USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 968 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 93 HIS :FLIP no HE2:sc= -0.921 F(o=-2.8,f=-1.1) USER MOD Set 1.2: A 95 THR OG1 : rot -92:sc= -0.171 USER MOD Set 2.1: A 57 LYS NZ :NH3+ 170:sc= 1.16 (180deg=0) USER MOD Set 2.2: A 58 HIS : no HE2:sc= -5.89! C(o=-4.7!,f=-17!) USER MOD Set 3.1: A 14 SER OG : rot -140:sc= 0.215 USER MOD Set 3.2: A 27 ASN : amide:sc= -0.0594! X(o=0.65!,f=0.16) USER MOD Set 3.3: A 76 THR OG1 : rot 120:sc= 0.27 USER MOD Set 3.4: A 124 LYS NZ :NH3+ -159:sc= 0.228 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot -14:sc= -1.04 USER MOD Single : A 18 ASN : amide:sc= -0.0667 K(o=-0.067,f=-6.5!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 178:sc= -2.18! (180deg=-2.22!) USER MOD Single : A 42 MET CE :methyl -109:sc= -2.89! (180deg=-6.25!) USER MOD Single : A 43 THR OG1 : rot 62:sc= -3.01! USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 30:sc= -0.629 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -118:sc= -0.146 (180deg=-4.95!) USER MOD Single : A 51 THR OG1 : rot -26:sc= -0.448 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 135:sc= 0.804 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= -0.508 USER MOD Single : A 84 TYR OH : rot 180:sc= -0.0904 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 GLN : amide:sc=-0.00454 X(o=-0.0045,f=-0.073) USER MOD Single : A 98 SER OG : rot -52:sc= 0.987 USER MOD Single : A 116 SER OG : rot -72:sc= -0.651 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl -107:sc= -5.33! (180deg=-7.74!) USER MOD Single : A 127 MET CE :methyl -154:sc= -2.6! (180deg=-4.91!) USER MOD Single : A 128 ASN : amide:sc= -0.351! C(o=-0.35!,f=-4.2!) USER MOD Single : A 133 SER OG : rot 180:sc=-0.00526 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 -14.025 -10.286 4.123 1.00 0.00 N ATOM 67 CA LEU A 8 -13.976 -8.834 4.103 1.00 0.00 C ATOM 68 C LEU A 8 -13.966 -8.348 2.653 1.00 0.00 C ATOM 69 O LEU A 8 -15.018 -8.072 2.079 1.00 0.00 O ATOM 70 CB LEU A 8 -12.794 -8.326 4.931 1.00 0.00 C ATOM 71 CG LEU A 8 -12.909 -8.505 6.446 1.00 0.00 C ATOM 72 CD1 LEU A 8 -14.332 -8.210 6.926 1.00 0.00 C ATOM 73 CD2 LEU A 8 -12.438 -9.897 6.871 1.00 0.00 C ATOM 0 HA LEU A 8 -14.867 -8.416 4.573 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.893 -8.837 4.592 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.658 -7.265 4.720 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.250 -7.782 6.927 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.387 -8.345 8.006 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.595 -7.183 6.674 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -15.029 -8.893 6.440 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -12.530 -9.998 7.952 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -13.052 -10.654 6.382 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.396 -10.033 6.581 1.00 0.00 H new ATOM 85 N GLY A 9 -12.764 -8.257 2.101 1.00 0.00 N ATOM 86 CA GLY A 9 -12.603 -7.809 0.728 1.00 0.00 C ATOM 87 C GLY A 9 -11.198 -8.124 0.211 1.00 0.00 C ATOM 88 O GLY A 9 -10.466 -8.901 0.822 1.00 0.00 O ATOM 0 H GLY A 9 -11.893 -8.486 2.580 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.345 -8.294 0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.785 -6.736 0.668 1.00 0.00 H new ATOM 92 N THR A 10 -10.862 -7.504 -0.911 1.00 0.00 N ATOM 93 CA THR A 10 -9.558 -7.708 -1.518 1.00 0.00 C ATOM 94 C THR A 10 -8.781 -6.391 -1.568 1.00 0.00 C ATOM 95 O THR A 10 -9.337 -5.328 -1.296 1.00 0.00 O ATOM 96 CB THR A 10 -9.771 -8.340 -2.895 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.424 -9.575 -2.613 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.456 -8.757 -3.557 1.00 0.00 C ATOM 0 H THR A 10 -11.471 -6.860 -1.416 1.00 0.00 H new ATOM 0 HA THR A 10 -8.947 -8.387 -0.923 1.00 0.00 H new ATOM 0 HB THR A 10 -10.295 -7.635 -3.541 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.602 -10.050 -3.452 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.663 -9.200 -4.531 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.819 -7.882 -3.684 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.947 -9.487 -2.928 1.00 0.00 H new ATOM 106 N LEU A 11 -7.508 -6.504 -1.917 1.00 0.00 N ATOM 107 CA LEU A 11 -6.649 -5.336 -2.006 1.00 0.00 C ATOM 108 C LEU A 11 -5.775 -5.445 -3.257 1.00 0.00 C ATOM 109 O LEU A 11 -5.037 -6.416 -3.420 1.00 0.00 O ATOM 110 CB LEU A 11 -5.853 -5.157 -0.713 1.00 0.00 C ATOM 111 CG LEU A 11 -4.659 -4.202 -0.787 1.00 0.00 C ATOM 112 CD1 LEU A 11 -3.351 -4.973 -0.973 1.00 0.00 C ATOM 113 CD2 LEU A 11 -4.865 -3.150 -1.878 1.00 0.00 C ATOM 0 H LEU A 11 -7.051 -7.388 -2.142 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.247 -4.431 -2.113 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.532 -4.799 0.061 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.492 -6.135 -0.394 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.587 -3.671 0.162 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.519 -4.271 -1.023 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.205 -5.650 -0.131 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.396 -5.548 -1.898 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.002 -2.484 -1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.977 -3.644 -2.843 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.762 -2.571 -1.660 1.00 0.00 H new ATOM 125 N PHE A 12 -5.886 -4.436 -4.108 1.00 0.00 N ATOM 126 CA PHE A 12 -5.114 -4.406 -5.339 1.00 0.00 C ATOM 127 C PHE A 12 -3.976 -3.387 -5.248 1.00 0.00 C ATOM 128 O PHE A 12 -4.159 -2.292 -4.719 1.00 0.00 O ATOM 129 CB PHE A 12 -6.071 -3.987 -6.457 1.00 0.00 C ATOM 130 CG PHE A 12 -7.327 -4.854 -6.558 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.259 -6.185 -6.284 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.512 -4.295 -6.922 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.425 -6.989 -6.379 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.678 -5.099 -7.017 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.610 -6.430 -6.743 1.00 0.00 C ATOM 0 H PHE A 12 -6.499 -3.633 -3.970 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.674 -5.385 -5.526 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.369 -2.951 -6.297 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.540 -4.023 -7.408 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.318 -6.630 -5.994 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.566 -3.238 -7.139 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.371 -8.046 -6.162 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.619 -4.654 -7.307 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.497 -7.042 -6.815 1.00 0.00 H new ATOM 145 N PHE A 13 -2.826 -3.784 -5.773 1.00 0.00 N ATOM 146 CA PHE A 13 -1.659 -2.919 -5.759 1.00 0.00 C ATOM 147 C PHE A 13 -0.574 -3.446 -6.700 1.00 0.00 C ATOM 148 O PHE A 13 -0.714 -4.526 -7.271 1.00 0.00 O ATOM 149 CB PHE A 13 -1.119 -2.920 -4.327 1.00 0.00 C ATOM 150 CG PHE A 13 -0.534 -4.262 -3.883 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.350 -5.337 -3.716 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.801 -4.380 -3.656 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.807 -6.583 -3.304 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.345 -5.626 -3.245 1.00 0.00 C ATOM 155 CZ PHE A 13 0.529 -6.701 -3.077 1.00 0.00 C ATOM 0 H PHE A 13 -2.678 -4.693 -6.211 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.934 -1.918 -6.090 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.349 -2.153 -4.239 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.924 -2.643 -3.646 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.411 -5.243 -3.897 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.448 -3.526 -3.788 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.455 -7.437 -3.171 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.406 -5.720 -3.066 1.00 0.00 H new ATOM 0 HZ PHE A 13 0.942 -7.648 -2.763 1.00 0.00 H new ATOM 165 N SER A 14 0.483 -2.658 -6.833 1.00 0.00 N ATOM 166 CA SER A 14 1.591 -3.031 -7.696 1.00 0.00 C ATOM 167 C SER A 14 2.898 -2.456 -7.147 1.00 0.00 C ATOM 168 O SER A 14 2.918 -1.346 -6.617 1.00 0.00 O ATOM 169 CB SER A 14 1.359 -2.550 -9.129 1.00 0.00 C ATOM 170 OG SER A 14 0.754 -1.261 -9.169 1.00 0.00 O ATOM 0 H SER A 14 0.596 -1.763 -6.357 1.00 0.00 H new ATOM 0 HA SER A 14 1.660 -4.119 -7.714 1.00 0.00 H new ATOM 0 HB2 SER A 14 2.311 -2.520 -9.660 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.724 -3.265 -9.653 1.00 0.00 H new ATOM 0 HG SER A 14 0.084 -1.236 -9.884 1.00 0.00 H new ATOM 176 N LEU A 15 3.959 -3.237 -7.293 1.00 0.00 N ATOM 177 CA LEU A 15 5.267 -2.818 -6.819 1.00 0.00 C ATOM 178 C LEU A 15 6.126 -2.396 -8.012 1.00 0.00 C ATOM 179 O LEU A 15 6.016 -2.970 -9.095 1.00 0.00 O ATOM 180 CB LEU A 15 5.902 -3.915 -5.961 1.00 0.00 C ATOM 181 CG LEU A 15 5.154 -4.279 -4.677 1.00 0.00 C ATOM 182 CD1 LEU A 15 5.233 -5.782 -4.404 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.664 -3.455 -3.493 1.00 0.00 C ATOM 0 H LEU A 15 3.939 -4.157 -7.733 1.00 0.00 H new ATOM 0 HA LEU A 15 5.176 -1.948 -6.168 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.998 -4.814 -6.569 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.911 -3.601 -5.694 1.00 0.00 H new ATOM 0 HG LEU A 15 4.101 -4.031 -4.813 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.693 -6.014 -3.486 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.786 -6.327 -5.235 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.277 -6.078 -4.296 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.116 -3.733 -2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.726 -3.649 -3.345 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.514 -2.395 -3.696 1.00 0.00 H new ATOM 195 N GLU A 16 6.962 -1.396 -7.774 1.00 0.00 N ATOM 196 CA GLU A 16 7.839 -0.890 -8.816 1.00 0.00 C ATOM 197 C GLU A 16 9.046 -0.183 -8.197 1.00 0.00 C ATOM 198 O GLU A 16 8.890 0.676 -7.330 1.00 0.00 O ATOM 199 CB GLU A 16 7.084 0.044 -9.764 1.00 0.00 C ATOM 200 CG GLU A 16 8.055 0.894 -10.585 1.00 0.00 C ATOM 201 CD GLU A 16 7.612 0.974 -12.048 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.493 1.482 -12.275 1.00 0.00 O ATOM 203 OE2 GLU A 16 8.403 0.525 -12.905 1.00 0.00 O ATOM 0 H GLU A 16 7.051 -0.923 -6.875 1.00 0.00 H new ATOM 0 HA GLU A 16 8.199 -1.736 -9.402 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.454 -0.543 -10.433 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.423 0.693 -9.190 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.112 1.897 -10.163 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.056 0.467 -10.527 1.00 0.00 H new ATOM 210 N TYR A 17 10.224 -0.570 -8.665 1.00 0.00 N ATOM 211 CA TYR A 17 11.457 0.016 -8.168 1.00 0.00 C ATOM 212 C TYR A 17 11.996 1.066 -9.141 1.00 0.00 C ATOM 213 O TYR A 17 12.092 0.814 -10.341 1.00 0.00 O ATOM 214 CB TYR A 17 12.461 -1.134 -8.069 1.00 0.00 C ATOM 215 CG TYR A 17 13.761 -0.765 -7.352 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.787 -0.674 -5.975 1.00 0.00 C ATOM 217 CD2 TYR A 17 14.907 -0.524 -8.081 1.00 0.00 C ATOM 218 CE1 TYR A 17 15.011 -0.327 -5.299 1.00 0.00 C ATOM 219 CE2 TYR A 17 16.131 -0.177 -7.406 1.00 0.00 C ATOM 220 CZ TYR A 17 16.122 -0.096 -6.048 1.00 0.00 C ATOM 221 OH TYR A 17 17.278 0.232 -5.410 1.00 0.00 O ATOM 0 H TYR A 17 10.350 -1.283 -9.384 1.00 0.00 H new ATOM 0 HA TYR A 17 11.289 0.508 -7.210 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.993 -1.967 -7.545 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.699 -1.483 -9.074 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.890 -0.863 -5.404 1.00 0.00 H new ATOM 0 HD2 TYR A 17 14.886 -0.596 -9.158 1.00 0.00 H new ATOM 0 HE1 TYR A 17 15.045 -0.252 -4.222 1.00 0.00 H new ATOM 0 HE2 TYR A 17 17.035 0.014 -7.965 1.00 0.00 H new ATOM 0 HH TYR A 17 17.081 0.476 -4.481 1.00 0.00 H new ATOM 231 N ASN A 18 12.335 2.221 -8.587 1.00 0.00 N ATOM 232 CA ASN A 18 12.862 3.311 -9.392 1.00 0.00 C ATOM 233 C ASN A 18 14.314 3.006 -9.765 1.00 0.00 C ATOM 234 O ASN A 18 15.216 3.780 -9.449 1.00 0.00 O ATOM 235 CB ASN A 18 12.840 4.629 -8.616 1.00 0.00 C ATOM 236 CG ASN A 18 13.084 5.818 -9.547 1.00 0.00 C ATOM 237 OD1 ASN A 18 13.979 5.816 -10.376 1.00 0.00 O ATOM 238 ND2 ASN A 18 12.241 6.830 -9.365 1.00 0.00 N ATOM 0 H ASN A 18 12.255 2.426 -7.591 1.00 0.00 H new ATOM 0 HA ASN A 18 12.239 3.406 -10.281 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.878 4.745 -8.117 1.00 0.00 H new ATOM 0 HB3 ASN A 18 13.603 4.610 -7.838 1.00 0.00 H new ATOM 0 HD21 ASN A 18 12.322 7.670 -9.938 1.00 0.00 H new ATOM 0 HD22 ASN A 18 11.514 6.766 -8.653 1.00 0.00 H new ATOM 245 N PHE A 19 14.495 1.877 -10.434 1.00 0.00 N ATOM 246 CA PHE A 19 15.822 1.460 -10.854 1.00 0.00 C ATOM 247 C PHE A 19 16.681 2.668 -11.236 1.00 0.00 C ATOM 248 O PHE A 19 17.813 2.801 -10.773 1.00 0.00 O ATOM 249 CB PHE A 19 15.643 0.568 -12.084 1.00 0.00 C ATOM 250 CG PHE A 19 14.989 -0.782 -11.783 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.731 -1.796 -11.264 1.00 0.00 C ATOM 252 CD2 PHE A 19 13.665 -0.968 -12.035 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.124 -3.049 -10.985 1.00 0.00 C ATOM 254 CE2 PHE A 19 13.059 -2.221 -11.756 1.00 0.00 C ATOM 255 CZ PHE A 19 13.801 -3.235 -11.237 1.00 0.00 C ATOM 0 H PHE A 19 13.744 1.238 -10.696 1.00 0.00 H new ATOM 0 HA PHE A 19 16.322 0.935 -10.040 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.037 1.098 -12.819 1.00 0.00 H new ATOM 0 HB3 PHE A 19 16.618 0.394 -12.539 1.00 0.00 H new ATOM 0 HD1 PHE A 19 16.782 -1.649 -11.064 1.00 0.00 H new ATOM 0 HD2 PHE A 19 13.075 -0.163 -12.447 1.00 0.00 H new ATOM 0 HE1 PHE A 19 15.713 -3.854 -10.573 1.00 0.00 H new ATOM 0 HE2 PHE A 19 12.008 -2.369 -11.956 1.00 0.00 H new ATOM 0 HZ PHE A 19 13.340 -4.188 -11.025 1.00 0.00 H new ATOM 265 N GLU A 20 16.109 3.518 -12.076 1.00 0.00 N ATOM 266 CA GLU A 20 16.807 4.710 -12.525 1.00 0.00 C ATOM 267 C GLU A 20 17.493 5.401 -11.344 1.00 0.00 C ATOM 268 O GLU A 20 18.677 5.726 -11.412 1.00 0.00 O ATOM 269 CB GLU A 20 15.853 5.668 -13.242 1.00 0.00 C ATOM 270 CG GLU A 20 16.619 6.827 -13.884 1.00 0.00 C ATOM 271 CD GLU A 20 16.154 7.060 -15.323 1.00 0.00 C ATOM 272 OE1 GLU A 20 15.956 6.046 -16.027 1.00 0.00 O ATOM 273 OE2 GLU A 20 16.008 8.247 -15.687 1.00 0.00 O ATOM 0 H GLU A 20 15.170 3.405 -12.457 1.00 0.00 H new ATOM 0 HA GLU A 20 17.573 4.410 -13.240 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.296 5.127 -14.007 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.123 6.058 -12.533 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.471 7.734 -13.299 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.687 6.612 -13.873 1.00 0.00 H new ATOM 280 N ARG A 21 16.718 5.605 -10.289 1.00 0.00 N ATOM 281 CA ARG A 21 17.235 6.250 -9.094 1.00 0.00 C ATOM 282 C ARG A 21 17.344 5.241 -7.950 1.00 0.00 C ATOM 283 O ARG A 21 17.348 5.621 -6.780 1.00 0.00 O ATOM 284 CB ARG A 21 16.335 7.408 -8.660 1.00 0.00 C ATOM 285 CG ARG A 21 15.939 8.274 -9.858 1.00 0.00 C ATOM 286 CD ARG A 21 14.705 9.120 -9.539 1.00 0.00 C ATOM 287 NE ARG A 21 15.092 10.539 -9.377 1.00 0.00 N ATOM 288 CZ ARG A 21 15.463 11.337 -10.388 1.00 0.00 C ATOM 289 NH1 ARG A 21 15.500 10.859 -11.639 1.00 0.00 N ATOM 290 NH2 ARG A 21 15.798 12.612 -10.147 1.00 0.00 N ATOM 0 H ARG A 21 15.736 5.335 -10.237 1.00 0.00 H new ATOM 0 HA ARG A 21 18.224 6.643 -9.331 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.439 7.016 -8.178 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.853 8.019 -7.921 1.00 0.00 H new ATOM 0 HG2 ARG A 21 16.770 8.925 -10.131 1.00 0.00 H new ATOM 0 HG3 ARG A 21 15.736 7.638 -10.720 1.00 0.00 H new ATOM 0 HD2 ARG A 21 13.971 9.024 -10.339 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.231 8.757 -8.627 1.00 0.00 H new ATOM 0 HE ARG A 21 15.075 10.935 -8.437 1.00 0.00 H new ATOM 0 HH11 ARG A 21 15.246 9.888 -11.822 1.00 0.00 H new ATOM 0 HH12 ARG A 21 15.782 11.466 -12.409 1.00 0.00 H new ATOM 0 HH21 ARG A 21 15.771 12.975 -9.194 1.00 0.00 H new ATOM 0 HH22 ARG A 21 16.080 13.219 -10.916 1.00 0.00 H new ATOM 304 N LYS A 22 17.430 3.974 -8.327 1.00 0.00 N ATOM 305 CA LYS A 22 17.538 2.907 -7.347 1.00 0.00 C ATOM 306 C LYS A 22 16.675 3.248 -6.130 1.00 0.00 C ATOM 307 O LYS A 22 17.198 3.499 -5.045 1.00 0.00 O ATOM 308 CB LYS A 22 19.005 2.640 -7.005 1.00 0.00 C ATOM 309 CG LYS A 22 19.595 1.564 -7.920 1.00 0.00 C ATOM 310 CD LYS A 22 20.094 0.368 -7.108 1.00 0.00 C ATOM 311 CE LYS A 22 21.153 0.798 -6.091 1.00 0.00 C ATOM 312 NZ LYS A 22 22.314 -0.120 -6.132 1.00 0.00 N ATOM 0 H LYS A 22 17.427 3.662 -9.298 1.00 0.00 H new ATOM 0 HA LYS A 22 17.155 1.973 -7.758 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.579 3.561 -7.104 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.088 2.324 -5.965 1.00 0.00 H new ATOM 0 HG2 LYS A 22 18.840 1.234 -8.633 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.418 1.984 -8.498 1.00 0.00 H new ATOM 0 HD2 LYS A 22 19.256 -0.099 -6.590 1.00 0.00 H new ATOM 0 HD3 LYS A 22 20.513 -0.382 -7.779 1.00 0.00 H new ATOM 0 HE2 LYS A 22 21.479 1.816 -6.305 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.722 0.805 -5.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 23.023 0.186 -5.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.001 -1.086 -5.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.734 -0.106 -7.083 1.00 0.00 H new ATOM 326 N ALA A 23 15.369 3.247 -6.352 1.00 0.00 N ATOM 327 CA ALA A 23 14.429 3.554 -5.287 1.00 0.00 C ATOM 328 C ALA A 23 13.269 2.557 -5.334 1.00 0.00 C ATOM 329 O ALA A 23 13.152 1.780 -6.280 1.00 0.00 O ATOM 330 CB ALA A 23 13.959 5.003 -5.423 1.00 0.00 C ATOM 0 H ALA A 23 14.939 3.039 -7.253 1.00 0.00 H new ATOM 0 HA ALA A 23 14.907 3.457 -4.312 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.254 5.233 -4.624 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.817 5.672 -5.354 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.471 5.138 -6.388 1.00 0.00 H new ATOM 336 N PHE A 24 12.442 2.613 -4.300 1.00 0.00 N ATOM 337 CA PHE A 24 11.295 1.724 -4.212 1.00 0.00 C ATOM 338 C PHE A 24 9.986 2.503 -4.358 1.00 0.00 C ATOM 339 O PHE A 24 9.833 3.581 -3.786 1.00 0.00 O ATOM 340 CB PHE A 24 11.337 1.077 -2.826 1.00 0.00 C ATOM 341 CG PHE A 24 10.296 -0.026 -2.623 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.933 -0.819 -3.667 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.734 -0.213 -1.399 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.966 -1.842 -3.478 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.767 -1.236 -1.210 1.00 0.00 C ATOM 346 CZ PHE A 24 8.404 -2.029 -2.254 1.00 0.00 C ATOM 0 H PHE A 24 12.543 3.259 -3.517 1.00 0.00 H new ATOM 0 HA PHE A 24 11.337 0.982 -5.009 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.330 0.660 -2.661 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.186 1.849 -2.071 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.380 -0.671 -4.639 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.023 0.416 -0.570 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.677 -2.471 -4.307 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.320 -1.384 -0.238 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.669 -2.807 -2.111 1.00 0.00 H new ATOM 356 N VAL A 25 9.075 1.926 -5.128 1.00 0.00 N ATOM 357 CA VAL A 25 7.784 2.552 -5.357 1.00 0.00 C ATOM 358 C VAL A 25 6.673 1.538 -5.076 1.00 0.00 C ATOM 359 O VAL A 25 6.552 0.534 -5.776 1.00 0.00 O ATOM 360 CB VAL A 25 7.724 3.127 -6.774 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.667 4.228 -6.875 1.00 0.00 C ATOM 362 CG2 VAL A 25 9.096 3.641 -7.214 1.00 0.00 C ATOM 0 H VAL A 25 9.205 1.032 -5.601 1.00 0.00 H new ATOM 0 HA VAL A 25 7.640 3.390 -4.675 1.00 0.00 H new ATOM 0 HB VAL A 25 7.434 2.323 -7.451 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.645 4.619 -7.892 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.689 3.818 -6.623 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.912 5.033 -6.182 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.027 4.044 -8.224 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.427 4.425 -6.532 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.814 2.821 -7.199 1.00 0.00 H new ATOM 372 N VAL A 26 5.889 1.836 -4.050 1.00 0.00 N ATOM 373 CA VAL A 26 4.793 0.963 -3.667 1.00 0.00 C ATOM 374 C VAL A 26 3.465 1.636 -4.020 1.00 0.00 C ATOM 375 O VAL A 26 2.974 2.480 -3.271 1.00 0.00 O ATOM 376 CB VAL A 26 4.905 0.600 -2.185 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.748 -0.304 -1.753 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.254 -0.053 -1.881 1.00 0.00 C ATOM 0 H VAL A 26 5.991 2.670 -3.472 1.00 0.00 H new ATOM 0 HA VAL A 26 4.840 0.025 -4.221 1.00 0.00 H new ATOM 0 HB VAL A 26 4.842 1.523 -1.608 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.852 -0.547 -0.696 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.802 0.213 -1.916 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.765 -1.222 -2.340 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.308 -0.301 -0.821 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.359 -0.963 -2.472 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.058 0.639 -2.133 1.00 0.00 H new ATOM 388 N ASN A 27 2.920 1.237 -5.159 1.00 0.00 N ATOM 389 CA ASN A 27 1.658 1.791 -5.620 1.00 0.00 C ATOM 390 C ASN A 27 0.503 1.047 -4.946 1.00 0.00 C ATOM 391 O ASN A 27 0.499 -0.182 -4.891 1.00 0.00 O ATOM 392 CB ASN A 27 1.505 1.629 -7.133 1.00 0.00 C ATOM 393 CG ASN A 27 0.064 1.903 -7.571 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.639 1.034 -8.061 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.334 3.155 -7.369 1.00 0.00 N ATOM 0 H ASN A 27 3.329 0.536 -5.777 1.00 0.00 H new ATOM 0 HA ASN A 27 1.643 2.851 -5.368 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.181 2.313 -7.646 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.792 0.619 -7.425 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.279 3.438 -7.629 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.305 3.833 -6.954 1.00 0.00 H new ATOM 402 N ILE A 28 -0.449 1.823 -4.449 1.00 0.00 N ATOM 403 CA ILE A 28 -1.606 1.253 -3.780 1.00 0.00 C ATOM 404 C ILE A 28 -2.857 1.518 -4.621 1.00 0.00 C ATOM 405 O ILE A 28 -3.415 2.614 -4.581 1.00 0.00 O ATOM 406 CB ILE A 28 -1.707 1.775 -2.346 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.511 1.316 -1.510 1.00 0.00 C ATOM 408 CG2 ILE A 28 -3.039 1.373 -1.709 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.162 2.350 -0.437 1.00 0.00 C ATOM 0 H ILE A 28 -0.443 2.842 -4.496 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.502 0.171 -3.694 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.680 2.864 -2.376 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.738 0.360 -1.038 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.350 1.155 -2.159 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -3.085 1.757 -0.690 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.861 1.789 -2.291 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.121 0.286 -1.692 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.692 1.999 0.143 1.00 0.00 H new ATOM 0 HD12 ILE A 28 0.088 3.298 -0.913 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.017 2.491 0.225 1.00 0.00 H new ATOM 421 N LYS A 29 -3.261 0.497 -5.362 1.00 0.00 N ATOM 422 CA LYS A 29 -4.435 0.606 -6.210 1.00 0.00 C ATOM 423 C LYS A 29 -5.661 0.897 -5.342 1.00 0.00 C ATOM 424 O LYS A 29 -5.593 1.705 -4.417 1.00 0.00 O ATOM 425 CB LYS A 29 -4.583 -0.641 -7.084 1.00 0.00 C ATOM 426 CG LYS A 29 -5.271 -0.304 -8.409 1.00 0.00 C ATOM 427 CD LYS A 29 -4.767 -1.210 -9.534 1.00 0.00 C ATOM 428 CE LYS A 29 -5.930 -1.737 -10.377 1.00 0.00 C ATOM 429 NZ LYS A 29 -6.282 -0.767 -11.438 1.00 0.00 N ATOM 0 H LYS A 29 -2.796 -0.410 -5.393 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.328 1.441 -6.902 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.601 -1.071 -7.279 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.161 -1.396 -6.552 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.350 -0.417 -8.302 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.084 0.739 -8.665 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.075 -0.657 -10.169 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.212 -2.047 -9.110 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -5.658 -2.693 -10.825 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.796 -1.918 -9.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -7.073 -1.140 -12.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.561 0.136 -11.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.459 -0.614 -12.056 1.00 0.00 H new ATOM 443 N GLU A 30 -6.753 0.224 -5.672 1.00 0.00 N ATOM 444 CA GLU A 30 -7.992 0.400 -4.934 1.00 0.00 C ATOM 445 C GLU A 30 -8.352 -0.885 -4.186 1.00 0.00 C ATOM 446 O GLU A 30 -7.684 -1.906 -4.342 1.00 0.00 O ATOM 447 CB GLU A 30 -9.129 0.829 -5.865 1.00 0.00 C ATOM 448 CG GLU A 30 -9.485 -0.290 -6.846 1.00 0.00 C ATOM 449 CD GLU A 30 -10.998 -0.515 -6.895 1.00 0.00 C ATOM 450 OE1 GLU A 30 -11.725 0.445 -6.562 1.00 0.00 O ATOM 451 OE2 GLU A 30 -11.392 -1.642 -7.264 1.00 0.00 O ATOM 0 H GLU A 30 -6.806 -0.444 -6.441 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.846 1.194 -4.202 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.007 1.094 -5.275 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.835 1.722 -6.417 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.119 -0.036 -7.841 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.986 -1.212 -6.548 1.00 0.00 H new ATOM 458 N ALA A 31 -9.406 -0.792 -3.389 1.00 0.00 N ATOM 459 CA ALA A 31 -9.863 -1.935 -2.616 1.00 0.00 C ATOM 460 C ALA A 31 -11.344 -2.183 -2.906 1.00 0.00 C ATOM 461 O ALA A 31 -12.159 -1.266 -2.820 1.00 0.00 O ATOM 462 CB ALA A 31 -9.594 -1.687 -1.130 1.00 0.00 C ATOM 0 H ALA A 31 -9.957 0.057 -3.262 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.316 -2.834 -2.901 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.937 -2.544 -0.550 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.525 -1.546 -0.972 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -10.129 -0.794 -0.808 1.00 0.00 H new ATOM 468 N ARG A 32 -11.647 -3.428 -3.245 1.00 0.00 N ATOM 469 CA ARG A 32 -13.016 -3.808 -3.549 1.00 0.00 C ATOM 470 C ARG A 32 -13.505 -4.869 -2.560 1.00 0.00 C ATOM 471 O ARG A 32 -12.759 -5.779 -2.202 1.00 0.00 O ATOM 472 CB ARG A 32 -13.133 -4.356 -4.973 1.00 0.00 C ATOM 473 CG ARG A 32 -13.711 -3.303 -5.920 1.00 0.00 C ATOM 474 CD ARG A 32 -15.056 -3.758 -6.490 1.00 0.00 C ATOM 475 NE ARG A 32 -15.388 -2.968 -7.696 1.00 0.00 N ATOM 476 CZ ARG A 32 -14.774 -3.108 -8.879 1.00 0.00 C ATOM 477 NH1 ARG A 32 -13.792 -4.008 -9.021 1.00 0.00 N ATOM 478 NH2 ARG A 32 -15.141 -2.347 -9.919 1.00 0.00 N ATOM 0 H ARG A 32 -10.968 -4.186 -3.316 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.634 -2.914 -3.464 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.151 -4.669 -5.328 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.770 -5.241 -4.975 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.838 -2.360 -5.388 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.011 -3.118 -6.734 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -15.014 -4.818 -6.740 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.838 -3.638 -5.740 1.00 0.00 H new ATOM 0 HE ARG A 32 -16.131 -2.273 -7.622 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -13.512 -4.586 -8.229 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -13.324 -4.115 -9.921 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.888 -1.661 -9.810 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -14.673 -2.454 -10.819 1.00 0.00 H new ATOM 492 N GLY A 33 -14.754 -4.716 -2.147 1.00 0.00 N ATOM 493 CA GLY A 33 -15.351 -5.649 -1.206 1.00 0.00 C ATOM 494 C GLY A 33 -15.176 -5.163 0.234 1.00 0.00 C ATOM 495 O GLY A 33 -14.764 -5.928 1.105 1.00 0.00 O ATOM 0 H GLY A 33 -15.370 -3.960 -2.447 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.412 -5.766 -1.428 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.891 -6.631 -1.321 1.00 0.00 H new ATOM 499 N LEU A 34 -15.497 -3.895 0.440 1.00 0.00 N ATOM 500 CA LEU A 34 -15.380 -3.298 1.760 1.00 0.00 C ATOM 501 C LEU A 34 -16.758 -3.266 2.424 1.00 0.00 C ATOM 502 O LEU A 34 -17.686 -2.645 1.908 1.00 0.00 O ATOM 503 CB LEU A 34 -14.709 -1.926 1.670 1.00 0.00 C ATOM 504 CG LEU A 34 -13.438 -1.855 0.821 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.639 -0.589 1.135 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.596 -3.121 0.988 1.00 0.00 C ATOM 0 H LEU A 34 -15.838 -3.264 -0.285 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.733 -3.903 2.396 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.431 -1.216 1.267 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.466 -1.595 2.680 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.730 -1.799 -0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.741 -0.563 0.518 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.250 0.289 0.923 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.356 -0.589 2.188 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.699 -3.045 0.374 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.311 -3.233 2.034 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.177 -3.988 0.675 1.00 0.00 H new ATOM 518 N PRO A 35 -16.851 -3.962 3.589 1.00 0.00 N ATOM 519 CA PRO A 35 -18.099 -4.020 4.329 1.00 0.00 C ATOM 520 C PRO A 35 -18.367 -2.700 5.056 1.00 0.00 C ATOM 521 O PRO A 35 -17.487 -2.171 5.733 1.00 0.00 O ATOM 522 CB PRO A 35 -17.941 -5.198 5.276 1.00 0.00 C ATOM 523 CG PRO A 35 -16.448 -5.467 5.361 1.00 0.00 C ATOM 524 CD PRO A 35 -15.773 -4.710 4.229 1.00 0.00 C ATOM 0 HA PRO A 35 -18.965 -4.160 3.682 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.353 -4.967 6.258 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.475 -6.072 4.904 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.056 -5.142 6.325 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.247 -6.535 5.279 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -14.998 -4.043 4.606 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.293 -5.392 3.527 1.00 0.00 H new ATOM 532 N ALA A 36 -19.586 -2.207 4.891 1.00 0.00 N ATOM 533 CA ALA A 36 -19.980 -0.960 5.523 1.00 0.00 C ATOM 534 C ALA A 36 -19.742 -1.059 7.031 1.00 0.00 C ATOM 535 O ALA A 36 -19.899 -2.128 7.619 1.00 0.00 O ATOM 536 CB ALA A 36 -21.440 -0.655 5.183 1.00 0.00 C ATOM 0 H ALA A 36 -20.313 -2.649 4.329 1.00 0.00 H new ATOM 0 HA ALA A 36 -19.377 -0.133 5.148 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.736 0.281 5.657 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.551 -0.565 4.102 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -22.075 -1.463 5.547 1.00 0.00 H new ATOM 542 N MET A 37 -19.365 0.070 7.614 1.00 0.00 N ATOM 543 CA MET A 37 -19.103 0.123 9.042 1.00 0.00 C ATOM 544 C MET A 37 -20.178 0.936 9.767 1.00 0.00 C ATOM 545 O MET A 37 -20.488 0.666 10.926 1.00 0.00 O ATOM 546 CB MET A 37 -17.732 0.757 9.286 1.00 0.00 C ATOM 547 CG MET A 37 -16.625 -0.298 9.245 1.00 0.00 C ATOM 548 SD MET A 37 -16.807 -1.428 10.615 1.00 0.00 S ATOM 549 CE MET A 37 -15.551 -2.626 10.198 1.00 0.00 C ATOM 0 H MET A 37 -19.235 0.955 7.123 1.00 0.00 H new ATOM 0 HA MET A 37 -19.118 -0.894 9.433 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.541 1.520 8.531 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.726 1.258 10.254 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.668 -0.845 8.303 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.649 0.185 9.289 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.505 -3.390 10.974 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.796 -3.093 9.244 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.584 -2.128 10.121 1.00 0.00 H new ATOM 614 N MET A 42 -25.213 3.572 4.304 1.00 0.00 N ATOM 615 CA MET A 42 -24.690 2.269 3.928 1.00 0.00 C ATOM 616 C MET A 42 -23.312 2.399 3.276 1.00 0.00 C ATOM 617 O MET A 42 -22.965 1.621 2.390 1.00 0.00 O ATOM 618 CB MET A 42 -25.656 1.594 2.952 1.00 0.00 C ATOM 619 CG MET A 42 -25.806 0.105 3.273 1.00 0.00 C ATOM 620 SD MET A 42 -25.574 -0.864 1.792 1.00 0.00 S ATOM 621 CE MET A 42 -23.804 -1.094 1.847 1.00 0.00 C ATOM 0 HA MET A 42 -24.589 1.664 4.829 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.630 2.081 3.003 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.292 1.715 1.932 1.00 0.00 H new ATOM 0 HG2 MET A 42 -25.076 -0.188 4.028 1.00 0.00 H new ATOM 0 HG3 MET A 42 -26.793 -0.088 3.693 1.00 0.00 H new ATOM 0 HE1 MET A 42 -23.336 -0.502 1.060 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.425 -0.772 2.817 1.00 0.00 H new ATOM 0 HE3 MET A 42 -23.569 -2.148 1.697 1.00 0.00 H new ATOM 631 N THR A 43 -22.564 3.389 3.740 1.00 0.00 N ATOM 632 CA THR A 43 -21.232 3.632 3.213 1.00 0.00 C ATOM 633 C THR A 43 -20.222 3.762 4.355 1.00 0.00 C ATOM 634 O THR A 43 -20.573 3.588 5.521 1.00 0.00 O ATOM 635 CB THR A 43 -21.297 4.868 2.315 1.00 0.00 C ATOM 636 OG1 THR A 43 -19.948 5.065 1.898 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.635 6.141 3.094 1.00 0.00 C ATOM 0 H THR A 43 -22.855 4.033 4.476 1.00 0.00 H new ATOM 0 HA THR A 43 -20.886 2.793 2.610 1.00 0.00 H new ATOM 0 HB THR A 43 -22.042 4.711 1.535 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.647 4.285 1.386 1.00 0.00 H new ATOM 0 HG21 THR A 43 -21.669 6.988 2.409 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.606 6.025 3.576 1.00 0.00 H new ATOM 0 HG23 THR A 43 -20.872 6.317 3.852 1.00 0.00 H new ATOM 645 N SER A 44 -18.989 4.068 3.980 1.00 0.00 N ATOM 646 CA SER A 44 -17.926 4.223 4.958 1.00 0.00 C ATOM 647 C SER A 44 -16.721 4.914 4.316 1.00 0.00 C ATOM 648 O SER A 44 -16.722 5.184 3.116 1.00 0.00 O ATOM 649 CB SER A 44 -17.513 2.871 5.543 1.00 0.00 C ATOM 650 OG SER A 44 -17.483 1.848 4.553 1.00 0.00 O ATOM 0 H SER A 44 -18.702 4.213 3.012 1.00 0.00 H new ATOM 0 HA SER A 44 -18.300 4.842 5.774 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.528 2.960 6.002 1.00 0.00 H new ATOM 0 HB3 SER A 44 -18.209 2.590 6.333 1.00 0.00 H new ATOM 0 HG SER A 44 -17.213 1.001 4.966 1.00 0.00 H new ATOM 656 N ASP A 45 -15.721 5.180 5.144 1.00 0.00 N ATOM 657 CA ASP A 45 -14.512 5.833 4.671 1.00 0.00 C ATOM 658 C ASP A 45 -13.297 4.988 5.056 1.00 0.00 C ATOM 659 O ASP A 45 -12.493 5.395 5.894 1.00 0.00 O ATOM 660 CB ASP A 45 -14.348 7.214 5.309 1.00 0.00 C ATOM 661 CG ASP A 45 -15.624 8.058 5.362 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.554 7.729 4.594 1.00 0.00 O ATOM 663 OD2 ASP A 45 -15.640 9.012 6.169 1.00 0.00 O ATOM 0 H ASP A 45 -15.723 4.955 6.139 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.588 5.941 3.589 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -13.972 7.086 6.324 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.588 7.766 4.755 1.00 0.00 H new ATOM 668 N PRO A 46 -13.198 3.795 4.410 1.00 0.00 N ATOM 669 CA PRO A 46 -12.094 2.889 4.675 1.00 0.00 C ATOM 670 C PRO A 46 -10.804 3.389 4.022 1.00 0.00 C ATOM 671 O PRO A 46 -10.830 4.328 3.228 1.00 0.00 O ATOM 672 CB PRO A 46 -12.551 1.544 4.135 1.00 0.00 C ATOM 673 CG PRO A 46 -13.691 1.845 3.176 1.00 0.00 C ATOM 674 CD PRO A 46 -14.132 3.280 3.412 1.00 0.00 C ATOM 0 HA PRO A 46 -11.855 2.817 5.736 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.736 1.031 3.624 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.882 0.891 4.943 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.367 1.710 2.144 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.521 1.158 3.342 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -14.090 3.863 2.492 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.160 3.324 3.771 1.00 0.00 H new ATOM 682 N TYR A 47 -9.707 2.740 4.381 1.00 0.00 N ATOM 683 CA TYR A 47 -8.409 3.107 3.840 1.00 0.00 C ATOM 684 C TYR A 47 -7.320 2.150 4.329 1.00 0.00 C ATOM 685 O TYR A 47 -7.341 1.717 5.480 1.00 0.00 O ATOM 686 CB TYR A 47 -8.113 4.511 4.370 1.00 0.00 C ATOM 687 CG TYR A 47 -7.675 4.543 5.836 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.483 3.992 6.810 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.472 5.123 6.184 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.071 4.022 8.189 1.00 0.00 C ATOM 691 CE2 TYR A 47 -6.060 5.153 7.563 1.00 0.00 C ATOM 692 CZ TYR A 47 -6.879 4.601 8.498 1.00 0.00 C ATOM 693 OH TYR A 47 -6.490 4.629 9.800 1.00 0.00 O ATOM 0 H TYR A 47 -9.690 1.962 5.040 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.422 3.065 2.751 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.332 4.962 3.758 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -9.004 5.127 4.254 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.424 3.538 6.538 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.840 5.554 5.422 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -8.694 3.595 8.961 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.121 5.604 7.849 1.00 0.00 H new ATOM 0 HH TYR A 47 -6.859 3.851 10.268 1.00 0.00 H new ATOM 703 N ILE A 48 -6.395 1.848 3.429 1.00 0.00 N ATOM 704 CA ILE A 48 -5.300 0.950 3.755 1.00 0.00 C ATOM 705 C ILE A 48 -4.115 1.765 4.275 1.00 0.00 C ATOM 706 O ILE A 48 -3.965 2.937 3.932 1.00 0.00 O ATOM 707 CB ILE A 48 -4.958 0.065 2.554 1.00 0.00 C ATOM 708 CG1 ILE A 48 -5.969 -1.075 2.408 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.521 -0.451 2.645 1.00 0.00 C ATOM 710 CD1 ILE A 48 -6.209 -1.408 0.934 1.00 0.00 C ATOM 0 H ILE A 48 -6.381 2.209 2.475 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.592 0.267 4.553 1.00 0.00 H new ATOM 0 HB ILE A 48 -5.025 0.672 1.651 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.603 -1.959 2.930 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -6.911 -0.794 2.879 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.304 -1.077 1.780 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.832 0.393 2.664 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.402 -1.037 3.556 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.931 -2.221 0.858 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -6.597 -0.528 0.421 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.270 -1.712 0.472 1.00 0.00 H new ATOM 722 N LYS A 49 -3.303 1.113 5.094 1.00 0.00 N ATOM 723 CA LYS A 49 -2.136 1.764 5.665 1.00 0.00 C ATOM 724 C LYS A 49 -0.877 0.999 5.250 1.00 0.00 C ATOM 725 O LYS A 49 -0.804 -0.218 5.414 1.00 0.00 O ATOM 726 CB LYS A 49 -2.293 1.913 7.179 1.00 0.00 C ATOM 727 CG LYS A 49 -3.205 3.094 7.522 1.00 0.00 C ATOM 728 CD LYS A 49 -3.147 3.416 9.016 1.00 0.00 C ATOM 729 CE LYS A 49 -3.267 4.922 9.258 1.00 0.00 C ATOM 730 NZ LYS A 49 -2.220 5.381 10.198 1.00 0.00 N ATOM 0 H LYS A 49 -3.430 0.141 5.376 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.037 2.778 5.277 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.707 0.996 7.597 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.315 2.059 7.637 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.905 3.969 6.946 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -4.231 2.861 7.236 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.952 2.895 9.535 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.209 3.051 9.434 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.175 5.457 8.313 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.253 5.154 9.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.316 6.405 10.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.326 4.884 11.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.282 5.177 9.799 1.00 0.00 H new ATOM 744 N MET A 50 0.082 1.744 4.721 1.00 0.00 N ATOM 745 CA MET A 50 1.334 1.151 4.281 1.00 0.00 C ATOM 746 C MET A 50 2.406 1.268 5.366 1.00 0.00 C ATOM 747 O MET A 50 2.415 2.228 6.135 1.00 0.00 O ATOM 748 CB MET A 50 1.814 1.855 3.011 1.00 0.00 C ATOM 749 CG MET A 50 2.532 0.876 2.080 1.00 0.00 C ATOM 750 SD MET A 50 4.190 0.576 2.672 1.00 0.00 S ATOM 751 CE MET A 50 5.063 1.878 1.818 1.00 0.00 C ATOM 0 H MET A 50 0.018 2.753 4.587 1.00 0.00 H new ATOM 0 HA MET A 50 1.162 0.094 4.078 1.00 0.00 H new ATOM 0 HB2 MET A 50 0.964 2.298 2.493 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.487 2.671 3.275 1.00 0.00 H new ATOM 0 HG2 MET A 50 1.980 -0.062 2.029 1.00 0.00 H new ATOM 0 HG3 MET A 50 2.566 1.281 1.069 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.803 1.441 1.147 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.355 2.472 1.240 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.565 2.517 2.545 1.00 0.00 H new ATOM 761 N THR A 51 3.285 0.276 5.394 1.00 0.00 N ATOM 762 CA THR A 51 4.359 0.256 6.372 1.00 0.00 C ATOM 763 C THR A 51 5.529 -0.587 5.861 1.00 0.00 C ATOM 764 O THR A 51 5.350 -1.749 5.497 1.00 0.00 O ATOM 765 CB THR A 51 3.783 -0.245 7.698 1.00 0.00 C ATOM 766 OG1 THR A 51 2.778 0.712 8.023 1.00 0.00 O ATOM 767 CG2 THR A 51 4.785 -0.139 8.849 1.00 0.00 C ATOM 0 H THR A 51 3.275 -0.519 4.755 1.00 0.00 H new ATOM 0 HA THR A 51 4.764 1.255 6.534 1.00 0.00 H new ATOM 0 HB THR A 51 3.466 -1.282 7.588 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.996 1.571 7.604 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.326 -0.507 9.766 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.667 -0.737 8.620 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.077 0.903 8.982 1.00 0.00 H new ATOM 775 N ILE A 52 6.702 0.030 5.850 1.00 0.00 N ATOM 776 CA ILE A 52 7.901 -0.650 5.390 1.00 0.00 C ATOM 777 C ILE A 52 8.513 -1.437 6.550 1.00 0.00 C ATOM 778 O ILE A 52 9.242 -0.878 7.367 1.00 0.00 O ATOM 779 CB ILE A 52 8.867 0.346 4.745 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.375 0.768 3.358 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.288 -0.218 4.702 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.469 1.514 2.592 1.00 0.00 C ATOM 0 H ILE A 52 6.847 0.993 6.152 1.00 0.00 H new ATOM 0 HA ILE A 52 7.655 -1.371 4.610 1.00 0.00 H new ATOM 0 HB ILE A 52 8.895 1.243 5.363 1.00 0.00 H new ATOM 0 HG12 ILE A 52 8.067 -0.112 2.794 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.497 1.406 3.458 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.954 0.510 4.239 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.627 -0.427 5.717 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.296 -1.139 4.120 1.00 0.00 H new ATOM 0 HD11 ILE A 52 9.094 1.802 1.610 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.758 2.407 3.147 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.337 0.865 2.472 1.00 0.00 H new ATOM 794 N LEU A 53 8.193 -2.722 6.585 1.00 0.00 N ATOM 795 CA LEU A 53 8.703 -3.592 7.632 1.00 0.00 C ATOM 796 C LEU A 53 10.059 -4.157 7.204 1.00 0.00 C ATOM 797 O LEU A 53 10.363 -4.216 6.014 1.00 0.00 O ATOM 798 CB LEU A 53 7.672 -4.666 7.984 1.00 0.00 C ATOM 799 CG LEU A 53 6.407 -4.176 8.691 1.00 0.00 C ATOM 800 CD1 LEU A 53 5.215 -5.080 8.370 1.00 0.00 C ATOM 801 CD2 LEU A 53 6.637 -4.042 10.197 1.00 0.00 C ATOM 0 H LEU A 53 7.587 -3.182 5.906 1.00 0.00 H new ATOM 0 HA LEU A 53 8.868 -3.028 8.550 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.377 -5.173 7.065 1.00 0.00 H new ATOM 0 HB3 LEU A 53 8.154 -5.410 8.619 1.00 0.00 H new ATOM 0 HG LEU A 53 6.168 -3.182 8.313 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.329 -4.710 8.885 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.037 -5.079 7.295 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.429 -6.096 8.701 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.722 -3.692 10.675 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.915 -5.012 10.610 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.439 -3.327 10.380 1.00 0.00 H new ATOM 813 N PRO A 54 10.857 -4.569 8.225 1.00 0.00 N ATOM 814 CA PRO A 54 10.420 -4.464 9.606 1.00 0.00 C ATOM 815 C PRO A 54 10.486 -3.015 10.094 1.00 0.00 C ATOM 816 O PRO A 54 9.563 -2.534 10.749 1.00 0.00 O ATOM 817 CB PRO A 54 11.339 -5.394 10.382 1.00 0.00 C ATOM 818 CG PRO A 54 12.547 -5.627 9.488 1.00 0.00 C ATOM 819 CD PRO A 54 12.193 -5.144 8.091 1.00 0.00 C ATOM 0 HA PRO A 54 9.378 -4.753 9.740 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.636 -4.948 11.331 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.838 -6.334 10.615 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.414 -5.088 9.870 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.811 -6.684 9.471 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.909 -4.403 7.735 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.201 -5.965 7.374 1.00 0.00 H new ATOM 827 N GLU A 55 11.587 -2.360 9.754 1.00 0.00 N ATOM 828 CA GLU A 55 11.785 -0.976 10.149 1.00 0.00 C ATOM 829 C GLU A 55 10.481 -0.386 10.690 1.00 0.00 C ATOM 830 O GLU A 55 10.384 -0.065 11.873 1.00 0.00 O ATOM 831 CB GLU A 55 12.321 -0.144 8.982 1.00 0.00 C ATOM 832 CG GLU A 55 13.833 0.060 9.103 1.00 0.00 C ATOM 833 CD GLU A 55 14.562 -0.510 7.884 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.906 -0.608 6.825 1.00 0.00 O ATOM 835 OE2 GLU A 55 15.759 -0.834 8.040 1.00 0.00 O ATOM 0 H GLU A 55 12.350 -2.762 9.210 1.00 0.00 H new ATOM 0 HA GLU A 55 12.530 -0.949 10.944 1.00 0.00 H new ATOM 0 HB2 GLU A 55 12.092 -0.642 8.040 1.00 0.00 H new ATOM 0 HB3 GLU A 55 11.820 0.824 8.961 1.00 0.00 H new ATOM 0 HG2 GLU A 55 14.054 1.123 9.199 1.00 0.00 H new ATOM 0 HG3 GLU A 55 14.198 -0.424 10.009 1.00 0.00 H new ATOM 842 N LYS A 56 9.510 -0.260 9.796 1.00 0.00 N ATOM 843 CA LYS A 56 8.216 0.285 10.168 1.00 0.00 C ATOM 844 C LYS A 56 8.301 1.813 10.197 1.00 0.00 C ATOM 845 O LYS A 56 7.323 2.486 10.516 1.00 0.00 O ATOM 846 CB LYS A 56 7.735 -0.328 11.485 1.00 0.00 C ATOM 847 CG LYS A 56 6.355 -0.969 11.318 1.00 0.00 C ATOM 848 CD LYS A 56 5.915 -1.666 12.608 1.00 0.00 C ATOM 849 CE LYS A 56 4.559 -1.139 13.080 1.00 0.00 C ATOM 850 NZ LYS A 56 4.344 -1.466 14.507 1.00 0.00 N ATOM 0 H LYS A 56 9.594 -0.526 8.815 1.00 0.00 H new ATOM 0 HA LYS A 56 7.463 0.020 9.425 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.450 -1.078 11.824 1.00 0.00 H new ATOM 0 HB3 LYS A 56 7.692 0.442 12.255 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.626 -0.206 11.046 1.00 0.00 H new ATOM 0 HG3 LYS A 56 6.381 -1.690 10.501 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.853 -2.741 12.442 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.662 -1.506 13.385 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.512 -0.059 12.937 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.763 -1.575 12.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.419 -1.101 14.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.368 -2.498 14.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.094 -1.029 15.080 1.00 0.00 H new ATOM 864 N LYS A 57 9.479 2.315 9.858 1.00 0.00 N ATOM 865 CA LYS A 57 9.704 3.750 9.840 1.00 0.00 C ATOM 866 C LYS A 57 8.927 4.370 8.677 1.00 0.00 C ATOM 867 O LYS A 57 8.119 5.275 8.878 1.00 0.00 O ATOM 868 CB LYS A 57 11.203 4.057 9.811 1.00 0.00 C ATOM 869 CG LYS A 57 11.648 4.485 8.411 1.00 0.00 C ATOM 870 CD LYS A 57 13.060 5.073 8.440 1.00 0.00 C ATOM 871 CE LYS A 57 14.116 3.965 8.419 1.00 0.00 C ATOM 872 NZ LYS A 57 14.913 4.033 7.174 1.00 0.00 N ATOM 0 H LYS A 57 10.288 1.753 9.593 1.00 0.00 H new ATOM 0 HA LYS A 57 9.326 4.206 10.755 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.430 4.848 10.526 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.764 3.176 10.121 1.00 0.00 H new ATOM 0 HG2 LYS A 57 11.621 3.627 7.739 1.00 0.00 H new ATOM 0 HG3 LYS A 57 10.951 5.223 8.014 1.00 0.00 H new ATOM 0 HD2 LYS A 57 13.201 5.731 7.583 1.00 0.00 H new ATOM 0 HD3 LYS A 57 13.185 5.683 9.335 1.00 0.00 H new ATOM 0 HE2 LYS A 57 14.772 4.063 9.284 1.00 0.00 H new ATOM 0 HE3 LYS A 57 13.632 2.991 8.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 15.728 3.391 7.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 14.321 3.750 6.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 15.251 5.006 7.031 1.00 0.00 H new ATOM 886 N HIS A 58 9.198 3.856 7.486 1.00 0.00 N ATOM 887 CA HIS A 58 8.534 4.348 6.291 1.00 0.00 C ATOM 888 C HIS A 58 7.045 4.003 6.352 1.00 0.00 C ATOM 889 O HIS A 58 6.579 3.116 5.639 1.00 0.00 O ATOM 890 CB HIS A 58 9.215 3.810 5.031 1.00 0.00 C ATOM 891 CG HIS A 58 10.641 3.361 5.247 1.00 0.00 C ATOM 892 ND1 HIS A 58 10.970 2.245 5.997 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.818 3.888 4.805 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.288 2.116 5.999 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.812 3.136 5.260 1.00 0.00 N ATOM 0 H HIS A 58 9.868 3.104 7.323 1.00 0.00 H new ATOM 0 HA HIS A 58 8.619 5.434 6.245 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.635 2.971 4.647 1.00 0.00 H new ATOM 0 HB3 HIS A 58 9.201 4.584 4.264 1.00 0.00 H new ATOM 0 HD1 HIS A 58 10.309 1.627 6.468 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.924 4.769 4.189 1.00 0.00 H new ATOM 0 HE1 HIS A 58 12.849 1.340 6.498 1.00 0.00 H new ATOM 903 N LYS A 59 6.339 4.723 7.212 1.00 0.00 N ATOM 904 CA LYS A 59 4.912 4.505 7.376 1.00 0.00 C ATOM 905 C LYS A 59 4.144 5.527 6.535 1.00 0.00 C ATOM 906 O LYS A 59 4.308 6.733 6.714 1.00 0.00 O ATOM 907 CB LYS A 59 4.534 4.521 8.858 1.00 0.00 C ATOM 908 CG LYS A 59 3.360 3.579 9.135 1.00 0.00 C ATOM 909 CD LYS A 59 2.699 3.907 10.476 1.00 0.00 C ATOM 910 CE LYS A 59 3.750 4.192 11.550 1.00 0.00 C ATOM 911 NZ LYS A 59 3.109 4.340 12.876 1.00 0.00 N ATOM 0 H LYS A 59 6.729 5.458 7.802 1.00 0.00 H new ATOM 0 HA LYS A 59 4.634 3.517 7.010 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.393 4.224 9.459 1.00 0.00 H new ATOM 0 HB3 LYS A 59 4.270 5.535 9.159 1.00 0.00 H new ATOM 0 HG2 LYS A 59 2.626 3.662 8.334 1.00 0.00 H new ATOM 0 HG3 LYS A 59 3.711 2.547 9.141 1.00 0.00 H new ATOM 0 HD2 LYS A 59 2.047 4.773 10.362 1.00 0.00 H new ATOM 0 HD3 LYS A 59 2.071 3.073 10.789 1.00 0.00 H new ATOM 0 HE2 LYS A 59 4.477 3.381 11.580 1.00 0.00 H new ATOM 0 HE3 LYS A 59 4.297 5.101 11.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 3.837 4.533 13.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 2.432 5.129 12.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 2.607 3.462 13.119 1.00 0.00 H new ATOM 925 N VAL A 60 3.321 5.007 5.635 1.00 0.00 N ATOM 926 CA VAL A 60 2.528 5.859 4.766 1.00 0.00 C ATOM 927 C VAL A 60 1.137 5.246 4.590 1.00 0.00 C ATOM 928 O VAL A 60 0.992 4.025 4.560 1.00 0.00 O ATOM 929 CB VAL A 60 3.257 6.077 3.439 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.475 6.984 3.626 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.658 4.743 2.808 1.00 0.00 C ATOM 0 H VAL A 60 3.187 4.006 5.489 1.00 0.00 H new ATOM 0 HA VAL A 60 2.396 6.844 5.214 1.00 0.00 H new ATOM 0 HB VAL A 60 2.569 6.576 2.757 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.976 7.123 2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.153 7.952 4.011 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.166 6.524 4.333 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.174 4.927 1.866 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.320 4.204 3.486 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.765 4.146 2.622 1.00 0.00 H new ATOM 941 N LYS A 61 0.149 6.122 4.479 1.00 0.00 N ATOM 942 CA LYS A 61 -1.225 5.682 4.307 1.00 0.00 C ATOM 943 C LYS A 61 -1.804 6.317 3.041 1.00 0.00 C ATOM 944 O LYS A 61 -1.435 7.432 2.676 1.00 0.00 O ATOM 945 CB LYS A 61 -2.042 5.971 5.568 1.00 0.00 C ATOM 946 CG LYS A 61 -2.034 7.465 5.897 1.00 0.00 C ATOM 947 CD LYS A 61 -3.232 7.840 6.772 1.00 0.00 C ATOM 948 CE LYS A 61 -4.207 8.740 6.011 1.00 0.00 C ATOM 949 NZ LYS A 61 -4.593 9.904 6.840 1.00 0.00 N ATOM 0 H LYS A 61 0.273 7.134 4.505 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.265 4.601 4.170 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.068 5.632 5.426 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.633 5.408 6.407 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.108 7.723 6.412 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -2.058 8.044 4.974 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.746 6.936 7.098 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -2.885 8.351 7.670 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -3.747 9.083 5.084 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -5.095 8.172 5.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -5.255 10.505 6.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -5.051 9.572 7.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -3.744 10.454 7.082 1.00 0.00 H new ATOM 963 N THR A 62 -2.702 5.579 2.405 1.00 0.00 N ATOM 964 CA THR A 62 -3.336 6.056 1.187 1.00 0.00 C ATOM 965 C THR A 62 -4.575 6.889 1.522 1.00 0.00 C ATOM 966 O THR A 62 -5.296 6.582 2.470 1.00 0.00 O ATOM 967 CB THR A 62 -3.640 4.842 0.306 1.00 0.00 C ATOM 968 OG1 THR A 62 -4.790 4.254 0.909 1.00 0.00 O ATOM 969 CG2 THR A 62 -2.567 3.757 0.414 1.00 0.00 C ATOM 0 H THR A 62 -3.006 4.654 2.710 1.00 0.00 H new ATOM 0 HA THR A 62 -2.676 6.722 0.632 1.00 0.00 H new ATOM 0 HB THR A 62 -3.731 5.161 -0.732 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.439 4.017 0.214 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.831 2.919 -0.231 1.00 0.00 H new ATOM 0 HG22 THR A 62 -1.605 4.164 0.103 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.499 3.414 1.446 1.00 0.00 H new ATOM 977 N ARG A 63 -4.783 7.927 0.725 1.00 0.00 N ATOM 978 CA ARG A 63 -5.922 8.807 0.925 1.00 0.00 C ATOM 979 C ARG A 63 -7.150 7.998 1.349 1.00 0.00 C ATOM 980 O ARG A 63 -7.403 6.920 0.814 1.00 0.00 O ATOM 981 CB ARG A 63 -6.248 9.584 -0.352 1.00 0.00 C ATOM 982 CG ARG A 63 -7.274 10.685 -0.077 1.00 0.00 C ATOM 983 CD ARG A 63 -8.067 11.024 -1.340 1.00 0.00 C ATOM 984 NE ARG A 63 -7.679 12.362 -1.838 1.00 0.00 N ATOM 985 CZ ARG A 63 -8.123 12.895 -2.985 1.00 0.00 C ATOM 986 NH1 ARG A 63 -8.972 12.206 -3.760 1.00 0.00 N ATOM 987 NH2 ARG A 63 -7.716 14.116 -3.358 1.00 0.00 N ATOM 0 H ARG A 63 -4.182 8.178 -0.060 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.660 9.515 1.711 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.337 10.024 -0.757 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.636 8.901 -1.108 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.956 10.363 0.709 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.766 11.578 0.288 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.881 10.273 -2.108 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -9.135 11.003 -1.125 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.033 12.913 -1.273 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.280 11.276 -3.477 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.310 12.612 -4.633 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.068 14.640 -2.769 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.054 14.522 -4.231 1.00 0.00 H new ATOM 1001 N VAL A 64 -7.880 8.550 2.307 1.00 0.00 N ATOM 1002 CA VAL A 64 -9.075 7.893 2.809 1.00 0.00 C ATOM 1003 C VAL A 64 -10.312 8.618 2.276 1.00 0.00 C ATOM 1004 O VAL A 64 -10.750 9.612 2.853 1.00 0.00 O ATOM 1005 CB VAL A 64 -9.033 7.827 4.337 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -8.276 9.024 4.917 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -10.444 7.735 4.921 1.00 0.00 C ATOM 0 H VAL A 64 -7.667 9.444 2.749 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.123 6.864 2.454 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.495 6.922 4.618 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.261 8.953 6.005 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.254 9.026 4.539 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.774 9.947 4.621 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.385 7.689 6.008 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -11.018 8.613 4.625 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.935 6.837 4.546 1.00 0.00 H new ATOM 1017 N LEU A 65 -10.841 8.092 1.181 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.020 8.676 0.564 1.00 0.00 C ATOM 1019 C LEU A 65 -13.140 8.772 1.602 1.00 0.00 C ATOM 1020 O LEU A 65 -13.030 8.212 2.692 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.410 7.895 -0.692 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.382 7.891 -1.826 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.095 6.465 -2.300 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -11.829 8.798 -2.974 1.00 0.00 C ATOM 0 H LEU A 65 -10.475 7.268 0.705 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.810 9.691 0.227 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.610 6.862 -0.406 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.344 8.306 -1.076 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.446 8.297 -1.441 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.362 6.490 -3.106 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.702 5.878 -1.470 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -12.017 6.010 -2.662 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.081 8.777 -3.767 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -12.783 8.445 -3.366 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -11.942 9.819 -2.608 1.00 0.00 H new ATOM 1036 N ARG A 66 -14.192 9.485 1.227 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.331 9.660 2.112 1.00 0.00 C ATOM 1038 C ARG A 66 -16.587 9.051 1.487 1.00 0.00 C ATOM 1039 O ARG A 66 -16.967 9.409 0.373 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.581 11.142 2.401 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.370 11.778 3.087 1.00 0.00 C ATOM 1042 CD ARG A 66 -13.821 10.866 4.187 1.00 0.00 C ATOM 1043 NE ARG A 66 -13.101 11.671 5.198 1.00 0.00 N ATOM 1044 CZ ARG A 66 -11.851 12.129 5.043 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -11.176 11.864 3.916 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -11.276 12.851 6.015 1.00 0.00 N ATOM 0 H ARG A 66 -14.279 9.948 0.322 1.00 0.00 H new ATOM 0 HA ARG A 66 -15.104 9.152 3.049 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -15.793 11.667 1.470 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.461 11.249 3.035 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.591 11.974 2.350 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -14.653 12.740 3.515 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.637 10.320 4.659 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.149 10.124 3.755 1.00 0.00 H new ATOM 0 HE ARG A 66 -13.586 11.891 6.068 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -11.614 11.314 3.177 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -10.225 12.212 3.797 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.790 13.052 6.873 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -10.325 13.199 5.897 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.197 8.139 2.230 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.403 7.477 1.763 1.00 0.00 C ATOM 1062 C LYS A 67 -18.106 6.758 0.445 1.00 0.00 C ATOM 1063 O LYS A 67 -18.273 7.332 -0.630 1.00 0.00 O ATOM 1064 CB LYS A 67 -19.561 8.473 1.673 1.00 0.00 C ATOM 1065 CG LYS A 67 -19.673 9.300 2.955 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.134 9.629 3.270 1.00 0.00 C ATOM 1067 CE LYS A 67 -21.441 9.401 4.751 1.00 0.00 C ATOM 1068 NZ LYS A 67 -22.561 10.263 5.188 1.00 0.00 N ATOM 0 H LYS A 67 -16.878 7.843 3.153 1.00 0.00 H new ATOM 0 HA LYS A 67 -18.722 6.718 2.477 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.410 9.135 0.821 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.494 7.937 1.499 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -19.233 8.750 3.787 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -19.104 10.223 2.847 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -21.341 10.666 3.008 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -21.790 9.008 2.659 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -21.694 8.354 4.919 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -20.555 9.615 5.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.756 10.095 6.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -22.306 11.261 5.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -23.409 10.039 4.630 1.00 0.00 H new ATOM 1082 N THR A 68 -17.672 5.513 0.572 1.00 0.00 N ATOM 1083 CA THR A 68 -17.350 4.710 -0.595 1.00 0.00 C ATOM 1084 C THR A 68 -16.942 3.297 -0.175 1.00 0.00 C ATOM 1085 O THR A 68 -15.973 3.120 0.561 1.00 0.00 O ATOM 1086 CB THR A 68 -16.269 5.443 -1.391 1.00 0.00 C ATOM 1087 OG1 THR A 68 -16.008 4.584 -2.497 1.00 0.00 O ATOM 1088 CG2 THR A 68 -14.934 5.506 -0.644 1.00 0.00 C ATOM 0 H THR A 68 -17.536 5.040 1.466 1.00 0.00 H new ATOM 0 HA THR A 68 -18.220 4.585 -1.240 1.00 0.00 H new ATOM 0 HB THR A 68 -16.607 6.454 -1.616 1.00 0.00 H new ATOM 0 HG1 THR A 68 -15.319 4.985 -3.067 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.201 6.036 -1.252 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.070 6.032 0.301 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.579 4.494 -0.448 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.703 2.326 -0.660 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.433 0.934 -0.344 1.00 0.00 C ATOM 1098 C LEU A 69 -16.246 0.447 -1.178 1.00 0.00 C ATOM 1099 O LEU A 69 -15.534 -0.471 -0.774 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.696 0.090 -0.521 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.777 0.268 0.547 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -20.679 -0.966 0.626 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -19.157 0.612 1.903 1.00 0.00 C ATOM 0 H LEU A 69 -18.507 2.477 -1.270 1.00 0.00 H new ATOM 0 HA LEU A 69 -17.151 0.829 0.704 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -19.131 0.323 -1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.407 -0.961 -0.545 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.407 1.109 0.258 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -21.438 -0.813 1.393 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -21.163 -1.125 -0.338 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -20.079 -1.840 0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.947 0.733 2.644 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.489 -0.192 2.212 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.592 1.541 1.820 1.00 0.00 H new ATOM 1115 N ASP A 70 -16.069 1.085 -2.326 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.981 0.728 -3.220 1.00 0.00 C ATOM 1117 C ASP A 70 -14.125 1.966 -3.494 1.00 0.00 C ATOM 1118 O ASP A 70 -14.207 2.557 -4.569 1.00 0.00 O ATOM 1119 CB ASP A 70 -15.514 0.216 -4.560 1.00 0.00 C ATOM 1120 CG ASP A 70 -16.611 1.076 -5.190 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -16.641 2.284 -4.869 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -17.396 0.506 -5.978 1.00 0.00 O ATOM 0 H ASP A 70 -16.661 1.847 -2.657 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.395 -0.057 -2.741 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.682 0.143 -5.261 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -15.901 -0.793 -4.419 1.00 0.00 H new ATOM 1127 N PRO A 71 -13.301 2.332 -2.475 1.00 0.00 N ATOM 1128 CA PRO A 71 -12.430 3.489 -2.595 1.00 0.00 C ATOM 1129 C PRO A 71 -11.234 3.183 -3.499 1.00 0.00 C ATOM 1130 O PRO A 71 -10.667 2.094 -3.437 1.00 0.00 O ATOM 1131 CB PRO A 71 -12.026 3.827 -1.169 1.00 0.00 C ATOM 1132 CG PRO A 71 -12.305 2.578 -0.350 1.00 0.00 C ATOM 1133 CD PRO A 71 -13.177 1.656 -1.187 1.00 0.00 C ATOM 0 HA PRO A 71 -12.922 4.339 -3.067 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.972 4.101 -1.116 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.596 4.676 -0.792 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.373 2.082 -0.082 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.808 2.837 0.582 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.721 0.672 -1.298 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -14.152 1.504 -0.724 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.886 4.165 -4.317 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.767 4.016 -5.233 1.00 0.00 C ATOM 1143 C ALA A 72 -8.750 5.129 -4.975 1.00 0.00 C ATOM 1144 O ALA A 72 -8.902 6.242 -5.476 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.282 4.018 -6.673 1.00 0.00 C ATOM 0 H ALA A 72 -11.359 5.067 -4.365 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.262 3.064 -5.070 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.443 3.906 -7.360 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.977 3.190 -6.812 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.793 4.959 -6.875 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.735 4.790 -4.194 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.693 5.748 -3.863 1.00 0.00 C ATOM 1153 C PHE A 73 -5.621 5.789 -4.954 1.00 0.00 C ATOM 1154 O PHE A 73 -5.121 6.859 -5.298 1.00 0.00 O ATOM 1155 CB PHE A 73 -6.054 5.279 -2.555 1.00 0.00 C ATOM 1156 CG PHE A 73 -7.016 4.542 -1.621 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -8.015 5.224 -0.998 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.873 3.206 -1.415 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.908 4.539 -0.131 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.766 2.521 -0.548 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.765 3.203 0.075 1.00 0.00 C ATOM 0 H PHE A 73 -7.612 3.866 -3.781 1.00 0.00 H new ATOM 0 HA PHE A 73 -7.120 6.747 -3.772 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.215 4.623 -2.787 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.647 6.144 -2.031 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -8.129 6.285 -1.162 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.080 2.665 -1.911 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.701 5.080 0.365 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.652 1.460 -0.384 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.445 2.683 0.734 1.00 0.00 H new ATOM 1171 N ASP A 74 -5.300 4.612 -5.469 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.296 4.500 -6.514 1.00 0.00 C ATOM 1173 C ASP A 74 -3.136 5.448 -6.204 1.00 0.00 C ATOM 1174 O ASP A 74 -2.701 6.206 -7.069 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.874 4.889 -7.876 1.00 0.00 C ATOM 1176 CG ASP A 74 -6.374 4.636 -8.039 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -7.145 5.565 -7.713 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -6.716 3.520 -8.485 1.00 0.00 O ATOM 0 H ASP A 74 -5.717 3.727 -5.182 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.958 3.464 -6.548 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -4.679 5.948 -8.048 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.342 4.337 -8.651 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.667 5.374 -4.967 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.566 6.215 -4.532 1.00 0.00 C ATOM 1185 C GLU A 75 -0.229 5.528 -4.814 1.00 0.00 C ATOM 1186 O GLU A 75 -0.195 4.353 -5.178 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.699 6.569 -3.049 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.733 7.677 -2.840 1.00 0.00 C ATOM 1189 CD GLU A 75 -2.062 9.051 -2.782 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -1.656 9.530 -3.863 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -1.969 9.590 -1.658 1.00 0.00 O ATOM 0 H GLU A 75 -3.030 4.744 -4.252 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.600 7.146 -5.098 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -1.991 5.683 -2.485 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.733 6.890 -2.660 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -3.461 7.658 -3.651 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.282 7.497 -1.916 1.00 0.00 H new ATOM 1198 N THR A 76 0.841 6.288 -4.635 1.00 0.00 N ATOM 1199 CA THR A 76 2.177 5.767 -4.865 1.00 0.00 C ATOM 1200 C THR A 76 3.197 6.511 -4.000 1.00 0.00 C ATOM 1201 O THR A 76 3.203 7.740 -3.961 1.00 0.00 O ATOM 1202 CB THR A 76 2.469 5.860 -6.364 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.658 4.840 -6.940 1.00 0.00 O ATOM 1204 CG2 THR A 76 3.899 5.439 -6.710 1.00 0.00 C ATOM 0 H THR A 76 0.810 7.262 -4.333 1.00 0.00 H new ATOM 0 HA THR A 76 2.249 4.720 -4.569 1.00 0.00 H new ATOM 0 HB THR A 76 2.300 6.882 -6.703 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.029 5.242 -7.575 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.053 5.524 -7.786 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.605 6.087 -6.190 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.059 4.406 -6.401 1.00 0.00 H new ATOM 1212 N PHE A 77 4.034 5.734 -3.329 1.00 0.00 N ATOM 1213 CA PHE A 77 5.056 6.304 -2.467 1.00 0.00 C ATOM 1214 C PHE A 77 6.453 5.860 -2.905 1.00 0.00 C ATOM 1215 O PHE A 77 6.690 4.674 -3.130 1.00 0.00 O ATOM 1216 CB PHE A 77 4.789 5.784 -1.053 1.00 0.00 C ATOM 1217 CG PHE A 77 3.405 6.143 -0.509 1.00 0.00 C ATOM 1218 CD1 PHE A 77 3.089 7.441 -0.254 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.489 5.163 -0.281 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.804 7.774 0.250 1.00 0.00 C ATOM 1221 CE2 PHE A 77 1.204 5.496 0.224 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.889 6.794 0.479 1.00 0.00 C ATOM 0 H PHE A 77 4.026 4.715 -3.365 1.00 0.00 H new ATOM 0 HA PHE A 77 5.018 7.392 -2.515 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.900 4.700 -1.049 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.548 6.184 -0.380 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.816 8.219 -0.435 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.739 4.132 -0.484 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.553 8.805 0.451 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.477 4.718 0.405 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.088 7.047 0.863 1.00 0.00 H new ATOM 1232 N THR A 78 7.342 6.837 -3.014 1.00 0.00 N ATOM 1233 CA THR A 78 8.709 6.562 -3.422 1.00 0.00 C ATOM 1234 C THR A 78 9.643 6.590 -2.210 1.00 0.00 C ATOM 1235 O THR A 78 9.343 7.234 -1.206 1.00 0.00 O ATOM 1236 CB THR A 78 9.091 7.570 -4.507 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.563 7.008 -5.705 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.601 7.622 -4.753 1.00 0.00 C ATOM 0 H THR A 78 7.142 7.820 -2.827 1.00 0.00 H new ATOM 0 HA THR A 78 8.802 5.560 -3.842 1.00 0.00 H new ATOM 0 HB THR A 78 8.735 8.560 -4.223 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.764 7.599 -6.460 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.818 8.353 -5.532 1.00 0.00 H new ATOM 0 HG22 THR A 78 11.110 7.910 -3.833 1.00 0.00 H new ATOM 0 HG23 THR A 78 10.952 6.640 -5.069 1.00 0.00 H new ATOM 1246 N PHE A 79 10.756 5.884 -2.344 1.00 0.00 N ATOM 1247 CA PHE A 79 11.735 5.820 -1.272 1.00 0.00 C ATOM 1248 C PHE A 79 13.143 5.596 -1.829 1.00 0.00 C ATOM 1249 O PHE A 79 13.394 4.603 -2.510 1.00 0.00 O ATOM 1250 CB PHE A 79 11.354 4.632 -0.388 1.00 0.00 C ATOM 1251 CG PHE A 79 9.865 4.567 -0.041 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.323 5.487 0.801 1.00 0.00 C ATOM 1253 CD2 PHE A 79 9.085 3.590 -0.574 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.941 5.427 1.123 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.703 3.530 -0.252 1.00 0.00 C ATOM 1256 CZ PHE A 79 7.160 4.450 0.590 1.00 0.00 C ATOM 0 H PHE A 79 11.002 5.351 -3.178 1.00 0.00 H new ATOM 0 HA PHE A 79 11.738 6.757 -0.714 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.639 3.710 -0.894 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.930 4.680 0.536 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.943 6.263 1.225 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.516 2.859 -1.242 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.510 6.158 1.792 1.00 0.00 H new ATOM 0 HE2 PHE A 79 7.083 2.754 -0.676 1.00 0.00 H new ATOM 0 HZ PHE A 79 6.109 4.404 0.835 1.00 0.00 H new ATOM 1266 N TYR A 80 14.024 6.535 -1.518 1.00 0.00 N ATOM 1267 CA TYR A 80 15.400 6.452 -1.978 1.00 0.00 C ATOM 1268 C TYR A 80 16.334 6.029 -0.842 1.00 0.00 C ATOM 1269 O TYR A 80 16.090 6.352 0.319 1.00 0.00 O ATOM 1270 CB TYR A 80 15.778 7.862 -2.435 1.00 0.00 C ATOM 1271 CG TYR A 80 14.776 8.492 -3.405 1.00 0.00 C ATOM 1272 CD1 TYR A 80 14.768 8.112 -4.731 1.00 0.00 C ATOM 1273 CD2 TYR A 80 13.880 9.439 -2.953 1.00 0.00 C ATOM 1274 CE1 TYR A 80 13.825 8.704 -5.644 1.00 0.00 C ATOM 1275 CE2 TYR A 80 12.937 10.032 -3.866 1.00 0.00 C ATOM 1276 CZ TYR A 80 12.956 9.635 -5.166 1.00 0.00 C ATOM 1277 OH TYR A 80 12.065 10.194 -6.029 1.00 0.00 O ATOM 0 H TYR A 80 13.812 7.357 -0.953 1.00 0.00 H new ATOM 0 HA TYR A 80 15.494 5.715 -2.776 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.872 8.504 -1.559 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.757 7.828 -2.912 1.00 0.00 H new ATOM 0 HD1 TYR A 80 15.469 7.370 -5.084 1.00 0.00 H new ATOM 0 HD2 TYR A 80 13.886 9.736 -1.915 1.00 0.00 H new ATOM 0 HE1 TYR A 80 13.808 8.415 -6.685 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.231 10.775 -3.526 1.00 0.00 H new ATOM 0 HH TYR A 80 11.507 10.841 -5.549 1.00 0.00 H new ATOM 1287 N GLY A 81 17.384 5.313 -1.217 1.00 0.00 N ATOM 1288 CA GLY A 81 18.355 4.843 -0.245 1.00 0.00 C ATOM 1289 C GLY A 81 18.409 3.314 -0.218 1.00 0.00 C ATOM 1290 O GLY A 81 19.419 2.732 0.174 1.00 0.00 O ATOM 0 H GLY A 81 17.583 5.047 -2.181 1.00 0.00 H new ATOM 0 HA2 GLY A 81 19.340 5.241 -0.488 1.00 0.00 H new ATOM 0 HA3 GLY A 81 18.095 5.219 0.745 1.00 0.00 H new ATOM 1294 N ILE A 82 17.308 2.708 -0.640 1.00 0.00 N ATOM 1295 CA ILE A 82 17.217 1.258 -0.669 1.00 0.00 C ATOM 1296 C ILE A 82 18.194 0.711 -1.712 1.00 0.00 C ATOM 1297 O ILE A 82 18.113 1.063 -2.888 1.00 0.00 O ATOM 1298 CB ILE A 82 15.769 0.817 -0.891 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.833 1.476 0.124 1.00 0.00 C ATOM 1300 CG2 ILE A 82 15.652 -0.708 -0.872 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.929 2.508 -0.553 1.00 0.00 C ATOM 0 H ILE A 82 16.472 3.195 -0.964 1.00 0.00 H new ATOM 0 HA ILE A 82 17.510 0.838 0.293 1.00 0.00 H new ATOM 0 HB ILE A 82 15.458 1.152 -1.880 1.00 0.00 H new ATOM 0 HG12 ILE A 82 14.222 0.714 0.609 1.00 0.00 H new ATOM 0 HG13 ILE A 82 15.420 1.959 0.905 1.00 0.00 H new ATOM 0 HG21 ILE A 82 14.613 -0.995 -1.032 1.00 0.00 H new ATOM 0 HG22 ILE A 82 16.271 -1.130 -1.663 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.989 -1.087 0.093 1.00 0.00 H new ATOM 0 HD11 ILE A 82 13.274 2.961 0.191 1.00 0.00 H new ATOM 0 HD12 ILE A 82 14.542 3.281 -1.016 1.00 0.00 H new ATOM 0 HD13 ILE A 82 13.326 2.018 -1.317 1.00 0.00 H new ATOM 1313 N PRO A 83 19.117 -0.164 -1.231 1.00 0.00 N ATOM 1314 CA PRO A 83 20.108 -0.763 -2.109 1.00 0.00 C ATOM 1315 C PRO A 83 19.481 -1.852 -2.982 1.00 0.00 C ATOM 1316 O PRO A 83 20.190 -2.665 -3.572 1.00 0.00 O ATOM 1317 CB PRO A 83 21.187 -1.295 -1.179 1.00 0.00 C ATOM 1318 CG PRO A 83 20.543 -1.389 0.195 1.00 0.00 C ATOM 1319 CD PRO A 83 19.243 -0.604 0.155 1.00 0.00 C ATOM 0 HA PRO A 83 20.528 -0.049 -2.818 1.00 0.00 H new ATOM 0 HB2 PRO A 83 21.543 -2.270 -1.511 1.00 0.00 H new ATOM 0 HB3 PRO A 83 22.050 -0.630 -1.161 1.00 0.00 H new ATOM 0 HG2 PRO A 83 20.353 -2.430 0.457 1.00 0.00 H new ATOM 0 HG3 PRO A 83 21.209 -0.985 0.957 1.00 0.00 H new ATOM 0 HD2 PRO A 83 18.397 -1.224 0.452 1.00 0.00 H new ATOM 0 HD3 PRO A 83 19.272 0.245 0.839 1.00 0.00 H new ATOM 1327 N TYR A 84 18.157 -1.833 -3.035 1.00 0.00 N ATOM 1328 CA TYR A 84 17.426 -2.808 -3.826 1.00 0.00 C ATOM 1329 C TYR A 84 17.548 -4.207 -3.219 1.00 0.00 C ATOM 1330 O TYR A 84 16.541 -4.846 -2.917 1.00 0.00 O ATOM 1331 CB TYR A 84 18.081 -2.806 -5.209 1.00 0.00 C ATOM 1332 CG TYR A 84 17.312 -3.606 -6.262 1.00 0.00 C ATOM 1333 CD1 TYR A 84 15.988 -3.314 -6.520 1.00 0.00 C ATOM 1334 CD2 TYR A 84 17.943 -4.619 -6.955 1.00 0.00 C ATOM 1335 CE1 TYR A 84 15.264 -4.066 -7.512 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.219 -5.372 -7.947 1.00 0.00 C ATOM 1337 CZ TYR A 84 15.916 -5.058 -8.176 1.00 0.00 C ATOM 1338 OH TYR A 84 15.232 -5.769 -9.113 1.00 0.00 O ATOM 0 H TYR A 84 17.572 -1.158 -2.543 1.00 0.00 H new ATOM 0 HA TYR A 84 16.367 -2.554 -3.865 1.00 0.00 H new ATOM 0 HB2 TYR A 84 18.181 -1.776 -5.551 1.00 0.00 H new ATOM 0 HB3 TYR A 84 19.089 -3.212 -5.123 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.495 -2.521 -5.978 1.00 0.00 H new ATOM 0 HD2 TYR A 84 18.979 -4.847 -6.754 1.00 0.00 H new ATOM 0 HE1 TYR A 84 14.228 -3.847 -7.724 1.00 0.00 H new ATOM 0 HE2 TYR A 84 17.700 -6.168 -8.496 1.00 0.00 H new ATOM 0 HH TYR A 84 15.823 -6.444 -9.507 1.00 0.00 H new ATOM 1348 N THR A 85 18.789 -4.642 -3.059 1.00 0.00 N ATOM 1349 CA THR A 85 19.055 -5.954 -2.494 1.00 0.00 C ATOM 1350 C THR A 85 18.427 -6.074 -1.104 1.00 0.00 C ATOM 1351 O THR A 85 18.284 -7.176 -0.576 1.00 0.00 O ATOM 1352 CB THR A 85 20.569 -6.172 -2.497 1.00 0.00 C ATOM 1353 OG1 THR A 85 21.057 -5.231 -1.545 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.220 -5.742 -3.814 1.00 0.00 C ATOM 0 H THR A 85 19.622 -4.109 -3.311 1.00 0.00 H new ATOM 0 HA THR A 85 18.597 -6.742 -3.092 1.00 0.00 H new ATOM 0 HB THR A 85 20.785 -7.224 -2.312 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.032 -5.305 -1.482 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.295 -5.918 -3.763 1.00 0.00 H new ATOM 0 HG22 THR A 85 20.796 -6.320 -4.635 1.00 0.00 H new ATOM 0 HG23 THR A 85 21.033 -4.681 -3.983 1.00 0.00 H new ATOM 1362 N GLN A 86 18.068 -4.924 -0.551 1.00 0.00 N ATOM 1363 CA GLN A 86 17.459 -4.886 0.767 1.00 0.00 C ATOM 1364 C GLN A 86 15.939 -5.023 0.653 1.00 0.00 C ATOM 1365 O GLN A 86 15.260 -5.292 1.643 1.00 0.00 O ATOM 1366 CB GLN A 86 17.840 -3.605 1.510 1.00 0.00 C ATOM 1367 CG GLN A 86 17.596 -3.750 3.014 1.00 0.00 C ATOM 1368 CD GLN A 86 18.334 -2.662 3.796 1.00 0.00 C ATOM 1369 OE1 GLN A 86 19.359 -2.894 4.416 1.00 0.00 O ATOM 1370 NE2 GLN A 86 17.758 -1.465 3.733 1.00 0.00 N ATOM 0 H GLN A 86 18.188 -4.012 -0.992 1.00 0.00 H new ATOM 0 HA GLN A 86 17.838 -5.728 1.346 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.890 -3.374 1.329 1.00 0.00 H new ATOM 0 HB3 GLN A 86 17.258 -2.769 1.122 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.527 -3.690 3.220 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.930 -4.733 3.347 1.00 0.00 H new ATOM 0 HE21 GLN A 86 16.900 -1.339 3.196 1.00 0.00 H new ATOM 0 HE22 GLN A 86 18.174 -0.672 4.222 1.00 0.00 H new ATOM 1379 N ILE A 87 15.449 -4.832 -0.563 1.00 0.00 N ATOM 1380 CA ILE A 87 14.022 -4.930 -0.819 1.00 0.00 C ATOM 1381 C ILE A 87 13.500 -6.258 -0.265 1.00 0.00 C ATOM 1382 O ILE A 87 12.477 -6.290 0.417 1.00 0.00 O ATOM 1383 CB ILE A 87 13.729 -4.726 -2.306 1.00 0.00 C ATOM 1384 CG1 ILE A 87 14.237 -3.364 -2.784 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.241 -4.919 -2.604 1.00 0.00 C ATOM 1386 CD1 ILE A 87 13.311 -2.239 -2.317 1.00 0.00 C ATOM 0 H ILE A 87 16.015 -4.610 -1.382 1.00 0.00 H new ATOM 0 HA ILE A 87 13.486 -4.135 -0.301 1.00 0.00 H new ATOM 0 HB ILE A 87 14.271 -5.487 -2.867 1.00 0.00 H new ATOM 0 HG12 ILE A 87 15.244 -3.193 -2.403 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.303 -3.358 -3.872 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.061 -4.768 -3.668 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.942 -5.929 -2.325 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.659 -4.197 -2.031 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.695 -1.282 -2.670 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.311 -2.400 -2.720 1.00 0.00 H new ATOM 0 HD13 ILE A 87 13.267 -2.233 -1.228 1.00 0.00 H new ATOM 1398 N GLN A 88 14.226 -7.320 -0.580 1.00 0.00 N ATOM 1399 CA GLN A 88 13.848 -8.647 -0.123 1.00 0.00 C ATOM 1400 C GLN A 88 13.900 -8.716 1.405 1.00 0.00 C ATOM 1401 O GLN A 88 13.422 -9.680 2.002 1.00 0.00 O ATOM 1402 CB GLN A 88 14.742 -9.718 -0.751 1.00 0.00 C ATOM 1403 CG GLN A 88 14.736 -9.612 -2.277 1.00 0.00 C ATOM 1404 CD GLN A 88 16.009 -10.215 -2.874 1.00 0.00 C ATOM 1405 OE1 GLN A 88 16.500 -11.246 -2.443 1.00 0.00 O ATOM 1406 NE2 GLN A 88 16.514 -9.518 -3.888 1.00 0.00 N ATOM 0 H GLN A 88 15.074 -7.289 -1.146 1.00 0.00 H new ATOM 0 HA GLN A 88 12.824 -8.843 -0.442 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.761 -9.610 -0.379 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.397 -10.707 -0.450 1.00 0.00 H new ATOM 0 HG2 GLN A 88 13.863 -10.127 -2.677 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.652 -8.566 -2.572 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.053 -8.663 -4.199 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.362 -9.839 -4.355 1.00 0.00 H new ATOM 1415 N GLU A 89 14.483 -7.682 1.993 1.00 0.00 N ATOM 1416 CA GLU A 89 14.603 -7.614 3.439 1.00 0.00 C ATOM 1417 C GLU A 89 13.542 -6.674 4.016 1.00 0.00 C ATOM 1418 O GLU A 89 13.586 -6.333 5.197 1.00 0.00 O ATOM 1419 CB GLU A 89 16.009 -7.174 3.853 1.00 0.00 C ATOM 1420 CG GLU A 89 16.951 -8.375 3.956 1.00 0.00 C ATOM 1421 CD GLU A 89 17.363 -8.626 5.408 1.00 0.00 C ATOM 1422 OE1 GLU A 89 16.597 -9.329 6.101 1.00 0.00 O ATOM 1423 OE2 GLU A 89 18.435 -8.109 5.791 1.00 0.00 O ATOM 0 H GLU A 89 14.877 -6.884 1.494 1.00 0.00 H new ATOM 0 HA GLU A 89 14.436 -8.612 3.845 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.400 -6.462 3.126 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.965 -6.658 4.812 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.460 -9.262 3.555 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.838 -8.199 3.348 1.00 0.00 H new ATOM 1430 N LEU A 90 12.614 -6.282 3.156 1.00 0.00 N ATOM 1431 CA LEU A 90 11.544 -5.388 3.565 1.00 0.00 C ATOM 1432 C LEU A 90 10.221 -6.157 3.581 1.00 0.00 C ATOM 1433 O LEU A 90 10.205 -7.375 3.413 1.00 0.00 O ATOM 1434 CB LEU A 90 11.520 -4.141 2.679 1.00 0.00 C ATOM 1435 CG LEU A 90 12.824 -3.344 2.607 1.00 0.00 C ATOM 1436 CD1 LEU A 90 12.665 -2.113 1.713 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.319 -2.975 4.007 1.00 0.00 C ATOM 0 H LEU A 90 12.581 -6.567 2.177 1.00 0.00 H new ATOM 0 HA LEU A 90 11.716 -5.027 4.579 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.246 -4.443 1.668 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.732 -3.479 3.039 1.00 0.00 H new ATOM 0 HG LEU A 90 13.586 -3.976 2.152 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.606 -1.564 1.679 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.392 -2.428 0.706 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.884 -1.469 2.116 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.247 -2.409 3.927 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.566 -2.369 4.511 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.497 -3.884 4.581 1.00 0.00 H new ATOM 1449 N ALA A 91 9.144 -5.413 3.785 1.00 0.00 N ATOM 1450 CA ALA A 91 7.820 -6.009 3.825 1.00 0.00 C ATOM 1451 C ALA A 91 6.775 -4.909 4.024 1.00 0.00 C ATOM 1452 O ALA A 91 6.926 -4.056 4.898 1.00 0.00 O ATOM 1453 CB ALA A 91 7.769 -7.067 4.929 1.00 0.00 C ATOM 0 H ALA A 91 9.161 -4.403 3.924 1.00 0.00 H new ATOM 0 HA ALA A 91 7.597 -6.509 2.883 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.775 -7.514 4.959 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.509 -7.841 4.726 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.986 -6.601 5.890 1.00 0.00 H new ATOM 1459 N LEU A 92 5.740 -4.964 3.199 1.00 0.00 N ATOM 1460 CA LEU A 92 4.671 -3.983 3.274 1.00 0.00 C ATOM 1461 C LEU A 92 3.497 -4.572 4.057 1.00 0.00 C ATOM 1462 O LEU A 92 3.138 -5.733 3.865 1.00 0.00 O ATOM 1463 CB LEU A 92 4.293 -3.495 1.874 1.00 0.00 C ATOM 1464 CG LEU A 92 5.456 -3.076 0.972 1.00 0.00 C ATOM 1465 CD1 LEU A 92 5.021 -3.020 -0.494 1.00 0.00 C ATOM 1466 CD2 LEU A 92 6.064 -1.753 1.441 1.00 0.00 C ATOM 0 H LEU A 92 5.619 -5.673 2.475 1.00 0.00 H new ATOM 0 HA LEU A 92 5.004 -3.098 3.816 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.738 -4.288 1.372 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.616 -2.647 1.977 1.00 0.00 H new ATOM 0 HG LEU A 92 6.236 -3.833 1.047 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.866 -2.720 -1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.673 -4.004 -0.808 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.214 -2.296 -0.607 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.888 -1.478 0.783 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.303 -0.973 1.415 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.435 -1.864 2.460 1.00 0.00 H new ATOM 1478 N HIS A 93 2.931 -3.746 4.925 1.00 0.00 N ATOM 1479 CA HIS A 93 1.805 -4.171 5.739 1.00 0.00 C ATOM 1480 C HIS A 93 0.583 -3.309 5.414 1.00 0.00 C ATOM 1481 O HIS A 93 0.508 -2.152 5.826 1.00 0.00 O ATOM 1482 CB HIS A 93 2.169 -4.148 7.224 1.00 0.00 C ATOM 1483 CG HIS A 93 1.074 -4.655 8.133 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.520 -5.895 8.254 1.00 0.00 N flip ATOM 1485 CD2 HIS A 93 0.427 -3.846 9.051 1.00 0.00 C flip ATOM 1486 CE1 HIS A 93 -0.414 -5.847 9.196 1.00 0.00 C flip ATOM 1487 NE2 HIS A 93 -0.474 -4.578 9.690 1.00 0.00 N flip ATOM 0 H HIS A 93 3.232 -2.784 5.082 1.00 0.00 H new ATOM 0 HA HIS A 93 1.550 -5.204 5.503 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.063 -4.752 7.378 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.421 -3.127 7.510 1.00 0.00 H new ATOM 0 HD1 HIS A 93 0.779 -6.720 7.713 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.623 -2.797 9.218 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -1.026 -6.677 9.518 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.344 -3.906 4.679 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.558 -3.207 4.294 1.00 0.00 C ATOM 1497 C PHE A 94 -2.685 -3.476 5.294 1.00 0.00 C ATOM 1498 O PHE A 94 -3.330 -4.522 5.242 1.00 0.00 O ATOM 1499 CB PHE A 94 -1.970 -3.747 2.923 1.00 0.00 C ATOM 1500 CG PHE A 94 -0.988 -3.405 1.800 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.537 -2.130 1.656 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.568 -4.376 0.945 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.374 -1.813 0.614 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.343 -4.059 -0.097 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.794 -2.784 -0.241 1.00 0.00 C ATOM 0 H PHE A 94 -0.279 -4.866 4.340 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.377 -2.132 4.270 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.071 -4.830 2.986 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.952 -3.349 2.667 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.872 -1.359 2.334 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.927 -5.388 1.059 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.733 -0.801 0.500 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.678 -4.830 -0.775 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.486 -2.542 -1.034 1.00 0.00 H new ATOM 1515 N THR A 95 -2.888 -2.513 6.181 1.00 0.00 N ATOM 1516 CA THR A 95 -3.926 -2.632 7.191 1.00 0.00 C ATOM 1517 C THR A 95 -5.231 -2.009 6.691 1.00 0.00 C ATOM 1518 O THR A 95 -5.285 -0.812 6.413 1.00 0.00 O ATOM 1519 CB THR A 95 -3.405 -1.997 8.482 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.139 -2.619 8.687 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.224 -2.406 9.707 1.00 0.00 C ATOM 0 H THR A 95 -2.351 -1.647 6.221 1.00 0.00 H new ATOM 0 HA THR A 95 -4.159 -3.677 7.397 1.00 0.00 H new ATOM 0 HB THR A 95 -3.417 -0.911 8.384 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.251 -3.411 9.253 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.812 -1.928 10.596 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.260 -2.093 9.573 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.185 -3.489 9.826 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.250 -2.849 6.591 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.551 -2.395 6.130 1.00 0.00 C ATOM 1531 C ILE A 96 -8.366 -1.896 7.325 1.00 0.00 C ATOM 1532 O ILE A 96 -9.107 -2.661 7.940 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.249 -3.496 5.328 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.437 -3.867 4.085 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.683 -3.093 4.977 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.158 -4.615 4.469 1.00 0.00 C ATOM 0 H ILE A 96 -6.201 -3.841 6.821 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.440 -1.554 5.446 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.309 -4.388 5.952 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.041 -4.488 3.424 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.182 -2.964 3.530 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.157 -3.893 4.407 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.246 -2.918 5.894 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.669 -2.181 4.380 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.599 -4.867 3.568 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.545 -3.982 5.111 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.418 -5.529 5.003 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.201 -0.614 7.618 1.00 0.00 N ATOM 1549 CA LEU A 97 -8.911 -0.003 8.729 1.00 0.00 C ATOM 1550 C LEU A 97 -10.198 0.643 8.211 1.00 0.00 C ATOM 1551 O LEU A 97 -10.631 0.364 7.095 1.00 0.00 O ATOM 1552 CB LEU A 97 -7.997 0.965 9.482 1.00 0.00 C ATOM 1553 CG LEU A 97 -6.684 0.379 10.005 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -5.544 0.614 9.012 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.355 0.926 11.395 1.00 0.00 C ATOM 0 H LEU A 97 -7.586 0.018 7.105 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.203 -0.760 9.457 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.762 1.799 8.821 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.551 1.374 10.327 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.807 -0.699 10.104 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.622 0.188 9.408 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.785 0.137 8.062 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.411 1.685 8.857 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.417 0.494 11.744 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.258 2.011 11.346 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.155 0.664 12.088 1.00 0.00 H new ATOM 1567 N SER A 98 -10.773 1.494 9.048 1.00 0.00 N ATOM 1568 CA SER A 98 -12.001 2.182 8.689 1.00 0.00 C ATOM 1569 C SER A 98 -12.063 3.542 9.388 1.00 0.00 C ATOM 1570 O SER A 98 -12.371 3.621 10.576 1.00 0.00 O ATOM 1571 CB SER A 98 -13.228 1.343 9.053 1.00 0.00 C ATOM 1572 OG SER A 98 -14.151 2.069 9.861 1.00 0.00 O ATOM 0 H SER A 98 -10.411 1.723 9.974 1.00 0.00 H new ATOM 0 HA SER A 98 -12.004 2.335 7.610 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.726 1.014 8.141 1.00 0.00 H new ATOM 0 HB3 SER A 98 -12.909 0.446 9.584 1.00 0.00 H new ATOM 0 HG SER A 98 -13.680 2.455 10.629 1.00 0.00 H new ATOM 1701 N ASP A 106 -11.234 0.915 13.156 1.00 0.00 N ATOM 1702 CA ASP A 106 -11.829 -0.406 13.047 1.00 0.00 C ATOM 1703 C ASP A 106 -11.055 -1.224 12.010 1.00 0.00 C ATOM 1704 O ASP A 106 -11.348 -1.156 10.817 1.00 0.00 O ATOM 1705 CB ASP A 106 -13.286 -0.318 12.589 1.00 0.00 C ATOM 1706 CG ASP A 106 -14.320 -0.716 13.644 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -13.886 -1.215 14.704 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -15.522 -0.510 13.366 1.00 0.00 O ATOM 0 HA ASP A 106 -11.788 -0.877 14.029 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -13.490 0.704 12.270 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -13.416 -0.957 11.715 1.00 0.00 H new ATOM 1713 N ILE A 107 -10.084 -1.978 12.503 1.00 0.00 N ATOM 1714 CA ILE A 107 -9.267 -2.808 11.635 1.00 0.00 C ATOM 1715 C ILE A 107 -10.149 -3.868 10.972 1.00 0.00 C ATOM 1716 O ILE A 107 -10.441 -4.901 11.573 1.00 0.00 O ATOM 1717 CB ILE A 107 -8.082 -3.389 12.408 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -6.989 -2.337 12.610 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -7.546 -4.649 11.725 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -6.078 -2.710 13.781 1.00 0.00 C ATOM 0 H ILE A 107 -9.845 -2.031 13.493 1.00 0.00 H new ATOM 0 HA ILE A 107 -8.832 -2.209 10.835 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.432 -3.683 13.398 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.397 -2.243 11.700 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -7.445 -1.364 12.795 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -6.704 -5.042 12.295 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.334 -5.400 11.678 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.217 -4.404 10.715 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -5.310 -1.946 13.903 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -6.669 -2.779 14.694 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -5.605 -3.671 13.582 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.548 -3.576 9.743 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.391 -4.492 8.993 1.00 0.00 C ATOM 1734 C ILE A 108 -10.598 -5.760 8.671 1.00 0.00 C ATOM 1735 O ILE A 108 -11.166 -6.849 8.598 1.00 0.00 O ATOM 1736 CB ILE A 108 -11.968 -3.798 7.757 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -12.904 -2.655 8.157 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.656 -4.806 6.834 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -13.135 -1.700 6.984 1.00 0.00 C ATOM 0 H ILE A 108 -10.303 -2.718 9.248 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.250 -4.796 9.591 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.144 -3.358 7.196 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -13.858 -3.062 8.493 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -12.477 -2.108 8.998 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.057 -4.287 5.963 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.933 -5.554 6.509 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.468 -5.296 7.371 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -13.803 -0.897 7.295 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -12.182 -1.277 6.667 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.584 -2.245 6.154 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.298 -5.578 8.489 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.422 -6.694 8.177 1.00 0.00 C ATOM 1753 C GLY A 109 -6.970 -6.230 8.042 1.00 0.00 C ATOM 1754 O GLY A 109 -6.702 -5.032 7.970 1.00 0.00 O ATOM 0 H GLY A 109 -8.830 -4.674 8.552 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.495 -7.448 8.960 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.745 -7.166 7.249 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.072 -7.204 8.013 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.655 -6.911 7.888 1.00 0.00 C ATOM 1760 C GLU A 110 -4.054 -7.686 6.713 1.00 0.00 C ATOM 1761 O GLU A 110 -4.348 -8.866 6.528 1.00 0.00 O ATOM 1762 CB GLU A 110 -3.913 -7.224 9.188 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.400 -6.327 10.328 1.00 0.00 C ATOM 1764 CD GLU A 110 -5.328 -7.094 11.272 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -6.536 -7.155 10.955 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -4.809 -7.603 12.288 1.00 0.00 O ATOM 0 H GLU A 110 -6.299 -8.197 8.074 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.541 -5.845 7.691 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.064 -8.270 9.454 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.842 -7.084 9.042 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.545 -5.944 10.885 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.925 -5.464 9.918 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.223 -6.991 5.950 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.579 -7.599 4.798 1.00 0.00 C ATOM 1775 C VAL A 111 -1.073 -7.334 4.863 1.00 0.00 C ATOM 1776 O VAL A 111 -0.641 -6.315 5.400 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.221 -7.087 3.508 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.236 -7.159 2.339 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.505 -7.857 3.191 1.00 0.00 C ATOM 0 H VAL A 111 -2.981 -6.013 6.107 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.720 -8.680 4.808 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.486 -6.041 3.659 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.718 -6.789 1.434 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.362 -6.546 2.561 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.925 -8.193 2.188 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -4.941 -7.473 2.269 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.274 -8.915 3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.215 -7.732 4.008 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.316 -8.269 4.308 1.00 0.00 N ATOM 1790 CA LEU A 112 1.132 -8.149 4.296 1.00 0.00 C ATOM 1791 C LEU A 112 1.680 -8.763 3.006 1.00 0.00 C ATOM 1792 O LEU A 112 1.157 -9.766 2.521 1.00 0.00 O ATOM 1793 CB LEU A 112 1.731 -8.753 5.568 1.00 0.00 C ATOM 1794 CG LEU A 112 3.257 -8.723 5.671 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.739 -7.406 6.283 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.779 -9.938 6.441 1.00 0.00 C ATOM 0 H LEU A 112 -0.678 -9.113 3.864 1.00 0.00 H new ATOM 0 HA LEU A 112 1.427 -7.100 4.300 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.318 -8.224 6.427 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.402 -9.789 5.644 1.00 0.00 H new ATOM 0 HG LEU A 112 3.669 -8.780 4.663 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.827 -7.410 6.345 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.415 -6.574 5.658 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.319 -7.294 7.283 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.866 -9.892 6.500 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.361 -9.938 7.448 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.482 -10.851 5.925 1.00 0.00 H new ATOM 1808 N ILE A 113 2.726 -8.137 2.487 1.00 0.00 N ATOM 1809 CA ILE A 113 3.350 -8.610 1.263 1.00 0.00 C ATOM 1810 C ILE A 113 4.869 -8.474 1.385 1.00 0.00 C ATOM 1811 O ILE A 113 5.421 -7.402 1.142 1.00 0.00 O ATOM 1812 CB ILE A 113 2.763 -7.888 0.049 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.662 -8.829 -1.153 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.563 -6.625 -0.277 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.321 -9.565 -1.162 1.00 0.00 C ATOM 0 H ILE A 113 3.157 -7.306 2.892 1.00 0.00 H new ATOM 0 HA ILE A 113 3.136 -9.668 1.110 1.00 0.00 H new ATOM 0 HB ILE A 113 1.749 -7.572 0.296 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.775 -8.260 -2.076 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.477 -9.552 -1.123 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.125 -6.130 -1.144 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.539 -5.948 0.577 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.596 -6.895 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.275 -10.227 -2.027 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.222 -10.153 -0.249 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.509 -8.840 -1.217 1.00 0.00 H new ATOM 1827 N PRO A 114 5.518 -9.605 1.771 1.00 0.00 N ATOM 1828 CA PRO A 114 6.963 -9.622 1.927 1.00 0.00 C ATOM 1829 C PRO A 114 7.662 -9.644 0.567 1.00 0.00 C ATOM 1830 O PRO A 114 7.421 -10.536 -0.245 1.00 0.00 O ATOM 1831 CB PRO A 114 7.253 -10.858 2.764 1.00 0.00 C ATOM 1832 CG PRO A 114 6.017 -11.736 2.652 1.00 0.00 C ATOM 1833 CD PRO A 114 4.897 -10.892 2.067 1.00 0.00 C ATOM 0 HA PRO A 114 7.344 -8.726 2.417 1.00 0.00 H new ATOM 0 HB2 PRO A 114 8.137 -11.379 2.397 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.449 -10.590 3.802 1.00 0.00 H new ATOM 0 HG2 PRO A 114 6.218 -12.598 2.016 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.733 -12.122 3.631 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.485 -11.349 1.167 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.074 -10.781 2.773 1.00 0.00 H new ATOM 1841 N LEU A 115 8.513 -8.650 0.359 1.00 0.00 N ATOM 1842 CA LEU A 115 9.248 -8.543 -0.890 1.00 0.00 C ATOM 1843 C LEU A 115 10.394 -9.557 -0.890 1.00 0.00 C ATOM 1844 O LEU A 115 11.153 -9.641 -1.854 1.00 0.00 O ATOM 1845 CB LEU A 115 9.704 -7.101 -1.122 1.00 0.00 C ATOM 1846 CG LEU A 115 8.696 -6.012 -0.751 1.00 0.00 C ATOM 1847 CD1 LEU A 115 9.282 -4.619 -0.987 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.374 -6.210 -1.495 1.00 0.00 C ATOM 0 H LEU A 115 8.710 -7.911 1.034 1.00 0.00 H new ATOM 0 HA LEU A 115 8.603 -8.789 -1.734 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.617 -6.933 -0.551 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.961 -6.987 -2.175 1.00 0.00 H new ATOM 0 HG LEU A 115 8.481 -6.096 0.314 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.545 -3.863 -0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.175 -4.491 -0.375 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.544 -4.508 -2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.676 -5.422 -1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.552 -6.169 -2.570 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.951 -7.180 -1.234 1.00 0.00 H new ATOM 1860 N SER A 116 10.482 -10.303 0.202 1.00 0.00 N ATOM 1861 CA SER A 116 11.522 -11.308 0.340 1.00 0.00 C ATOM 1862 C SER A 116 11.350 -12.389 -0.728 1.00 0.00 C ATOM 1863 O SER A 116 10.867 -13.483 -0.437 1.00 0.00 O ATOM 1864 CB SER A 116 11.503 -11.932 1.736 1.00 0.00 C ATOM 1865 OG SER A 116 10.408 -11.461 2.517 1.00 0.00 O ATOM 0 H SER A 116 9.850 -10.231 0.999 1.00 0.00 H new ATOM 0 HA SER A 116 12.488 -10.822 0.203 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.445 -13.017 1.647 1.00 0.00 H new ATOM 0 HB3 SER A 116 12.438 -11.704 2.248 1.00 0.00 H new ATOM 0 HG SER A 116 10.570 -10.531 2.781 1.00 0.00 H new ATOM 1871 N GLY A 117 11.754 -12.047 -1.943 1.00 0.00 N ATOM 1872 CA GLY A 117 11.650 -12.975 -3.056 1.00 0.00 C ATOM 1873 C GLY A 117 11.125 -12.272 -4.309 1.00 0.00 C ATOM 1874 O GLY A 117 11.608 -12.520 -5.413 1.00 0.00 O ATOM 0 H GLY A 117 12.154 -11.139 -2.181 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.627 -13.412 -3.262 1.00 0.00 H new ATOM 0 HA3 GLY A 117 10.984 -13.795 -2.789 1.00 0.00 H new ATOM 1878 N ILE A 118 10.143 -11.409 -4.097 1.00 0.00 N ATOM 1879 CA ILE A 118 9.547 -10.668 -5.196 1.00 0.00 C ATOM 1880 C ILE A 118 10.653 -10.164 -6.124 1.00 0.00 C ATOM 1881 O ILE A 118 11.702 -9.717 -5.661 1.00 0.00 O ATOM 1882 CB ILE A 118 8.637 -9.559 -4.663 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.279 -10.120 -4.239 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.497 -8.428 -5.684 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.334 -10.234 -5.437 1.00 0.00 C ATOM 0 H ILE A 118 9.745 -11.206 -3.180 1.00 0.00 H new ATOM 0 HA ILE A 118 8.904 -11.318 -5.790 1.00 0.00 H new ATOM 0 HB ILE A 118 9.101 -9.134 -3.773 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.413 -11.101 -3.783 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.835 -9.474 -3.481 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.845 -7.653 -5.281 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.479 -8.004 -5.894 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.067 -8.821 -6.605 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.376 -10.636 -5.108 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.183 -9.248 -5.876 1.00 0.00 H new ATOM 0 HD13 ILE A 118 6.770 -10.900 -6.182 1.00 0.00 H new ATOM 1897 N GLU A 119 10.382 -10.251 -7.418 1.00 0.00 N ATOM 1898 CA GLU A 119 11.341 -9.809 -8.416 1.00 0.00 C ATOM 1899 C GLU A 119 10.778 -8.627 -9.207 1.00 0.00 C ATOM 1900 O GLU A 119 9.928 -8.807 -10.077 1.00 0.00 O ATOM 1901 CB GLU A 119 11.730 -10.958 -9.348 1.00 0.00 C ATOM 1902 CG GLU A 119 12.917 -11.743 -8.786 1.00 0.00 C ATOM 1903 CD GLU A 119 13.283 -12.914 -9.700 1.00 0.00 C ATOM 1904 OE1 GLU A 119 13.826 -12.634 -10.791 1.00 0.00 O ATOM 1905 OE2 GLU A 119 13.010 -14.062 -9.288 1.00 0.00 O ATOM 0 H GLU A 119 9.511 -10.621 -7.799 1.00 0.00 H new ATOM 0 HA GLU A 119 12.244 -9.479 -7.903 1.00 0.00 H new ATOM 0 HB2 GLU A 119 10.879 -11.626 -9.483 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.984 -10.563 -10.332 1.00 0.00 H new ATOM 0 HG2 GLU A 119 13.776 -11.081 -8.676 1.00 0.00 H new ATOM 0 HG3 GLU A 119 12.673 -12.116 -7.791 1.00 0.00 H new ATOM 1912 N LEU A 120 11.274 -7.444 -8.876 1.00 0.00 N ATOM 1913 CA LEU A 120 10.831 -6.233 -9.544 1.00 0.00 C ATOM 1914 C LEU A 120 11.765 -5.932 -10.718 1.00 0.00 C ATOM 1915 O LEU A 120 11.443 -5.116 -11.580 1.00 0.00 O ATOM 1916 CB LEU A 120 10.711 -5.082 -8.544 1.00 0.00 C ATOM 1917 CG LEU A 120 9.633 -5.237 -7.469 1.00 0.00 C ATOM 1918 CD1 LEU A 120 9.831 -4.220 -6.343 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.233 -5.151 -8.080 1.00 0.00 C ATOM 0 H LEU A 120 11.979 -7.299 -8.153 1.00 0.00 H new ATOM 0 HA LEU A 120 9.832 -6.371 -9.958 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.674 -4.955 -8.049 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.514 -4.164 -9.098 1.00 0.00 H new ATOM 0 HG LEU A 120 9.731 -6.229 -7.028 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.052 -4.352 -5.592 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.807 -4.372 -5.883 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.775 -3.211 -6.750 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.486 -5.264 -7.295 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.106 -4.183 -8.565 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.108 -5.945 -8.817 1.00 0.00 H new ATOM 1931 N SER A 121 12.905 -6.608 -10.714 1.00 0.00 N ATOM 1932 CA SER A 121 13.888 -6.424 -11.768 1.00 0.00 C ATOM 1933 C SER A 121 13.186 -6.099 -13.088 1.00 0.00 C ATOM 1934 O SER A 121 13.334 -5.000 -13.619 1.00 0.00 O ATOM 1935 CB SER A 121 14.766 -7.667 -11.925 1.00 0.00 C ATOM 1936 OG SER A 121 16.076 -7.341 -12.381 1.00 0.00 O ATOM 0 H SER A 121 13.170 -7.284 -9.997 1.00 0.00 H new ATOM 0 HA SER A 121 14.533 -5.589 -11.492 1.00 0.00 H new ATOM 0 HB2 SER A 121 14.834 -8.186 -10.969 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.298 -8.355 -12.629 1.00 0.00 H new ATOM 0 HG SER A 121 16.606 -8.161 -12.467 1.00 0.00 H new ATOM 1942 N GLU A 122 12.437 -7.076 -13.579 1.00 0.00 N ATOM 1943 CA GLU A 122 11.712 -6.907 -14.827 1.00 0.00 C ATOM 1944 C GLU A 122 11.104 -5.505 -14.902 1.00 0.00 C ATOM 1945 O GLU A 122 11.398 -4.746 -15.824 1.00 0.00 O ATOM 1946 CB GLU A 122 10.634 -7.982 -14.984 1.00 0.00 C ATOM 1947 CG GLU A 122 11.150 -9.158 -15.815 1.00 0.00 C ATOM 1948 CD GLU A 122 10.816 -8.971 -17.296 1.00 0.00 C ATOM 1949 OE1 GLU A 122 11.247 -7.937 -17.849 1.00 0.00 O ATOM 1950 OE2 GLU A 122 10.136 -9.867 -17.842 1.00 0.00 O ATOM 0 H GLU A 122 12.317 -7.987 -13.135 1.00 0.00 H new ATOM 0 HA GLU A 122 12.415 -7.021 -15.652 1.00 0.00 H new ATOM 0 HB2 GLU A 122 10.322 -8.336 -14.001 1.00 0.00 H new ATOM 0 HB3 GLU A 122 9.754 -7.552 -15.462 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.229 -9.250 -15.691 1.00 0.00 H new ATOM 0 HG3 GLU A 122 10.707 -10.086 -15.453 1.00 0.00 H new ATOM 1957 N GLY A 123 10.267 -5.205 -13.920 1.00 0.00 N ATOM 1958 CA GLY A 123 9.614 -3.908 -13.863 1.00 0.00 C ATOM 1959 C GLY A 123 8.503 -3.898 -12.811 1.00 0.00 C ATOM 1960 O GLY A 123 8.656 -4.477 -11.736 1.00 0.00 O ATOM 0 H GLY A 123 10.026 -5.838 -13.157 1.00 0.00 H new ATOM 0 HA2 GLY A 123 10.348 -3.137 -13.629 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.197 -3.664 -14.840 1.00 0.00 H new ATOM 1964 N LYS A 124 7.410 -3.235 -13.157 1.00 0.00 N ATOM 1965 CA LYS A 124 6.274 -3.142 -12.256 1.00 0.00 C ATOM 1966 C LYS A 124 5.437 -4.418 -12.365 1.00 0.00 C ATOM 1967 O LYS A 124 5.274 -4.967 -13.453 1.00 0.00 O ATOM 1968 CB LYS A 124 5.480 -1.862 -12.524 1.00 0.00 C ATOM 1969 CG LYS A 124 4.261 -1.770 -11.605 1.00 0.00 C ATOM 1970 CD LYS A 124 3.346 -0.616 -12.021 1.00 0.00 C ATOM 1971 CE LYS A 124 3.294 0.461 -10.935 1.00 0.00 C ATOM 1972 NZ LYS A 124 1.946 1.068 -10.871 1.00 0.00 N ATOM 0 H LYS A 124 7.287 -2.757 -14.049 1.00 0.00 H new ATOM 0 HA LYS A 124 6.613 -3.069 -11.223 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.121 -0.994 -12.372 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.157 -1.841 -13.565 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.706 -2.708 -11.636 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.588 -1.627 -10.575 1.00 0.00 H new ATOM 0 HD2 LYS A 124 3.705 -0.180 -12.953 1.00 0.00 H new ATOM 0 HD3 LYS A 124 2.342 -0.994 -12.212 1.00 0.00 H new ATOM 0 HE2 LYS A 124 3.549 0.025 -9.969 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.037 1.231 -11.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 2.006 2.000 -10.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 1.569 1.180 -11.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 1.314 0.452 -10.321 1.00 0.00 H new ATOM 1986 N MET A 125 4.929 -4.853 -11.221 1.00 0.00 N ATOM 1987 CA MET A 125 4.113 -6.055 -11.174 1.00 0.00 C ATOM 1988 C MET A 125 2.820 -5.809 -10.394 1.00 0.00 C ATOM 1989 O MET A 125 2.827 -5.123 -9.373 1.00 0.00 O ATOM 1990 CB MET A 125 4.904 -7.183 -10.509 1.00 0.00 C ATOM 1991 CG MET A 125 5.006 -6.965 -8.998 1.00 0.00 C ATOM 1992 SD MET A 125 5.851 -8.341 -8.238 1.00 0.00 S ATOM 1993 CE MET A 125 7.329 -8.387 -9.238 1.00 0.00 C ATOM 0 H MET A 125 5.066 -4.395 -10.320 1.00 0.00 H new ATOM 0 HA MET A 125 3.852 -6.335 -12.195 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.420 -8.139 -10.710 1.00 0.00 H new ATOM 0 HB3 MET A 125 5.903 -7.235 -10.941 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.543 -6.039 -8.791 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.009 -6.858 -8.570 1.00 0.00 H new ATOM 0 HE1 MET A 125 7.289 -9.247 -9.907 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.399 -7.472 -9.826 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.203 -8.471 -8.592 1.00 0.00 H new ATOM 2003 N LEU A 126 1.740 -6.383 -10.905 1.00 0.00 N ATOM 2004 CA LEU A 126 0.442 -6.234 -10.269 1.00 0.00 C ATOM 2005 C LEU A 126 0.198 -7.422 -9.336 1.00 0.00 C ATOM 2006 O LEU A 126 0.486 -8.564 -9.690 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.652 -6.044 -11.322 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.907 -5.302 -10.858 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.643 -6.093 -9.775 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.567 -3.883 -10.401 1.00 0.00 C ATOM 0 H LEU A 126 1.738 -6.952 -11.752 1.00 0.00 H new ATOM 0 HA LEU A 126 0.419 -5.334 -9.654 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.226 -5.503 -12.167 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.950 -7.026 -11.690 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.585 -5.213 -11.707 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.531 -5.543 -9.463 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.938 -7.065 -10.171 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.985 -6.236 -8.918 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.477 -3.378 -10.076 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.861 -3.927 -9.572 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.121 -3.331 -11.229 1.00 0.00 H new ATOM 2022 N MET A 127 -0.332 -7.112 -8.162 1.00 0.00 N ATOM 2023 CA MET A 127 -0.619 -8.139 -7.175 1.00 0.00 C ATOM 2024 C MET A 127 -1.898 -7.814 -6.400 1.00 0.00 C ATOM 2025 O MET A 127 -2.282 -6.650 -6.291 1.00 0.00 O ATOM 2026 CB MET A 127 0.554 -8.252 -6.199 1.00 0.00 C ATOM 2027 CG MET A 127 1.855 -8.568 -6.941 1.00 0.00 C ATOM 2028 SD MET A 127 2.867 -9.662 -5.959 1.00 0.00 S ATOM 2029 CE MET A 127 2.822 -8.805 -4.394 1.00 0.00 C ATOM 0 H MET A 127 -0.570 -6.164 -7.872 1.00 0.00 H new ATOM 0 HA MET A 127 -0.763 -9.086 -7.696 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.663 -7.319 -5.647 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.349 -9.033 -5.467 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.632 -9.031 -7.902 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.398 -7.646 -7.149 1.00 0.00 H new ATOM 0 HE1 MET A 127 3.715 -9.050 -3.819 1.00 0.00 H new ATOM 0 HE2 MET A 127 2.786 -7.730 -4.569 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.937 -9.112 -3.837 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.521 -8.862 -5.883 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.748 -8.702 -5.121 1.00 0.00 C ATOM 2041 C ASN A 128 -3.679 -9.570 -3.863 1.00 0.00 C ATOM 2042 O ASN A 128 -3.178 -10.693 -3.905 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.964 -9.148 -5.936 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.593 -10.276 -6.901 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.605 -10.972 -6.734 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -5.439 -10.417 -7.918 1.00 0.00 N ATOM 0 H ASN A 128 -2.199 -9.825 -5.977 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.851 -7.647 -4.866 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.753 -9.484 -5.264 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.361 -8.301 -6.496 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -5.279 -11.142 -8.617 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -6.247 -9.800 -7.998 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.189 -9.016 -2.772 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.191 -9.725 -1.504 1.00 0.00 C ATOM 2055 C ARG A 129 -5.612 -9.803 -0.942 1.00 0.00 C ATOM 2056 O ARG A 129 -6.432 -8.922 -1.195 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.284 -9.033 -0.485 1.00 0.00 C ATOM 2058 CG ARG A 129 -2.003 -9.838 -0.255 1.00 0.00 C ATOM 2059 CD ARG A 129 -2.325 -11.280 0.142 1.00 0.00 C ATOM 2060 NE ARG A 129 -1.257 -11.815 1.016 1.00 0.00 N ATOM 2061 CZ ARG A 129 -1.163 -13.099 1.387 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -2.071 -13.987 0.963 1.00 0.00 N ATOM 2063 NH2 ARG A 129 -0.159 -13.494 2.182 1.00 0.00 N ATOM 0 H ARG A 129 -4.603 -8.085 -2.741 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.813 -10.731 -1.686 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.031 -8.033 -0.838 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.816 -8.913 0.458 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.399 -9.833 -1.162 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.408 -9.366 0.527 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -3.283 -11.318 0.660 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.420 -11.899 -0.750 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.548 -11.166 1.357 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.835 -13.686 0.357 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.999 -14.964 1.246 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.533 -12.817 2.504 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -0.087 -14.471 2.465 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.860 -10.866 -0.191 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.167 -11.071 0.408 1.00 0.00 C ATOM 2079 C GLU A 130 -7.200 -10.487 1.822 1.00 0.00 C ATOM 2080 O GLU A 130 -6.181 -10.463 2.511 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.540 -12.555 0.419 1.00 0.00 C ATOM 2082 CG GLU A 130 -6.884 -13.276 1.598 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.242 -14.590 1.149 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -5.323 -14.514 0.305 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -6.686 -15.642 1.659 1.00 0.00 O ATOM 0 H GLU A 130 -5.177 -11.595 0.016 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.908 -10.549 -0.198 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.623 -12.661 0.480 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.227 -13.019 -0.516 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.128 -12.632 2.047 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.630 -13.476 2.367 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.381 -10.031 2.213 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.560 -9.449 3.532 1.00 0.00 C ATOM 2094 C ILE A 131 -9.388 -10.402 4.397 1.00 0.00 C ATOM 2095 O ILE A 131 -10.564 -10.633 4.121 1.00 0.00 O ATOM 2096 CB ILE A 131 -9.155 -8.044 3.422 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.187 -7.092 2.716 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.577 -7.518 4.795 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.916 -6.242 1.673 1.00 0.00 C ATOM 0 H ILE A 131 -9.224 -10.053 1.639 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.597 -9.324 4.027 1.00 0.00 H new ATOM 0 HB ILE A 131 -10.054 -8.101 2.809 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.710 -6.443 3.450 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.395 -7.665 2.234 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -9.997 -6.518 4.688 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.327 -8.182 5.224 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.708 -7.479 5.452 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.205 -5.574 1.186 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.372 -6.893 0.927 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.691 -5.652 2.162 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.741 -10.928 5.427 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.403 -11.850 6.334 1.00 0.00 C ATOM 2113 C ILE A 132 -9.215 -11.366 7.773 1.00 0.00 C ATOM 2114 O ILE A 132 -8.706 -10.270 8.002 1.00 0.00 O ATOM 2115 CB ILE A 132 -8.912 -13.280 6.097 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.396 -13.312 5.894 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.661 -13.931 4.932 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.661 -12.953 7.187 1.00 0.00 C ATOM 0 H ILE A 132 -7.766 -10.733 5.653 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.476 -11.870 6.141 1.00 0.00 H new ATOM 0 HB ILE A 132 -9.130 -13.869 6.988 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -7.091 -14.304 5.562 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -7.116 -12.612 5.106 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.293 -14.946 4.785 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.727 -13.960 5.156 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.497 -13.350 4.024 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.585 -12.983 7.014 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -6.950 -11.951 7.503 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -6.924 -13.669 7.966 1.00 0.00 H new ATOM 2130 N SER A 133 -9.637 -12.207 8.706 1.00 0.00 N ATOM 2131 CA SER A 133 -9.522 -11.878 10.117 1.00 0.00 C ATOM 2132 C SER A 133 -8.179 -12.371 10.661 1.00 0.00 C ATOM 2133 O SER A 133 -8.123 -13.372 11.374 1.00 0.00 O ATOM 2134 CB SER A 133 -10.674 -12.485 10.920 1.00 0.00 C ATOM 2135 OG SER A 133 -10.489 -12.326 12.323 1.00 0.00 O ATOM 0 H SER A 133 -10.059 -13.115 8.513 1.00 0.00 H new ATOM 0 HA SER A 133 -9.574 -10.794 10.221 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.611 -12.014 10.622 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.761 -13.546 10.684 1.00 0.00 H new ATOM 0 HG SER A 133 -11.246 -12.725 12.800 1.00 0.00 H new