATOM 1867 O LYS A 121 4.233 7.473 -8.024 1.00 0.00 O ATOM 1868 CB LYS A 121 3.948 6.443 -10.880 1.00 0.00 C ATOM 1869 CG LYS A 121 5.178 5.556 -11.160 1.00 0.00 C ATOM 1870 CD LYS A 121 5.983 6.048 -12.379 1.00 0.00 C ATOM 1871 CE LYS A 121 7.182 5.144 -12.716 1.00 0.00 C ATOM 1872 NZ LYS A 121 7.919 5.636 -13.892 1.00 0.00 N ATOM 0 H LYS A 121 1.854 7.689 -9.972 1.00 0.00 H new ATOM 0 HA LYS A 121 3.017 4.943 -9.689 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.298 6.426 -11.755 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.281 7.473 -10.750 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.823 5.544 -10.281 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.853 4.530 -11.331 1.00 0.00 H new ATOM 0 HD2 LYS A 121 5.323 6.103 -13.245 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.341 7.059 -12.186 1.00 0.00 H new ATOM 0 HE2 LYS A 121 7.854 5.096 -11.859 1.00 0.00 H new ATOM 0 HE3 LYS A 121 6.832 4.129 -12.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 8.720 5.003 -14.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 7.284 5.659 -14.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.275 6.595 -13.703 1.00 0.00 H new ATOM 1886 N ARG A 122 3.884 5.311 -7.420 1.00 0.00 N ATOM 1887 CA ARG A 122 4.450 5.420 -6.052 1.00 0.00 C ATOM 1888 C ARG A 122 5.854 4.769 -6.051 1.00 0.00 C ATOM 1889 O ARG A 122 5.973 3.542 -6.105 1.00 0.00 O ATOM 1890 CB ARG A 122 3.525 4.712 -5.024 1.00 0.00 C ATOM 1891 CG ARG A 122 2.224 5.469 -4.675 1.00 0.00 C ATOM 1892 CD ARG A 122 1.471 4.930 -3.441 1.00 0.00 C ATOM 1893 NE ARG A 122 0.851 3.598 -3.667 1.00 0.00 N ATOM 1894 CZ ARG A 122 -0.271 3.160 -3.062 1.00 0.00 C ATOM 1895 NH1 ARG A 122 -1.017 3.898 -2.242 1.00 0.00 N ATOM 1896 NH2 ARG A 122 -0.659 1.921 -3.296 1.00 0.00 N ATOM 0 H ARG A 122 3.555 4.373 -7.649 1.00 0.00 H new ATOM 0 HA ARG A 122 4.527 6.469 -5.766 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.260 3.729 -5.415 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.088 4.549 -4.105 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.466 6.518 -4.506 1.00 0.00 H new ATOM 0 HG3 ARG A 122 1.556 5.431 -5.536 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.163 4.863 -2.602 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.695 5.641 -3.158 1.00 0.00 H new ATOM 0 HE ARG A 122 1.308 2.970 -4.328 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -0.750 4.861 -2.037 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -1.855 3.500 -1.819 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -0.114 1.325 -3.919 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -1.504 1.559 -2.854 1.00 0.00 H new ATOM 1910 N ILE A 123 6.910 5.597 -5.966 1.00 0.00 N ATOM 1911 CA ILE A 123 8.321 5.112 -5.930 1.00 0.00 C ATOM 1912 C ILE A 123 8.686 5.071 -4.419 1.00 0.00 C ATOM 1913 O ILE A 123 8.838 6.127 -3.801 1.00 0.00 O ATOM 1914 CB ILE A 123 9.290 5.999 -6.797 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.935 6.070 -8.319 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.759 5.513 -6.673 1.00 0.00 C ATOM 1917 CD1 ILE A 123 7.892 7.127 -8.720 1.00 0.00 C ATOM 0 H ILE A 123 6.823 6.612 -5.920 1.00 0.00 H new ATOM 0 HA ILE A 123 8.430 4.127 -6.383 1.00 0.00 H new ATOM 0 HB ILE A 123 9.165 7.000 -6.385 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.851 6.263 -8.877 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.571 5.092 -8.633 1.00 0.00 H new ATOM 0 HG21 ILE A 123 11.404 6.145 -7.283 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.075 5.571 -5.631 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.831 4.481 -7.018 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.726 7.084 -9.796 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.955 6.929 -8.200 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.255 8.118 -8.448 1.00 0.00 H new ATOM 1929 N SER A 124 8.782 3.861 -3.836 1.00 0.00 N ATOM 1930 CA SER A 124 8.796 3.686 -2.360 1.00 0.00 C ATOM 1931 C SER A 124 9.972 2.762 -1.952 1.00 0.00 C ATOM 1932 O SER A 124 9.987 1.576 -2.286 1.00 0.00 O ATOM 1933 CB SER A 124 7.437 3.103 -1.900 1.00 0.00 C ATOM 1934 OG SER A 124 6.344 3.942 -2.259 1.00 0.00 O ATOM 0 H SER A 124 8.851 2.988 -4.358 1.00 0.00 H new ATOM 0 HA SER A 124 8.941 4.650 -1.872 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.297 2.117 -2.344 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.449 2.967 -0.819 1.00 0.00 H new ATOM 0 HG SER A 124 5.506 3.537 -1.952 1.00 0.00 H new ATOM 1940 N LYS A 125 10.957 3.311 -1.220 1.00 0.00 N ATOM 1941 CA LYS A 125 12.253 2.638 -0.950 1.00 0.00 C ATOM 1942 C LYS A 125 12.131 1.510 0.112 1.00 0.00 C ATOM 1943 O LYS A 125 11.604 1.726 1.208 1.00 0.00 O ATOM 1944 CB LYS A 125 13.233 3.743 -0.466 1.00 0.00 C ATOM 1945 CG LYS A 125 14.716 3.352 -0.270 1.00 0.00 C ATOM 1946 CD LYS A 125 15.583 3.278 -1.546 1.00 0.00 C ATOM 1947 CE LYS A 125 15.885 4.606 -2.273 1.00 0.00 C ATOM 1948 NZ LYS A 125 16.802 5.486 -1.524 1.00 0.00 N ATOM 0 H LYS A 125 10.883 4.235 -0.795 1.00 0.00 H new ATOM 0 HA LYS A 125 12.610 2.149 -1.856 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.194 4.563 -1.183 1.00 0.00 H new ATOM 0 HB3 LYS A 125 12.860 4.130 0.482 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.171 4.071 0.411 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.751 2.380 0.223 1.00 0.00 H new ATOM 0 HD2 LYS A 125 16.533 2.814 -1.282 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.088 2.611 -2.252 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.319 4.387 -3.249 1.00 0.00 H new ATOM 0 HE3 LYS A 125 14.949 5.136 -2.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 16.964 6.359 -2.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 16.381 5.722 -0.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.708 4.998 -1.376 1.00 0.00 H new ATOM 1962 N ARG A 126 12.691 0.331 -0.210 1.00 0.00 N ATOM 1963 CA ARG A 126 12.707 -0.847 0.684 1.00 0.00 C ATOM 1964 C ARG A 126 13.738 -0.649 1.835 1.00 0.00 C ATOM 1965 O ARG A 126 14.938 -0.480 1.591 1.00 0.00 O ATOM 1966 CB ARG A 126 13.049 -2.069 -0.208 1.00 0.00 C ATOM 1967 CG ARG A 126 12.823 -3.434 0.469 1.00 0.00 C ATOM 1968 CD ARG A 126 12.965 -4.647 -0.472 1.00 0.00 C ATOM 1969 NE ARG A 126 14.366 -4.926 -0.876 1.00 0.00 N ATOM 1970 CZ ARG A 126 14.720 -5.826 -1.816 1.00 0.00 C ATOM 1971 NH1 ARG A 126 13.853 -6.558 -2.514 1.00 0.00 N ATOM 1972 NH2 ARG A 126 16.003 -5.999 -2.062 1.00 0.00 N ATOM 0 H ARG A 126 13.150 0.164 -1.105 1.00 0.00 H new ATOM 0 HA ARG A 126 11.744 -0.997 1.171 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.445 -2.022 -1.114 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.092 -1.998 -0.516 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.534 -3.541 1.288 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.826 -3.446 0.909 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.556 -5.529 0.021 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.366 -4.475 -1.366 1.00 0.00 H new ATOM 0 HE ARG A 126 15.109 -4.403 -0.413 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.851 -6.455 -2.351 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.191 -7.221 -3.211 1.00 0.00 H new ATOM 0 HH21 ARG A 126 16.698 -5.459 -1.547 1.00 0.00 H new ATOM 0 HH22 ARG A 126 16.301 -6.673 -2.768 1.00 0.00 H new ATOM 1986 N ILE A 127 13.226 -0.630 3.075 1.00 0.00 N ATOM 1987 CA ILE A 127 13.997 -0.213 4.274 1.00 0.00 C ATOM 1988 C ILE A 127 13.630 -1.196 5.396 1.00 0.00 C ATOM 1989 O ILE A 127 14.294 -2.214 5.595 1.00 0.00 O ATOM 1990 CB ILE A 127 13.766 1.284 4.688 1.00 0.00 C ATOM 1991 CG1 ILE A 127 12.282 1.681 4.975 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.415 2.251 3.666 1.00 0.00 C ATOM 1993 CD1 ILE A 127 12.081 3.013 5.713 1.00 0.00 C ATOM 0 H ILE A 127 12.265 -0.902 3.283 1.00 0.00 H new ATOM 0 HA ILE A 127 15.064 -0.252 4.054 1.00 0.00 H new ATOM 0 HB ILE A 127 14.266 1.382 5.652 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.747 1.728 4.026 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.820 0.888 5.562 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.240 3.281 3.977 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.488 2.064 3.619 1.00 0.00 H new ATOM 0 HG23 ILE A 127 13.975 2.090 2.682 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.016 3.190 5.860 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.579 2.971 6.682 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.506 3.824 5.122 1.00 0.00 H new