USER MOD reduce.3.24.130724 H: found=0, std=0, add=1018, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1025 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 19 TYR OH : rot -34:sc= 1.23 USER MOD Set 1.2: A 102 THR OG1 : rot 4:sc= 2.27 USER MOD Set 2.1: A 80 CYS SG : rot 85:sc= -0.67 USER MOD Set 2.2: A 82 SER OG : rot 60:sc= 1.66 USER MOD Set 2.3: A 95 GLN :FLIP amide:sc= 0.938 F(o=-0.36,f=1.9) USER MOD Set 3.1: A 36 THR OG1 : rot -70:sc= 1.23 USER MOD Set 3.2: A 55 SER OG : rot 60:sc= 2.33 USER MOD Set 4.1: A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 63 SER OG : rot 32:sc= 0.544 USER MOD Set 5.1: A 5 CYS SG : rot 170:sc= 0 USER MOD Set 5.2: A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -60:sc= 0.939 USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 13 SER OG : rot 27:sc= 0.959 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 15 ASN : amide:sc= 0.126 K(o=0.13,f=-3.3!) USER MOD Single : A 20 MET CE :methyl -160:sc= -0.459 (180deg=-0.924) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -167:sc= 1.16 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 ASN : amide:sc= 1.39 K(o=1.4,f=-1.2) USER MOD Single : A 37 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.561) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 131:sc= 1.08 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -41:sc= 1.01 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -20:sc= -0.171 USER MOD Single : A 79 ASN : amide:sc= -0.651 K(o=-0.65,f=-3.2!) USER MOD Single : A 81 LYS NZ :NH3+ 170:sc= 0.718 (180deg=0.649) USER MOD Single : A 85 SER OG : rot 11:sc= 0.647 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 HIS : no HD1:sc= -0.0363 X(o=-0.036,f=-0.5) USER MOD Single : A 96 LYS NZ :NH3+ 150:sc= 0.283 (180deg=-0.516) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl 179:sc= 0 (180deg=-0.00151) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 72:sc= 0.857 USER MOD Single : A 127 HIS : no HE2:sc= 0.434 K(o=0.43,f=-1.4!) USER MOD Single : A 128 TYR OH : rot 165:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N GLU A 2 0.456 0.704 -1.226 1.00 0.00 N ATOM 19 CA GLU A 2 -0.320 1.977 -1.082 1.00 0.00 C ATOM 20 C GLU A 2 0.464 3.333 -0.998 1.00 0.00 C ATOM 21 O GLU A 2 0.040 4.307 -1.624 1.00 0.00 O ATOM 22 CB GLU A 2 -1.382 1.810 0.042 1.00 0.00 C ATOM 23 CG GLU A 2 -0.863 1.731 1.504 1.00 0.00 C ATOM 24 CD GLU A 2 -1.962 1.483 2.534 1.00 0.00 C ATOM 25 OE1 GLU A 2 -2.232 0.371 2.978 1.00 0.00 O ATOM 26 OE2 GLU A 2 -2.600 2.636 2.897 1.00 0.00 O ATOM 0 HA GLU A 2 -0.798 2.109 -2.053 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -2.078 2.646 -0.024 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -1.952 0.904 -0.164 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -0.124 0.933 1.575 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -0.351 2.662 1.749 1.00 0.00 H new ATOM 34 N ALA A 3 1.614 3.392 -0.298 1.00 0.00 N ATOM 35 CA ALA A 3 2.552 4.552 -0.375 1.00 0.00 C ATOM 36 C ALA A 3 3.171 4.913 -1.775 1.00 0.00 C ATOM 37 O ALA A 3 3.567 6.062 -1.983 1.00 0.00 O ATOM 38 CB ALA A 3 3.648 4.281 0.672 1.00 0.00 C ATOM 0 H ALA A 3 1.925 2.652 0.332 1.00 0.00 H new ATOM 0 HA ALA A 3 1.961 5.447 -0.179 1.00 0.00 H new ATOM 0 HB1 ALA A 3 4.369 5.099 0.664 1.00 0.00 H new ATOM 0 HB2 ALA A 3 3.196 4.205 1.661 1.00 0.00 H new ATOM 0 HB3 ALA A 3 4.156 3.347 0.433 1.00 0.00 H new ATOM 44 N PHE A 4 3.227 3.968 -2.731 1.00 0.00 N ATOM 45 CA PHE A 4 3.560 4.260 -4.156 1.00 0.00 C ATOM 46 C PHE A 4 2.395 4.814 -5.048 1.00 0.00 C ATOM 47 O PHE A 4 2.696 5.272 -6.151 1.00 0.00 O ATOM 48 CB PHE A 4 4.162 2.978 -4.808 1.00 0.00 C ATOM 49 CG PHE A 4 5.512 2.506 -4.243 1.00 0.00 C ATOM 50 CD1 PHE A 4 6.691 3.169 -4.599 1.00 0.00 C ATOM 51 CD2 PHE A 4 5.570 1.430 -3.351 1.00 0.00 C ATOM 52 CE1 PHE A 4 7.907 2.775 -4.050 1.00 0.00 C ATOM 53 CE2 PHE A 4 6.790 1.032 -2.809 1.00 0.00 C ATOM 54 CZ PHE A 4 7.956 1.709 -3.155 1.00 0.00 C ATOM 0 H PHE A 4 3.045 2.981 -2.549 1.00 0.00 H new ATOM 0 HA PHE A 4 4.276 5.081 -4.117 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.442 2.167 -4.700 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.281 3.159 -5.876 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.657 3.989 -5.302 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.665 0.906 -3.081 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.814 3.296 -4.318 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.831 0.200 -2.122 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.901 1.407 -2.728 1.00 0.00 H new ATOM 64 N CYS A 5 1.107 4.787 -4.647 1.00 0.00 N ATOM 65 CA CYS A 5 -0.025 5.223 -5.510 1.00 0.00 C ATOM 66 C CYS A 5 -0.208 6.779 -5.542 1.00 0.00 C ATOM 67 O CYS A 5 -0.882 7.363 -4.687 1.00 0.00 O ATOM 68 CB CYS A 5 -1.270 4.469 -4.996 1.00 0.00 C ATOM 69 SG CYS A 5 -1.034 2.662 -5.120 1.00 0.00 S ATOM 0 H CYS A 5 0.817 4.466 -3.723 1.00 0.00 H new ATOM 0 HA CYS A 5 0.166 4.975 -6.554 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -1.465 4.744 -3.959 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -2.145 4.766 -5.574 1.00 0.00 H new ATOM 0 HG CYS A 5 -1.995 2.055 -4.490 1.00 0.00 H new ATOM 75 N ALA A 6 0.433 7.452 -6.519 1.00 0.00 N ATOM 76 CA ALA A 6 0.500 8.941 -6.587 1.00 0.00 C ATOM 77 C ALA A 6 0.986 9.473 -7.981 1.00 0.00 C ATOM 78 O ALA A 6 1.541 8.744 -8.814 1.00 0.00 O ATOM 79 CB ALA A 6 1.415 9.465 -5.448 1.00 0.00 C ATOM 0 H ALA A 6 0.920 6.987 -7.285 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.513 9.322 -6.458 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.467 10.553 -5.494 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.006 9.162 -4.484 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.416 9.049 -5.565 1.00 0.00 H new ATOM 85 N THR A 7 0.813 10.791 -8.205 1.00 0.00 N ATOM 86 CA THR A 7 1.475 11.533 -9.321 1.00 0.00 C ATOM 87 C THR A 7 2.946 11.871 -8.918 1.00 0.00 C ATOM 88 O THR A 7 3.173 12.688 -8.023 1.00 0.00 O ATOM 89 CB THR A 7 0.625 12.802 -9.646 1.00 0.00 C ATOM 90 OG1 THR A 7 -0.663 12.420 -10.116 1.00 0.00 O ATOM 91 CG2 THR A 7 1.193 13.735 -10.728 1.00 0.00 C ATOM 0 H THR A 7 0.214 11.379 -7.625 1.00 0.00 H new ATOM 0 HA THR A 7 1.527 10.928 -10.226 1.00 0.00 H new ATOM 0 HB THR A 7 0.615 13.345 -8.701 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.190 13.222 -10.316 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.520 14.581 -10.869 1.00 0.00 H new ATOM 0 HG22 THR A 7 2.172 14.099 -10.417 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.290 13.188 -11.666 1.00 0.00 H new ATOM 99 N TRP A 8 3.940 11.243 -9.563 1.00 0.00 N ATOM 100 CA TRP A 8 5.369 11.385 -9.162 1.00 0.00 C ATOM 101 C TRP A 8 6.157 12.251 -10.186 1.00 0.00 C ATOM 102 O TRP A 8 6.422 11.811 -11.308 1.00 0.00 O ATOM 103 CB TRP A 8 5.994 9.971 -9.023 1.00 0.00 C ATOM 104 CG TRP A 8 5.499 9.130 -7.846 1.00 0.00 C ATOM 105 CD1 TRP A 8 4.642 8.020 -7.933 1.00 0.00 C ATOM 106 CD2 TRP A 8 5.794 9.270 -6.505 1.00 0.00 C ATOM 107 NE1 TRP A 8 4.415 7.437 -6.674 1.00 0.00 N ATOM 108 CE2 TRP A 8 5.136 8.232 -5.802 1.00 0.00 C ATOM 109 CE3 TRP A 8 6.555 10.239 -5.810 1.00 0.00 C ATOM 110 CZ2 TRP A 8 5.240 8.152 -4.396 1.00 0.00 C ATOM 111 CZ3 TRP A 8 6.651 10.137 -4.423 1.00 0.00 C ATOM 112 CH2 TRP A 8 6.009 9.105 -3.726 1.00 0.00 C ATOM 0 H TRP A 8 3.793 10.630 -10.365 1.00 0.00 H new ATOM 0 HA TRP A 8 5.425 11.900 -8.203 1.00 0.00 H new ATOM 0 HB2 TRP A 8 5.803 9.419 -9.943 1.00 0.00 H new ATOM 0 HB3 TRP A 8 7.075 10.081 -8.936 1.00 0.00 H new ATOM 0 HD1 TRP A 8 4.210 7.659 -8.855 1.00 0.00 H new ATOM 0 HE1 TRP A 8 3.849 6.617 -6.455 1.00 0.00 H new ATOM 0 HE3 TRP A 8 7.050 11.039 -6.341 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 4.735 7.369 -3.850 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 7.230 10.866 -3.876 1.00 0.00 H new ATOM 0 HH2 TRP A 8 6.111 9.046 -2.652 1.00 0.00 H new ATOM 123 N LYS A 9 6.580 13.463 -9.797 1.00 0.00 N ATOM 124 CA LYS A 9 7.381 14.363 -10.678 1.00 0.00 C ATOM 125 C LYS A 9 8.892 14.329 -10.283 1.00 0.00 C ATOM 126 O LYS A 9 9.249 14.418 -9.103 1.00 0.00 O ATOM 127 CB LYS A 9 6.773 15.792 -10.637 1.00 0.00 C ATOM 128 CG LYS A 9 5.447 15.918 -11.423 1.00 0.00 C ATOM 129 CD LYS A 9 4.870 17.344 -11.451 1.00 0.00 C ATOM 130 CE LYS A 9 3.589 17.412 -12.299 1.00 0.00 C ATOM 131 NZ LYS A 9 3.035 18.779 -12.278 1.00 0.00 N ATOM 0 H LYS A 9 6.386 13.855 -8.876 1.00 0.00 H new ATOM 0 HA LYS A 9 7.334 14.013 -11.709 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.600 16.075 -9.599 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.496 16.498 -11.044 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.610 15.583 -12.447 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.710 15.247 -10.982 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.653 17.671 -10.434 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.613 18.031 -11.855 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.808 17.116 -13.325 1.00 0.00 H new ATOM 0 HE3 LYS A 9 2.852 16.707 -11.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.170 18.812 -12.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.809 19.047 -11.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.735 19.443 -12.666 1.00 0.00 H new ATOM 144 N LEU A 10 9.784 14.185 -11.285 1.00 0.00 N ATOM 145 CA LEU A 10 11.256 14.071 -11.050 1.00 0.00 C ATOM 146 C LEU A 10 11.896 15.421 -10.577 1.00 0.00 C ATOM 147 O LEU A 10 11.957 16.397 -11.328 1.00 0.00 O ATOM 148 CB LEU A 10 11.943 13.527 -12.338 1.00 0.00 C ATOM 149 CG LEU A 10 13.270 12.735 -12.157 1.00 0.00 C ATOM 150 CD1 LEU A 10 13.774 12.246 -13.525 1.00 0.00 C ATOM 151 CD2 LEU A 10 14.413 13.504 -11.474 1.00 0.00 C ATOM 0 H LEU A 10 9.519 14.144 -12.269 1.00 0.00 H new ATOM 0 HA LEU A 10 11.418 13.367 -10.234 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.232 12.881 -12.853 1.00 0.00 H new ATOM 0 HB3 LEU A 10 12.141 14.372 -12.997 1.00 0.00 H new ATOM 0 HG LEU A 10 13.011 11.913 -11.489 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.703 11.692 -13.394 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.025 11.596 -13.978 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.951 13.103 -14.175 1.00 0.00 H new ATOM 0 HD21 LEU A 10 15.290 12.861 -11.398 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.661 14.387 -12.063 1.00 0.00 H new ATOM 0 HD23 LEU A 10 14.100 13.810 -10.476 1.00 0.00 H new ATOM 163 N THR A 11 12.389 15.451 -9.329 1.00 0.00 N ATOM 164 CA THR A 11 12.939 16.690 -8.692 1.00 0.00 C ATOM 165 C THR A 11 14.500 16.829 -8.700 1.00 0.00 C ATOM 166 O THR A 11 14.991 17.953 -8.829 1.00 0.00 O ATOM 167 CB THR A 11 12.329 16.916 -7.272 1.00 0.00 C ATOM 168 OG1 THR A 11 12.692 15.890 -6.346 1.00 0.00 O ATOM 169 CG2 THR A 11 10.795 17.042 -7.259 1.00 0.00 C ATOM 0 H THR A 11 12.424 14.630 -8.724 1.00 0.00 H new ATOM 0 HA THR A 11 12.614 17.500 -9.345 1.00 0.00 H new ATOM 0 HB THR A 11 12.759 17.869 -6.964 1.00 0.00 H new ATOM 0 HG1 THR A 11 12.378 15.023 -6.678 1.00 0.00 H new ATOM 0 HG21 THR A 11 10.451 17.197 -6.236 1.00 0.00 H new ATOM 0 HG22 THR A 11 10.494 17.889 -7.875 1.00 0.00 H new ATOM 0 HG23 THR A 11 10.352 16.129 -7.656 1.00 0.00 H new ATOM 177 N ASN A 12 15.284 15.740 -8.556 1.00 0.00 N ATOM 178 CA ASN A 12 16.776 15.790 -8.635 1.00 0.00 C ATOM 179 C ASN A 12 17.304 14.519 -9.374 1.00 0.00 C ATOM 180 O ASN A 12 17.078 13.389 -8.926 1.00 0.00 O ATOM 181 CB ASN A 12 17.368 15.968 -7.207 1.00 0.00 C ATOM 182 CG ASN A 12 18.896 16.113 -7.146 1.00 0.00 C ATOM 183 OD1 ASN A 12 19.509 16.868 -7.892 1.00 0.00 O ATOM 184 ND2 ASN A 12 19.564 15.397 -6.273 1.00 0.00 N ATOM 0 H ASN A 12 14.914 14.805 -8.383 1.00 0.00 H new ATOM 0 HA ASN A 12 17.104 16.650 -9.219 1.00 0.00 H new ATOM 0 HB2 ASN A 12 16.917 16.849 -6.751 1.00 0.00 H new ATOM 0 HB3 ASN A 12 17.076 15.111 -6.600 1.00 0.00 H new ATOM 0 HD21 ASN A 12 20.580 15.473 -6.222 1.00 0.00 H new ATOM 0 HD22 ASN A 12 19.068 14.764 -5.646 1.00 0.00 H new ATOM 191 N SER A 13 18.017 14.705 -10.498 1.00 0.00 N ATOM 192 CA SER A 13 18.509 13.584 -11.343 1.00 0.00 C ATOM 193 C SER A 13 20.050 13.390 -11.255 1.00 0.00 C ATOM 194 O SER A 13 20.810 14.120 -11.905 1.00 0.00 O ATOM 195 CB SER A 13 18.059 13.843 -12.801 1.00 0.00 C ATOM 196 OG SER A 13 18.749 14.950 -13.387 1.00 0.00 O ATOM 0 H SER A 13 18.271 15.627 -10.852 1.00 0.00 H new ATOM 0 HA SER A 13 18.078 12.654 -10.972 1.00 0.00 H new ATOM 0 HB2 SER A 13 18.235 12.949 -13.399 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.986 14.033 -12.821 1.00 0.00 H new ATOM 0 HG SER A 13 19.625 15.052 -12.960 1.00 0.00 H new ATOM 202 N GLN A 14 20.507 12.358 -10.529 1.00 0.00 N ATOM 203 CA GLN A 14 21.907 11.868 -10.633 1.00 0.00 C ATOM 204 C GLN A 14 22.063 10.935 -11.874 1.00 0.00 C ATOM 205 O GLN A 14 21.362 9.926 -12.007 1.00 0.00 O ATOM 206 CB GLN A 14 22.259 11.155 -9.301 1.00 0.00 C ATOM 207 CG GLN A 14 23.675 10.534 -9.172 1.00 0.00 C ATOM 208 CD GLN A 14 24.825 11.542 -9.210 1.00 0.00 C ATOM 209 OE1 GLN A 14 25.242 12.006 -10.267 1.00 0.00 O ATOM 210 NE2 GLN A 14 25.353 11.915 -8.071 1.00 0.00 N ATOM 0 H GLN A 14 19.935 11.841 -9.861 1.00 0.00 H new ATOM 0 HA GLN A 14 22.603 12.693 -10.784 1.00 0.00 H new ATOM 0 HB2 GLN A 14 22.132 11.874 -8.491 1.00 0.00 H new ATOM 0 HB3 GLN A 14 21.528 10.362 -9.141 1.00 0.00 H new ATOM 0 HG2 GLN A 14 23.729 9.979 -8.236 1.00 0.00 H new ATOM 0 HG3 GLN A 14 23.815 9.814 -9.978 1.00 0.00 H new ATOM 0 HE21 GLN A 14 25.003 11.527 -7.195 1.00 0.00 H new ATOM 0 HE22 GLN A 14 26.114 12.594 -8.060 1.00 0.00 H new ATOM 219 N ASN A 15 22.986 11.302 -12.779 1.00 0.00 N ATOM 220 CA ASN A 15 23.245 10.580 -14.057 1.00 0.00 C ATOM 221 C ASN A 15 21.992 10.370 -14.978 1.00 0.00 C ATOM 222 O ASN A 15 21.517 9.247 -15.182 1.00 0.00 O ATOM 223 CB ASN A 15 24.096 9.302 -13.796 1.00 0.00 C ATOM 224 CG ASN A 15 24.902 8.838 -15.014 1.00 0.00 C ATOM 225 OD1 ASN A 15 24.377 8.298 -15.983 1.00 0.00 O ATOM 226 ND2 ASN A 15 26.193 9.072 -15.025 1.00 0.00 N ATOM 0 H ASN A 15 23.586 12.117 -12.651 1.00 0.00 H new ATOM 0 HA ASN A 15 23.847 11.245 -14.676 1.00 0.00 H new ATOM 0 HB2 ASN A 15 24.781 9.495 -12.970 1.00 0.00 H new ATOM 0 HB3 ASN A 15 23.435 8.495 -13.480 1.00 0.00 H new ATOM 0 HD21 ASN A 15 26.753 8.806 -15.835 1.00 0.00 H new ATOM 0 HD22 ASN A 15 26.637 9.520 -14.224 1.00 0.00 H new ATOM 233 N PHE A 16 21.480 11.455 -15.584 1.00 0.00 N ATOM 234 CA PHE A 16 20.536 11.344 -16.737 1.00 0.00 C ATOM 235 C PHE A 16 21.186 11.824 -18.079 1.00 0.00 C ATOM 236 O PHE A 16 20.703 12.736 -18.753 1.00 0.00 O ATOM 237 CB PHE A 16 19.149 11.955 -16.355 1.00 0.00 C ATOM 238 CG PHE A 16 17.890 11.449 -17.115 1.00 0.00 C ATOM 239 CD1 PHE A 16 17.962 10.670 -18.280 1.00 0.00 C ATOM 240 CD2 PHE A 16 16.640 11.629 -16.508 1.00 0.00 C ATOM 241 CE1 PHE A 16 16.839 10.023 -18.776 1.00 0.00 C ATOM 242 CE2 PHE A 16 15.512 10.969 -17.000 1.00 0.00 C ATOM 243 CZ PHE A 16 15.626 10.142 -18.117 1.00 0.00 C ATOM 0 H PHE A 16 21.694 12.413 -15.307 1.00 0.00 H new ATOM 0 HA PHE A 16 20.320 10.298 -16.953 1.00 0.00 H new ATOM 0 HB2 PHE A 16 18.989 11.779 -15.291 1.00 0.00 H new ATOM 0 HB3 PHE A 16 19.211 13.034 -16.494 1.00 0.00 H new ATOM 0 HD1 PHE A 16 18.905 10.573 -18.798 1.00 0.00 H new ATOM 0 HD2 PHE A 16 16.548 12.283 -15.653 1.00 0.00 H new ATOM 0 HE1 PHE A 16 16.910 9.428 -19.674 1.00 0.00 H new ATOM 0 HE2 PHE A 16 14.555 11.099 -16.517 1.00 0.00 H new ATOM 0 HZ PHE A 16 14.766 9.592 -18.470 1.00 0.00 H new ATOM 253 N ASP A 17 22.262 11.126 -18.490 1.00 0.00 N ATOM 254 CA ASP A 17 22.935 11.320 -19.806 1.00 0.00 C ATOM 255 C ASP A 17 23.687 10.010 -20.206 1.00 0.00 C ATOM 256 O ASP A 17 23.309 9.351 -21.179 1.00 0.00 O ATOM 257 CB ASP A 17 23.842 12.587 -19.787 1.00 0.00 C ATOM 258 CG ASP A 17 24.280 13.088 -21.164 1.00 0.00 C ATOM 259 OD1 ASP A 17 23.774 12.726 -22.227 1.00 0.00 O ATOM 260 OD2 ASP A 17 25.277 14.015 -21.074 1.00 0.00 O ATOM 0 H ASP A 17 22.699 10.403 -17.919 1.00 0.00 H new ATOM 0 HA ASP A 17 22.193 11.509 -20.581 1.00 0.00 H new ATOM 0 HB2 ASP A 17 23.309 13.390 -19.277 1.00 0.00 H new ATOM 0 HB3 ASP A 17 24.732 12.370 -19.196 1.00 0.00 H new ATOM 266 N GLU A 18 24.721 9.619 -19.431 1.00 0.00 N ATOM 267 CA GLU A 18 25.456 8.335 -19.637 1.00 0.00 C ATOM 268 C GLU A 18 24.613 7.030 -19.472 1.00 0.00 C ATOM 269 O GLU A 18 24.809 6.110 -20.265 1.00 0.00 O ATOM 270 CB GLU A 18 26.721 8.322 -18.738 1.00 0.00 C ATOM 271 CG GLU A 18 27.791 7.247 -19.077 1.00 0.00 C ATOM 272 CD GLU A 18 28.466 7.341 -20.450 1.00 0.00 C ATOM 273 OE1 GLU A 18 28.414 8.318 -21.192 1.00 0.00 O ATOM 274 OE2 GLU A 18 29.143 6.201 -20.758 1.00 0.00 O ATOM 0 H GLU A 18 25.074 10.172 -18.650 1.00 0.00 H new ATOM 0 HA GLU A 18 25.733 8.315 -20.691 1.00 0.00 H new ATOM 0 HB2 GLU A 18 27.191 9.304 -18.794 1.00 0.00 H new ATOM 0 HB3 GLU A 18 26.406 8.178 -17.705 1.00 0.00 H new ATOM 0 HG2 GLU A 18 28.568 7.292 -18.314 1.00 0.00 H new ATOM 0 HG3 GLU A 18 27.322 6.266 -18.997 1.00 0.00 H new ATOM 282 N TYR A 19 23.657 6.946 -18.521 1.00 0.00 N ATOM 283 CA TYR A 19 22.640 5.852 -18.488 1.00 0.00 C ATOM 284 C TYR A 19 21.884 5.615 -19.843 1.00 0.00 C ATOM 285 O TYR A 19 21.856 4.481 -20.318 1.00 0.00 O ATOM 286 CB TYR A 19 21.685 6.085 -17.280 1.00 0.00 C ATOM 287 CG TYR A 19 20.645 4.965 -17.060 1.00 0.00 C ATOM 288 CD1 TYR A 19 20.952 3.844 -16.283 1.00 0.00 C ATOM 289 CD2 TYR A 19 19.414 5.015 -17.733 1.00 0.00 C ATOM 290 CE1 TYR A 19 20.053 2.781 -16.198 1.00 0.00 C ATOM 291 CE2 TYR A 19 18.521 3.952 -17.644 1.00 0.00 C ATOM 292 CZ TYR A 19 18.842 2.835 -16.883 1.00 0.00 C ATOM 293 OH TYR A 19 17.933 1.817 -16.790 1.00 0.00 O ATOM 0 H TYR A 19 23.562 7.620 -17.761 1.00 0.00 H new ATOM 0 HA TYR A 19 23.173 4.912 -18.347 1.00 0.00 H new ATOM 0 HB2 TYR A 19 22.283 6.190 -16.375 1.00 0.00 H new ATOM 0 HB3 TYR A 19 21.159 7.028 -17.426 1.00 0.00 H new ATOM 0 HD1 TYR A 19 21.888 3.801 -15.747 1.00 0.00 H new ATOM 0 HD2 TYR A 19 19.159 5.883 -18.323 1.00 0.00 H new ATOM 0 HE1 TYR A 19 20.296 1.915 -15.600 1.00 0.00 H new ATOM 0 HE2 TYR A 19 17.577 3.995 -18.167 1.00 0.00 H new ATOM 0 HH TYR A 19 18.406 0.962 -16.709 1.00 0.00 H new ATOM 303 N MET A 20 21.317 6.666 -20.469 1.00 0.00 N ATOM 304 CA MET A 20 20.770 6.577 -21.855 1.00 0.00 C ATOM 305 C MET A 20 21.793 6.106 -22.944 1.00 0.00 C ATOM 306 O MET A 20 21.503 5.159 -23.682 1.00 0.00 O ATOM 307 CB MET A 20 20.136 7.945 -22.228 1.00 0.00 C ATOM 308 CG MET A 20 18.804 8.317 -21.539 1.00 0.00 C ATOM 309 SD MET A 20 18.154 9.857 -22.226 1.00 0.00 S ATOM 310 CE MET A 20 19.411 11.067 -21.752 1.00 0.00 C ATOM 0 H MET A 20 21.222 7.589 -20.045 1.00 0.00 H new ATOM 0 HA MET A 20 20.017 5.789 -21.847 1.00 0.00 H new ATOM 0 HB2 MET A 20 20.862 8.726 -22.004 1.00 0.00 H new ATOM 0 HB3 MET A 20 19.975 7.960 -23.306 1.00 0.00 H new ATOM 0 HG2 MET A 20 18.079 7.515 -21.676 1.00 0.00 H new ATOM 0 HG3 MET A 20 18.960 8.426 -20.466 1.00 0.00 H new ATOM 0 HE1 MET A 20 18.984 12.069 -21.790 1.00 0.00 H new ATOM 0 HE2 MET A 20 19.755 10.857 -20.739 1.00 0.00 H new ATOM 0 HE3 MET A 20 20.253 11.005 -22.441 1.00 0.00 H new ATOM 320 N LYS A 21 22.991 6.716 -23.014 1.00 0.00 N ATOM 321 CA LYS A 21 24.090 6.244 -23.908 1.00 0.00 C ATOM 322 C LYS A 21 24.577 4.763 -23.686 1.00 0.00 C ATOM 323 O LYS A 21 24.780 4.039 -24.663 1.00 0.00 O ATOM 324 CB LYS A 21 25.223 7.306 -23.820 1.00 0.00 C ATOM 325 CG LYS A 21 26.267 7.303 -24.964 1.00 0.00 C ATOM 326 CD LYS A 21 25.736 7.575 -26.397 1.00 0.00 C ATOM 327 CE LYS A 21 24.951 8.882 -26.640 1.00 0.00 C ATOM 328 NZ LYS A 21 25.811 10.079 -26.543 1.00 0.00 N ATOM 0 H LYS A 21 23.233 7.540 -22.464 1.00 0.00 H new ATOM 0 HA LYS A 21 23.705 6.169 -24.925 1.00 0.00 H new ATOM 0 HB2 LYS A 21 24.762 8.293 -23.782 1.00 0.00 H new ATOM 0 HB3 LYS A 21 25.751 7.164 -22.877 1.00 0.00 H new ATOM 0 HG2 LYS A 21 27.025 8.052 -24.735 1.00 0.00 H new ATOM 0 HG3 LYS A 21 26.767 6.334 -24.965 1.00 0.00 H new ATOM 0 HD2 LYS A 21 26.588 7.565 -27.077 1.00 0.00 H new ATOM 0 HD3 LYS A 21 25.093 6.741 -26.679 1.00 0.00 H new ATOM 0 HE2 LYS A 21 24.490 8.848 -27.627 1.00 0.00 H new ATOM 0 HE3 LYS A 21 24.143 8.958 -25.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 25.240 10.931 -26.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 26.232 10.128 -25.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 26.568 10.021 -27.254 1.00 0.00 H new ATOM 341 N ALA A 22 24.702 4.300 -22.426 1.00 0.00 N ATOM 342 CA ALA A 22 24.930 2.867 -22.088 1.00 0.00 C ATOM 343 C ALA A 22 23.770 1.872 -22.427 1.00 0.00 C ATOM 344 O ALA A 22 24.035 0.778 -22.930 1.00 0.00 O ATOM 345 CB ALA A 22 25.268 2.822 -20.584 1.00 0.00 C ATOM 0 H ALA A 22 24.649 4.905 -21.607 1.00 0.00 H new ATOM 0 HA ALA A 22 25.739 2.511 -22.726 1.00 0.00 H new ATOM 0 HB1 ALA A 22 25.445 1.790 -20.282 1.00 0.00 H new ATOM 0 HB2 ALA A 22 26.163 3.414 -20.394 1.00 0.00 H new ATOM 0 HB3 ALA A 22 24.435 3.230 -20.011 1.00 0.00 H new ATOM 351 N LEU A 23 22.502 2.244 -22.170 1.00 0.00 N ATOM 352 CA LEU A 23 21.302 1.420 -22.504 1.00 0.00 C ATOM 353 C LEU A 23 21.045 1.094 -24.022 1.00 0.00 C ATOM 354 O LEU A 23 20.356 0.117 -24.330 1.00 0.00 O ATOM 355 CB LEU A 23 20.104 2.193 -21.866 1.00 0.00 C ATOM 356 CG LEU A 23 18.788 1.414 -21.631 1.00 0.00 C ATOM 357 CD1 LEU A 23 18.935 0.420 -20.469 1.00 0.00 C ATOM 358 CD2 LEU A 23 17.651 2.397 -21.302 1.00 0.00 C ATOM 0 H LEU A 23 22.269 3.130 -21.721 1.00 0.00 H new ATOM 0 HA LEU A 23 21.454 0.416 -22.107 1.00 0.00 H new ATOM 0 HB2 LEU A 23 20.434 2.590 -20.906 1.00 0.00 H new ATOM 0 HB3 LEU A 23 19.878 3.047 -22.504 1.00 0.00 H new ATOM 0 HG LEU A 23 18.557 0.862 -22.542 1.00 0.00 H new ATOM 0 HD11 LEU A 23 17.996 -0.114 -20.326 1.00 0.00 H new ATOM 0 HD12 LEU A 23 19.726 -0.294 -20.698 1.00 0.00 H new ATOM 0 HD13 LEU A 23 19.188 0.961 -19.557 1.00 0.00 H new ATOM 0 HD21 LEU A 23 16.727 1.843 -21.138 1.00 0.00 H new ATOM 0 HD22 LEU A 23 17.903 2.957 -20.402 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.516 3.089 -22.134 1.00 0.00 H new ATOM 370 N GLY A 24 21.577 1.911 -24.948 1.00 0.00 N ATOM 371 CA GLY A 24 21.351 1.765 -26.408 1.00 0.00 C ATOM 372 C GLY A 24 20.174 2.588 -26.965 1.00 0.00 C ATOM 373 O GLY A 24 19.278 2.019 -27.593 1.00 0.00 O ATOM 0 H GLY A 24 22.180 2.698 -24.709 1.00 0.00 H new ATOM 0 HA2 GLY A 24 22.261 2.057 -26.933 1.00 0.00 H new ATOM 0 HA3 GLY A 24 21.178 0.712 -26.631 1.00 0.00 H new ATOM 377 N VAL A 25 20.180 3.913 -26.743 1.00 0.00 N ATOM 378 CA VAL A 25 19.122 4.834 -27.262 1.00 0.00 C ATOM 379 C VAL A 25 19.364 5.275 -28.746 1.00 0.00 C ATOM 380 O VAL A 25 20.503 5.450 -29.194 1.00 0.00 O ATOM 381 CB VAL A 25 18.944 6.100 -26.341 1.00 0.00 C ATOM 382 CG1 VAL A 25 18.406 5.803 -24.926 1.00 0.00 C ATOM 383 CG2 VAL A 25 20.181 7.020 -26.231 1.00 0.00 C ATOM 0 H VAL A 25 20.906 4.385 -26.205 1.00 0.00 H new ATOM 0 HA VAL A 25 18.198 4.255 -27.243 1.00 0.00 H new ATOM 0 HB VAL A 25 18.176 6.645 -26.890 1.00 0.00 H new ATOM 0 HG11 VAL A 25 18.317 6.735 -24.367 1.00 0.00 H new ATOM 0 HG12 VAL A 25 17.427 5.330 -25.001 1.00 0.00 H new ATOM 0 HG13 VAL A 25 19.093 5.134 -24.408 1.00 0.00 H new ATOM 0 HG21 VAL A 25 19.953 7.860 -25.575 1.00 0.00 H new ATOM 0 HG22 VAL A 25 21.019 6.456 -25.820 1.00 0.00 H new ATOM 0 HG23 VAL A 25 20.446 7.394 -27.220 1.00 0.00 H new ATOM 393 N GLY A 26 18.277 5.624 -29.461 1.00 0.00 N ATOM 394 CA GLY A 26 18.360 6.639 -30.548 1.00 0.00 C ATOM 395 C GLY A 26 18.676 8.072 -30.035 1.00 0.00 C ATOM 396 O GLY A 26 18.140 8.505 -29.011 1.00 0.00 O ATOM 0 H GLY A 26 17.346 5.232 -29.316 1.00 0.00 H new ATOM 0 HA2 GLY A 26 19.130 6.338 -31.258 1.00 0.00 H new ATOM 0 HA3 GLY A 26 17.415 6.656 -31.091 1.00 0.00 H new ATOM 400 N PHE A 27 19.552 8.811 -30.737 1.00 0.00 N ATOM 401 CA PHE A 27 20.087 10.123 -30.244 1.00 0.00 C ATOM 402 C PHE A 27 19.047 11.253 -29.905 1.00 0.00 C ATOM 403 O PHE A 27 19.264 11.995 -28.942 1.00 0.00 O ATOM 404 CB PHE A 27 21.196 10.577 -31.235 1.00 0.00 C ATOM 405 CG PHE A 27 22.124 11.696 -30.722 1.00 0.00 C ATOM 406 CD1 PHE A 27 23.278 11.383 -29.995 1.00 0.00 C ATOM 407 CD2 PHE A 27 21.835 13.036 -31.005 1.00 0.00 C ATOM 408 CE1 PHE A 27 24.138 12.395 -29.571 1.00 0.00 C ATOM 409 CE2 PHE A 27 22.691 14.046 -30.574 1.00 0.00 C ATOM 410 CZ PHE A 27 23.845 13.725 -29.865 1.00 0.00 C ATOM 0 H PHE A 27 19.914 8.535 -31.650 1.00 0.00 H new ATOM 0 HA PHE A 27 20.491 9.943 -29.248 1.00 0.00 H new ATOM 0 HB2 PHE A 27 21.806 9.711 -31.492 1.00 0.00 H new ATOM 0 HB3 PHE A 27 20.720 10.916 -32.155 1.00 0.00 H new ATOM 0 HD1 PHE A 27 23.503 10.353 -29.761 1.00 0.00 H new ATOM 0 HD2 PHE A 27 20.944 13.288 -31.560 1.00 0.00 H new ATOM 0 HE1 PHE A 27 25.031 12.148 -29.015 1.00 0.00 H new ATOM 0 HE2 PHE A 27 22.460 15.079 -30.790 1.00 0.00 H new ATOM 0 HZ PHE A 27 24.515 14.508 -29.542 1.00 0.00 H new ATOM 420 N ALA A 28 17.912 11.348 -30.624 1.00 0.00 N ATOM 421 CA ALA A 28 16.732 12.146 -30.182 1.00 0.00 C ATOM 422 C ALA A 28 16.168 11.846 -28.748 1.00 0.00 C ATOM 423 O ALA A 28 15.903 12.794 -28.006 1.00 0.00 O ATOM 424 CB ALA A 28 15.657 12.000 -31.275 1.00 0.00 C ATOM 0 H ALA A 28 17.779 10.881 -31.521 1.00 0.00 H new ATOM 0 HA ALA A 28 17.066 13.177 -30.066 1.00 0.00 H new ATOM 0 HB1 ALA A 28 14.772 12.570 -30.993 1.00 0.00 H new ATOM 0 HB2 ALA A 28 16.046 12.378 -32.221 1.00 0.00 H new ATOM 0 HB3 ALA A 28 15.392 10.949 -31.386 1.00 0.00 H new ATOM 430 N THR A 29 16.064 10.570 -28.318 1.00 0.00 N ATOM 431 CA THR A 29 15.835 10.203 -26.884 1.00 0.00 C ATOM 432 C THR A 29 16.955 10.697 -25.897 1.00 0.00 C ATOM 433 O THR A 29 16.615 11.173 -24.810 1.00 0.00 O ATOM 434 CB THR A 29 15.562 8.671 -26.763 1.00 0.00 C ATOM 435 OG1 THR A 29 14.455 8.293 -27.579 1.00 0.00 O ATOM 436 CG2 THR A 29 15.226 8.185 -25.341 1.00 0.00 C ATOM 0 H THR A 29 16.134 9.765 -28.940 1.00 0.00 H new ATOM 0 HA THR A 29 14.947 10.746 -26.560 1.00 0.00 H new ATOM 0 HB THR A 29 16.500 8.212 -27.076 1.00 0.00 H new ATOM 0 HG1 THR A 29 14.167 7.387 -27.341 1.00 0.00 H new ATOM 0 HG21 THR A 29 15.052 7.109 -25.356 1.00 0.00 H new ATOM 0 HG22 THR A 29 16.058 8.409 -24.674 1.00 0.00 H new ATOM 0 HG23 THR A 29 14.329 8.692 -24.985 1.00 0.00 H new ATOM 444 N ARG A 30 18.259 10.629 -26.250 1.00 0.00 N ATOM 445 CA ARG A 30 19.343 11.310 -25.471 1.00 0.00 C ATOM 446 C ARG A 30 19.214 12.872 -25.361 1.00 0.00 C ATOM 447 O ARG A 30 19.391 13.419 -24.270 1.00 0.00 O ATOM 448 CB ARG A 30 20.748 10.726 -25.855 1.00 0.00 C ATOM 449 CG ARG A 30 21.835 11.629 -26.496 1.00 0.00 C ATOM 450 CD ARG A 30 22.659 12.453 -25.485 1.00 0.00 C ATOM 451 NE ARG A 30 23.573 13.352 -26.238 1.00 0.00 N ATOM 452 CZ ARG A 30 24.427 14.221 -25.696 1.00 0.00 C ATOM 453 NH1 ARG A 30 24.619 14.356 -24.409 1.00 0.00 N ATOM 454 NH2 ARG A 30 25.118 14.981 -26.494 1.00 0.00 N ATOM 0 H ARG A 30 18.595 10.114 -27.064 1.00 0.00 H new ATOM 0 HA ARG A 30 19.207 11.056 -24.420 1.00 0.00 H new ATOM 0 HB2 ARG A 30 21.178 10.302 -24.947 1.00 0.00 H new ATOM 0 HB3 ARG A 30 20.574 9.898 -26.542 1.00 0.00 H new ATOM 0 HG2 ARG A 30 22.514 11.003 -27.075 1.00 0.00 H new ATOM 0 HG3 ARG A 30 21.355 12.312 -27.197 1.00 0.00 H new ATOM 0 HD2 ARG A 30 21.998 13.036 -24.844 1.00 0.00 H new ATOM 0 HD3 ARG A 30 23.231 11.791 -24.834 1.00 0.00 H new ATOM 0 HE ARG A 30 23.544 13.300 -27.256 1.00 0.00 H new ATOM 0 HH11 ARG A 30 24.098 13.775 -23.752 1.00 0.00 H new ATOM 0 HH12 ARG A 30 25.289 15.042 -24.063 1.00 0.00 H new ATOM 0 HH21 ARG A 30 24.998 14.902 -27.504 1.00 0.00 H new ATOM 0 HH22 ARG A 30 25.779 15.656 -26.110 1.00 0.00 H new ATOM 468 N GLN A 31 18.860 13.582 -26.449 1.00 0.00 N ATOM 469 CA GLN A 31 18.420 15.010 -26.382 1.00 0.00 C ATOM 470 C GLN A 31 17.164 15.266 -25.476 1.00 0.00 C ATOM 471 O GLN A 31 17.237 16.093 -24.563 1.00 0.00 O ATOM 472 CB GLN A 31 18.235 15.569 -27.825 1.00 0.00 C ATOM 473 CG GLN A 31 19.465 15.554 -28.778 1.00 0.00 C ATOM 474 CD GLN A 31 20.648 16.441 -28.375 1.00 0.00 C ATOM 475 OE1 GLN A 31 20.795 17.574 -28.815 1.00 0.00 O ATOM 476 NE2 GLN A 31 21.532 15.963 -27.533 1.00 0.00 N ATOM 0 H GLN A 31 18.867 13.198 -27.394 1.00 0.00 H new ATOM 0 HA GLN A 31 19.216 15.561 -25.881 1.00 0.00 H new ATOM 0 HB2 GLN A 31 17.436 15.002 -28.303 1.00 0.00 H new ATOM 0 HB3 GLN A 31 17.889 16.599 -27.742 1.00 0.00 H new ATOM 0 HG2 GLN A 31 19.820 14.527 -28.861 1.00 0.00 H new ATOM 0 HG3 GLN A 31 19.132 15.858 -29.771 1.00 0.00 H new ATOM 0 HE21 GLN A 31 21.422 15.021 -27.158 1.00 0.00 H new ATOM 0 HE22 GLN A 31 22.330 16.533 -27.252 1.00 0.00 H new ATOM 485 N VAL A 32 16.059 14.518 -25.679 1.00 0.00 N ATOM 486 CA VAL A 32 14.839 14.554 -24.811 1.00 0.00 C ATOM 487 C VAL A 32 15.117 14.261 -23.294 1.00 0.00 C ATOM 488 O VAL A 32 14.769 15.104 -22.464 1.00 0.00 O ATOM 489 CB VAL A 32 13.722 13.659 -25.463 1.00 0.00 C ATOM 490 CG1 VAL A 32 12.492 13.397 -24.566 1.00 0.00 C ATOM 491 CG2 VAL A 32 13.174 14.243 -26.789 1.00 0.00 C ATOM 0 H VAL A 32 15.977 13.862 -26.456 1.00 0.00 H new ATOM 0 HA VAL A 32 14.469 15.579 -24.775 1.00 0.00 H new ATOM 0 HB VAL A 32 14.253 12.722 -25.631 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.778 12.772 -25.102 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.808 12.889 -23.655 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.021 14.346 -24.308 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.407 13.580 -27.189 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.742 15.226 -26.603 1.00 0.00 H new ATOM 0 HG23 VAL A 32 13.987 14.334 -27.510 1.00 0.00 H new ATOM 501 N GLY A 33 15.735 13.121 -22.916 1.00 0.00 N ATOM 502 CA GLY A 33 16.036 12.807 -21.485 1.00 0.00 C ATOM 503 C GLY A 33 16.925 13.770 -20.653 1.00 0.00 C ATOM 504 O GLY A 33 16.791 13.803 -19.430 1.00 0.00 O ATOM 0 H GLY A 33 16.037 12.400 -23.571 1.00 0.00 H new ATOM 0 HA2 GLY A 33 15.082 12.715 -20.965 1.00 0.00 H new ATOM 0 HA3 GLY A 33 16.509 11.825 -21.460 1.00 0.00 H new ATOM 508 N ASN A 34 17.798 14.559 -21.301 1.00 0.00 N ATOM 509 CA ASN A 34 18.455 15.734 -20.657 1.00 0.00 C ATOM 510 C ASN A 34 17.522 16.975 -20.446 1.00 0.00 C ATOM 511 O ASN A 34 17.562 17.569 -19.365 1.00 0.00 O ATOM 512 CB ASN A 34 19.730 16.123 -21.458 1.00 0.00 C ATOM 513 CG ASN A 34 20.939 15.192 -21.309 1.00 0.00 C ATOM 514 OD1 ASN A 34 21.754 15.320 -20.402 1.00 0.00 O ATOM 515 ND2 ASN A 34 21.135 14.258 -22.206 1.00 0.00 N ATOM 0 H ASN A 34 18.073 14.413 -22.272 1.00 0.00 H new ATOM 0 HA ASN A 34 18.723 15.418 -19.649 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.467 16.175 -22.515 1.00 0.00 H new ATOM 0 HB3 ASN A 34 20.031 17.126 -21.155 1.00 0.00 H new ATOM 0 HD21 ASN A 34 21.954 13.653 -22.142 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.469 14.135 -22.968 1.00 0.00 H new ATOM 522 N VAL A 35 16.717 17.391 -21.444 1.00 0.00 N ATOM 523 CA VAL A 35 15.802 18.573 -21.314 1.00 0.00 C ATOM 524 C VAL A 35 14.464 18.345 -20.522 1.00 0.00 C ATOM 525 O VAL A 35 13.947 19.316 -19.963 1.00 0.00 O ATOM 526 CB VAL A 35 15.539 19.281 -22.694 1.00 0.00 C ATOM 527 CG1 VAL A 35 16.818 19.830 -23.368 1.00 0.00 C ATOM 528 CG2 VAL A 35 14.750 18.452 -23.733 1.00 0.00 C ATOM 0 H VAL A 35 16.672 16.934 -22.355 1.00 0.00 H new ATOM 0 HA VAL A 35 16.372 19.246 -20.673 1.00 0.00 H new ATOM 0 HB VAL A 35 14.902 20.112 -22.390 1.00 0.00 H new ATOM 0 HG11 VAL A 35 16.556 20.304 -24.314 1.00 0.00 H new ATOM 0 HG12 VAL A 35 17.288 20.563 -22.713 1.00 0.00 H new ATOM 0 HG13 VAL A 35 17.512 19.010 -23.553 1.00 0.00 H new ATOM 0 HG21 VAL A 35 14.626 19.035 -24.645 1.00 0.00 H new ATOM 0 HG22 VAL A 35 15.297 17.536 -23.959 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.770 18.199 -23.328 1.00 0.00 H new ATOM 538 N THR A 36 13.861 17.136 -20.516 1.00 0.00 N ATOM 539 CA THR A 36 12.432 16.948 -20.108 1.00 0.00 C ATOM 540 C THR A 36 12.246 16.310 -18.691 1.00 0.00 C ATOM 541 O THR A 36 12.933 15.352 -18.321 1.00 0.00 O ATOM 542 CB THR A 36 11.642 16.215 -21.241 1.00 0.00 C ATOM 543 OG1 THR A 36 10.274 16.603 -21.184 1.00 0.00 O ATOM 544 CG2 THR A 36 11.658 14.675 -21.252 1.00 0.00 C ATOM 0 H THR A 36 14.331 16.272 -20.786 1.00 0.00 H new ATOM 0 HA THR A 36 11.996 17.940 -19.987 1.00 0.00 H new ATOM 0 HB THR A 36 12.172 16.523 -22.142 1.00 0.00 H new ATOM 0 HG1 THR A 36 9.859 16.222 -20.382 1.00 0.00 H new ATOM 0 HG21 THR A 36 11.068 14.311 -22.093 1.00 0.00 H new ATOM 0 HG22 THR A 36 12.685 14.322 -21.349 1.00 0.00 H new ATOM 0 HG23 THR A 36 11.232 14.300 -20.321 1.00 0.00 H new ATOM 552 N LYS A 37 11.243 16.794 -17.934 1.00 0.00 N ATOM 553 CA LYS A 37 10.838 16.184 -16.638 1.00 0.00 C ATOM 554 C LYS A 37 9.737 15.076 -16.849 1.00 0.00 C ATOM 555 O LYS A 37 8.651 15.416 -17.344 1.00 0.00 O ATOM 556 CB LYS A 37 10.352 17.325 -15.704 1.00 0.00 C ATOM 557 CG LYS A 37 10.120 16.897 -14.234 1.00 0.00 C ATOM 558 CD LYS A 37 9.522 17.985 -13.314 1.00 0.00 C ATOM 559 CE LYS A 37 10.455 19.146 -12.917 1.00 0.00 C ATOM 560 NZ LYS A 37 10.514 20.203 -13.948 1.00 0.00 N ATOM 0 H LYS A 37 10.691 17.611 -18.194 1.00 0.00 H new ATOM 0 HA LYS A 37 11.686 15.678 -16.176 1.00 0.00 H new ATOM 0 HB2 LYS A 37 11.086 18.130 -15.723 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.422 17.732 -16.102 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.456 16.033 -14.225 1.00 0.00 H new ATOM 0 HG3 LYS A 37 11.072 16.572 -13.813 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.647 18.406 -13.809 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.171 17.503 -12.401 1.00 0.00 H new ATOM 0 HE2 LYS A 37 10.112 19.579 -11.977 1.00 0.00 H new ATOM 0 HE3 LYS A 37 11.458 18.758 -12.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.710 21.119 -13.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 11.270 19.983 -14.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.603 20.252 -14.448 1.00 0.00 H new ATOM 573 N PRO A 38 9.922 13.772 -16.488 1.00 0.00 N ATOM 574 CA PRO A 38 8.823 12.772 -16.520 1.00 0.00 C ATOM 575 C PRO A 38 7.865 12.838 -15.285 1.00 0.00 C ATOM 576 O PRO A 38 8.287 12.810 -14.122 1.00 0.00 O ATOM 577 CB PRO A 38 9.598 11.448 -16.630 1.00 0.00 C ATOM 578 CG PRO A 38 10.921 11.710 -15.906 1.00 0.00 C ATOM 579 CD PRO A 38 11.244 13.175 -16.211 1.00 0.00 C ATOM 0 HA PRO A 38 8.123 12.934 -17.340 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.049 10.628 -16.167 1.00 0.00 H new ATOM 0 HB3 PRO A 38 9.764 11.172 -17.671 1.00 0.00 H new ATOM 0 HG2 PRO A 38 10.827 11.540 -14.834 1.00 0.00 H new ATOM 0 HG3 PRO A 38 11.708 11.047 -16.266 1.00 0.00 H new ATOM 0 HD2 PRO A 38 11.735 13.661 -15.368 1.00 0.00 H new ATOM 0 HD3 PRO A 38 11.913 13.268 -17.066 1.00 0.00 H new ATOM 587 N THR A 39 6.557 12.886 -15.578 1.00 0.00 N ATOM 588 CA THR A 39 5.479 12.736 -14.562 1.00 0.00 C ATOM 589 C THR A 39 5.025 11.241 -14.560 1.00 0.00 C ATOM 590 O THR A 39 4.379 10.766 -15.500 1.00 0.00 O ATOM 591 CB THR A 39 4.326 13.733 -14.884 1.00 0.00 C ATOM 592 OG1 THR A 39 4.829 15.064 -14.958 1.00 0.00 O ATOM 593 CG2 THR A 39 3.216 13.761 -13.824 1.00 0.00 C ATOM 0 H THR A 39 6.206 13.030 -16.525 1.00 0.00 H new ATOM 0 HA THR A 39 5.826 12.980 -13.558 1.00 0.00 H new ATOM 0 HB THR A 39 3.912 13.383 -15.830 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.095 15.680 -15.163 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.450 14.478 -14.118 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.771 12.770 -13.737 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.638 14.055 -12.863 1.00 0.00 H new ATOM 601 N VAL A 40 5.403 10.498 -13.512 1.00 0.00 N ATOM 602 CA VAL A 40 5.159 9.028 -13.407 1.00 0.00 C ATOM 603 C VAL A 40 3.899 8.807 -12.505 1.00 0.00 C ATOM 604 O VAL A 40 3.997 8.782 -11.276 1.00 0.00 O ATOM 605 CB VAL A 40 6.479 8.325 -12.915 1.00 0.00 C ATOM 606 CG1 VAL A 40 6.325 6.813 -12.637 1.00 0.00 C ATOM 607 CG2 VAL A 40 7.660 8.451 -13.908 1.00 0.00 C ATOM 0 H VAL A 40 5.889 10.887 -12.704 1.00 0.00 H new ATOM 0 HA VAL A 40 4.928 8.564 -14.366 1.00 0.00 H new ATOM 0 HB VAL A 40 6.688 8.863 -11.991 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.279 6.406 -12.303 1.00 0.00 H new ATOM 0 HG12 VAL A 40 5.574 6.660 -11.862 1.00 0.00 H new ATOM 0 HG13 VAL A 40 6.014 6.305 -13.550 1.00 0.00 H new ATOM 0 HG21 VAL A 40 8.534 7.943 -13.501 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.386 7.995 -14.859 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.893 9.504 -14.064 1.00 0.00 H new ATOM 617 N ILE A 41 2.702 8.642 -13.099 1.00 0.00 N ATOM 618 CA ILE A 41 1.438 8.461 -12.319 1.00 0.00 C ATOM 619 C ILE A 41 1.236 6.935 -12.057 1.00 0.00 C ATOM 620 O ILE A 41 0.738 6.204 -12.921 1.00 0.00 O ATOM 621 CB ILE A 41 0.180 9.165 -12.947 1.00 0.00 C ATOM 622 CG1 ILE A 41 0.398 10.659 -13.340 1.00 0.00 C ATOM 623 CG2 ILE A 41 -1.032 9.100 -11.977 1.00 0.00 C ATOM 624 CD1 ILE A 41 0.772 10.872 -14.816 1.00 0.00 C ATOM 0 H ILE A 41 2.572 8.629 -14.111 1.00 0.00 H new ATOM 0 HA ILE A 41 1.545 8.978 -11.366 1.00 0.00 H new ATOM 0 HB ILE A 41 -0.010 8.608 -13.865 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -0.513 11.217 -13.123 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.185 11.077 -12.713 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -1.890 9.593 -12.433 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.279 8.058 -11.772 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -0.778 9.603 -11.044 1.00 0.00 H new ATOM 0 HD11 ILE A 41 0.906 11.937 -15.007 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.700 10.344 -15.036 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -0.024 10.486 -15.452 1.00 0.00 H new ATOM 636 N ILE A 42 1.613 6.471 -10.852 1.00 0.00 N ATOM 637 CA ILE A 42 1.420 5.052 -10.426 1.00 0.00 C ATOM 638 C ILE A 42 -0.041 4.922 -9.878 1.00 0.00 C ATOM 639 O ILE A 42 -0.400 5.568 -8.888 1.00 0.00 O ATOM 640 CB ILE A 42 2.515 4.603 -9.386 1.00 0.00 C ATOM 641 CG1 ILE A 42 3.984 4.772 -9.889 1.00 0.00 C ATOM 642 CG2 ILE A 42 2.283 3.151 -8.877 1.00 0.00 C ATOM 643 CD1 ILE A 42 5.107 4.458 -8.882 1.00 0.00 C ATOM 0 H ILE A 42 2.057 7.055 -10.143 1.00 0.00 H new ATOM 0 HA ILE A 42 1.547 4.374 -11.270 1.00 0.00 H new ATOM 0 HB ILE A 42 2.392 5.292 -8.550 1.00 0.00 H new ATOM 0 HG12 ILE A 42 4.120 4.130 -10.760 1.00 0.00 H new ATOM 0 HG13 ILE A 42 4.110 5.800 -10.228 1.00 0.00 H new ATOM 0 HG21 ILE A 42 3.063 2.887 -8.163 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.309 3.087 -8.391 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.314 2.461 -9.720 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.076 4.615 -9.357 1.00 0.00 H new ATOM 0 HD12 ILE A 42 5.015 5.116 -8.018 1.00 0.00 H new ATOM 0 HD13 ILE A 42 5.026 3.420 -8.558 1.00 0.00 H new ATOM 655 N SER A 43 -0.884 4.109 -10.538 1.00 0.00 N ATOM 656 CA SER A 43 -2.348 4.084 -10.268 1.00 0.00 C ATOM 657 C SER A 43 -2.938 2.644 -10.333 1.00 0.00 C ATOM 658 O SER A 43 -2.887 2.006 -11.386 1.00 0.00 O ATOM 659 CB SER A 43 -3.050 5.034 -11.277 1.00 0.00 C ATOM 660 OG SER A 43 -2.859 4.660 -12.650 1.00 0.00 O ATOM 0 H SER A 43 -0.585 3.457 -11.264 1.00 0.00 H new ATOM 0 HA SER A 43 -2.526 4.430 -9.250 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.118 5.055 -11.060 1.00 0.00 H new ATOM 0 HB3 SER A 43 -2.675 6.047 -11.130 1.00 0.00 H new ATOM 0 HG SER A 43 -3.724 4.651 -13.110 1.00 0.00 H new ATOM 666 N GLN A 44 -3.558 2.139 -9.248 1.00 0.00 N ATOM 667 CA GLN A 44 -4.337 0.862 -9.301 1.00 0.00 C ATOM 668 C GLN A 44 -5.755 1.110 -9.905 1.00 0.00 C ATOM 669 O GLN A 44 -6.642 1.669 -9.253 1.00 0.00 O ATOM 670 CB GLN A 44 -4.389 0.178 -7.909 1.00 0.00 C ATOM 671 CG GLN A 44 -3.063 -0.522 -7.514 1.00 0.00 C ATOM 672 CD GLN A 44 -3.065 -1.286 -6.189 1.00 0.00 C ATOM 673 OE1 GLN A 44 -3.076 -2.510 -6.140 1.00 0.00 O ATOM 674 NE2 GLN A 44 -3.016 -0.605 -5.072 1.00 0.00 N ATOM 0 H GLN A 44 -3.542 2.582 -8.329 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.824 0.166 -9.965 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -4.635 0.925 -7.155 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -5.194 -0.557 -7.904 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.794 -1.218 -8.309 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.278 0.233 -7.472 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -3.006 0.415 -5.096 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.988 -1.094 -4.177 1.00 0.00 H new ATOM 683 N GLU A 45 -5.937 0.731 -11.181 1.00 0.00 N ATOM 684 CA GLU A 45 -7.149 1.090 -11.968 1.00 0.00 C ATOM 685 C GLU A 45 -8.090 -0.147 -12.061 1.00 0.00 C ATOM 686 O GLU A 45 -7.884 -1.052 -12.879 1.00 0.00 O ATOM 687 CB GLU A 45 -6.723 1.649 -13.354 1.00 0.00 C ATOM 688 CG GLU A 45 -5.988 3.017 -13.310 1.00 0.00 C ATOM 689 CD GLU A 45 -5.664 3.632 -14.674 1.00 0.00 C ATOM 690 OE1 GLU A 45 -6.392 3.542 -15.659 1.00 0.00 O ATOM 691 OE2 GLU A 45 -4.483 4.320 -14.661 1.00 0.00 O ATOM 0 H GLU A 45 -5.260 0.172 -11.700 1.00 0.00 H new ATOM 0 HA GLU A 45 -7.714 1.880 -11.474 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -6.074 0.920 -13.840 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -7.611 1.750 -13.977 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -6.601 3.722 -12.749 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.058 2.893 -12.756 1.00 0.00 H new ATOM 699 N GLY A 46 -9.101 -0.210 -11.173 1.00 0.00 N ATOM 700 CA GLY A 46 -9.982 -1.404 -11.056 1.00 0.00 C ATOM 701 C GLY A 46 -9.412 -2.523 -10.162 1.00 0.00 C ATOM 702 O GLY A 46 -9.875 -2.747 -9.044 1.00 0.00 O ATOM 0 H GLY A 46 -9.333 0.544 -10.526 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -10.947 -1.092 -10.658 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -10.164 -1.807 -12.052 1.00 0.00 H new ATOM 706 N ASP A 47 -8.421 -3.251 -10.682 1.00 0.00 N ATOM 707 CA ASP A 47 -7.633 -4.248 -9.897 1.00 0.00 C ATOM 708 C ASP A 47 -6.090 -4.087 -10.127 1.00 0.00 C ATOM 709 O ASP A 47 -5.346 -3.995 -9.148 1.00 0.00 O ATOM 710 CB ASP A 47 -8.134 -5.692 -10.198 1.00 0.00 C ATOM 711 CG ASP A 47 -9.428 -6.232 -9.566 1.00 0.00 C ATOM 712 OD1 ASP A 47 -9.707 -7.426 -9.601 1.00 0.00 O ATOM 713 OD2 ASP A 47 -10.221 -5.286 -8.974 1.00 0.00 O ATOM 0 H ASP A 47 -8.130 -3.178 -11.657 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.798 -4.056 -8.837 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -8.251 -5.770 -11.279 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -7.332 -6.373 -9.914 1.00 0.00 H new ATOM 719 N LYS A 48 -5.595 -4.086 -11.383 1.00 0.00 N ATOM 720 CA LYS A 48 -4.135 -4.072 -11.687 1.00 0.00 C ATOM 721 C LYS A 48 -3.442 -2.665 -11.620 1.00 0.00 C ATOM 722 O LYS A 48 -4.081 -1.610 -11.701 1.00 0.00 O ATOM 723 CB LYS A 48 -3.941 -4.818 -13.038 1.00 0.00 C ATOM 724 CG LYS A 48 -4.448 -4.114 -14.322 1.00 0.00 C ATOM 725 CD LYS A 48 -4.512 -5.008 -15.581 1.00 0.00 C ATOM 726 CE LYS A 48 -3.182 -5.685 -15.957 1.00 0.00 C ATOM 727 NZ LYS A 48 -3.239 -6.266 -17.311 1.00 0.00 N ATOM 0 H LYS A 48 -6.186 -4.095 -12.215 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.606 -4.594 -10.890 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.877 -5.018 -13.162 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -4.441 -5.784 -12.964 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.443 -3.714 -14.129 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.798 -3.264 -14.532 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.265 -5.780 -15.424 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.847 -4.403 -16.423 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -2.373 -4.956 -15.906 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -2.952 -6.467 -15.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.328 -6.715 -17.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -3.995 -6.979 -17.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.434 -5.515 -18.003 1.00 0.00 H new ATOM 740 N VAL A 49 -2.103 -2.668 -11.478 1.00 0.00 N ATOM 741 CA VAL A 49 -1.282 -1.426 -11.340 1.00 0.00 C ATOM 742 C VAL A 49 -0.967 -0.858 -12.766 1.00 0.00 C ATOM 743 O VAL A 49 -0.240 -1.471 -13.554 1.00 0.00 O ATOM 744 CB VAL A 49 0.030 -1.683 -10.515 1.00 0.00 C ATOM 745 CG1 VAL A 49 0.844 -0.388 -10.260 1.00 0.00 C ATOM 746 CG2 VAL A 49 -0.149 -2.356 -9.131 1.00 0.00 C ATOM 0 H VAL A 49 -1.550 -3.525 -11.454 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.853 -0.685 -10.780 1.00 0.00 H new ATOM 0 HB VAL A 49 0.554 -2.378 -11.171 1.00 0.00 H new ATOM 0 HG11 VAL A 49 1.739 -0.628 -9.686 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.132 0.054 -11.214 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.234 0.321 -9.701 1.00 0.00 H new ATOM 0 HG21 VAL A 49 0.825 -2.481 -8.658 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.781 -1.730 -8.501 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.618 -3.332 -9.259 1.00 0.00 H new ATOM 756 N VAL A 50 -1.502 0.333 -13.070 1.00 0.00 N ATOM 757 CA VAL A 50 -1.248 1.056 -14.346 1.00 0.00 C ATOM 758 C VAL A 50 -0.305 2.261 -14.015 1.00 0.00 C ATOM 759 O VAL A 50 -0.731 3.257 -13.411 1.00 0.00 O ATOM 760 CB VAL A 50 -2.590 1.472 -15.039 1.00 0.00 C ATOM 761 CG1 VAL A 50 -2.372 2.218 -16.379 1.00 0.00 C ATOM 762 CG2 VAL A 50 -3.552 0.295 -15.335 1.00 0.00 C ATOM 0 H VAL A 50 -2.129 0.834 -12.440 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.753 0.416 -15.076 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.044 2.129 -14.298 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.338 2.480 -16.811 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.796 3.126 -16.200 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.828 1.574 -17.070 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.454 0.674 -15.815 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.061 -0.418 -15.998 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.818 -0.201 -14.402 1.00 0.00 H new ATOM 772 N ILE A 51 0.973 2.166 -14.431 1.00 0.00 N ATOM 773 CA ILE A 51 1.945 3.300 -14.340 1.00 0.00 C ATOM 774 C ILE A 51 1.885 4.103 -15.680 1.00 0.00 C ATOM 775 O ILE A 51 2.165 3.554 -16.749 1.00 0.00 O ATOM 776 CB ILE A 51 3.407 2.842 -13.973 1.00 0.00 C ATOM 777 CG1 ILE A 51 3.482 2.050 -12.633 1.00 0.00 C ATOM 778 CG2 ILE A 51 4.393 4.042 -13.944 1.00 0.00 C ATOM 779 CD1 ILE A 51 4.875 1.550 -12.195 1.00 0.00 C ATOM 0 H ILE A 51 1.368 1.317 -14.836 1.00 0.00 H new ATOM 0 HA ILE A 51 1.655 3.947 -13.512 1.00 0.00 H new ATOM 0 HB ILE A 51 3.709 2.159 -14.767 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.085 2.685 -11.841 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.821 1.187 -12.711 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.391 3.687 -13.687 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.418 4.516 -14.925 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.063 4.766 -13.199 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.789 1.015 -11.249 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.277 0.880 -12.955 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.545 2.401 -12.071 1.00 0.00 H new ATOM 791 N ARG A 52 1.580 5.408 -15.601 1.00 0.00 N ATOM 792 CA ARG A 52 1.610 6.327 -16.779 1.00 0.00 C ATOM 793 C ARG A 52 2.856 7.266 -16.700 1.00 0.00 C ATOM 794 O ARG A 52 2.887 8.193 -15.888 1.00 0.00 O ATOM 795 CB ARG A 52 0.274 7.121 -16.826 1.00 0.00 C ATOM 796 CG ARG A 52 -0.967 6.295 -17.256 1.00 0.00 C ATOM 797 CD ARG A 52 -2.319 6.995 -17.029 1.00 0.00 C ATOM 798 NE ARG A 52 -2.683 6.957 -15.585 1.00 0.00 N ATOM 799 CZ ARG A 52 -3.743 7.548 -15.038 1.00 0.00 C ATOM 800 NH1 ARG A 52 -4.593 8.282 -15.710 1.00 0.00 N ATOM 801 NH2 ARG A 52 -3.947 7.382 -13.764 1.00 0.00 N ATOM 0 H ARG A 52 1.306 5.865 -14.731 1.00 0.00 H new ATOM 0 HA ARG A 52 1.704 5.759 -17.704 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.086 7.544 -15.839 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.391 7.958 -17.515 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.874 6.050 -18.314 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.966 5.352 -16.709 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -2.263 8.029 -17.370 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -3.094 6.506 -17.620 1.00 0.00 H new ATOM 0 HE ARG A 52 -2.068 6.434 -14.962 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -4.461 8.427 -16.711 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -5.387 8.709 -15.233 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -3.304 6.812 -13.214 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -4.750 7.822 -13.315 1.00 0.00 H new ATOM 815 N THR A 53 3.880 7.034 -17.542 1.00 0.00 N ATOM 816 CA THR A 53 5.091 7.910 -17.624 1.00 0.00 C ATOM 817 C THR A 53 4.877 8.987 -18.734 1.00 0.00 C ATOM 818 O THR A 53 4.954 8.690 -19.932 1.00 0.00 O ATOM 819 CB THR A 53 6.345 7.014 -17.855 1.00 0.00 C ATOM 820 OG1 THR A 53 6.484 6.106 -16.766 1.00 0.00 O ATOM 821 CG2 THR A 53 7.679 7.771 -17.959 1.00 0.00 C ATOM 0 H THR A 53 3.904 6.243 -18.185 1.00 0.00 H new ATOM 0 HA THR A 53 5.255 8.454 -16.694 1.00 0.00 H new ATOM 0 HB THR A 53 6.163 6.527 -18.813 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.271 5.540 -16.910 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.489 7.060 -18.119 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.637 8.468 -18.796 1.00 0.00 H new ATOM 0 HG23 THR A 53 7.857 8.322 -17.036 1.00 0.00 H new ATOM 829 N LEU A 54 4.585 10.230 -18.318 1.00 0.00 N ATOM 830 CA LEU A 54 4.143 11.312 -19.239 1.00 0.00 C ATOM 831 C LEU A 54 5.124 12.523 -19.159 1.00 0.00 C ATOM 832 O LEU A 54 5.247 13.168 -18.113 1.00 0.00 O ATOM 833 CB LEU A 54 2.687 11.750 -18.881 1.00 0.00 C ATOM 834 CG LEU A 54 1.561 10.677 -18.852 1.00 0.00 C ATOM 835 CD1 LEU A 54 0.217 11.329 -18.483 1.00 0.00 C ATOM 836 CD2 LEU A 54 1.388 9.919 -20.178 1.00 0.00 C ATOM 0 H LEU A 54 4.645 10.521 -17.342 1.00 0.00 H new ATOM 0 HA LEU A 54 4.150 10.937 -20.263 1.00 0.00 H new ATOM 0 HB2 LEU A 54 2.718 12.221 -17.899 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.390 12.519 -19.594 1.00 0.00 H new ATOM 0 HG LEU A 54 1.868 9.950 -18.100 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.564 10.569 -18.466 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.295 11.791 -17.499 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.034 12.090 -19.222 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.585 9.189 -20.078 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.140 10.625 -20.971 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.316 9.405 -20.427 1.00 0.00 H new ATOM 848 N SER A 55 5.800 12.866 -20.267 1.00 0.00 N ATOM 849 CA SER A 55 6.507 14.172 -20.413 1.00 0.00 C ATOM 850 C SER A 55 6.078 14.906 -21.728 1.00 0.00 C ATOM 851 O SER A 55 5.401 14.343 -22.596 1.00 0.00 O ATOM 852 CB SER A 55 8.033 13.915 -20.321 1.00 0.00 C ATOM 853 OG SER A 55 8.710 15.094 -19.882 1.00 0.00 O ATOM 0 H SER A 55 5.879 12.261 -21.085 1.00 0.00 H new ATOM 0 HA SER A 55 6.227 14.849 -19.606 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.229 13.096 -19.629 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.416 13.609 -21.294 1.00 0.00 H new ATOM 0 HG SER A 55 8.373 15.356 -19.000 1.00 0.00 H new ATOM 859 N THR A 56 6.504 16.171 -21.916 1.00 0.00 N ATOM 860 CA THR A 56 6.185 16.970 -23.152 1.00 0.00 C ATOM 861 C THR A 56 6.872 16.559 -24.518 1.00 0.00 C ATOM 862 O THR A 56 6.975 17.382 -25.434 1.00 0.00 O ATOM 863 CB THR A 56 6.354 18.484 -22.806 1.00 0.00 C ATOM 864 OG1 THR A 56 5.857 19.265 -23.887 1.00 0.00 O ATOM 865 CG2 THR A 56 7.790 18.976 -22.547 1.00 0.00 C ATOM 0 H THR A 56 7.072 16.676 -21.236 1.00 0.00 H new ATOM 0 HA THR A 56 5.152 16.725 -23.398 1.00 0.00 H new ATOM 0 HB THR A 56 5.807 18.600 -21.870 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.128 18.858 -24.736 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.774 20.042 -22.318 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.215 18.430 -21.705 1.00 0.00 H new ATOM 0 HG23 THR A 56 8.399 18.805 -23.435 1.00 0.00 H new ATOM 873 N PHE A 57 7.290 15.293 -24.658 1.00 0.00 N ATOM 874 CA PHE A 57 7.866 14.710 -25.906 1.00 0.00 C ATOM 875 C PHE A 57 7.525 13.177 -25.950 1.00 0.00 C ATOM 876 O PHE A 57 6.902 12.712 -26.905 1.00 0.00 O ATOM 877 CB PHE A 57 9.407 14.921 -26.063 1.00 0.00 C ATOM 878 CG PHE A 57 10.003 16.332 -25.925 1.00 0.00 C ATOM 879 CD1 PHE A 57 10.384 16.787 -24.658 1.00 0.00 C ATOM 880 CD2 PHE A 57 10.245 17.139 -27.042 1.00 0.00 C ATOM 881 CE1 PHE A 57 11.003 18.023 -24.508 1.00 0.00 C ATOM 882 CE2 PHE A 57 10.872 18.376 -26.891 1.00 0.00 C ATOM 883 CZ PHE A 57 11.257 18.811 -25.624 1.00 0.00 C ATOM 0 H PHE A 57 7.241 14.618 -23.894 1.00 0.00 H new ATOM 0 HA PHE A 57 7.413 15.242 -26.742 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.899 14.287 -25.326 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.688 14.544 -27.046 1.00 0.00 H new ATOM 0 HD1 PHE A 57 10.196 16.173 -23.789 1.00 0.00 H new ATOM 0 HD2 PHE A 57 9.946 16.803 -28.024 1.00 0.00 H new ATOM 0 HE1 PHE A 57 11.286 18.370 -23.525 1.00 0.00 H new ATOM 0 HE2 PHE A 57 11.059 18.996 -27.755 1.00 0.00 H new ATOM 0 HZ PHE A 57 11.754 19.763 -25.509 1.00 0.00 H new ATOM 893 N LYS A 58 7.945 12.400 -24.924 1.00 0.00 N ATOM 894 CA LYS A 58 7.649 10.947 -24.800 1.00 0.00 C ATOM 895 C LYS A 58 6.490 10.698 -23.783 1.00 0.00 C ATOM 896 O LYS A 58 6.518 11.186 -22.645 1.00 0.00 O ATOM 897 CB LYS A 58 8.938 10.208 -24.337 1.00 0.00 C ATOM 898 CG LYS A 58 10.104 10.150 -25.352 1.00 0.00 C ATOM 899 CD LYS A 58 9.867 9.193 -26.537 1.00 0.00 C ATOM 900 CE LYS A 58 11.119 9.070 -27.416 1.00 0.00 C ATOM 901 NZ LYS A 58 10.878 8.106 -28.506 1.00 0.00 N ATOM 0 H LYS A 58 8.503 12.764 -24.152 1.00 0.00 H new ATOM 0 HA LYS A 58 7.330 10.564 -25.769 1.00 0.00 H new ATOM 0 HB2 LYS A 58 9.300 10.690 -23.429 1.00 0.00 H new ATOM 0 HB3 LYS A 58 8.668 9.187 -24.069 1.00 0.00 H new ATOM 0 HG2 LYS A 58 10.282 11.153 -25.740 1.00 0.00 H new ATOM 0 HG3 LYS A 58 11.010 9.845 -24.829 1.00 0.00 H new ATOM 0 HD2 LYS A 58 9.586 8.209 -26.162 1.00 0.00 H new ATOM 0 HD3 LYS A 58 9.033 9.555 -27.138 1.00 0.00 H new ATOM 0 HE2 LYS A 58 11.379 10.044 -27.831 1.00 0.00 H new ATOM 0 HE3 LYS A 58 11.966 8.745 -26.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 11.731 8.029 -29.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 10.651 7.175 -28.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 10.082 8.434 -29.089 1.00 0.00 H new ATOM 914 N ASN A 59 5.492 9.895 -24.185 1.00 0.00 N ATOM 915 CA ASN A 59 4.347 9.519 -23.308 1.00 0.00 C ATOM 916 C ASN A 59 4.006 8.000 -23.459 1.00 0.00 C ATOM 917 O ASN A 59 3.518 7.564 -24.506 1.00 0.00 O ATOM 918 CB ASN A 59 3.147 10.489 -23.511 1.00 0.00 C ATOM 919 CG ASN A 59 2.549 10.698 -24.909 1.00 0.00 C ATOM 920 OD1 ASN A 59 2.767 11.710 -25.564 1.00 0.00 O ATOM 921 ND2 ASN A 59 1.748 9.783 -25.394 1.00 0.00 N ATOM 0 H ASN A 59 5.446 9.485 -25.118 1.00 0.00 H new ATOM 0 HA ASN A 59 4.630 9.642 -22.263 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.341 10.145 -22.863 1.00 0.00 H new ATOM 0 HB3 ASN A 59 3.457 11.467 -23.143 1.00 0.00 H new ATOM 0 HD21 ASN A 59 1.314 9.917 -26.307 1.00 0.00 H new ATOM 0 HD22 ASN A 59 1.558 8.936 -24.859 1.00 0.00 H new ATOM 928 N THR A 60 4.272 7.195 -22.415 1.00 0.00 N ATOM 929 CA THR A 60 4.079 5.710 -22.444 1.00 0.00 C ATOM 930 C THR A 60 3.433 5.178 -21.118 1.00 0.00 C ATOM 931 O THR A 60 3.534 5.802 -20.056 1.00 0.00 O ATOM 932 CB THR A 60 5.412 4.999 -22.846 1.00 0.00 C ATOM 933 OG1 THR A 60 5.170 3.611 -23.043 1.00 0.00 O ATOM 934 CG2 THR A 60 6.590 5.117 -21.861 1.00 0.00 C ATOM 0 H THR A 60 4.626 7.541 -21.524 1.00 0.00 H new ATOM 0 HA THR A 60 3.354 5.459 -23.218 1.00 0.00 H new ATOM 0 HB THR A 60 5.719 5.528 -23.748 1.00 0.00 H new ATOM 0 HG1 THR A 60 6.006 3.166 -23.297 1.00 0.00 H new ATOM 0 HG21 THR A 60 7.452 4.581 -22.258 1.00 0.00 H new ATOM 0 HG22 THR A 60 6.847 6.168 -21.726 1.00 0.00 H new ATOM 0 HG23 THR A 60 6.306 4.686 -20.901 1.00 0.00 H new ATOM 942 N GLU A 61 2.748 4.019 -21.175 1.00 0.00 N ATOM 943 CA GLU A 61 2.054 3.430 -19.990 1.00 0.00 C ATOM 944 C GLU A 61 2.188 1.879 -19.884 1.00 0.00 C ATOM 945 O GLU A 61 2.222 1.171 -20.896 1.00 0.00 O ATOM 946 CB GLU A 61 0.581 3.923 -19.909 1.00 0.00 C ATOM 947 CG GLU A 61 -0.409 3.433 -20.999 1.00 0.00 C ATOM 948 CD GLU A 61 -1.853 3.919 -20.829 1.00 0.00 C ATOM 949 OE1 GLU A 61 -2.258 4.586 -19.878 1.00 0.00 O ATOM 950 OE2 GLU A 61 -2.642 3.515 -21.867 1.00 0.00 O ATOM 0 H GLU A 61 2.655 3.464 -22.026 1.00 0.00 H new ATOM 0 HA GLU A 61 2.574 3.801 -19.107 1.00 0.00 H new ATOM 0 HB2 GLU A 61 0.182 3.628 -18.938 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.591 5.013 -19.932 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.044 3.759 -21.973 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.407 2.343 -21.007 1.00 0.00 H new ATOM 958 N ILE A 62 2.238 1.357 -18.642 1.00 0.00 N ATOM 959 CA ILE A 62 2.413 -0.105 -18.373 1.00 0.00 C ATOM 960 C ILE A 62 1.344 -0.622 -17.361 1.00 0.00 C ATOM 961 O ILE A 62 1.247 -0.147 -16.226 1.00 0.00 O ATOM 962 CB ILE A 62 3.869 -0.500 -17.942 1.00 0.00 C ATOM 963 CG1 ILE A 62 4.450 0.265 -16.720 1.00 0.00 C ATOM 964 CG2 ILE A 62 4.813 -0.420 -19.159 1.00 0.00 C ATOM 965 CD1 ILE A 62 5.657 -0.403 -16.042 1.00 0.00 C ATOM 0 H ILE A 62 2.160 1.922 -17.796 1.00 0.00 H new ATOM 0 HA ILE A 62 2.252 -0.609 -19.326 1.00 0.00 H new ATOM 0 HB ILE A 62 3.794 -1.527 -17.584 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.742 1.264 -17.043 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.660 0.388 -15.979 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.823 -0.695 -18.855 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.468 -1.105 -19.933 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.816 0.597 -19.551 1.00 0.00 H new ATOM 0 HD11 ILE A 62 5.987 0.208 -15.202 1.00 0.00 H new ATOM 0 HD12 ILE A 62 5.371 -1.391 -15.681 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.470 -0.501 -16.761 1.00 0.00 H new ATOM 977 N SER A 63 0.575 -1.629 -17.794 1.00 0.00 N ATOM 978 CA SER A 63 -0.492 -2.276 -16.985 1.00 0.00 C ATOM 979 C SER A 63 -0.033 -3.677 -16.479 1.00 0.00 C ATOM 980 O SER A 63 0.194 -4.594 -17.285 1.00 0.00 O ATOM 981 CB SER A 63 -1.758 -2.374 -17.873 1.00 0.00 C ATOM 982 OG SER A 63 -1.542 -3.215 -19.010 1.00 0.00 O ATOM 0 H SER A 63 0.669 -2.030 -18.727 1.00 0.00 H new ATOM 0 HA SER A 63 -0.711 -1.685 -16.096 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.587 -2.765 -17.283 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.047 -1.377 -18.207 1.00 0.00 H new ATOM 0 HG SER A 63 -0.902 -3.920 -18.778 1.00 0.00 H new ATOM 988 N PHE A 64 0.072 -3.860 -15.151 1.00 0.00 N ATOM 989 CA PHE A 64 0.626 -5.111 -14.560 1.00 0.00 C ATOM 990 C PHE A 64 -0.049 -5.550 -13.226 1.00 0.00 C ATOM 991 O PHE A 64 -0.291 -4.758 -12.310 1.00 0.00 O ATOM 992 CB PHE A 64 2.182 -5.048 -14.448 1.00 0.00 C ATOM 993 CG PHE A 64 2.764 -3.960 -13.533 1.00 0.00 C ATOM 994 CD1 PHE A 64 2.915 -4.188 -12.161 1.00 0.00 C ATOM 995 CD2 PHE A 64 3.051 -2.697 -14.058 1.00 0.00 C ATOM 996 CE1 PHE A 64 3.310 -3.152 -11.319 1.00 0.00 C ATOM 997 CE2 PHE A 64 3.447 -1.666 -13.216 1.00 0.00 C ATOM 998 CZ PHE A 64 3.566 -1.890 -11.847 1.00 0.00 C ATOM 0 H PHE A 64 -0.216 -3.166 -14.461 1.00 0.00 H new ATOM 0 HA PHE A 64 0.372 -5.903 -15.264 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.537 -6.016 -14.094 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.590 -4.905 -15.449 1.00 0.00 H new ATOM 0 HD1 PHE A 64 2.725 -5.170 -11.754 1.00 0.00 H new ATOM 0 HD2 PHE A 64 2.965 -2.522 -15.120 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.417 -3.327 -10.259 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.663 -0.689 -13.624 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.858 -1.082 -11.193 1.00 0.00 H new ATOM 1008 N GLN A 65 -0.235 -6.869 -13.080 1.00 0.00 N ATOM 1009 CA GLN A 65 -0.220 -7.532 -11.746 1.00 0.00 C ATOM 1010 C GLN A 65 1.256 -7.752 -11.254 1.00 0.00 C ATOM 1011 O GLN A 65 2.203 -7.822 -12.050 1.00 0.00 O ATOM 1012 CB GLN A 65 -1.006 -8.869 -11.862 1.00 0.00 C ATOM 1013 CG GLN A 65 -2.534 -8.716 -12.104 1.00 0.00 C ATOM 1014 CD GLN A 65 -3.278 -10.047 -12.245 1.00 0.00 C ATOM 1015 OE1 GLN A 65 -3.661 -10.684 -11.272 1.00 0.00 O ATOM 1016 NE2 GLN A 65 -3.507 -10.514 -13.450 1.00 0.00 N ATOM 0 H GLN A 65 -0.398 -7.506 -13.860 1.00 0.00 H new ATOM 0 HA GLN A 65 -0.702 -6.901 -10.999 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.581 -9.453 -12.679 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -0.854 -9.442 -10.948 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -2.968 -8.155 -11.277 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.691 -8.126 -13.007 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -3.192 -9.992 -14.268 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -4.000 -11.399 -13.569 1.00 0.00 H new ATOM 1025 N LEU A 66 1.466 -7.856 -9.931 1.00 0.00 N ATOM 1026 CA LEU A 66 2.828 -8.035 -9.344 1.00 0.00 C ATOM 1027 C LEU A 66 3.401 -9.462 -9.642 1.00 0.00 C ATOM 1028 O LEU A 66 2.833 -10.478 -9.229 1.00 0.00 O ATOM 1029 CB LEU A 66 2.786 -7.709 -7.824 1.00 0.00 C ATOM 1030 CG LEU A 66 2.459 -6.239 -7.431 1.00 0.00 C ATOM 1031 CD1 LEU A 66 2.204 -6.130 -5.919 1.00 0.00 C ATOM 1032 CD2 LEU A 66 3.573 -5.253 -7.827 1.00 0.00 C ATOM 0 H LEU A 66 0.718 -7.821 -9.238 1.00 0.00 H new ATOM 0 HA LEU A 66 3.517 -7.336 -9.818 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.045 -8.358 -7.358 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.753 -7.969 -7.394 1.00 0.00 H new ATOM 0 HG LEU A 66 1.561 -5.966 -7.985 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.977 -5.095 -5.662 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.362 -6.765 -5.645 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.093 -6.452 -5.376 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.289 -4.244 -7.528 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.501 -5.532 -7.327 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.719 -5.284 -8.907 1.00 0.00 H new ATOM 1044 N GLY A 67 4.485 -9.517 -10.433 1.00 0.00 N ATOM 1045 CA GLY A 67 4.930 -10.769 -11.113 1.00 0.00 C ATOM 1046 C GLY A 67 4.615 -10.946 -12.625 1.00 0.00 C ATOM 1047 O GLY A 67 5.118 -11.905 -13.212 1.00 0.00 O ATOM 0 H GLY A 67 5.079 -8.711 -10.625 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.010 -10.848 -10.988 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.486 -11.610 -10.581 1.00 0.00 H new ATOM 1051 N GLU A 68 3.824 -10.064 -13.273 1.00 0.00 N ATOM 1052 CA GLU A 68 3.504 -10.156 -14.726 1.00 0.00 C ATOM 1053 C GLU A 68 4.747 -9.869 -15.630 1.00 0.00 C ATOM 1054 O GLU A 68 5.333 -8.783 -15.571 1.00 0.00 O ATOM 1055 CB GLU A 68 2.344 -9.162 -15.026 1.00 0.00 C ATOM 1056 CG GLU A 68 1.732 -9.236 -16.454 1.00 0.00 C ATOM 1057 CD GLU A 68 0.733 -8.113 -16.742 1.00 0.00 C ATOM 1058 OE1 GLU A 68 -0.435 -8.122 -16.359 1.00 0.00 O ATOM 1059 OE2 GLU A 68 1.304 -7.073 -17.419 1.00 0.00 O ATOM 0 H GLU A 68 3.387 -9.267 -12.810 1.00 0.00 H new ATOM 0 HA GLU A 68 3.199 -11.176 -14.961 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.548 -9.335 -14.302 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.709 -8.148 -14.861 1.00 0.00 H new ATOM 0 HG2 GLU A 68 2.536 -9.195 -17.189 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.234 -10.197 -16.579 1.00 0.00 H new ATOM 1067 N GLU A 69 5.096 -10.838 -16.492 1.00 0.00 N ATOM 1068 CA GLU A 69 6.097 -10.637 -17.575 1.00 0.00 C ATOM 1069 C GLU A 69 5.398 -10.123 -18.877 1.00 0.00 C ATOM 1070 O GLU A 69 4.539 -10.804 -19.446 1.00 0.00 O ATOM 1071 CB GLU A 69 6.878 -11.961 -17.784 1.00 0.00 C ATOM 1072 CG GLU A 69 8.136 -11.817 -18.681 1.00 0.00 C ATOM 1073 CD GLU A 69 8.969 -13.094 -18.754 1.00 0.00 C ATOM 1074 OE1 GLU A 69 8.825 -13.957 -19.613 1.00 0.00 O ATOM 1075 OE2 GLU A 69 9.885 -13.175 -17.749 1.00 0.00 O ATOM 0 H GLU A 69 4.701 -11.778 -16.466 1.00 0.00 H new ATOM 0 HA GLU A 69 6.816 -9.867 -17.296 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.180 -12.350 -16.812 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.210 -12.699 -18.229 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.827 -11.534 -19.687 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.757 -11.007 -18.299 1.00 0.00 H new ATOM 1083 N PHE A 70 5.772 -8.919 -19.335 1.00 0.00 N ATOM 1084 CA PHE A 70 5.126 -8.245 -20.501 1.00 0.00 C ATOM 1085 C PHE A 70 6.202 -7.611 -21.444 1.00 0.00 C ATOM 1086 O PHE A 70 7.129 -6.939 -20.980 1.00 0.00 O ATOM 1087 CB PHE A 70 4.041 -7.230 -20.006 1.00 0.00 C ATOM 1088 CG PHE A 70 4.504 -6.061 -19.107 1.00 0.00 C ATOM 1089 CD1 PHE A 70 4.554 -6.218 -17.717 1.00 0.00 C ATOM 1090 CD2 PHE A 70 4.972 -4.873 -19.678 1.00 0.00 C ATOM 1091 CE1 PHE A 70 5.121 -5.230 -16.917 1.00 0.00 C ATOM 1092 CE2 PHE A 70 5.539 -3.887 -18.876 1.00 0.00 C ATOM 1093 CZ PHE A 70 5.630 -4.072 -17.500 1.00 0.00 C ATOM 0 H PHE A 70 6.528 -8.376 -18.918 1.00 0.00 H new ATOM 0 HA PHE A 70 4.602 -8.984 -21.107 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.555 -6.805 -20.884 1.00 0.00 H new ATOM 0 HB3 PHE A 70 3.282 -7.791 -19.461 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.150 -7.111 -17.263 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.893 -4.720 -20.744 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.166 -5.361 -15.846 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.909 -2.976 -19.323 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.096 -3.317 -16.884 1.00 0.00 H new ATOM 1103 N ASP A 71 6.075 -7.774 -22.779 1.00 0.00 N ATOM 1104 CA ASP A 71 6.963 -7.064 -23.751 1.00 0.00 C ATOM 1105 C ASP A 71 6.550 -5.563 -23.896 1.00 0.00 C ATOM 1106 O ASP A 71 5.383 -5.227 -24.119 1.00 0.00 O ATOM 1107 CB ASP A 71 7.020 -7.733 -25.148 1.00 0.00 C ATOM 1108 CG ASP A 71 7.704 -9.104 -25.201 1.00 0.00 C ATOM 1109 OD1 ASP A 71 7.362 -10.056 -24.504 1.00 0.00 O ATOM 1110 OD2 ASP A 71 8.726 -9.160 -26.112 1.00 0.00 O ATOM 0 H ASP A 71 5.379 -8.380 -23.213 1.00 0.00 H new ATOM 0 HA ASP A 71 7.966 -7.130 -23.330 1.00 0.00 H new ATOM 0 HB2 ASP A 71 6.001 -7.841 -25.521 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.540 -7.061 -25.831 1.00 0.00 H new ATOM 1116 N GLU A 72 7.539 -4.676 -23.755 1.00 0.00 N ATOM 1117 CA GLU A 72 7.303 -3.217 -23.582 1.00 0.00 C ATOM 1118 C GLU A 72 8.201 -2.418 -24.571 1.00 0.00 C ATOM 1119 O GLU A 72 9.416 -2.326 -24.364 1.00 0.00 O ATOM 1120 CB GLU A 72 7.622 -2.887 -22.097 1.00 0.00 C ATOM 1121 CG GLU A 72 7.428 -1.401 -21.667 1.00 0.00 C ATOM 1122 CD GLU A 72 8.259 -0.879 -20.484 1.00 0.00 C ATOM 1123 OE1 GLU A 72 8.083 0.223 -19.973 1.00 0.00 O ATOM 1124 OE2 GLU A 72 9.259 -1.724 -20.114 1.00 0.00 O ATOM 0 H GLU A 72 8.526 -4.935 -23.756 1.00 0.00 H new ATOM 0 HA GLU A 72 6.273 -2.938 -23.805 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.992 -3.512 -21.464 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.656 -3.170 -21.897 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.644 -0.772 -22.531 1.00 0.00 H new ATOM 0 HG3 GLU A 72 6.375 -1.258 -21.425 1.00 0.00 H new ATOM 1132 N THR A 73 7.606 -1.788 -25.603 1.00 0.00 N ATOM 1133 CA THR A 73 8.350 -0.892 -26.541 1.00 0.00 C ATOM 1134 C THR A 73 8.659 0.482 -25.857 1.00 0.00 C ATOM 1135 O THR A 73 7.787 1.345 -25.713 1.00 0.00 O ATOM 1136 CB THR A 73 7.593 -0.762 -27.897 1.00 0.00 C ATOM 1137 OG1 THR A 73 7.407 -2.049 -28.479 1.00 0.00 O ATOM 1138 CG2 THR A 73 8.338 0.060 -28.964 1.00 0.00 C ATOM 0 H THR A 73 6.613 -1.876 -25.817 1.00 0.00 H new ATOM 0 HA THR A 73 9.316 -1.337 -26.780 1.00 0.00 H new ATOM 0 HB THR A 73 6.661 -0.259 -27.640 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.929 -1.957 -29.330 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.741 0.100 -29.875 1.00 0.00 H new ATOM 0 HG22 THR A 73 8.503 1.072 -28.594 1.00 0.00 H new ATOM 0 HG23 THR A 73 9.298 -0.409 -29.180 1.00 0.00 H new ATOM 1146 N THR A 74 9.913 0.651 -25.410 1.00 0.00 N ATOM 1147 CA THR A 74 10.327 1.824 -24.583 1.00 0.00 C ATOM 1148 C THR A 74 10.717 3.081 -25.428 1.00 0.00 C ATOM 1149 O THR A 74 11.101 2.978 -26.598 1.00 0.00 O ATOM 1150 CB THR A 74 11.483 1.431 -23.601 1.00 0.00 C ATOM 1151 OG1 THR A 74 12.682 1.073 -24.293 1.00 0.00 O ATOM 1152 CG2 THR A 74 11.134 0.327 -22.586 1.00 0.00 C ATOM 0 H THR A 74 10.670 -0.006 -25.602 1.00 0.00 H new ATOM 0 HA THR A 74 9.449 2.111 -24.005 1.00 0.00 H new ATOM 0 HB THR A 74 11.643 2.343 -23.026 1.00 0.00 H new ATOM 0 HG1 THR A 74 12.467 0.835 -25.219 1.00 0.00 H new ATOM 0 HG21 THR A 74 11.999 0.128 -21.953 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.299 0.653 -21.967 1.00 0.00 H new ATOM 0 HG23 THR A 74 10.857 -0.583 -23.119 1.00 0.00 H new ATOM 1160 N ALA A 75 10.734 4.266 -24.783 1.00 0.00 N ATOM 1161 CA ALA A 75 11.358 5.506 -25.342 1.00 0.00 C ATOM 1162 C ALA A 75 12.838 5.443 -25.873 1.00 0.00 C ATOM 1163 O ALA A 75 13.214 6.230 -26.744 1.00 0.00 O ATOM 1164 CB ALA A 75 11.216 6.563 -24.230 1.00 0.00 C ATOM 0 H ALA A 75 10.319 4.401 -23.861 1.00 0.00 H new ATOM 0 HA ALA A 75 10.830 5.729 -26.269 1.00 0.00 H new ATOM 0 HB1 ALA A 75 11.652 7.504 -24.565 1.00 0.00 H new ATOM 0 HB2 ALA A 75 10.160 6.712 -24.003 1.00 0.00 H new ATOM 0 HB3 ALA A 75 11.735 6.221 -23.335 1.00 0.00 H new ATOM 1170 N ASP A 76 13.656 4.483 -25.401 1.00 0.00 N ATOM 1171 CA ASP A 76 14.902 4.041 -26.097 1.00 0.00 C ATOM 1172 C ASP A 76 14.776 3.580 -27.598 1.00 0.00 C ATOM 1173 O ASP A 76 15.749 3.709 -28.345 1.00 0.00 O ATOM 1174 CB ASP A 76 15.460 2.906 -25.186 1.00 0.00 C ATOM 1175 CG ASP A 76 16.885 2.438 -25.463 1.00 0.00 C ATOM 1176 OD1 ASP A 76 17.838 2.708 -24.743 1.00 0.00 O ATOM 1177 OD2 ASP A 76 16.972 1.680 -26.592 1.00 0.00 O ATOM 0 H ASP A 76 13.481 3.986 -24.528 1.00 0.00 H new ATOM 0 HA ASP A 76 15.562 4.901 -26.213 1.00 0.00 H new ATOM 0 HB2 ASP A 76 15.409 3.245 -24.151 1.00 0.00 H new ATOM 0 HB3 ASP A 76 14.797 2.045 -25.272 1.00 0.00 H new ATOM 1183 N ASP A 77 13.619 3.007 -27.994 1.00 0.00 N ATOM 1184 CA ASP A 77 13.442 2.130 -29.186 1.00 0.00 C ATOM 1185 C ASP A 77 13.955 0.669 -28.928 1.00 0.00 C ATOM 1186 O ASP A 77 14.864 0.186 -29.611 1.00 0.00 O ATOM 1187 CB ASP A 77 13.884 2.802 -30.521 1.00 0.00 C ATOM 1188 CG ASP A 77 13.420 2.115 -31.803 1.00 0.00 C ATOM 1189 OD1 ASP A 77 12.582 2.595 -32.560 1.00 0.00 O ATOM 1190 OD2 ASP A 77 14.051 0.919 -32.005 1.00 0.00 O ATOM 0 H ASP A 77 12.749 3.143 -27.479 1.00 0.00 H new ATOM 0 HA ASP A 77 12.371 1.999 -29.344 1.00 0.00 H new ATOM 0 HB2 ASP A 77 13.515 3.827 -30.528 1.00 0.00 H new ATOM 0 HB3 ASP A 77 14.973 2.855 -30.535 1.00 0.00 H new ATOM 1196 N ARG A 78 13.318 -0.035 -27.972 1.00 0.00 N ATOM 1197 CA ARG A 78 13.611 -1.463 -27.654 1.00 0.00 C ATOM 1198 C ARG A 78 12.327 -2.130 -27.060 1.00 0.00 C ATOM 1199 O ARG A 78 11.696 -1.532 -26.176 1.00 0.00 O ATOM 1200 CB ARG A 78 14.869 -1.571 -26.724 1.00 0.00 C ATOM 1201 CG ARG A 78 14.655 -1.569 -25.186 1.00 0.00 C ATOM 1202 CD ARG A 78 15.849 -1.024 -24.394 1.00 0.00 C ATOM 1203 NE ARG A 78 15.777 -1.443 -22.976 1.00 0.00 N ATOM 1204 CZ ARG A 78 15.229 -0.762 -21.975 1.00 0.00 C ATOM 1205 NH1 ARG A 78 14.609 0.377 -22.120 1.00 0.00 N ATOM 1206 NH2 ARG A 78 15.305 -1.269 -20.786 1.00 0.00 N ATOM 0 H ARG A 78 12.581 0.365 -27.391 1.00 0.00 H new ATOM 0 HA ARG A 78 13.867 -2.013 -28.559 1.00 0.00 H new ATOM 0 HB2 ARG A 78 15.396 -2.489 -26.984 1.00 0.00 H new ATOM 0 HB3 ARG A 78 15.534 -0.742 -26.967 1.00 0.00 H new ATOM 0 HG2 ARG A 78 13.773 -0.972 -24.952 1.00 0.00 H new ATOM 0 HG3 ARG A 78 14.447 -2.587 -24.857 1.00 0.00 H new ATOM 0 HD2 ARG A 78 16.778 -1.382 -24.837 1.00 0.00 H new ATOM 0 HD3 ARG A 78 15.865 0.064 -24.456 1.00 0.00 H new ATOM 0 HE ARG A 78 16.190 -2.346 -22.744 1.00 0.00 H new ATOM 0 HH11 ARG A 78 14.523 0.797 -23.046 1.00 0.00 H new ATOM 0 HH12 ARG A 78 14.211 0.848 -21.308 1.00 0.00 H new ATOM 0 HH21 ARG A 78 15.774 -2.163 -20.642 1.00 0.00 H new ATOM 0 HH22 ARG A 78 14.896 -0.774 -19.993 1.00 0.00 H new ATOM 1220 N ASN A 79 11.972 -3.369 -27.465 1.00 0.00 N ATOM 1221 CA ASN A 79 10.919 -4.157 -26.754 1.00 0.00 C ATOM 1222 C ASN A 79 11.552 -5.036 -25.620 1.00 0.00 C ATOM 1223 O ASN A 79 12.307 -5.970 -25.906 1.00 0.00 O ATOM 1224 CB ASN A 79 9.931 -4.857 -27.736 1.00 0.00 C ATOM 1225 CG ASN A 79 10.160 -6.322 -28.119 1.00 0.00 C ATOM 1226 OD1 ASN A 79 9.566 -7.230 -27.542 1.00 0.00 O ATOM 1227 ND2 ASN A 79 11.002 -6.600 -29.084 1.00 0.00 N ATOM 0 H ASN A 79 12.386 -3.846 -28.266 1.00 0.00 H new ATOM 0 HA ASN A 79 10.254 -3.480 -26.218 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.934 -4.785 -27.302 1.00 0.00 H new ATOM 0 HB3 ASN A 79 9.921 -4.276 -28.658 1.00 0.00 H new ATOM 0 HD21 ASN A 79 11.164 -7.570 -29.356 1.00 0.00 H new ATOM 0 HD22 ASN A 79 11.495 -5.847 -29.563 1.00 0.00 H new ATOM 1234 N CYS A 80 11.268 -4.720 -24.344 1.00 0.00 N ATOM 1235 CA CYS A 80 11.837 -5.462 -23.186 1.00 0.00 C ATOM 1236 C CYS A 80 10.802 -6.363 -22.457 1.00 0.00 C ATOM 1237 O CYS A 80 9.737 -5.901 -22.029 1.00 0.00 O ATOM 1238 CB CYS A 80 12.469 -4.453 -22.212 1.00 0.00 C ATOM 1239 SG CYS A 80 11.299 -3.137 -21.743 1.00 0.00 S ATOM 0 H CYS A 80 10.647 -3.955 -24.080 1.00 0.00 H new ATOM 0 HA CYS A 80 12.594 -6.145 -23.571 1.00 0.00 H new ATOM 0 HB2 CYS A 80 12.806 -4.975 -21.317 1.00 0.00 H new ATOM 0 HB3 CYS A 80 13.351 -4.008 -22.672 1.00 0.00 H new ATOM 0 HG CYS A 80 10.564 -3.543 -20.751 1.00 0.00 H new ATOM 1245 N LYS A 81 11.185 -7.634 -22.236 1.00 0.00 N ATOM 1246 CA LYS A 81 10.465 -8.588 -21.349 1.00 0.00 C ATOM 1247 C LYS A 81 10.537 -8.100 -19.866 1.00 0.00 C ATOM 1248 O LYS A 81 11.562 -8.220 -19.186 1.00 0.00 O ATOM 1249 CB LYS A 81 11.109 -10.001 -21.484 1.00 0.00 C ATOM 1250 CG LYS A 81 10.803 -10.841 -22.741 1.00 0.00 C ATOM 1251 CD LYS A 81 11.366 -10.295 -24.073 1.00 0.00 C ATOM 1252 CE LYS A 81 11.440 -11.327 -25.214 1.00 0.00 C ATOM 1253 NZ LYS A 81 10.105 -11.747 -25.685 1.00 0.00 N ATOM 0 H LYS A 81 12.014 -8.040 -22.671 1.00 0.00 H new ATOM 0 HA LYS A 81 9.417 -8.640 -21.645 1.00 0.00 H new ATOM 0 HB2 LYS A 81 12.190 -9.878 -21.425 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.807 -10.586 -20.615 1.00 0.00 H new ATOM 0 HG2 LYS A 81 11.197 -11.846 -22.587 1.00 0.00 H new ATOM 0 HG3 LYS A 81 9.721 -10.934 -22.837 1.00 0.00 H new ATOM 0 HD2 LYS A 81 10.746 -9.459 -24.398 1.00 0.00 H new ATOM 0 HD3 LYS A 81 12.366 -9.900 -23.894 1.00 0.00 H new ATOM 0 HE2 LYS A 81 11.999 -10.902 -26.048 1.00 0.00 H new ATOM 0 HE3 LYS A 81 11.993 -12.202 -24.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 10.204 -12.306 -26.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 9.645 -12.325 -24.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 9.524 -10.906 -25.877 1.00 0.00 H new ATOM 1266 N SER A 82 9.458 -7.457 -19.418 1.00 0.00 N ATOM 1267 CA SER A 82 9.474 -6.639 -18.185 1.00 0.00 C ATOM 1268 C SER A 82 8.718 -7.327 -17.020 1.00 0.00 C ATOM 1269 O SER A 82 7.516 -7.583 -17.123 1.00 0.00 O ATOM 1270 CB SER A 82 8.853 -5.273 -18.526 1.00 0.00 C ATOM 1271 OG SER A 82 9.614 -4.571 -19.508 1.00 0.00 O ATOM 0 H SER A 82 8.553 -7.482 -19.887 1.00 0.00 H new ATOM 0 HA SER A 82 10.501 -6.515 -17.840 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.836 -5.418 -18.891 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.784 -4.670 -17.621 1.00 0.00 H new ATOM 0 HG SER A 82 9.657 -5.103 -20.330 1.00 0.00 H new ATOM 1277 N VAL A 83 9.428 -7.596 -15.913 1.00 0.00 N ATOM 1278 CA VAL A 83 8.831 -8.195 -14.680 1.00 0.00 C ATOM 1279 C VAL A 83 8.851 -7.105 -13.558 1.00 0.00 C ATOM 1280 O VAL A 83 9.922 -6.629 -13.164 1.00 0.00 O ATOM 1281 CB VAL A 83 9.572 -9.513 -14.251 1.00 0.00 C ATOM 1282 CG1 VAL A 83 8.939 -10.187 -13.008 1.00 0.00 C ATOM 1283 CG2 VAL A 83 9.623 -10.600 -15.351 1.00 0.00 C ATOM 0 H VAL A 83 10.428 -7.410 -15.834 1.00 0.00 H new ATOM 0 HA VAL A 83 7.801 -8.497 -14.873 1.00 0.00 H new ATOM 0 HB VAL A 83 10.579 -9.157 -14.035 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.495 -11.092 -12.762 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.974 -9.499 -12.164 1.00 0.00 H new ATOM 0 HG13 VAL A 83 7.902 -10.446 -13.223 1.00 0.00 H new ATOM 0 HG21 VAL A 83 10.151 -11.476 -14.973 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.608 -10.881 -15.632 1.00 0.00 H new ATOM 0 HG23 VAL A 83 10.146 -10.210 -16.224 1.00 0.00 H new ATOM 1293 N VAL A 84 7.674 -6.731 -13.021 1.00 0.00 N ATOM 1294 CA VAL A 84 7.571 -5.706 -11.934 1.00 0.00 C ATOM 1295 C VAL A 84 7.108 -6.391 -10.604 1.00 0.00 C ATOM 1296 O VAL A 84 6.113 -7.126 -10.570 1.00 0.00 O ATOM 1297 CB VAL A 84 6.659 -4.493 -12.326 1.00 0.00 C ATOM 1298 CG1 VAL A 84 6.770 -3.349 -11.290 1.00 0.00 C ATOM 1299 CG2 VAL A 84 6.946 -3.850 -13.700 1.00 0.00 C ATOM 0 H VAL A 84 6.776 -7.116 -13.313 1.00 0.00 H new ATOM 0 HA VAL A 84 8.562 -5.280 -11.779 1.00 0.00 H new ATOM 0 HB VAL A 84 5.667 -4.944 -12.361 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.126 -2.523 -11.590 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.460 -3.714 -10.311 1.00 0.00 H new ATOM 0 HG13 VAL A 84 7.803 -3.004 -11.238 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.256 -3.022 -13.866 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.970 -3.478 -13.721 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.814 -4.595 -14.485 1.00 0.00 H new ATOM 1309 N SER A 85 7.827 -6.153 -9.491 1.00 0.00 N ATOM 1310 CA SER A 85 7.471 -6.711 -8.149 1.00 0.00 C ATOM 1311 C SER A 85 8.000 -5.821 -6.979 1.00 0.00 C ATOM 1312 O SER A 85 9.025 -5.140 -7.101 1.00 0.00 O ATOM 1313 CB SER A 85 7.995 -8.166 -8.037 1.00 0.00 C ATOM 1314 OG SER A 85 7.285 -9.018 -8.934 1.00 0.00 O ATOM 0 H SER A 85 8.667 -5.574 -9.483 1.00 0.00 H new ATOM 0 HA SER A 85 6.385 -6.716 -8.059 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.061 -8.195 -8.264 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.877 -8.524 -7.014 1.00 0.00 H new ATOM 0 HG SER A 85 6.741 -8.474 -9.541 1.00 0.00 H new ATOM 1320 N LEU A 86 7.319 -5.852 -5.814 1.00 0.00 N ATOM 1321 CA LEU A 86 7.874 -5.276 -4.553 1.00 0.00 C ATOM 1322 C LEU A 86 8.825 -6.302 -3.853 1.00 0.00 C ATOM 1323 O LEU A 86 8.406 -7.413 -3.511 1.00 0.00 O ATOM 1324 CB LEU A 86 6.756 -4.822 -3.567 1.00 0.00 C ATOM 1325 CG LEU A 86 6.107 -3.434 -3.822 1.00 0.00 C ATOM 1326 CD1 LEU A 86 4.921 -3.527 -4.795 1.00 0.00 C ATOM 1327 CD2 LEU A 86 5.622 -2.798 -2.508 1.00 0.00 C ATOM 0 H LEU A 86 6.392 -6.264 -5.712 1.00 0.00 H new ATOM 0 HA LEU A 86 8.443 -4.389 -4.832 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.966 -5.573 -3.583 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.174 -4.820 -2.560 1.00 0.00 H new ATOM 0 HG LEU A 86 6.881 -2.809 -4.268 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.496 -2.535 -4.946 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.264 -3.924 -5.750 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.161 -4.188 -4.380 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.172 -1.827 -2.718 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.882 -3.448 -2.041 1.00 0.00 H new ATOM 0 HD23 LEU A 86 6.468 -2.668 -1.833 1.00 0.00 H new ATOM 1339 N ASP A 87 10.088 -5.911 -3.605 1.00 0.00 N ATOM 1340 CA ASP A 87 11.067 -6.769 -2.875 1.00 0.00 C ATOM 1341 C ASP A 87 10.946 -6.633 -1.313 1.00 0.00 C ATOM 1342 O ASP A 87 10.597 -7.606 -0.643 1.00 0.00 O ATOM 1343 CB ASP A 87 12.467 -6.475 -3.482 1.00 0.00 C ATOM 1344 CG ASP A 87 13.542 -7.485 -3.095 1.00 0.00 C ATOM 1345 OD1 ASP A 87 13.736 -8.536 -3.696 1.00 0.00 O ATOM 1346 OD2 ASP A 87 14.259 -7.090 -2.009 1.00 0.00 O ATOM 0 H ASP A 87 10.464 -5.008 -3.895 1.00 0.00 H new ATOM 0 HA ASP A 87 10.858 -7.829 -3.017 1.00 0.00 H new ATOM 0 HB2 ASP A 87 12.382 -6.451 -4.568 1.00 0.00 H new ATOM 0 HB3 ASP A 87 12.786 -5.482 -3.165 1.00 0.00 H new ATOM 1352 N GLY A 88 11.210 -5.443 -0.743 1.00 0.00 N ATOM 1353 CA GLY A 88 11.013 -5.172 0.708 1.00 0.00 C ATOM 1354 C GLY A 88 10.665 -3.692 0.953 1.00 0.00 C ATOM 1355 O GLY A 88 11.551 -2.885 1.238 1.00 0.00 O ATOM 0 H GLY A 88 11.564 -4.641 -1.265 1.00 0.00 H new ATOM 0 HA2 GLY A 88 10.214 -5.805 1.094 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.919 -5.431 1.256 1.00 0.00 H new ATOM 1359 N ASP A 89 9.385 -3.323 0.747 1.00 0.00 N ATOM 1360 CA ASP A 89 8.954 -1.900 0.528 1.00 0.00 C ATOM 1361 C ASP A 89 9.716 -1.104 -0.607 1.00 0.00 C ATOM 1362 O ASP A 89 9.954 0.103 -0.483 1.00 0.00 O ATOM 1363 CB ASP A 89 8.852 -1.165 1.900 1.00 0.00 C ATOM 1364 CG ASP A 89 7.914 0.047 1.958 1.00 0.00 C ATOM 1365 OD1 ASP A 89 6.897 0.076 2.644 1.00 0.00 O ATOM 1366 OD2 ASP A 89 8.339 1.081 1.172 1.00 0.00 O ATOM 0 H ASP A 89 8.613 -3.989 0.725 1.00 0.00 H new ATOM 0 HA ASP A 89 7.956 -1.939 0.091 1.00 0.00 H new ATOM 0 HB2 ASP A 89 8.525 -1.886 2.650 1.00 0.00 H new ATOM 0 HB3 ASP A 89 9.851 -0.837 2.187 1.00 0.00 H new ATOM 1372 N LYS A 90 10.061 -1.773 -1.722 1.00 0.00 N ATOM 1373 CA LYS A 90 10.805 -1.162 -2.854 1.00 0.00 C ATOM 1374 C LYS A 90 10.343 -1.816 -4.193 1.00 0.00 C ATOM 1375 O LYS A 90 10.420 -3.037 -4.372 1.00 0.00 O ATOM 1376 CB LYS A 90 12.339 -1.152 -2.608 1.00 0.00 C ATOM 1377 CG LYS A 90 13.095 -2.500 -2.606 1.00 0.00 C ATOM 1378 CD LYS A 90 14.551 -2.349 -2.127 1.00 0.00 C ATOM 1379 CE LYS A 90 15.350 -3.652 -2.275 1.00 0.00 C ATOM 1380 NZ LYS A 90 16.725 -3.463 -1.778 1.00 0.00 N ATOM 0 H LYS A 90 9.834 -2.756 -1.870 1.00 0.00 H new ATOM 0 HA LYS A 90 10.560 -0.103 -2.934 1.00 0.00 H new ATOM 0 HB2 LYS A 90 12.793 -0.519 -3.370 1.00 0.00 H new ATOM 0 HB3 LYS A 90 12.517 -0.671 -1.646 1.00 0.00 H new ATOM 0 HG2 LYS A 90 12.573 -3.206 -1.960 1.00 0.00 H new ATOM 0 HG3 LYS A 90 13.087 -2.921 -3.611 1.00 0.00 H new ATOM 0 HD2 LYS A 90 15.039 -1.559 -2.698 1.00 0.00 H new ATOM 0 HD3 LYS A 90 14.557 -2.038 -1.082 1.00 0.00 H new ATOM 0 HE2 LYS A 90 14.861 -4.452 -1.720 1.00 0.00 H new ATOM 0 HE3 LYS A 90 15.372 -3.957 -3.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 17.257 -4.350 -1.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 17.192 -2.713 -2.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 16.697 -3.192 -0.774 1.00 0.00 H new ATOM 1393 N LEU A 91 9.824 -0.989 -5.111 1.00 0.00 N ATOM 1394 CA LEU A 91 9.175 -1.439 -6.371 1.00 0.00 C ATOM 1395 C LEU A 91 10.233 -1.607 -7.510 1.00 0.00 C ATOM 1396 O LEU A 91 10.812 -0.617 -7.967 1.00 0.00 O ATOM 1397 CB LEU A 91 8.072 -0.389 -6.744 1.00 0.00 C ATOM 1398 CG LEU A 91 6.606 -0.875 -6.858 1.00 0.00 C ATOM 1399 CD1 LEU A 91 5.703 0.277 -7.339 1.00 0.00 C ATOM 1400 CD2 LEU A 91 6.406 -2.091 -7.779 1.00 0.00 C ATOM 0 H LEU A 91 9.838 0.026 -5.007 1.00 0.00 H new ATOM 0 HA LEU A 91 8.712 -2.417 -6.236 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.102 0.405 -5.998 1.00 0.00 H new ATOM 0 HB3 LEU A 91 8.349 0.060 -7.698 1.00 0.00 H new ATOM 0 HG LEU A 91 6.330 -1.200 -5.855 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.674 -0.075 -7.416 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.753 1.100 -6.626 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.042 0.622 -8.316 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.351 -2.362 -7.799 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.736 -1.842 -8.788 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.990 -2.932 -7.404 1.00 0.00 H new ATOM 1412 N VAL A 92 10.489 -2.843 -7.966 1.00 0.00 N ATOM 1413 CA VAL A 92 11.652 -3.154 -8.855 1.00 0.00 C ATOM 1414 C VAL A 92 11.114 -3.523 -10.281 1.00 0.00 C ATOM 1415 O VAL A 92 10.512 -4.586 -10.465 1.00 0.00 O ATOM 1416 CB VAL A 92 12.570 -4.255 -8.208 1.00 0.00 C ATOM 1417 CG1 VAL A 92 13.873 -4.462 -9.011 1.00 0.00 C ATOM 1418 CG2 VAL A 92 13.001 -3.981 -6.744 1.00 0.00 C ATOM 0 H VAL A 92 9.913 -3.654 -7.741 1.00 0.00 H new ATOM 0 HA VAL A 92 12.295 -2.282 -8.970 1.00 0.00 H new ATOM 0 HB VAL A 92 11.931 -5.138 -8.223 1.00 0.00 H new ATOM 0 HG11 VAL A 92 14.478 -5.231 -8.530 1.00 0.00 H new ATOM 0 HG12 VAL A 92 13.629 -4.775 -10.026 1.00 0.00 H new ATOM 0 HG13 VAL A 92 14.433 -3.527 -9.044 1.00 0.00 H new ATOM 0 HG21 VAL A 92 13.630 -4.798 -6.391 1.00 0.00 H new ATOM 0 HG22 VAL A 92 13.560 -3.046 -6.698 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.116 -3.906 -6.112 1.00 0.00 H new ATOM 1428 N HIS A 93 11.337 -2.649 -11.285 1.00 0.00 N ATOM 1429 CA HIS A 93 10.948 -2.910 -12.709 1.00 0.00 C ATOM 1430 C HIS A 93 12.138 -3.529 -13.510 1.00 0.00 C ATOM 1431 O HIS A 93 13.025 -2.805 -13.967 1.00 0.00 O ATOM 1432 CB HIS A 93 10.441 -1.560 -13.296 1.00 0.00 C ATOM 1433 CG HIS A 93 9.965 -1.476 -14.756 1.00 0.00 C ATOM 1434 ND1 HIS A 93 9.631 -2.546 -15.579 1.00 0.00 N ATOM 1435 CD2 HIS A 93 9.741 -0.258 -15.428 1.00 0.00 C ATOM 1436 CE1 HIS A 93 9.218 -1.856 -16.690 1.00 0.00 C ATOM 1437 NE2 HIS A 93 9.257 -0.488 -16.701 1.00 0.00 N ATOM 0 H HIS A 93 11.788 -1.745 -11.145 1.00 0.00 H new ATOM 0 HA HIS A 93 10.150 -3.650 -12.778 1.00 0.00 H new ATOM 0 HB2 HIS A 93 9.615 -1.226 -12.668 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.246 -0.835 -13.177 1.00 0.00 H new ATOM 0 HD2 HIS A 93 9.923 0.720 -15.006 1.00 0.00 H new ATOM 0 HE1 HIS A 93 8.862 -2.393 -17.557 1.00 0.00 H new ATOM 0 HE2 HIS A 93 9.002 0.171 -17.437 1.00 0.00 H new ATOM 1445 N ILE A 94 12.138 -4.861 -13.678 1.00 0.00 N ATOM 1446 CA ILE A 94 13.255 -5.628 -14.315 1.00 0.00 C ATOM 1447 C ILE A 94 12.990 -5.731 -15.852 1.00 0.00 C ATOM 1448 O ILE A 94 12.111 -6.491 -16.260 1.00 0.00 O ATOM 1449 CB ILE A 94 13.378 -7.047 -13.632 1.00 0.00 C ATOM 1450 CG1 ILE A 94 13.722 -6.990 -12.113 1.00 0.00 C ATOM 1451 CG2 ILE A 94 14.400 -7.967 -14.351 1.00 0.00 C ATOM 1452 CD1 ILE A 94 13.425 -8.271 -11.313 1.00 0.00 C ATOM 0 H ILE A 94 11.364 -5.453 -13.378 1.00 0.00 H new ATOM 0 HA ILE A 94 14.206 -5.115 -14.173 1.00 0.00 H new ATOM 0 HB ILE A 94 12.380 -7.473 -13.730 1.00 0.00 H new ATOM 0 HG12 ILE A 94 14.781 -6.755 -12.008 1.00 0.00 H new ATOM 0 HG13 ILE A 94 13.167 -6.166 -11.664 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.445 -8.929 -13.841 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.089 -8.119 -15.385 1.00 0.00 H new ATOM 0 HG23 ILE A 94 15.385 -7.500 -14.333 1.00 0.00 H new ATOM 0 HD11 ILE A 94 13.702 -8.121 -10.270 1.00 0.00 H new ATOM 0 HD12 ILE A 94 12.362 -8.501 -11.377 1.00 0.00 H new ATOM 0 HD13 ILE A 94 14.001 -9.099 -11.726 1.00 0.00 H new ATOM 1464 N GLN A 95 13.766 -5.028 -16.695 1.00 0.00 N ATOM 1465 CA GLN A 95 13.551 -5.008 -18.171 1.00 0.00 C ATOM 1466 C GLN A 95 14.635 -5.874 -18.885 1.00 0.00 C ATOM 1467 O GLN A 95 15.828 -5.568 -18.797 1.00 0.00 O ATOM 1468 CB GLN A 95 13.580 -3.530 -18.649 1.00 0.00 C ATOM 1469 CG GLN A 95 12.397 -2.657 -18.146 1.00 0.00 C ATOM 1470 CD GLN A 95 12.341 -1.209 -18.636 1.00 0.00 C ATOM 1471 OE1 GLN A 95 13.308 -0.395 -18.317 1.00 0.00 O flip ATOM 1472 NE2 GLN A 95 11.398 -0.761 -19.278 1.00 0.00 N flip ATOM 0 H GLN A 95 14.555 -4.460 -16.387 1.00 0.00 H new ATOM 0 HA GLN A 95 12.583 -5.440 -18.424 1.00 0.00 H new ATOM 0 HB2 GLN A 95 14.514 -3.075 -18.320 1.00 0.00 H new ATOM 0 HB3 GLN A 95 13.585 -3.516 -19.739 1.00 0.00 H new ATOM 0 HG2 GLN A 95 11.468 -3.148 -18.435 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.425 -2.644 -17.056 1.00 0.00 H new ATOM 0 HE21 GLN A 95 10.626 -1.372 -19.543 1.00 0.00 H new ATOM 0 HE22 GLN A 95 11.386 0.223 -19.547 1.00 0.00 H new ATOM 1481 N LYS A 96 14.215 -6.939 -19.593 1.00 0.00 N ATOM 1482 CA LYS A 96 15.139 -7.941 -20.209 1.00 0.00 C ATOM 1483 C LYS A 96 15.038 -7.919 -21.769 1.00 0.00 C ATOM 1484 O LYS A 96 13.961 -8.115 -22.340 1.00 0.00 O ATOM 1485 CB LYS A 96 14.775 -9.342 -19.638 1.00 0.00 C ATOM 1486 CG LYS A 96 15.239 -9.578 -18.181 1.00 0.00 C ATOM 1487 CD LYS A 96 14.798 -10.916 -17.547 1.00 0.00 C ATOM 1488 CE LYS A 96 13.298 -11.059 -17.206 1.00 0.00 C ATOM 1489 NZ LYS A 96 12.509 -11.571 -18.346 1.00 0.00 N ATOM 0 H LYS A 96 13.229 -7.139 -19.761 1.00 0.00 H new ATOM 0 HA LYS A 96 16.172 -7.697 -19.962 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.694 -9.472 -19.688 1.00 0.00 H new ATOM 0 HB3 LYS A 96 15.217 -10.107 -20.276 1.00 0.00 H new ATOM 0 HG2 LYS A 96 16.327 -9.525 -18.152 1.00 0.00 H new ATOM 0 HG3 LYS A 96 14.863 -8.763 -17.563 1.00 0.00 H new ATOM 0 HD2 LYS A 96 15.071 -11.722 -18.228 1.00 0.00 H new ATOM 0 HD3 LYS A 96 15.371 -11.065 -16.632 1.00 0.00 H new ATOM 0 HE2 LYS A 96 13.184 -11.732 -16.357 1.00 0.00 H new ATOM 0 HE3 LYS A 96 12.903 -10.090 -16.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 11.697 -12.115 -17.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.167 -10.773 -18.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.107 -12.187 -18.933 1.00 0.00 H new ATOM 1502 N TRP A 97 16.160 -7.682 -22.471 1.00 0.00 N ATOM 1503 CA TRP A 97 16.179 -7.565 -23.961 1.00 0.00 C ATOM 1504 C TRP A 97 17.564 -8.007 -24.526 1.00 0.00 C ATOM 1505 O TRP A 97 18.598 -7.506 -24.077 1.00 0.00 O ATOM 1506 CB TRP A 97 15.761 -6.132 -24.429 1.00 0.00 C ATOM 1507 CG TRP A 97 16.794 -4.998 -24.295 1.00 0.00 C ATOM 1508 CD1 TRP A 97 17.535 -4.456 -25.369 1.00 0.00 C ATOM 1509 CD2 TRP A 97 17.298 -4.394 -23.154 1.00 0.00 C ATOM 1510 NE1 TRP A 97 18.483 -3.513 -24.928 1.00 0.00 N ATOM 1511 CE2 TRP A 97 18.335 -3.513 -23.553 1.00 0.00 C ATOM 1512 CE3 TRP A 97 16.956 -4.521 -21.781 1.00 0.00 C ATOM 1513 CZ2 TRP A 97 19.040 -2.765 -22.588 1.00 0.00 C ATOM 1514 CZ3 TRP A 97 17.685 -3.792 -20.841 1.00 0.00 C ATOM 1515 CH2 TRP A 97 18.723 -2.944 -21.238 1.00 0.00 C ATOM 0 H TRP A 97 17.076 -7.565 -22.038 1.00 0.00 H new ATOM 0 HA TRP A 97 15.433 -8.245 -24.372 1.00 0.00 H new ATOM 0 HB2 TRP A 97 15.468 -6.195 -25.477 1.00 0.00 H new ATOM 0 HB3 TRP A 97 14.873 -5.843 -23.867 1.00 0.00 H new ATOM 0 HD1 TRP A 97 17.392 -4.732 -26.403 1.00 0.00 H new ATOM 0 HE1 TRP A 97 19.128 -2.959 -25.491 1.00 0.00 H new ATOM 0 HE3 TRP A 97 16.149 -5.168 -21.471 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 19.809 -2.068 -22.886 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 17.444 -3.884 -19.792 1.00 0.00 H new ATOM 0 HH2 TRP A 97 19.292 -2.416 -20.487 1.00 0.00 H new ATOM 1526 N ASP A 98 17.613 -8.898 -25.538 1.00 0.00 N ATOM 1527 CA ASP A 98 18.887 -9.229 -26.275 1.00 0.00 C ATOM 1528 C ASP A 98 20.098 -9.791 -25.425 1.00 0.00 C ATOM 1529 O ASP A 98 21.258 -9.598 -25.799 1.00 0.00 O ATOM 1530 CB ASP A 98 19.300 -8.008 -27.167 1.00 0.00 C ATOM 1531 CG ASP A 98 18.338 -7.635 -28.295 1.00 0.00 C ATOM 1532 OD1 ASP A 98 17.402 -6.853 -28.150 1.00 0.00 O ATOM 1533 OD2 ASP A 98 18.640 -8.273 -29.464 1.00 0.00 O ATOM 0 H ASP A 98 16.797 -9.409 -25.875 1.00 0.00 H new ATOM 0 HA ASP A 98 18.639 -10.095 -26.889 1.00 0.00 H new ATOM 0 HB2 ASP A 98 19.423 -7.139 -26.521 1.00 0.00 H new ATOM 0 HB3 ASP A 98 20.275 -8.219 -27.605 1.00 0.00 H new ATOM 1539 N GLY A 99 19.854 -10.468 -24.284 1.00 0.00 N ATOM 1540 CA GLY A 99 20.916 -10.693 -23.252 1.00 0.00 C ATOM 1541 C GLY A 99 21.175 -9.590 -22.183 1.00 0.00 C ATOM 1542 O GLY A 99 21.785 -9.888 -21.156 1.00 0.00 O ATOM 0 H GLY A 99 18.947 -10.868 -24.045 1.00 0.00 H new ATOM 0 HA2 GLY A 99 20.671 -11.614 -22.722 1.00 0.00 H new ATOM 0 HA3 GLY A 99 21.854 -10.868 -23.778 1.00 0.00 H new ATOM 1546 N LYS A 100 20.752 -8.337 -22.412 1.00 0.00 N ATOM 1547 CA LYS A 100 20.967 -7.196 -21.486 1.00 0.00 C ATOM 1548 C LYS A 100 19.810 -7.045 -20.440 1.00 0.00 C ATOM 1549 O LYS A 100 18.635 -7.302 -20.736 1.00 0.00 O ATOM 1550 CB LYS A 100 21.053 -5.891 -22.326 1.00 0.00 C ATOM 1551 CG LYS A 100 22.151 -5.757 -23.403 1.00 0.00 C ATOM 1552 CD LYS A 100 21.586 -5.794 -24.832 1.00 0.00 C ATOM 1553 CE LYS A 100 22.647 -5.360 -25.842 1.00 0.00 C ATOM 1554 NZ LYS A 100 22.199 -5.640 -27.220 1.00 0.00 N ATOM 0 H LYS A 100 20.243 -8.076 -23.256 1.00 0.00 H new ATOM 0 HA LYS A 100 21.888 -7.383 -20.934 1.00 0.00 H new ATOM 0 HB2 LYS A 100 20.091 -5.756 -22.820 1.00 0.00 H new ATOM 0 HB3 LYS A 100 21.174 -5.061 -21.630 1.00 0.00 H new ATOM 0 HG2 LYS A 100 22.689 -4.821 -23.253 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.874 -6.563 -23.281 1.00 0.00 H new ATOM 0 HD2 LYS A 100 21.243 -6.802 -25.067 1.00 0.00 H new ATOM 0 HD3 LYS A 100 20.719 -5.138 -24.903 1.00 0.00 H new ATOM 0 HE2 LYS A 100 22.850 -4.295 -25.729 1.00 0.00 H new ATOM 0 HE3 LYS A 100 23.581 -5.885 -25.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 22.933 -5.338 -27.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 22.028 -6.660 -27.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 21.319 -5.119 -27.412 1.00 0.00 H new ATOM 1567 N GLU A 101 20.148 -6.561 -19.229 1.00 0.00 N ATOM 1568 CA GLU A 101 19.148 -6.250 -18.170 1.00 0.00 C ATOM 1569 C GLU A 101 19.394 -4.836 -17.548 1.00 0.00 C ATOM 1570 O GLU A 101 20.527 -4.441 -17.253 1.00 0.00 O ATOM 1571 CB GLU A 101 19.191 -7.369 -17.093 1.00 0.00 C ATOM 1572 CG GLU A 101 18.025 -7.310 -16.071 1.00 0.00 C ATOM 1573 CD GLU A 101 18.108 -8.348 -14.960 1.00 0.00 C ATOM 1574 OE1 GLU A 101 18.433 -8.084 -13.806 1.00 0.00 O ATOM 1575 OE2 GLU A 101 17.756 -9.593 -15.384 1.00 0.00 O ATOM 0 H GLU A 101 21.111 -6.373 -18.951 1.00 0.00 H new ATOM 0 HA GLU A 101 18.152 -6.221 -18.612 1.00 0.00 H new ATOM 0 HB2 GLU A 101 19.175 -8.338 -17.591 1.00 0.00 H new ATOM 0 HB3 GLU A 101 20.136 -7.303 -16.554 1.00 0.00 H new ATOM 0 HG2 GLU A 101 18.001 -6.317 -15.622 1.00 0.00 H new ATOM 0 HG3 GLU A 101 17.084 -7.441 -16.605 1.00 0.00 H new ATOM 1583 N THR A 102 18.298 -4.111 -17.263 1.00 0.00 N ATOM 1584 CA THR A 102 18.301 -2.990 -16.279 1.00 0.00 C ATOM 1585 C THR A 102 17.117 -3.177 -15.274 1.00 0.00 C ATOM 1586 O THR A 102 16.029 -3.622 -15.663 1.00 0.00 O ATOM 1587 CB THR A 102 18.340 -1.604 -17.001 1.00 0.00 C ATOM 1588 OG1 THR A 102 18.714 -0.564 -16.094 1.00 0.00 O ATOM 1589 CG2 THR A 102 17.033 -1.164 -17.671 1.00 0.00 C ATOM 0 H THR A 102 17.390 -4.275 -17.697 1.00 0.00 H new ATOM 0 HA THR A 102 19.214 -3.009 -15.683 1.00 0.00 H new ATOM 0 HB THR A 102 19.077 -1.757 -17.790 1.00 0.00 H new ATOM 0 HG1 THR A 102 18.926 -0.953 -15.220 1.00 0.00 H new ATOM 0 HG21 THR A 102 17.174 -0.190 -18.140 1.00 0.00 H new ATOM 0 HG22 THR A 102 16.749 -1.894 -18.429 1.00 0.00 H new ATOM 0 HG23 THR A 102 16.245 -1.094 -16.921 1.00 0.00 H new ATOM 1597 N ASN A 103 17.310 -2.828 -13.988 1.00 0.00 N ATOM 1598 CA ASN A 103 16.210 -2.835 -12.982 1.00 0.00 C ATOM 1599 C ASN A 103 16.067 -1.441 -12.293 1.00 0.00 C ATOM 1600 O ASN A 103 17.060 -0.820 -11.894 1.00 0.00 O ATOM 1601 CB ASN A 103 16.271 -4.074 -12.047 1.00 0.00 C ATOM 1602 CG ASN A 103 17.397 -4.171 -11.018 1.00 0.00 C ATOM 1603 OD1 ASN A 103 17.383 -3.515 -9.985 1.00 0.00 O ATOM 1604 ND2 ASN A 103 18.377 -5.016 -11.235 1.00 0.00 N ATOM 0 H ASN A 103 18.213 -2.537 -13.613 1.00 0.00 H new ATOM 0 HA ASN A 103 15.258 -2.974 -13.494 1.00 0.00 H new ATOM 0 HB2 ASN A 103 15.326 -4.125 -11.506 1.00 0.00 H new ATOM 0 HB3 ASN A 103 16.325 -4.961 -12.679 1.00 0.00 H new ATOM 0 HD21 ASN A 103 19.121 -5.123 -10.545 1.00 0.00 H new ATOM 0 HD22 ASN A 103 18.395 -5.566 -12.094 1.00 0.00 H new ATOM 1611 N PHE A 104 14.823 -0.931 -12.194 1.00 0.00 N ATOM 1612 CA PHE A 104 14.550 0.407 -11.597 1.00 0.00 C ATOM 1613 C PHE A 104 14.046 0.194 -10.140 1.00 0.00 C ATOM 1614 O PHE A 104 12.884 -0.178 -9.943 1.00 0.00 O ATOM 1615 CB PHE A 104 13.487 1.218 -12.399 1.00 0.00 C ATOM 1616 CG PHE A 104 13.651 1.637 -13.875 1.00 0.00 C ATOM 1617 CD1 PHE A 104 14.680 1.209 -14.724 1.00 0.00 C ATOM 1618 CD2 PHE A 104 12.664 2.493 -14.383 1.00 0.00 C ATOM 1619 CE1 PHE A 104 14.714 1.627 -16.052 1.00 0.00 C ATOM 1620 CE2 PHE A 104 12.704 2.914 -15.709 1.00 0.00 C ATOM 1621 CZ PHE A 104 13.731 2.483 -16.541 1.00 0.00 C ATOM 0 H PHE A 104 13.988 -1.419 -12.517 1.00 0.00 H new ATOM 0 HA PHE A 104 15.474 0.985 -11.621 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.563 0.642 -12.348 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.321 2.138 -11.839 1.00 0.00 H new ATOM 0 HD1 PHE A 104 15.450 0.552 -14.347 1.00 0.00 H new ATOM 0 HD2 PHE A 104 11.865 2.829 -13.739 1.00 0.00 H new ATOM 0 HE1 PHE A 104 15.505 1.286 -16.704 1.00 0.00 H new ATOM 0 HE2 PHE A 104 11.939 3.574 -16.091 1.00 0.00 H new ATOM 0 HZ PHE A 104 13.766 2.813 -17.569 1.00 0.00 H new ATOM 1631 N VAL A 105 14.896 0.435 -9.130 1.00 0.00 N ATOM 1632 CA VAL A 105 14.533 0.214 -7.697 1.00 0.00 C ATOM 1633 C VAL A 105 13.871 1.521 -7.147 1.00 0.00 C ATOM 1634 O VAL A 105 14.559 2.479 -6.783 1.00 0.00 O ATOM 1635 CB VAL A 105 15.783 -0.270 -6.880 1.00 0.00 C ATOM 1636 CG1 VAL A 105 15.498 -0.473 -5.373 1.00 0.00 C ATOM 1637 CG2 VAL A 105 16.409 -1.586 -7.399 1.00 0.00 C ATOM 0 H VAL A 105 15.845 0.784 -9.266 1.00 0.00 H new ATOM 0 HA VAL A 105 13.801 -0.587 -7.594 1.00 0.00 H new ATOM 0 HB VAL A 105 16.485 0.551 -7.024 1.00 0.00 H new ATOM 0 HG11 VAL A 105 16.407 -0.808 -4.873 1.00 0.00 H new ATOM 0 HG12 VAL A 105 15.168 0.469 -4.935 1.00 0.00 H new ATOM 0 HG13 VAL A 105 14.718 -1.224 -5.248 1.00 0.00 H new ATOM 0 HG21 VAL A 105 17.266 -1.850 -6.780 1.00 0.00 H new ATOM 0 HG22 VAL A 105 15.668 -2.384 -7.353 1.00 0.00 H new ATOM 0 HG23 VAL A 105 16.734 -1.452 -8.431 1.00 0.00 H new ATOM 1647 N ARG A 106 12.531 1.547 -7.099 1.00 0.00 N ATOM 1648 CA ARG A 106 11.741 2.688 -6.557 1.00 0.00 C ATOM 1649 C ARG A 106 11.509 2.508 -5.027 1.00 0.00 C ATOM 1650 O ARG A 106 10.796 1.586 -4.625 1.00 0.00 O ATOM 1651 CB ARG A 106 10.382 2.715 -7.315 1.00 0.00 C ATOM 1652 CG ARG A 106 10.427 3.215 -8.782 1.00 0.00 C ATOM 1653 CD ARG A 106 9.037 3.317 -9.446 1.00 0.00 C ATOM 1654 NE ARG A 106 8.398 1.984 -9.643 1.00 0.00 N ATOM 1655 CZ ARG A 106 8.437 1.246 -10.750 1.00 0.00 C ATOM 1656 NH1 ARG A 106 9.018 1.628 -11.857 1.00 0.00 N ATOM 1657 NH2 ARG A 106 7.859 0.081 -10.728 1.00 0.00 N ATOM 0 H ARG A 106 11.951 0.778 -7.434 1.00 0.00 H new ATOM 0 HA ARG A 106 12.276 3.627 -6.700 1.00 0.00 H new ATOM 0 HB2 ARG A 106 9.966 1.707 -7.309 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.691 3.348 -6.758 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.905 4.194 -8.808 1.00 0.00 H new ATOM 0 HG3 ARG A 106 11.051 2.540 -9.368 1.00 0.00 H new ATOM 0 HD2 ARG A 106 8.388 3.939 -8.830 1.00 0.00 H new ATOM 0 HD3 ARG A 106 9.134 3.815 -10.410 1.00 0.00 H new ATOM 0 HE ARG A 106 7.881 1.600 -8.852 1.00 0.00 H new ATOM 0 HH11 ARG A 106 9.476 2.538 -11.905 1.00 0.00 H new ATOM 0 HH12 ARG A 106 9.014 1.016 -12.673 1.00 0.00 H new ATOM 0 HH21 ARG A 106 7.394 -0.242 -9.879 1.00 0.00 H new ATOM 0 HH22 ARG A 106 7.870 -0.510 -11.559 1.00 0.00 H new ATOM 1671 N GLU A 107 12.075 3.376 -4.174 1.00 0.00 N ATOM 1672 CA GLU A 107 11.966 3.240 -2.687 1.00 0.00 C ATOM 1673 C GLU A 107 11.450 4.546 -1.997 1.00 0.00 C ATOM 1674 O GLU A 107 11.944 5.643 -2.275 1.00 0.00 O ATOM 1675 CB GLU A 107 13.307 2.702 -2.111 1.00 0.00 C ATOM 1676 CG GLU A 107 14.569 3.587 -2.282 1.00 0.00 C ATOM 1677 CD GLU A 107 15.847 2.924 -1.779 1.00 0.00 C ATOM 1678 OE1 GLU A 107 16.473 2.078 -2.412 1.00 0.00 O ATOM 1679 OE2 GLU A 107 16.216 3.373 -0.547 1.00 0.00 O ATOM 0 H GLU A 107 12.617 4.186 -4.475 1.00 0.00 H new ATOM 0 HA GLU A 107 11.197 2.503 -2.456 1.00 0.00 H new ATOM 0 HB2 GLU A 107 13.166 2.520 -1.046 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.508 1.736 -2.575 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.689 3.836 -3.336 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.421 4.525 -1.747 1.00 0.00 H new ATOM 1687 N ILE A 108 10.467 4.430 -1.079 1.00 0.00 N ATOM 1688 CA ILE A 108 9.871 5.607 -0.368 1.00 0.00 C ATOM 1689 C ILE A 108 10.801 6.056 0.812 1.00 0.00 C ATOM 1690 O ILE A 108 10.837 5.418 1.869 1.00 0.00 O ATOM 1691 CB ILE A 108 8.390 5.326 0.094 1.00 0.00 C ATOM 1692 CG1 ILE A 108 7.401 4.901 -1.032 1.00 0.00 C ATOM 1693 CG2 ILE A 108 7.750 6.499 0.888 1.00 0.00 C ATOM 1694 CD1 ILE A 108 7.196 5.897 -2.188 1.00 0.00 C ATOM 0 H ILE A 108 10.061 3.535 -0.805 1.00 0.00 H new ATOM 0 HA ILE A 108 9.808 6.439 -1.070 1.00 0.00 H new ATOM 0 HB ILE A 108 8.530 4.467 0.751 1.00 0.00 H new ATOM 0 HG12 ILE A 108 7.751 3.959 -1.454 1.00 0.00 H new ATOM 0 HG13 ILE A 108 6.431 4.705 -0.576 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.732 6.233 1.172 1.00 0.00 H new ATOM 0 HG22 ILE A 108 8.338 6.695 1.785 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.731 7.393 0.264 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.486 5.483 -2.904 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.808 6.836 -1.794 1.00 0.00 H new ATOM 0 HD13 ILE A 108 8.149 6.078 -2.686 1.00 0.00 H new ATOM 1706 N LYS A 109 11.500 7.190 0.640 1.00 0.00 N ATOM 1707 CA LYS A 109 12.235 7.870 1.739 1.00 0.00 C ATOM 1708 C LYS A 109 11.414 9.111 2.212 1.00 0.00 C ATOM 1709 O LYS A 109 11.454 10.172 1.583 1.00 0.00 O ATOM 1710 CB LYS A 109 13.663 8.201 1.218 1.00 0.00 C ATOM 1711 CG LYS A 109 14.613 8.897 2.223 1.00 0.00 C ATOM 1712 CD LYS A 109 15.017 8.030 3.434 1.00 0.00 C ATOM 1713 CE LYS A 109 15.883 8.808 4.434 1.00 0.00 C ATOM 1714 NZ LYS A 109 16.257 7.935 5.564 1.00 0.00 N ATOM 0 H LYS A 109 11.576 7.666 -0.259 1.00 0.00 H new ATOM 0 HA LYS A 109 12.352 7.241 2.621 1.00 0.00 H new ATOM 0 HB2 LYS A 109 14.132 7.273 0.890 1.00 0.00 H new ATOM 0 HB3 LYS A 109 13.568 8.838 0.339 1.00 0.00 H new ATOM 0 HG2 LYS A 109 15.516 9.204 1.696 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.132 9.805 2.587 1.00 0.00 H new ATOM 0 HD2 LYS A 109 14.120 7.668 3.936 1.00 0.00 H new ATOM 0 HD3 LYS A 109 15.563 7.153 3.086 1.00 0.00 H new ATOM 0 HE2 LYS A 109 16.780 9.180 3.939 1.00 0.00 H new ATOM 0 HE3 LYS A 109 15.338 9.678 4.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 16.843 8.470 6.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 15.397 7.601 6.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 16.795 7.119 5.209 1.00 0.00 H new ATOM 1727 N ASP A 110 10.645 8.964 3.313 1.00 0.00 N ATOM 1728 CA ASP A 110 9.777 10.046 3.886 1.00 0.00 C ATOM 1729 C ASP A 110 8.796 10.751 2.873 1.00 0.00 C ATOM 1730 O ASP A 110 8.895 11.954 2.616 1.00 0.00 O ATOM 1731 CB ASP A 110 10.681 11.004 4.717 1.00 0.00 C ATOM 1732 CG ASP A 110 9.931 11.960 5.644 1.00 0.00 C ATOM 1733 OD1 ASP A 110 9.094 11.597 6.466 1.00 0.00 O ATOM 1734 OD2 ASP A 110 10.294 13.258 5.459 1.00 0.00 O ATOM 0 H ASP A 110 10.600 8.092 3.840 1.00 0.00 H new ATOM 0 HA ASP A 110 9.049 9.583 4.552 1.00 0.00 H new ATOM 0 HB2 ASP A 110 11.366 10.404 5.316 1.00 0.00 H new ATOM 0 HB3 ASP A 110 11.290 11.592 4.030 1.00 0.00 H new ATOM 1740 N GLY A 111 7.875 9.980 2.267 1.00 0.00 N ATOM 1741 CA GLY A 111 7.039 10.480 1.132 1.00 0.00 C ATOM 1742 C GLY A 111 7.667 10.653 -0.280 1.00 0.00 C ATOM 1743 O GLY A 111 6.950 11.079 -1.187 1.00 0.00 O ATOM 0 H GLY A 111 7.683 9.014 2.533 1.00 0.00 H new ATOM 0 HA2 GLY A 111 6.193 9.801 1.029 1.00 0.00 H new ATOM 0 HA3 GLY A 111 6.636 11.449 1.428 1.00 0.00 H new ATOM 1747 N LYS A 112 8.963 10.350 -0.478 1.00 0.00 N ATOM 1748 CA LYS A 112 9.694 10.656 -1.739 1.00 0.00 C ATOM 1749 C LYS A 112 10.198 9.332 -2.389 1.00 0.00 C ATOM 1750 O LYS A 112 10.950 8.566 -1.776 1.00 0.00 O ATOM 1751 CB LYS A 112 10.879 11.621 -1.460 1.00 0.00 C ATOM 1752 CG LYS A 112 10.512 12.978 -0.802 1.00 0.00 C ATOM 1753 CD LYS A 112 11.696 13.954 -0.645 1.00 0.00 C ATOM 1754 CE LYS A 112 12.672 13.562 0.477 1.00 0.00 C ATOM 1755 NZ LYS A 112 13.744 14.571 0.592 1.00 0.00 N ATOM 0 H LYS A 112 9.539 9.887 0.225 1.00 0.00 H new ATOM 0 HA LYS A 112 9.015 11.151 -2.434 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.594 11.109 -0.816 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.387 11.823 -2.403 1.00 0.00 H new ATOM 0 HG2 LYS A 112 9.738 13.459 -1.399 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.083 12.786 0.181 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.241 14.006 -1.588 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.309 14.953 -0.446 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.137 13.479 1.423 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.104 12.583 0.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.398 14.297 1.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 14.263 14.630 -0.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.326 15.498 0.812 1.00 0.00 H new ATOM 1768 N MET A 113 9.800 9.068 -3.642 1.00 0.00 N ATOM 1769 CA MET A 113 10.203 7.844 -4.380 1.00 0.00 C ATOM 1770 C MET A 113 11.615 8.019 -5.018 1.00 0.00 C ATOM 1771 O MET A 113 11.795 8.697 -6.034 1.00 0.00 O ATOM 1772 CB MET A 113 9.084 7.538 -5.407 1.00 0.00 C ATOM 1773 CG MET A 113 9.232 6.212 -6.172 1.00 0.00 C ATOM 1774 SD MET A 113 7.800 5.982 -7.245 1.00 0.00 S ATOM 1775 CE MET A 113 8.310 6.908 -8.706 1.00 0.00 C ATOM 0 H MET A 113 9.193 9.688 -4.177 1.00 0.00 H new ATOM 0 HA MET A 113 10.305 6.988 -3.714 1.00 0.00 H new ATOM 0 HB2 MET A 113 8.127 7.531 -4.885 1.00 0.00 H new ATOM 0 HB3 MET A 113 9.046 8.352 -6.130 1.00 0.00 H new ATOM 0 HG2 MET A 113 10.147 6.220 -6.764 1.00 0.00 H new ATOM 0 HG3 MET A 113 9.313 5.381 -5.471 1.00 0.00 H new ATOM 0 HE1 MET A 113 7.525 6.858 -9.461 1.00 0.00 H new ATOM 0 HE2 MET A 113 8.486 7.949 -8.434 1.00 0.00 H new ATOM 0 HE3 MET A 113 9.227 6.478 -9.108 1.00 0.00 H new ATOM 1785 N VAL A 114 12.629 7.384 -4.416 1.00 0.00 N ATOM 1786 CA VAL A 114 14.024 7.422 -4.935 1.00 0.00 C ATOM 1787 C VAL A 114 14.155 6.262 -5.972 1.00 0.00 C ATOM 1788 O VAL A 114 14.238 5.088 -5.595 1.00 0.00 O ATOM 1789 CB VAL A 114 15.063 7.368 -3.761 1.00 0.00 C ATOM 1790 CG1 VAL A 114 16.521 7.474 -4.262 1.00 0.00 C ATOM 1791 CG2 VAL A 114 14.868 8.473 -2.693 1.00 0.00 C ATOM 0 H VAL A 114 12.520 6.833 -3.565 1.00 0.00 H new ATOM 0 HA VAL A 114 14.247 8.361 -5.441 1.00 0.00 H new ATOM 0 HB VAL A 114 14.878 6.396 -3.305 1.00 0.00 H new ATOM 0 HG11 VAL A 114 17.202 7.432 -3.412 1.00 0.00 H new ATOM 0 HG12 VAL A 114 16.734 6.647 -4.939 1.00 0.00 H new ATOM 0 HG13 VAL A 114 16.657 8.418 -4.789 1.00 0.00 H new ATOM 0 HG21 VAL A 114 15.625 8.366 -1.916 1.00 0.00 H new ATOM 0 HG22 VAL A 114 14.964 9.453 -3.161 1.00 0.00 H new ATOM 0 HG23 VAL A 114 13.877 8.379 -2.249 1.00 0.00 H new ATOM 1801 N MET A 115 14.140 6.595 -7.276 1.00 0.00 N ATOM 1802 CA MET A 115 14.310 5.598 -8.363 1.00 0.00 C ATOM 1803 C MET A 115 15.829 5.376 -8.629 1.00 0.00 C ATOM 1804 O MET A 115 16.512 6.249 -9.175 1.00 0.00 O ATOM 1805 CB MET A 115 13.534 6.092 -9.614 1.00 0.00 C ATOM 1806 CG MET A 115 13.378 5.033 -10.728 1.00 0.00 C ATOM 1807 SD MET A 115 12.760 5.795 -12.244 1.00 0.00 S ATOM 1808 CE MET A 115 10.981 5.645 -12.017 1.00 0.00 C ATOM 0 H MET A 115 14.012 7.550 -7.609 1.00 0.00 H new ATOM 0 HA MET A 115 13.897 4.629 -8.084 1.00 0.00 H new ATOM 0 HB2 MET A 115 12.543 6.424 -9.304 1.00 0.00 H new ATOM 0 HB3 MET A 115 14.047 6.961 -10.025 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.338 4.555 -10.920 1.00 0.00 H new ATOM 0 HG3 MET A 115 12.692 4.251 -10.401 1.00 0.00 H new ATOM 0 HE1 MET A 115 10.467 6.090 -12.869 1.00 0.00 H new ATOM 0 HE2 MET A 115 10.712 4.592 -11.940 1.00 0.00 H new ATOM 0 HE3 MET A 115 10.686 6.162 -11.104 1.00 0.00 H new ATOM 1818 N THR A 116 16.347 4.206 -8.229 1.00 0.00 N ATOM 1819 CA THR A 116 17.759 3.811 -8.501 1.00 0.00 C ATOM 1820 C THR A 116 17.781 2.869 -9.748 1.00 0.00 C ATOM 1821 O THR A 116 17.450 1.681 -9.665 1.00 0.00 O ATOM 1822 CB THR A 116 18.381 3.212 -7.206 1.00 0.00 C ATOM 1823 OG1 THR A 116 18.295 4.159 -6.144 1.00 0.00 O ATOM 1824 CG2 THR A 116 19.865 2.846 -7.331 1.00 0.00 C ATOM 0 H THR A 116 15.815 3.505 -7.712 1.00 0.00 H new ATOM 0 HA THR A 116 18.388 4.664 -8.757 1.00 0.00 H new ATOM 0 HB THR A 116 17.811 2.302 -7.017 1.00 0.00 H new ATOM 0 HG1 THR A 116 18.686 3.776 -5.331 1.00 0.00 H new ATOM 0 HG21 THR A 116 20.220 2.436 -6.385 1.00 0.00 H new ATOM 0 HG22 THR A 116 19.991 2.103 -8.119 1.00 0.00 H new ATOM 0 HG23 THR A 116 20.440 3.738 -7.578 1.00 0.00 H new ATOM 1832 N LEU A 117 18.147 3.425 -10.915 1.00 0.00 N ATOM 1833 CA LEU A 117 18.152 2.693 -12.208 1.00 0.00 C ATOM 1834 C LEU A 117 19.565 2.076 -12.436 1.00 0.00 C ATOM 1835 O LEU A 117 20.488 2.764 -12.885 1.00 0.00 O ATOM 1836 CB LEU A 117 17.768 3.602 -13.416 1.00 0.00 C ATOM 1837 CG LEU A 117 16.422 4.372 -13.456 1.00 0.00 C ATOM 1838 CD1 LEU A 117 16.433 5.632 -12.576 1.00 0.00 C ATOM 1839 CD2 LEU A 117 16.139 4.824 -14.901 1.00 0.00 C ATOM 0 H LEU A 117 18.449 4.396 -10.996 1.00 0.00 H new ATOM 0 HA LEU A 117 17.395 1.910 -12.150 1.00 0.00 H new ATOM 0 HB2 LEU A 117 18.560 4.344 -13.519 1.00 0.00 H new ATOM 0 HB3 LEU A 117 17.801 2.975 -14.307 1.00 0.00 H new ATOM 0 HG LEU A 117 15.659 3.691 -13.081 1.00 0.00 H new ATOM 0 HD11 LEU A 117 15.466 6.131 -12.643 1.00 0.00 H new ATOM 0 HD12 LEU A 117 16.626 5.351 -11.541 1.00 0.00 H new ATOM 0 HD13 LEU A 117 17.215 6.309 -12.920 1.00 0.00 H new ATOM 0 HD21 LEU A 117 15.194 5.366 -14.934 1.00 0.00 H new ATOM 0 HD22 LEU A 117 16.943 5.476 -15.242 1.00 0.00 H new ATOM 0 HD23 LEU A 117 16.080 3.951 -15.550 1.00 0.00 H new ATOM 1851 N THR A 118 19.730 0.780 -12.134 1.00 0.00 N ATOM 1852 CA THR A 118 20.997 0.037 -12.398 1.00 0.00 C ATOM 1853 C THR A 118 20.963 -0.604 -13.820 1.00 0.00 C ATOM 1854 O THR A 118 20.146 -1.483 -14.113 1.00 0.00 O ATOM 1855 CB THR A 118 21.332 -0.993 -11.266 1.00 0.00 C ATOM 1856 OG1 THR A 118 22.397 -1.863 -11.661 1.00 0.00 O ATOM 1857 CG2 THR A 118 20.204 -1.938 -10.820 1.00 0.00 C ATOM 0 H THR A 118 19.002 0.210 -11.703 1.00 0.00 H new ATOM 0 HA THR A 118 21.820 0.752 -12.383 1.00 0.00 H new ATOM 0 HB THR A 118 21.570 -0.330 -10.435 1.00 0.00 H new ATOM 0 HG1 THR A 118 23.242 -1.367 -11.660 1.00 0.00 H new ATOM 0 HG21 THR A 118 20.571 -2.597 -10.033 1.00 0.00 H new ATOM 0 HG22 THR A 118 19.367 -1.352 -10.441 1.00 0.00 H new ATOM 0 HG23 THR A 118 19.874 -2.536 -11.669 1.00 0.00 H new ATOM 1865 N PHE A 119 21.882 -0.191 -14.705 1.00 0.00 N ATOM 1866 CA PHE A 119 22.328 -1.031 -15.852 1.00 0.00 C ATOM 1867 C PHE A 119 23.702 -1.676 -15.467 1.00 0.00 C ATOM 1868 O PHE A 119 24.773 -1.206 -15.867 1.00 0.00 O ATOM 1869 CB PHE A 119 22.322 -0.119 -17.112 1.00 0.00 C ATOM 1870 CG PHE A 119 22.708 -0.799 -18.434 1.00 0.00 C ATOM 1871 CD1 PHE A 119 21.891 -1.781 -19.005 1.00 0.00 C ATOM 1872 CD2 PHE A 119 23.880 -0.420 -19.094 1.00 0.00 C ATOM 1873 CE1 PHE A 119 22.228 -2.357 -20.225 1.00 0.00 C ATOM 1874 CE2 PHE A 119 24.224 -1.009 -20.309 1.00 0.00 C ATOM 1875 CZ PHE A 119 23.389 -1.966 -20.880 1.00 0.00 C ATOM 0 H PHE A 119 22.338 0.720 -14.657 1.00 0.00 H new ATOM 0 HA PHE A 119 21.674 -1.871 -16.086 1.00 0.00 H new ATOM 0 HB2 PHE A 119 21.325 0.308 -17.223 1.00 0.00 H new ATOM 0 HB3 PHE A 119 23.007 0.711 -16.939 1.00 0.00 H new ATOM 0 HD1 PHE A 119 20.992 -2.094 -18.495 1.00 0.00 H new ATOM 0 HD2 PHE A 119 24.522 0.333 -18.660 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.587 -3.108 -20.663 1.00 0.00 H new ATOM 0 HE2 PHE A 119 25.138 -0.723 -20.808 1.00 0.00 H new ATOM 0 HZ PHE A 119 23.644 -2.405 -21.833 1.00 0.00 H new ATOM 1885 N GLY A 120 23.656 -2.708 -14.597 1.00 0.00 N ATOM 1886 CA GLY A 120 24.859 -3.237 -13.898 1.00 0.00 C ATOM 1887 C GLY A 120 25.601 -2.208 -13.011 1.00 0.00 C ATOM 1888 O GLY A 120 25.065 -1.735 -12.003 1.00 0.00 O ATOM 0 H GLY A 120 22.794 -3.198 -14.357 1.00 0.00 H new ATOM 0 HA2 GLY A 120 24.559 -4.081 -13.277 1.00 0.00 H new ATOM 0 HA3 GLY A 120 25.555 -3.621 -14.644 1.00 0.00 H new ATOM 1892 N ASP A 121 26.813 -1.828 -13.440 1.00 0.00 N ATOM 1893 CA ASP A 121 27.577 -0.710 -12.812 1.00 0.00 C ATOM 1894 C ASP A 121 27.178 0.745 -13.260 1.00 0.00 C ATOM 1895 O ASP A 121 27.667 1.689 -12.632 1.00 0.00 O ATOM 1896 CB ASP A 121 29.089 -1.007 -13.049 1.00 0.00 C ATOM 1897 CG ASP A 121 30.096 -0.420 -12.049 1.00 0.00 C ATOM 1898 OD1 ASP A 121 30.973 -1.098 -11.522 1.00 0.00 O ATOM 1899 OD2 ASP A 121 29.933 0.921 -11.830 1.00 0.00 O ATOM 0 H ASP A 121 27.297 -2.272 -14.220 1.00 0.00 H new ATOM 0 HA ASP A 121 27.324 -0.691 -11.752 1.00 0.00 H new ATOM 0 HB2 ASP A 121 29.220 -2.089 -13.062 1.00 0.00 H new ATOM 0 HB3 ASP A 121 29.351 -0.642 -14.042 1.00 0.00 H new ATOM 1905 N VAL A 122 26.340 0.970 -14.295 1.00 0.00 N ATOM 1906 CA VAL A 122 25.891 2.341 -14.695 1.00 0.00 C ATOM 1907 C VAL A 122 24.574 2.653 -13.904 1.00 0.00 C ATOM 1908 O VAL A 122 23.491 2.172 -14.256 1.00 0.00 O ATOM 1909 CB VAL A 122 25.763 2.482 -16.252 1.00 0.00 C ATOM 1910 CG1 VAL A 122 25.358 3.910 -16.688 1.00 0.00 C ATOM 1911 CG2 VAL A 122 27.057 2.137 -17.031 1.00 0.00 C ATOM 0 H VAL A 122 25.955 0.225 -14.876 1.00 0.00 H new ATOM 0 HA VAL A 122 26.636 3.092 -14.431 1.00 0.00 H new ATOM 0 HB VAL A 122 24.986 1.758 -16.499 1.00 0.00 H new ATOM 0 HG11 VAL A 122 25.284 3.951 -17.775 1.00 0.00 H new ATOM 0 HG12 VAL A 122 24.394 4.165 -16.249 1.00 0.00 H new ATOM 0 HG13 VAL A 122 26.111 4.621 -16.348 1.00 0.00 H new ATOM 0 HG21 VAL A 122 26.882 2.260 -18.100 1.00 0.00 H new ATOM 0 HG22 VAL A 122 27.860 2.803 -16.715 1.00 0.00 H new ATOM 0 HG23 VAL A 122 27.340 1.105 -16.827 1.00 0.00 H new ATOM 1921 N VAL A 123 24.697 3.420 -12.806 1.00 0.00 N ATOM 1922 CA VAL A 123 23.597 3.605 -11.811 1.00 0.00 C ATOM 1923 C VAL A 123 23.121 5.095 -11.849 1.00 0.00 C ATOM 1924 O VAL A 123 23.897 6.011 -11.552 1.00 0.00 O ATOM 1925 CB VAL A 123 24.037 3.140 -10.375 1.00 0.00 C ATOM 1926 CG1 VAL A 123 22.894 3.250 -9.337 1.00 0.00 C ATOM 1927 CG2 VAL A 123 24.554 1.681 -10.299 1.00 0.00 C ATOM 0 H VAL A 123 25.549 3.930 -12.574 1.00 0.00 H new ATOM 0 HA VAL A 123 22.751 2.971 -12.077 1.00 0.00 H new ATOM 0 HB VAL A 123 24.853 3.825 -10.144 1.00 0.00 H new ATOM 0 HG11 VAL A 123 23.253 2.916 -8.364 1.00 0.00 H new ATOM 0 HG12 VAL A 123 22.565 4.287 -9.266 1.00 0.00 H new ATOM 0 HG13 VAL A 123 22.058 2.625 -9.649 1.00 0.00 H new ATOM 0 HG21 VAL A 123 24.835 1.447 -9.272 1.00 0.00 H new ATOM 0 HG22 VAL A 123 23.768 0.999 -10.624 1.00 0.00 H new ATOM 0 HG23 VAL A 123 25.423 1.569 -10.947 1.00 0.00 H new ATOM 1937 N ALA A 124 21.835 5.329 -12.165 1.00 0.00 N ATOM 1938 CA ALA A 124 21.212 6.674 -12.069 1.00 0.00 C ATOM 1939 C ALA A 124 20.233 6.793 -10.863 1.00 0.00 C ATOM 1940 O ALA A 124 19.356 5.945 -10.679 1.00 0.00 O ATOM 1941 CB ALA A 124 20.496 6.944 -13.398 1.00 0.00 C ATOM 0 H ALA A 124 21.198 4.603 -12.492 1.00 0.00 H new ATOM 0 HA ALA A 124 21.985 7.421 -11.889 1.00 0.00 H new ATOM 0 HB1 ALA A 124 20.025 7.926 -13.364 1.00 0.00 H new ATOM 0 HB2 ALA A 124 21.219 6.916 -14.213 1.00 0.00 H new ATOM 0 HB3 ALA A 124 19.734 6.182 -13.562 1.00 0.00 H new ATOM 1947 N VAL A 125 20.369 7.857 -10.054 1.00 0.00 N ATOM 1948 CA VAL A 125 19.539 8.051 -8.819 1.00 0.00 C ATOM 1949 C VAL A 125 18.591 9.271 -9.057 1.00 0.00 C ATOM 1950 O VAL A 125 19.017 10.430 -9.022 1.00 0.00 O ATOM 1951 CB VAL A 125 20.379 8.198 -7.499 1.00 0.00 C ATOM 1952 CG1 VAL A 125 19.478 8.113 -6.248 1.00 0.00 C ATOM 1953 CG2 VAL A 125 21.522 7.172 -7.315 1.00 0.00 C ATOM 0 H VAL A 125 21.042 8.605 -10.220 1.00 0.00 H new ATOM 0 HA VAL A 125 18.954 7.146 -8.655 1.00 0.00 H new ATOM 0 HB VAL A 125 20.838 9.181 -7.607 1.00 0.00 H new ATOM 0 HG11 VAL A 125 20.089 8.218 -5.352 1.00 0.00 H new ATOM 0 HG12 VAL A 125 18.737 8.912 -6.278 1.00 0.00 H new ATOM 0 HG13 VAL A 125 18.971 7.149 -6.230 1.00 0.00 H new ATOM 0 HG21 VAL A 125 22.036 7.365 -6.373 1.00 0.00 H new ATOM 0 HG22 VAL A 125 21.108 6.164 -7.303 1.00 0.00 H new ATOM 0 HG23 VAL A 125 22.229 7.264 -8.139 1.00 0.00 H new ATOM 1963 N ARG A 126 17.303 9.009 -9.320 1.00 0.00 N ATOM 1964 CA ARG A 126 16.331 10.058 -9.740 1.00 0.00 C ATOM 1965 C ARG A 126 15.231 10.232 -8.648 1.00 0.00 C ATOM 1966 O ARG A 126 14.509 9.292 -8.299 1.00 0.00 O ATOM 1967 CB ARG A 126 15.807 9.691 -11.155 1.00 0.00 C ATOM 1968 CG ARG A 126 16.849 9.935 -12.285 1.00 0.00 C ATOM 1969 CD ARG A 126 16.497 9.242 -13.609 1.00 0.00 C ATOM 1970 NE ARG A 126 17.736 9.055 -14.413 1.00 0.00 N ATOM 1971 CZ ARG A 126 17.823 8.324 -15.521 1.00 0.00 C ATOM 1972 NH1 ARG A 126 16.787 7.815 -16.130 1.00 0.00 N ATOM 1973 NH2 ARG A 126 18.991 8.113 -16.041 1.00 0.00 N ATOM 0 H ARG A 126 16.897 8.076 -9.252 1.00 0.00 H new ATOM 0 HA ARG A 126 16.794 11.041 -9.824 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.512 8.642 -11.164 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.911 10.276 -11.365 1.00 0.00 H new ATOM 0 HG2 ARG A 126 16.939 11.007 -12.459 1.00 0.00 H new ATOM 0 HG3 ARG A 126 17.825 9.584 -11.949 1.00 0.00 H new ATOM 0 HD2 ARG A 126 16.028 8.278 -13.414 1.00 0.00 H new ATOM 0 HD3 ARG A 126 15.776 9.841 -14.165 1.00 0.00 H new ATOM 0 HE ARG A 126 18.583 9.523 -14.090 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.850 7.970 -15.758 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.914 7.262 -16.977 1.00 0.00 H new ATOM 0 HH21 ARG A 126 19.824 8.505 -15.601 1.00 0.00 H new ATOM 0 HH22 ARG A 126 19.078 7.555 -16.890 1.00 0.00 H new ATOM 1987 N HIS A 127 15.146 11.444 -8.075 1.00 0.00 N ATOM 1988 CA HIS A 127 14.434 11.689 -6.789 1.00 0.00 C ATOM 1989 C HIS A 127 13.017 12.275 -7.068 1.00 0.00 C ATOM 1990 O HIS A 127 12.850 13.475 -7.324 1.00 0.00 O ATOM 1991 CB HIS A 127 15.287 12.639 -5.897 1.00 0.00 C ATOM 1992 CG HIS A 127 16.678 12.144 -5.484 1.00 0.00 C ATOM 1993 ND1 HIS A 127 17.797 12.253 -6.284 1.00 0.00 N ATOM 1994 CD2 HIS A 127 17.022 11.526 -4.271 1.00 0.00 C ATOM 1995 CE1 HIS A 127 18.727 11.645 -5.489 1.00 0.00 C ATOM 1996 NE2 HIS A 127 18.367 11.179 -4.251 1.00 0.00 N ATOM 0 H HIS A 127 15.563 12.283 -8.479 1.00 0.00 H new ATOM 0 HA HIS A 127 14.301 10.750 -6.252 1.00 0.00 H new ATOM 0 HB2 HIS A 127 15.407 13.584 -6.427 1.00 0.00 H new ATOM 0 HB3 HIS A 127 14.720 12.852 -4.991 1.00 0.00 H new ATOM 0 HD1 HIS A 127 17.901 12.670 -7.209 1.00 0.00 H new ATOM 0 HD2 HIS A 127 16.332 11.344 -3.460 1.00 0.00 H new ATOM 0 HE1 HIS A 127 19.744 11.532 -5.835 1.00 0.00 H new ATOM 2004 N TYR A 128 11.996 11.412 -7.033 1.00 0.00 N ATOM 2005 CA TYR A 128 10.609 11.770 -7.412 1.00 0.00 C ATOM 2006 C TYR A 128 9.782 12.186 -6.162 1.00 0.00 C ATOM 2007 O TYR A 128 9.752 11.487 -5.144 1.00 0.00 O ATOM 2008 CB TYR A 128 9.959 10.544 -8.108 1.00 0.00 C ATOM 2009 CG TYR A 128 10.390 10.241 -9.552 1.00 0.00 C ATOM 2010 CD1 TYR A 128 11.508 9.438 -9.808 1.00 0.00 C ATOM 2011 CD2 TYR A 128 9.631 10.714 -10.622 1.00 0.00 C ATOM 2012 CE1 TYR A 128 11.863 9.131 -11.121 1.00 0.00 C ATOM 2013 CE2 TYR A 128 9.978 10.397 -11.932 1.00 0.00 C ATOM 2014 CZ TYR A 128 11.096 9.601 -12.179 1.00 0.00 C ATOM 2015 OH TYR A 128 11.432 9.274 -13.465 1.00 0.00 O ATOM 0 H TYR A 128 12.100 10.440 -6.741 1.00 0.00 H new ATOM 0 HA TYR A 128 10.625 12.621 -8.093 1.00 0.00 H new ATOM 0 HB2 TYR A 128 10.168 9.662 -7.502 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.878 10.687 -8.102 1.00 0.00 H new ATOM 0 HD1 TYR A 128 12.096 9.056 -8.987 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.766 11.332 -10.432 1.00 0.00 H new ATOM 0 HE1 TYR A 128 12.736 8.526 -11.316 1.00 0.00 H new ATOM 0 HE2 TYR A 128 9.383 10.766 -12.754 1.00 0.00 H new ATOM 0 HH TYR A 128 10.679 9.471 -14.060 1.00 0.00 H new ATOM 2025 N GLU A 129 9.077 13.317 -6.264 1.00 0.00 N ATOM 2026 CA GLU A 129 8.209 13.835 -5.164 1.00 0.00 C ATOM 2027 C GLU A 129 6.708 13.870 -5.611 1.00 0.00 C ATOM 2028 O GLU A 129 6.387 13.830 -6.807 1.00 0.00 O ATOM 2029 CB GLU A 129 8.773 15.199 -4.670 1.00 0.00 C ATOM 2030 CG GLU A 129 10.221 15.136 -4.105 1.00 0.00 C ATOM 2031 CD GLU A 129 10.728 16.418 -3.447 1.00 0.00 C ATOM 2032 OE1 GLU A 129 10.255 16.865 -2.407 1.00 0.00 O ATOM 2033 OE2 GLU A 129 11.778 16.982 -4.121 1.00 0.00 O ATOM 0 H GLU A 129 9.081 13.906 -7.097 1.00 0.00 H new ATOM 0 HA GLU A 129 8.227 13.163 -4.306 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.751 15.907 -5.498 1.00 0.00 H new ATOM 0 HB3 GLU A 129 8.112 15.592 -3.897 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.272 14.329 -3.374 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.898 14.873 -4.918 1.00 0.00 H new ATOM 2041 N LYS A 130 5.772 13.879 -4.640 1.00 0.00 N ATOM 2042 CA LYS A 130 4.309 13.793 -4.933 1.00 0.00 C ATOM 2043 C LYS A 130 3.743 15.147 -5.483 1.00 0.00 C ATOM 2044 O LYS A 130 3.535 16.097 -4.723 1.00 0.00 O ATOM 2045 CB LYS A 130 3.523 13.323 -3.675 1.00 0.00 C ATOM 2046 CG LYS A 130 3.805 11.879 -3.197 1.00 0.00 C ATOM 2047 CD LYS A 130 2.859 11.422 -2.070 1.00 0.00 C ATOM 2048 CE LYS A 130 3.189 10.004 -1.576 1.00 0.00 C ATOM 2049 NZ LYS A 130 2.250 9.602 -0.514 1.00 0.00 N ATOM 0 H LYS A 130 5.993 13.944 -3.646 1.00 0.00 H new ATOM 0 HA LYS A 130 4.174 13.049 -5.718 1.00 0.00 H new ATOM 0 HB2 LYS A 130 3.747 14.006 -2.855 1.00 0.00 H new ATOM 0 HB3 LYS A 130 2.457 13.414 -3.883 1.00 0.00 H new ATOM 0 HG2 LYS A 130 3.710 11.197 -4.042 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.836 11.812 -2.848 1.00 0.00 H new ATOM 0 HD2 LYS A 130 2.926 12.121 -1.236 1.00 0.00 H new ATOM 0 HD3 LYS A 130 1.830 11.450 -2.428 1.00 0.00 H new ATOM 0 HE2 LYS A 130 3.133 9.300 -2.406 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.211 9.971 -1.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 2.484 8.642 -0.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 2.324 10.265 0.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 1.279 9.614 -0.886 1.00 0.00 H new ATOM 2062 N ALA A 131 3.504 15.197 -6.808 1.00 0.00 N ATOM 2063 CA ALA A 131 3.091 16.417 -7.555 1.00 0.00 C ATOM 2064 C ALA A 131 4.058 17.636 -7.462 1.00 0.00 C ATOM 2065 O ALA A 131 3.654 18.733 -7.010 1.00 0.00 O ATOM 2066 CB ALA A 131 1.596 16.699 -7.297 1.00 0.00 C ATOM 2067 OXT ALA A 131 5.231 17.499 -7.885 1.00 0.00 O ATOM 0 H ALA A 131 3.593 14.377 -7.408 1.00 0.00 H new ATOM 0 HA ALA A 131 3.195 16.205 -8.619 1.00 0.00 H new ATOM 0 HB1 ALA A 131 1.295 17.592 -7.844 1.00 0.00 H new ATOM 0 HB2 ALA A 131 1.002 15.849 -7.634 1.00 0.00 H new ATOM 0 HB3 ALA A 131 1.434 16.855 -6.230 1.00 0.00 H new