USER MOD reduce.3.24.130724 H: found=0, std=0, add=539, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 536 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 NoAdj-H: A 69 HIS HE2 : A 69 HIS NE2 : A 401 ZNZN :(H bumps) USER MOD Single : A 1 GLY N :NH3+ -121:sc= 0.0965 (180deg=0) USER MOD Single : A 2 HIS :FLIP no HD1:sc= -0.981 F(o=-1.5,f=-0.98) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN : amide:sc= -0.804 K(o=-0.8,f=-5.9!) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.534 K(o=-0.53,f=-1.3) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 GLN : amide:sc= -0.0888 K(o=-0.089,f=-0.72) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 CYS SG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.165 K(o=-0.16,f=-1.4!) USER MOD Single : A 23 MET CE :methyl -116:sc= -0.747 (180deg=-3.63!) USER MOD Single : A 43 GLN :FLIP amide:sc= -4.22! C(o=-5.1!,f=-4.2!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 27:sc= 1.23 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.197 51.117 -39.090 1.00 12.24 N ATOM 2 CA GLY A 1 -7.944 50.403 -40.109 1.00 0.52 C ATOM 3 C GLY A 1 -7.051 49.866 -41.211 1.00 51.30 C ATOM 4 O GLY A 1 -5.864 50.186 -41.271 1.00 24.13 O ATOM 0 H1 GLY A 1 -7.348 50.663 -38.167 1.00 12.24 H new ATOM 0 H2 GLY A 1 -6.184 51.097 -39.324 1.00 12.24 H new ATOM 0 H3 GLY A 1 -7.523 52.104 -39.048 1.00 12.24 H new ATOM 0 HA2 GLY A 1 -8.484 49.576 -39.647 1.00 0.52 H new ATOM 0 HA3 GLY A 1 -8.690 51.069 -40.542 1.00 0.52 H new ATOM 8 N HIS A 2 -7.625 49.045 -42.087 1.00 0.43 N ATOM 9 CA HIS A 2 -6.872 48.462 -43.191 1.00 42.32 C ATOM 10 C HIS A 2 -7.779 48.214 -44.395 1.00 4.14 C ATOM 11 O HIS A 2 -8.600 47.298 -44.386 1.00 13.53 O ATOM 12 CB HIS A 2 -6.216 47.153 -42.755 1.00 22.54 C ATOM 13 CG HIS A 2 -5.638 47.205 -41.374 1.00 65.45 C ATOM 14 ND1 HIS A 2 -6.219 47.038 -40.164 1.00 24.50 N flip ATOM 15 CD2 HIS A 2 -4.305 47.455 -41.127 1.00 23.02 C flip ATOM 16 CE1 HIS A 2 -5.237 47.188 -39.215 1.00 64.33 C flip ATOM 17 NE2 HIS A 2 -4.091 47.439 -39.822 1.00 43.25 N flip ATOM 0 H HIS A 2 -8.607 48.770 -42.053 1.00 0.43 H new ATOM 0 HA HIS A 2 -6.095 49.169 -43.481 1.00 42.32 H new ATOM 0 HB2 HIS A 2 -6.955 46.353 -42.801 1.00 22.54 H new ATOM 0 HB3 HIS A 2 -5.426 46.899 -43.462 1.00 22.54 H new ATOM 0 HD2 HIS A 2 -3.553 47.636 -41.881 1.00 23.02 H new ATOM 0 HE1 HIS A 2 -5.379 47.113 -38.147 1.00 64.33 H new ATOM 0 HE2 HIS A 2 -3.194 47.594 -39.362 1.00 43.25 H new ATOM 25 N MET A 3 -7.623 49.038 -45.426 1.00 21.45 N ATOM 26 CA MET A 3 -8.427 48.906 -46.635 1.00 41.31 C ATOM 27 C MET A 3 -8.287 47.510 -47.234 1.00 42.42 C ATOM 28 O MET A 3 -7.183 47.070 -47.551 1.00 12.32 O ATOM 29 CB MET A 3 -8.014 49.960 -47.665 1.00 32.33 C ATOM 30 CG MET A 3 -8.249 51.388 -47.200 1.00 1.51 C ATOM 31 SD MET A 3 -7.951 52.599 -48.503 1.00 11.12 S ATOM 32 CE MET A 3 -6.261 53.070 -48.147 1.00 2.02 C ATOM 0 H MET A 3 -6.948 49.803 -45.448 1.00 21.45 H new ATOM 0 HA MET A 3 -9.471 49.061 -46.365 1.00 41.31 H new ATOM 0 HB2 MET A 3 -6.957 49.832 -47.900 1.00 32.33 H new ATOM 0 HB3 MET A 3 -8.569 49.791 -48.588 1.00 32.33 H new ATOM 0 HG2 MET A 3 -9.275 51.487 -46.845 1.00 1.51 H new ATOM 0 HG3 MET A 3 -7.597 51.603 -46.353 1.00 1.51 H new ATOM 0 HE1 MET A 3 -5.931 53.816 -48.870 1.00 2.02 H new ATOM 0 HE2 MET A 3 -6.204 53.488 -47.142 1.00 2.02 H new ATOM 0 HE3 MET A 3 -5.617 52.193 -48.212 1.00 2.02 H new ATOM 42 N GLY A 4 -9.412 46.820 -47.385 1.00 72.20 N ATOM 43 CA GLY A 4 -9.391 45.480 -47.945 1.00 2.34 C ATOM 44 C GLY A 4 -9.392 45.485 -49.460 1.00 3.24 C ATOM 45 O GLY A 4 -8.635 44.747 -50.090 1.00 20.25 O ATOM 0 H GLY A 4 -10.338 47.164 -47.130 1.00 72.20 H new ATOM 0 HA2 GLY A 4 -8.506 44.954 -47.587 1.00 2.34 H new ATOM 0 HA3 GLY A 4 -10.258 44.926 -47.586 1.00 2.34 H new ATOM 49 N GLU A 5 -10.244 46.320 -50.048 1.00 2.14 N ATOM 50 CA GLU A 5 -10.340 46.415 -51.499 1.00 73.25 C ATOM 51 C GLU A 5 -10.858 45.110 -52.097 1.00 13.03 C ATOM 52 O GLU A 5 -10.449 44.709 -53.186 1.00 34.31 O ATOM 53 CB GLU A 5 -8.977 46.759 -52.102 1.00 53.22 C ATOM 54 CG GLU A 5 -8.946 48.101 -52.813 1.00 4.02 C ATOM 55 CD GLU A 5 -9.395 48.007 -54.258 1.00 12.24 C ATOM 56 OE1 GLU A 5 -8.856 47.153 -54.993 1.00 3.35 O ATOM 57 OE2 GLU A 5 -10.286 48.787 -54.655 1.00 2.41 O ATOM 0 H GLU A 5 -10.877 46.939 -49.542 1.00 2.14 H new ATOM 0 HA GLU A 5 -11.046 47.210 -51.739 1.00 73.25 H new ATOM 0 HB2 GLU A 5 -8.229 46.760 -51.309 1.00 53.22 H new ATOM 0 HB3 GLU A 5 -8.694 45.977 -52.807 1.00 53.22 H new ATOM 0 HG2 GLU A 5 -9.588 48.804 -52.282 1.00 4.02 H new ATOM 0 HG3 GLU A 5 -7.934 48.504 -52.777 1.00 4.02 H new ATOM 64 N GLU A 6 -11.761 44.452 -51.375 1.00 32.41 N ATOM 65 CA GLU A 6 -12.333 43.192 -51.833 1.00 74.34 C ATOM 66 C GLU A 6 -13.856 43.274 -51.889 1.00 21.21 C ATOM 67 O GLU A 6 -14.464 44.142 -51.261 1.00 72.03 O ATOM 68 CB GLU A 6 -11.907 42.047 -50.912 1.00 1.33 C ATOM 69 CG GLU A 6 -11.070 40.986 -51.607 1.00 30.43 C ATOM 70 CD GLU A 6 -9.667 40.887 -51.041 1.00 63.40 C ATOM 71 OE1 GLU A 6 -9.504 41.084 -49.818 1.00 61.34 O ATOM 72 OE2 GLU A 6 -8.731 40.610 -51.820 1.00 75.14 O ATOM 0 H GLU A 6 -12.111 44.771 -50.472 1.00 32.41 H new ATOM 0 HA GLU A 6 -11.959 42.998 -52.838 1.00 74.34 H new ATOM 0 HB2 GLU A 6 -11.339 42.456 -50.076 1.00 1.33 H new ATOM 0 HB3 GLU A 6 -12.797 41.578 -50.493 1.00 1.33 H new ATOM 0 HG2 GLU A 6 -11.565 40.019 -51.513 1.00 30.43 H new ATOM 0 HG3 GLU A 6 -11.013 41.213 -52.672 1.00 30.43 H new ATOM 79 N GLN A 7 -14.466 42.366 -52.643 1.00 24.52 N ATOM 80 CA GLN A 7 -15.917 42.336 -52.781 1.00 23.22 C ATOM 81 C GLN A 7 -16.586 42.051 -51.440 1.00 51.31 C ATOM 82 O GLN A 7 -15.912 41.844 -50.430 1.00 30.41 O ATOM 83 CB GLN A 7 -16.331 41.280 -53.806 1.00 73.14 C ATOM 84 CG GLN A 7 -17.018 41.859 -55.032 1.00 52.22 C ATOM 85 CD GLN A 7 -16.218 42.972 -55.678 1.00 1.31 C ATOM 86 OE1 GLN A 7 -15.094 43.262 -55.269 1.00 61.14 O ATOM 87 NE2 GLN A 7 -16.795 43.604 -56.693 1.00 43.45 N ATOM 0 H GLN A 7 -13.978 41.641 -53.168 1.00 24.52 H new ATOM 0 HA GLN A 7 -16.244 43.316 -53.128 1.00 23.22 H new ATOM 0 HB2 GLN A 7 -15.447 40.727 -54.123 1.00 73.14 H new ATOM 0 HB3 GLN A 7 -17.001 40.565 -53.328 1.00 73.14 H new ATOM 0 HG2 GLN A 7 -17.183 41.065 -55.760 1.00 52.22 H new ATOM 0 HG3 GLN A 7 -17.999 42.240 -54.748 1.00 52.22 H new ATOM 0 HE21 GLN A 7 -17.729 43.331 -56.999 1.00 43.45 H new ATOM 0 HE22 GLN A 7 -16.305 44.363 -57.166 1.00 43.45 H new ATOM 96 N TYR A 8 -17.915 42.043 -51.438 1.00 22.53 N ATOM 97 CA TYR A 8 -18.674 41.785 -50.219 1.00 41.51 C ATOM 98 C TYR A 8 -19.782 40.768 -50.473 1.00 44.10 C ATOM 99 O TYR A 8 -20.760 41.058 -51.161 1.00 22.40 O ATOM 100 CB TYR A 8 -19.274 43.086 -49.683 1.00 42.43 C ATOM 101 CG TYR A 8 -18.556 43.630 -48.470 1.00 4.04 C ATOM 102 CD1 TYR A 8 -18.747 43.067 -47.214 1.00 63.34 C ATOM 103 CD2 TYR A 8 -17.684 44.707 -48.578 1.00 42.13 C ATOM 104 CE1 TYR A 8 -18.093 43.561 -46.102 1.00 62.51 C ATOM 105 CE2 TYR A 8 -17.025 45.207 -47.472 1.00 44.41 C ATOM 106 CZ TYR A 8 -17.233 44.631 -46.236 1.00 64.15 C ATOM 107 OH TYR A 8 -16.578 45.124 -45.131 1.00 22.03 O ATOM 0 H TYR A 8 -18.488 42.212 -52.265 1.00 22.53 H new ATOM 0 HA TYR A 8 -17.991 41.374 -49.476 1.00 41.51 H new ATOM 0 HB2 TYR A 8 -19.255 43.837 -50.473 1.00 42.43 H new ATOM 0 HB3 TYR A 8 -20.320 42.916 -49.429 1.00 42.43 H new ATOM 0 HD1 TYR A 8 -19.419 42.228 -47.105 1.00 63.34 H new ATOM 0 HD2 TYR A 8 -17.519 45.161 -49.544 1.00 42.13 H new ATOM 0 HE1 TYR A 8 -18.254 43.112 -45.133 1.00 62.51 H new ATOM 0 HE2 TYR A 8 -16.351 46.044 -47.574 1.00 44.41 H new ATOM 0 HH TYR A 8 -16.009 45.877 -45.397 1.00 22.03 H new ATOM 117 N ASN A 9 -19.619 39.574 -49.913 1.00 12.33 N ATOM 118 CA ASN A 9 -20.605 38.512 -50.077 1.00 62.12 C ATOM 119 C ASN A 9 -21.319 38.223 -48.760 1.00 1.43 C ATOM 120 O ASN A 9 -21.947 37.178 -48.599 1.00 74.24 O ATOM 121 CB ASN A 9 -19.932 37.240 -50.596 1.00 52.12 C ATOM 122 CG ASN A 9 -19.465 36.334 -49.472 1.00 24.31 C ATOM 123 OD1 ASN A 9 -20.171 35.410 -49.070 1.00 11.14 O ATOM 124 ND2 ASN A 9 -18.267 36.598 -48.962 1.00 31.02 N ATOM 0 H ASN A 9 -18.814 39.318 -49.342 1.00 12.33 H new ATOM 0 HA ASN A 9 -21.345 38.846 -50.804 1.00 62.12 H new ATOM 0 HB2 ASN A 9 -20.631 36.696 -51.231 1.00 52.12 H new ATOM 0 HB3 ASN A 9 -19.079 37.511 -51.219 1.00 52.12 H new ATOM 0 HD21 ASN A 9 -17.897 36.023 -48.205 1.00 31.02 H new ATOM 0 HD22 ASN A 9 -17.717 37.375 -49.328 1.00 31.02 H new ATOM 131 N ARG A 10 -21.217 39.158 -47.821 1.00 21.40 N ATOM 132 CA ARG A 10 -21.852 39.003 -46.517 1.00 52.12 C ATOM 133 C ARG A 10 -23.370 38.934 -46.656 1.00 43.50 C ATOM 134 O ARG A 10 -23.992 39.831 -47.228 1.00 23.21 O ATOM 135 CB ARG A 10 -21.465 40.164 -45.597 1.00 51.02 C ATOM 136 CG ARG A 10 -21.664 39.862 -44.121 1.00 63.14 C ATOM 137 CD ARG A 10 -20.390 40.108 -43.327 1.00 54.40 C ATOM 138 NE ARG A 10 -20.356 39.329 -42.092 1.00 55.14 N ATOM 139 CZ ARG A 10 -19.639 39.670 -41.028 1.00 64.42 C ATOM 140 NH1 ARG A 10 -18.899 40.770 -41.047 1.00 72.14 N ATOM 141 NH2 ARG A 10 -19.660 38.909 -39.941 1.00 23.52 N ATOM 0 H ARG A 10 -20.701 40.030 -47.938 1.00 21.40 H new ATOM 0 HA ARG A 10 -21.502 38.068 -46.079 1.00 52.12 H new ATOM 0 HB2 ARG A 10 -20.420 40.420 -45.769 1.00 51.02 H new ATOM 0 HB3 ARG A 10 -22.056 41.040 -45.863 1.00 51.02 H new ATOM 0 HG2 ARG A 10 -22.467 40.485 -43.726 1.00 63.14 H new ATOM 0 HG3 ARG A 10 -21.976 38.825 -43.999 1.00 63.14 H new ATOM 0 HD2 ARG A 10 -19.526 39.853 -43.940 1.00 54.40 H new ATOM 0 HD3 ARG A 10 -20.310 41.169 -43.089 1.00 54.40 H new ATOM 0 HE ARG A 10 -20.914 38.476 -42.044 1.00 55.14 H new ATOM 0 HH11 ARG A 10 -18.879 41.357 -41.881 1.00 72.14 H new ATOM 0 HH12 ARG A 10 -18.349 41.029 -40.228 1.00 72.14 H new ATOM 0 HH21 ARG A 10 -20.227 38.061 -39.923 1.00 23.52 H new ATOM 0 HH22 ARG A 10 -19.109 39.172 -39.124 1.00 23.52 H new ATOM 155 N TYR A 11 -23.959 37.867 -46.131 1.00 72.32 N ATOM 156 CA TYR A 11 -25.403 37.680 -46.200 1.00 44.00 C ATOM 157 C TYR A 11 -26.106 38.468 -45.099 1.00 55.05 C ATOM 158 O TYR A 11 -27.076 39.182 -45.356 1.00 33.41 O ATOM 159 CB TYR A 11 -25.752 36.196 -46.084 1.00 33.51 C ATOM 160 CG TYR A 11 -25.520 35.416 -47.358 1.00 25.12 C ATOM 161 CD1 TYR A 11 -26.076 35.832 -48.562 1.00 54.00 C ATOM 162 CD2 TYR A 11 -24.743 34.264 -47.360 1.00 44.52 C ATOM 163 CE1 TYR A 11 -25.866 35.124 -49.728 1.00 40.05 C ATOM 164 CE2 TYR A 11 -24.527 33.551 -48.522 1.00 42.12 C ATOM 165 CZ TYR A 11 -25.091 33.984 -49.704 1.00 71.53 C ATOM 166 OH TYR A 11 -24.878 33.274 -50.865 1.00 13.15 O ATOM 0 H TYR A 11 -23.459 37.118 -45.653 1.00 72.32 H new ATOM 0 HA TYR A 11 -25.747 38.052 -47.165 1.00 44.00 H new ATOM 0 HB2 TYR A 11 -25.158 35.754 -45.284 1.00 33.51 H new ATOM 0 HB3 TYR A 11 -26.798 36.099 -45.795 1.00 33.51 H new ATOM 0 HD1 TYR A 11 -26.683 36.725 -48.586 1.00 54.00 H new ATOM 0 HD2 TYR A 11 -24.301 33.921 -46.437 1.00 44.52 H new ATOM 0 HE1 TYR A 11 -26.307 35.461 -50.655 1.00 40.05 H new ATOM 0 HE2 TYR A 11 -23.919 32.658 -48.506 1.00 42.12 H new ATOM 0 HH TYR A 11 -24.310 32.499 -50.675 1.00 13.15 H new ATOM 176 N GLN A 12 -25.611 38.332 -43.874 1.00 32.21 N ATOM 177 CA GLN A 12 -26.192 39.030 -42.733 1.00 63.31 C ATOM 178 C GLN A 12 -27.588 38.500 -42.424 1.00 34.00 C ATOM 179 O GLN A 12 -28.484 39.262 -42.060 1.00 51.35 O ATOM 180 CB GLN A 12 -26.252 40.534 -43.005 1.00 44.14 C ATOM 181 CG GLN A 12 -25.305 41.348 -42.140 1.00 65.55 C ATOM 182 CD GLN A 12 -25.614 42.832 -42.172 1.00 24.53 C ATOM 183 OE1 GLN A 12 -26.106 43.396 -41.195 1.00 22.14 O ATOM 184 NE2 GLN A 12 -25.325 43.471 -43.299 1.00 43.43 N ATOM 0 H GLN A 12 -24.809 37.745 -43.645 1.00 32.21 H new ATOM 0 HA GLN A 12 -25.556 38.850 -41.866 1.00 63.31 H new ATOM 0 HB2 GLN A 12 -26.018 40.714 -44.054 1.00 44.14 H new ATOM 0 HB3 GLN A 12 -27.271 40.884 -42.841 1.00 44.14 H new ATOM 0 HG2 GLN A 12 -25.361 40.991 -41.112 1.00 65.55 H new ATOM 0 HG3 GLN A 12 -24.281 41.187 -42.478 1.00 65.55 H new ATOM 0 HE21 GLN A 12 -24.918 42.962 -44.084 1.00 43.43 H new ATOM 0 HE22 GLN A 12 -25.510 44.471 -43.380 1.00 43.43 H new ATOM 193 N GLN A 13 -27.766 37.192 -42.572 1.00 61.32 N ATOM 194 CA GLN A 13 -29.055 36.561 -42.310 1.00 10.43 C ATOM 195 C GLN A 13 -29.538 36.878 -40.898 1.00 71.12 C ATOM 196 O GLN A 13 -28.764 37.326 -40.053 1.00 11.44 O ATOM 197 CB GLN A 13 -28.953 35.046 -42.498 1.00 30.43 C ATOM 198 CG GLN A 13 -28.499 34.635 -43.890 1.00 12.03 C ATOM 199 CD GLN A 13 -29.099 33.314 -44.332 1.00 5.32 C ATOM 200 OE1 GLN A 13 -30.272 33.039 -44.087 1.00 34.41 O ATOM 201 NE2 GLN A 13 -28.292 32.489 -44.989 1.00 23.34 N ATOM 0 H GLN A 13 -27.034 36.548 -42.872 1.00 61.32 H new ATOM 0 HA GLN A 13 -29.778 36.960 -43.021 1.00 10.43 H new ATOM 0 HB2 GLN A 13 -28.255 34.643 -41.764 1.00 30.43 H new ATOM 0 HB3 GLN A 13 -29.925 34.597 -42.294 1.00 30.43 H new ATOM 0 HG2 GLN A 13 -28.775 35.412 -44.603 1.00 12.03 H new ATOM 0 HG3 GLN A 13 -27.412 34.560 -43.906 1.00 12.03 H new ATOM 0 HE21 GLN A 13 -27.325 32.758 -45.170 1.00 23.34 H new ATOM 0 HE22 GLN A 13 -28.639 31.586 -45.312 1.00 23.34 H new ATOM 210 N TYR A 14 -30.822 36.642 -40.652 1.00 43.42 N ATOM 211 CA TYR A 14 -31.410 36.907 -39.345 1.00 14.22 C ATOM 212 C TYR A 14 -30.659 36.158 -38.248 1.00 23.13 C ATOM 213 O TYR A 14 -29.864 35.260 -38.526 1.00 2.43 O ATOM 214 CB TYR A 14 -32.885 36.502 -39.335 1.00 1.34 C ATOM 215 CG TYR A 14 -33.758 37.373 -40.210 1.00 43.40 C ATOM 216 CD1 TYR A 14 -33.799 38.751 -40.032 1.00 71.14 C ATOM 217 CD2 TYR A 14 -34.541 36.819 -41.214 1.00 32.13 C ATOM 218 CE1 TYR A 14 -34.595 39.550 -40.829 1.00 12.20 C ATOM 219 CE2 TYR A 14 -35.339 37.609 -42.017 1.00 11.51 C ATOM 220 CZ TYR A 14 -35.364 38.975 -41.820 1.00 63.01 C ATOM 221 OH TYR A 14 -36.158 39.768 -42.617 1.00 31.45 O ATOM 0 H TYR A 14 -31.475 36.268 -41.340 1.00 43.42 H new ATOM 0 HA TYR A 14 -31.332 37.976 -39.150 1.00 14.22 H new ATOM 0 HB2 TYR A 14 -32.971 35.467 -39.666 1.00 1.34 H new ATOM 0 HB3 TYR A 14 -33.257 36.541 -38.311 1.00 1.34 H new ATOM 0 HD1 TYR A 14 -33.198 39.204 -39.257 1.00 71.14 H new ATOM 0 HD2 TYR A 14 -34.525 35.750 -41.370 1.00 32.13 H new ATOM 0 HE1 TYR A 14 -34.616 40.619 -40.677 1.00 12.20 H new ATOM 0 HE2 TYR A 14 -35.940 37.161 -42.795 1.00 11.51 H new ATOM 0 HH TYR A 14 -36.634 39.208 -43.265 1.00 31.45 H new ATOM 231 N GLY A 15 -30.917 36.534 -37.000 1.00 11.32 N ATOM 232 CA GLY A 15 -30.258 35.888 -35.878 1.00 51.11 C ATOM 233 C GLY A 15 -30.799 36.354 -34.541 1.00 3.32 C ATOM 234 O GLY A 15 -31.152 35.540 -33.690 1.00 34.42 O ATOM 0 H GLY A 15 -31.570 37.274 -36.745 1.00 11.32 H new ATOM 0 HA2 GLY A 15 -30.382 34.808 -35.960 1.00 51.11 H new ATOM 0 HA3 GLY A 15 -29.188 36.090 -35.924 1.00 51.11 H new ATOM 238 N ALA A 16 -30.862 37.669 -34.356 1.00 3.24 N ATOM 239 CA ALA A 16 -31.363 38.242 -33.112 1.00 63.53 C ATOM 240 C ALA A 16 -32.839 38.606 -33.233 1.00 20.22 C ATOM 241 O ALA A 16 -33.292 39.065 -34.281 1.00 24.12 O ATOM 242 CB ALA A 16 -30.546 39.465 -32.727 1.00 43.44 C ATOM 0 H ALA A 16 -30.573 38.357 -35.051 1.00 3.24 H new ATOM 0 HA ALA A 16 -31.263 37.491 -32.328 1.00 63.53 H new ATOM 0 HB1 ALA A 16 -30.932 39.882 -31.797 1.00 43.44 H new ATOM 0 HB2 ALA A 16 -29.503 39.178 -32.591 1.00 43.44 H new ATOM 0 HB3 ALA A 16 -30.617 40.213 -33.517 1.00 43.44 H new ATOM 248 N GLU A 17 -33.585 38.398 -32.152 1.00 60.13 N ATOM 249 CA GLU A 17 -35.011 38.703 -32.139 1.00 13.13 C ATOM 250 C GLU A 17 -35.249 40.172 -31.800 1.00 0.32 C ATOM 251 O GLU A 17 -34.931 40.625 -30.701 1.00 13.14 O ATOM 252 CB GLU A 17 -35.737 37.812 -31.129 1.00 63.53 C ATOM 253 CG GLU A 17 -37.213 37.623 -31.435 1.00 61.52 C ATOM 254 CD GLU A 17 -38.110 38.363 -30.462 1.00 64.34 C ATOM 255 OE1 GLU A 17 -37.742 39.482 -30.050 1.00 61.22 O ATOM 256 OE2 GLU A 17 -39.180 37.822 -30.114 1.00 41.10 O ATOM 0 H GLU A 17 -33.226 38.020 -31.275 1.00 60.13 H new ATOM 0 HA GLU A 17 -35.407 38.508 -33.135 1.00 13.13 H new ATOM 0 HB2 GLU A 17 -35.252 36.836 -31.104 1.00 63.53 H new ATOM 0 HB3 GLU A 17 -35.633 38.246 -30.134 1.00 63.53 H new ATOM 0 HG2 GLU A 17 -37.418 37.970 -32.448 1.00 61.52 H new ATOM 0 HG3 GLU A 17 -37.453 36.560 -31.408 1.00 61.52 H new ATOM 263 N GLU A 18 -35.811 40.910 -32.753 1.00 70.42 N ATOM 264 CA GLU A 18 -36.090 42.328 -32.556 1.00 32.12 C ATOM 265 C GLU A 18 -37.272 42.773 -33.412 1.00 31.02 C ATOM 266 O GLU A 18 -37.214 42.727 -34.642 1.00 3.45 O ATOM 267 CB GLU A 18 -34.855 43.165 -32.895 1.00 33.01 C ATOM 268 CG GLU A 18 -34.426 43.056 -34.348 1.00 32.42 C ATOM 269 CD GLU A 18 -32.981 42.618 -34.497 1.00 51.32 C ATOM 270 OE1 GLU A 18 -32.215 42.762 -33.522 1.00 21.52 O ATOM 271 OE2 GLU A 18 -32.617 42.134 -35.589 1.00 72.34 O ATOM 0 H GLU A 18 -36.082 40.550 -33.668 1.00 70.42 H new ATOM 0 HA GLU A 18 -36.346 42.480 -31.507 1.00 32.12 H new ATOM 0 HB2 GLU A 18 -35.060 44.210 -32.663 1.00 33.01 H new ATOM 0 HB3 GLU A 18 -34.029 42.853 -32.257 1.00 33.01 H new ATOM 0 HG2 GLU A 18 -35.073 42.345 -34.862 1.00 32.42 H new ATOM 0 HG3 GLU A 18 -34.562 44.021 -34.837 1.00 32.42 H new ATOM 278 N CYS A 19 -38.343 43.201 -32.754 1.00 43.42 N ATOM 279 CA CYS A 19 -39.540 43.654 -33.454 1.00 63.23 C ATOM 280 C CYS A 19 -39.643 45.176 -33.427 1.00 34.15 C ATOM 281 O CYS A 19 -39.979 45.768 -32.401 1.00 4.24 O ATOM 282 CB CYS A 19 -40.789 43.035 -32.826 1.00 11.03 C ATOM 283 SG CYS A 19 -42.081 42.608 -34.017 1.00 13.53 S ATOM 0 H CYS A 19 -38.407 43.244 -31.737 1.00 43.42 H new ATOM 0 HA CYS A 19 -39.467 43.331 -34.493 1.00 63.23 H new ATOM 0 HB2 CYS A 19 -40.501 42.136 -32.281 1.00 11.03 H new ATOM 0 HB3 CYS A 19 -41.199 43.733 -32.096 1.00 11.03 H new ATOM 0 HG CYS A 19 -43.095 42.089 -33.390 1.00 13.53 H new ATOM 289 N VAL A 20 -39.351 45.805 -34.561 1.00 71.54 N ATOM 290 CA VAL A 20 -39.410 47.257 -34.668 1.00 42.22 C ATOM 291 C VAL A 20 -39.002 47.921 -33.357 1.00 30.32 C ATOM 292 O VAL A 20 -39.498 48.995 -33.012 1.00 0.10 O ATOM 293 CB VAL A 20 -40.823 47.734 -35.055 1.00 5.21 C ATOM 294 CG1 VAL A 20 -41.478 46.746 -36.005 1.00 44.11 C ATOM 295 CG2 VAL A 20 -41.674 47.938 -33.812 1.00 10.02 C ATOM 0 H VAL A 20 -39.071 45.330 -35.419 1.00 71.54 H new ATOM 0 HA VAL A 20 -38.710 47.546 -35.452 1.00 42.22 H new ATOM 0 HB VAL A 20 -40.737 48.691 -35.569 1.00 5.21 H new ATOM 0 HG11 VAL A 20 -42.475 47.100 -36.267 1.00 44.11 H new ATOM 0 HG12 VAL A 20 -40.875 46.656 -36.909 1.00 44.11 H new ATOM 0 HG13 VAL A 20 -41.554 45.772 -35.522 1.00 44.11 H new ATOM 0 HG21 VAL A 20 -42.669 48.275 -34.103 1.00 10.02 H new ATOM 0 HG22 VAL A 20 -41.755 46.997 -33.268 1.00 10.02 H new ATOM 0 HG23 VAL A 20 -41.210 48.689 -33.172 1.00 10.02 H new ATOM 305 N LEU A 21 -38.095 47.277 -32.631 1.00 74.32 N ATOM 306 CA LEU A 21 -37.619 47.804 -31.357 1.00 12.33 C ATOM 307 C LEU A 21 -36.165 48.256 -31.463 1.00 33.41 C ATOM 308 O LEU A 21 -35.379 47.674 -32.210 1.00 43.12 O ATOM 309 CB LEU A 21 -37.759 46.748 -30.260 1.00 22.40 C ATOM 310 CG LEU A 21 -36.619 45.733 -30.158 1.00 13.15 C ATOM 311 CD1 LEU A 21 -35.511 46.264 -29.261 1.00 70.14 C ATOM 312 CD2 LEU A 21 -37.137 44.400 -29.637 1.00 5.32 C ATOM 0 H LEU A 21 -37.674 46.389 -32.903 1.00 74.32 H new ATOM 0 HA LEU A 21 -38.231 48.669 -31.099 1.00 12.33 H new ATOM 0 HB2 LEU A 21 -37.852 47.258 -29.301 1.00 22.40 H new ATOM 0 HB3 LEU A 21 -38.690 46.204 -30.423 1.00 22.40 H new ATOM 0 HG LEU A 21 -36.207 45.575 -31.155 1.00 13.15 H new ATOM 0 HD11 LEU A 21 -34.709 45.529 -29.200 1.00 70.14 H new ATOM 0 HD12 LEU A 21 -35.121 47.193 -29.676 1.00 70.14 H new ATOM 0 HD13 LEU A 21 -35.909 46.451 -28.263 1.00 70.14 H new ATOM 0 HD21 LEU A 21 -36.313 43.690 -29.571 1.00 5.32 H new ATOM 0 HD22 LEU A 21 -37.575 44.541 -28.649 1.00 5.32 H new ATOM 0 HD23 LEU A 21 -37.895 44.013 -30.318 1.00 5.32 H new ATOM 324 N GLN A 22 -35.818 49.294 -30.710 1.00 44.25 N ATOM 325 CA GLN A 22 -34.458 49.821 -30.720 1.00 44.52 C ATOM 326 C GLN A 22 -34.166 50.597 -29.438 1.00 64.04 C ATOM 327 O GLN A 22 -35.011 51.344 -28.949 1.00 22.10 O ATOM 328 CB GLN A 22 -34.247 50.724 -31.936 1.00 11.24 C ATOM 329 CG GLN A 22 -35.158 51.941 -31.956 1.00 75.14 C ATOM 330 CD GLN A 22 -34.451 53.193 -32.433 1.00 63.21 C ATOM 331 OE1 GLN A 22 -33.252 53.365 -32.212 1.00 21.24 O ATOM 332 NE2 GLN A 22 -35.191 54.078 -33.091 1.00 40.14 N ATOM 0 H GLN A 22 -36.458 49.786 -30.086 1.00 44.25 H new ATOM 0 HA GLN A 22 -33.769 48.979 -30.779 1.00 44.52 H new ATOM 0 HB2 GLN A 22 -33.209 51.057 -31.955 1.00 11.24 H new ATOM 0 HB3 GLN A 22 -34.412 50.142 -32.843 1.00 11.24 H new ATOM 0 HG2 GLN A 22 -36.011 51.741 -32.605 1.00 75.14 H new ATOM 0 HG3 GLN A 22 -35.553 52.111 -30.954 1.00 75.14 H new ATOM 0 HE21 GLN A 22 -36.181 53.895 -33.252 1.00 40.14 H new ATOM 0 HE22 GLN A 22 -34.769 54.940 -33.435 1.00 40.14 H new ATOM 341 N MET A 23 -32.964 50.412 -28.903 1.00 51.15 N ATOM 342 CA MET A 23 -32.561 51.095 -27.680 1.00 23.22 C ATOM 343 C MET A 23 -31.452 52.105 -27.960 1.00 4.03 C ATOM 344 O MET A 23 -31.400 53.170 -27.347 1.00 64.11 O ATOM 345 CB MET A 23 -32.090 50.081 -26.636 1.00 11.42 C ATOM 346 CG MET A 23 -30.650 49.637 -26.825 1.00 64.10 C ATOM 347 SD MET A 23 -30.434 48.583 -28.272 1.00 62.23 S ATOM 348 CE MET A 23 -28.861 49.176 -28.893 1.00 3.41 C ATOM 0 H MET A 23 -32.253 49.796 -29.297 1.00 51.15 H new ATOM 0 HA MET A 23 -33.427 51.631 -27.292 1.00 23.22 H new ATOM 0 HB2 MET A 23 -32.199 50.517 -25.643 1.00 11.42 H new ATOM 0 HB3 MET A 23 -32.739 49.206 -26.673 1.00 11.42 H new ATOM 0 HG2 MET A 23 -30.012 50.516 -26.922 1.00 64.10 H new ATOM 0 HG3 MET A 23 -30.320 49.100 -25.936 1.00 64.10 H new ATOM 0 HE1 MET A 23 -29.003 49.623 -29.877 1.00 3.41 H new ATOM 0 HE2 MET A 23 -28.459 49.924 -28.210 1.00 3.41 H new ATOM 0 HE3 MET A 23 -28.163 48.342 -28.971 1.00 3.41 H new ATOM 358 N GLY A 24 -30.567 51.762 -28.892 1.00 71.02 N ATOM 359 CA GLY A 24 -29.472 52.649 -29.237 1.00 23.14 C ATOM 360 C GLY A 24 -29.906 54.099 -29.324 1.00 24.24 C ATOM 361 O GLY A 24 -29.815 54.842 -28.347 1.00 72.23 O ATOM 0 H GLY A 24 -30.589 50.886 -29.414 1.00 71.02 H new ATOM 0 HA2 GLY A 24 -28.682 52.553 -28.492 1.00 23.14 H new ATOM 0 HA3 GLY A 24 -29.047 52.342 -30.193 1.00 23.14 H new ATOM 365 N GLY A 25 -30.377 54.504 -30.500 1.00 21.25 N ATOM 366 CA GLY A 25 -30.817 55.874 -30.690 1.00 32.22 C ATOM 367 C GLY A 25 -32.107 56.176 -29.953 1.00 22.45 C ATOM 368 O GLY A 25 -33.153 55.603 -30.256 1.00 24.44 O ATOM 0 H GLY A 25 -30.462 53.908 -31.324 1.00 21.25 H new ATOM 0 HA2 GLY A 25 -30.038 56.554 -30.346 1.00 32.22 H new ATOM 0 HA3 GLY A 25 -30.957 56.063 -31.754 1.00 32.22 H new ATOM 372 N VAL A 26 -32.031 57.077 -28.979 1.00 13.43 N ATOM 373 CA VAL A 26 -33.203 57.454 -28.194 1.00 41.34 C ATOM 374 C VAL A 26 -33.513 58.939 -28.351 1.00 71.23 C ATOM 375 O VAL A 26 -32.623 59.746 -28.622 1.00 53.11 O ATOM 376 CB VAL A 26 -33.003 57.137 -26.701 1.00 14.10 C ATOM 377 CG1 VAL A 26 -32.858 55.638 -26.488 1.00 74.01 C ATOM 378 CG2 VAL A 26 -31.794 57.881 -26.154 1.00 63.03 C ATOM 0 H VAL A 26 -31.172 57.559 -28.714 1.00 13.43 H new ATOM 0 HA VAL A 26 -34.041 56.869 -28.572 1.00 41.34 H new ATOM 0 HB VAL A 26 -33.885 57.474 -26.156 1.00 14.10 H new ATOM 0 HG11 VAL A 26 -32.717 55.433 -25.427 1.00 74.01 H new ATOM 0 HG12 VAL A 26 -33.757 55.132 -26.839 1.00 74.01 H new ATOM 0 HG13 VAL A 26 -31.995 55.273 -27.045 1.00 74.01 H new ATOM 0 HG21 VAL A 26 -31.669 57.644 -25.097 1.00 63.03 H new ATOM 0 HG22 VAL A 26 -30.902 57.578 -26.702 1.00 63.03 H new ATOM 0 HG23 VAL A 26 -31.944 58.954 -26.270 1.00 63.03 H new ATOM 388 N LEU A 27 -34.781 59.293 -28.175 1.00 54.44 N ATOM 389 CA LEU A 27 -35.210 60.682 -28.296 1.00 73.04 C ATOM 390 C LEU A 27 -36.249 61.026 -27.232 1.00 21.03 C ATOM 391 O LEU A 27 -36.795 60.117 -26.608 1.00 42.31 O ATOM 392 CB LEU A 27 -35.789 60.939 -29.688 1.00 71.25 C ATOM 393 CG LEU A 27 -36.817 59.923 -30.187 1.00 71.02 C ATOM 394 CD1 LEU A 27 -38.230 60.424 -29.932 1.00 41.02 C ATOM 395 CD2 LEU A 27 -36.609 59.636 -31.667 1.00 74.21 C ATOM 0 H LEU A 27 -35.530 58.638 -27.948 1.00 54.44 H new ATOM 0 HA LEU A 27 -34.338 61.319 -28.148 1.00 73.04 H new ATOM 0 HB2 LEU A 27 -36.253 61.925 -29.690 1.00 71.25 H new ATOM 0 HB3 LEU A 27 -34.965 60.972 -30.401 1.00 71.25 H new ATOM 0 HG LEU A 27 -36.678 58.994 -29.635 1.00 71.02 H new ATOM 0 HD11 LEU A 27 -38.948 59.688 -30.294 1.00 41.02 H new ATOM 0 HD12 LEU A 27 -38.374 60.577 -28.862 1.00 41.02 H new ATOM 0 HD13 LEU A 27 -38.382 61.367 -30.457 1.00 41.02 H new ATOM 0 HD21 LEU A 27 -37.350 58.911 -32.005 1.00 74.21 H new ATOM 0 HD22 LEU A 27 -36.720 60.559 -32.236 1.00 74.21 H new ATOM 0 HD23 LEU A 27 -35.609 59.232 -31.822 1.00 74.21 H new ATOM 407 N CYS A 28 -36.495 62.315 -27.050 1.00 71.33 N ATOM 408 CA CYS A 28 -37.466 62.760 -26.064 1.00 70.31 C ATOM 409 C CYS A 28 -38.816 62.933 -26.763 1.00 64.30 C ATOM 410 O CYS A 28 -38.985 63.709 -27.703 1.00 61.24 O ATOM 411 CB CYS A 28 -37.015 64.044 -25.366 1.00 55.14 C ATOM 412 SG CYS A 28 -36.394 63.662 -23.688 1.00 33.12 S ATOM 0 H CYS A 28 -36.039 63.066 -27.568 1.00 71.33 H new ATOM 0 HA CYS A 28 -37.559 62.011 -25.278 1.00 70.31 H new ATOM 0 HB2 CYS A 28 -36.233 64.529 -25.950 1.00 55.14 H new ATOM 0 HB3 CYS A 28 -37.847 64.745 -25.303 1.00 55.14 H new ATOM 417 N PRO A 29 -39.807 62.172 -26.275 1.00 53.32 N ATOM 418 CA PRO A 29 -41.168 62.204 -26.818 1.00 55.55 C ATOM 419 C PRO A 29 -41.887 63.514 -26.508 1.00 24.50 C ATOM 420 O PRO A 29 -43.038 63.708 -26.898 1.00 31.10 O ATOM 421 CB PRO A 29 -41.859 61.036 -26.112 1.00 34.45 C ATOM 422 CG PRO A 29 -41.101 60.858 -24.842 1.00 1.12 C ATOM 423 CD PRO A 29 -39.676 61.225 -25.156 1.00 32.33 C ATOM 0 HA PRO A 29 -41.174 62.127 -27.905 1.00 55.55 H new ATOM 0 HB2 PRO A 29 -42.909 61.256 -25.919 1.00 34.45 H new ATOM 0 HB3 PRO A 29 -41.829 60.132 -26.721 1.00 34.45 H new ATOM 0 HG2 PRO A 29 -41.504 61.495 -24.054 1.00 1.12 H new ATOM 0 HG3 PRO A 29 -41.170 59.830 -24.487 1.00 1.12 H new ATOM 0 HD2 PRO A 29 -39.180 61.681 -24.299 1.00 32.33 H new ATOM 0 HD3 PRO A 29 -39.088 60.351 -25.436 1.00 32.33 H new ATOM 431 N ARG A 30 -41.199 64.407 -25.805 1.00 43.31 N ATOM 432 CA ARG A 30 -41.772 65.697 -25.442 1.00 2.34 C ATOM 433 C ARG A 30 -42.311 66.418 -26.674 1.00 52.31 C ATOM 434 O ARG A 30 -41.908 66.151 -27.807 1.00 15.42 O ATOM 435 CB ARG A 30 -40.723 66.568 -24.746 1.00 53.23 C ATOM 436 CG ARG A 30 -40.637 66.337 -23.247 1.00 42.42 C ATOM 437 CD ARG A 30 -39.947 65.020 -22.925 1.00 52.45 C ATOM 438 NE ARG A 30 -40.899 63.988 -22.521 1.00 52.22 N ATOM 439 CZ ARG A 30 -41.341 63.843 -21.277 1.00 51.14 C ATOM 440 NH1 ARG A 30 -40.921 64.659 -20.321 1.00 25.23 N ATOM 441 NH2 ARG A 30 -42.207 62.879 -20.989 1.00 4.24 N ATOM 0 H ARG A 30 -40.245 64.261 -25.476 1.00 43.31 H new ATOM 0 HA ARG A 30 -42.599 65.519 -24.755 1.00 2.34 H new ATOM 0 HB2 ARG A 30 -39.748 66.373 -25.192 1.00 53.23 H new ATOM 0 HB3 ARG A 30 -40.954 67.617 -24.931 1.00 53.23 H new ATOM 0 HG2 ARG A 30 -40.091 67.158 -22.782 1.00 42.42 H new ATOM 0 HG3 ARG A 30 -41.640 66.338 -22.819 1.00 42.42 H new ATOM 0 HD2 ARG A 30 -39.391 64.679 -23.798 1.00 52.45 H new ATOM 0 HD3 ARG A 30 -39.221 65.176 -22.127 1.00 52.45 H new ATOM 0 HE ARG A 30 -41.243 63.344 -23.233 1.00 52.22 H new ATOM 0 HH11 ARG A 30 -40.256 65.401 -20.540 1.00 25.23 H new ATOM 0 HH12 ARG A 30 -41.262 64.545 -19.367 1.00 25.23 H new ATOM 0 HH21 ARG A 30 -42.533 62.250 -21.723 1.00 4.24 H new ATOM 0 HH22 ARG A 30 -42.547 62.767 -20.034 1.00 4.24 H new ATOM 455 N PRO A 31 -43.245 67.355 -26.451 1.00 4.22 N ATOM 456 CA PRO A 31 -43.859 68.134 -27.529 1.00 1.25 C ATOM 457 C PRO A 31 -42.883 69.119 -28.162 1.00 4.24 C ATOM 458 O PRO A 31 -43.153 69.685 -29.220 1.00 54.13 O ATOM 459 CB PRO A 31 -44.993 68.884 -26.825 1.00 33.12 C ATOM 460 CG PRO A 31 -44.559 68.979 -25.403 1.00 41.11 C ATOM 461 CD PRO A 31 -43.771 67.727 -25.127 1.00 15.24 C ATOM 0 HA PRO A 31 -44.194 67.499 -28.349 1.00 1.25 H new ATOM 0 HB2 PRO A 31 -45.144 69.872 -27.260 1.00 33.12 H new ATOM 0 HB3 PRO A 31 -45.938 68.348 -26.916 1.00 33.12 H new ATOM 0 HG2 PRO A 31 -43.950 69.868 -25.239 1.00 41.11 H new ATOM 0 HG3 PRO A 31 -45.418 69.054 -24.737 1.00 41.11 H new ATOM 0 HD2 PRO A 31 -42.968 67.907 -24.412 1.00 15.24 H new ATOM 0 HD3 PRO A 31 -44.400 66.941 -24.709 1.00 15.24 H new ATOM 469 N GLY A 32 -41.743 69.320 -27.507 1.00 31.22 N ATOM 470 CA GLY A 32 -40.743 70.238 -28.021 1.00 11.00 C ATOM 471 C GLY A 32 -39.394 70.058 -27.352 1.00 60.24 C ATOM 472 O GLY A 32 -38.871 71.020 -26.792 1.00 44.23 O ATOM 0 H GLY A 32 -41.494 68.863 -26.630 1.00 31.22 H new ATOM 0 HA2 GLY A 32 -40.635 70.089 -29.095 1.00 11.00 H new ATOM 0 HA3 GLY A 32 -41.085 71.263 -27.874 1.00 11.00 H new ATOM 476 N CYS A 33 -38.860 68.847 -27.421 1.00 12.44 N ATOM 477 CA CYS A 33 -37.571 68.563 -26.813 1.00 10.11 C ATOM 478 C CYS A 33 -36.601 68.142 -27.918 1.00 53.44 C ATOM 479 O CYS A 33 -35.419 68.479 -27.913 1.00 33.31 O ATOM 480 CB CYS A 33 -37.685 67.501 -25.718 1.00 20.32 C ATOM 481 SG CYS A 33 -36.055 67.246 -24.923 1.00 34.04 S ATOM 0 H CYS A 33 -39.296 68.052 -27.888 1.00 12.44 H new ATOM 0 HA CYS A 33 -37.192 69.459 -26.321 1.00 10.11 H new ATOM 0 HB2 CYS A 33 -38.418 67.812 -24.973 1.00 20.32 H new ATOM 0 HB3 CYS A 33 -38.042 66.564 -26.145 1.00 20.32 H new ATOM 486 N GLY A 34 -37.134 67.389 -28.876 1.00 71.24 N ATOM 487 CA GLY A 34 -36.326 66.919 -29.986 1.00 40.43 C ATOM 488 C GLY A 34 -34.905 66.593 -29.571 1.00 41.13 C ATOM 489 O GLY A 34 -33.955 66.913 -30.285 1.00 4.13 O ATOM 0 H GLY A 34 -38.111 67.096 -28.903 1.00 71.24 H new ATOM 0 HA2 GLY A 34 -36.788 66.031 -30.417 1.00 40.43 H new ATOM 0 HA3 GLY A 34 -36.308 67.680 -30.766 1.00 40.43 H new ATOM 493 N ALA A 35 -34.759 65.955 -28.415 1.00 43.44 N ATOM 494 CA ALA A 35 -33.444 65.586 -27.907 1.00 61.30 C ATOM 495 C ALA A 35 -32.708 64.684 -28.893 1.00 11.35 C ATOM 496 O ALA A 35 -31.595 64.992 -29.317 1.00 21.31 O ATOM 497 CB ALA A 35 -33.575 64.896 -26.556 1.00 44.43 C ATOM 0 H ALA A 35 -35.536 65.683 -27.812 1.00 43.44 H new ATOM 0 HA ALA A 35 -32.861 66.498 -27.783 1.00 61.30 H new ATOM 0 HB1 ALA A 35 -32.585 64.626 -26.188 1.00 44.43 H new ATOM 0 HB2 ALA A 35 -34.054 65.572 -25.847 1.00 44.43 H new ATOM 0 HB3 ALA A 35 -34.180 63.996 -26.664 1.00 44.43 H new ATOM 503 N GLY A 36 -33.338 63.570 -29.254 1.00 22.11 N ATOM 504 CA GLY A 36 -32.726 62.642 -30.186 1.00 34.43 C ATOM 505 C GLY A 36 -31.213 62.621 -30.076 1.00 34.41 C ATOM 506 O GLY A 36 -30.514 63.163 -30.932 1.00 51.11 O ATOM 0 H GLY A 36 -34.261 63.294 -28.918 1.00 22.11 H new ATOM 0 HA2 GLY A 36 -33.114 61.640 -30.004 1.00 34.43 H new ATOM 0 HA3 GLY A 36 -33.009 62.913 -31.203 1.00 34.43 H new ATOM 510 N LEU A 37 -30.708 61.994 -29.020 1.00 42.10 N ATOM 511 CA LEU A 37 -29.269 61.905 -28.800 1.00 52.00 C ATOM 512 C LEU A 37 -28.870 60.500 -28.359 1.00 34.00 C ATOM 513 O LEU A 37 -29.673 59.770 -27.774 1.00 72.35 O ATOM 514 CB LEU A 37 -28.830 62.925 -27.748 1.00 15.04 C ATOM 515 CG LEU A 37 -29.815 63.176 -26.604 1.00 71.44 C ATOM 516 CD1 LEU A 37 -29.788 62.021 -25.614 1.00 51.30 C ATOM 517 CD2 LEU A 37 -29.495 64.489 -25.904 1.00 63.14 C ATOM 0 H LEU A 37 -31.273 61.540 -28.303 1.00 42.10 H new ATOM 0 HA LEU A 37 -28.769 62.125 -29.743 1.00 52.00 H new ATOM 0 HB2 LEU A 37 -27.884 62.592 -27.320 1.00 15.04 H new ATOM 0 HB3 LEU A 37 -28.637 63.874 -28.249 1.00 15.04 H new ATOM 0 HG LEU A 37 -30.819 63.246 -27.022 1.00 71.44 H new ATOM 0 HD11 LEU A 37 -30.494 62.217 -24.807 1.00 51.30 H new ATOM 0 HD12 LEU A 37 -30.066 61.098 -26.124 1.00 51.30 H new ATOM 0 HD13 LEU A 37 -28.785 61.919 -25.201 1.00 51.30 H new ATOM 0 HD21 LEU A 37 -30.205 64.652 -25.093 1.00 63.14 H new ATOM 0 HD22 LEU A 37 -28.484 64.448 -25.498 1.00 63.14 H new ATOM 0 HD23 LEU A 37 -29.566 65.309 -26.619 1.00 63.14 H new ATOM 529 N LEU A 38 -27.627 60.128 -28.640 1.00 64.45 N ATOM 530 CA LEU A 38 -27.121 58.810 -28.271 1.00 61.34 C ATOM 531 C LEU A 38 -26.325 58.877 -26.971 1.00 32.22 C ATOM 532 O LEU A 38 -25.169 59.298 -26.944 1.00 24.42 O ATOM 533 CB LEU A 38 -26.244 58.246 -29.390 1.00 3.12 C ATOM 534 CG LEU A 38 -26.103 56.724 -29.432 1.00 3.12 C ATOM 535 CD1 LEU A 38 -27.058 56.127 -30.453 1.00 70.25 C ATOM 536 CD2 LEU A 38 -24.667 56.330 -29.747 1.00 75.43 C ATOM 0 H LEU A 38 -26.950 60.720 -29.122 1.00 64.45 H new ATOM 0 HA LEU A 38 -27.975 58.150 -28.120 1.00 61.34 H new ATOM 0 HB2 LEU A 38 -26.650 58.579 -30.345 1.00 3.12 H new ATOM 0 HB3 LEU A 38 -25.249 58.680 -29.298 1.00 3.12 H new ATOM 0 HG LEU A 38 -26.360 56.327 -28.450 1.00 3.12 H new ATOM 0 HD11 LEU A 38 -26.943 55.043 -30.469 1.00 70.25 H new ATOM 0 HD12 LEU A 38 -28.083 56.379 -30.183 1.00 70.25 H new ATOM 0 HD13 LEU A 38 -26.833 56.530 -31.441 1.00 70.25 H new ATOM 0 HD21 LEU A 38 -24.585 55.243 -29.773 1.00 75.43 H new ATOM 0 HD22 LEU A 38 -24.382 56.739 -30.716 1.00 75.43 H new ATOM 0 HD23 LEU A 38 -24.004 56.726 -28.977 1.00 75.43 H new ATOM 548 N PRO A 39 -26.957 58.450 -25.868 1.00 53.51 N ATOM 549 CA PRO A 39 -26.326 58.450 -24.544 1.00 71.42 C ATOM 550 C PRO A 39 -25.218 57.408 -24.431 1.00 40.44 C ATOM 551 O PRO A 39 -24.880 56.740 -25.407 1.00 53.24 O ATOM 552 CB PRO A 39 -27.481 58.107 -23.601 1.00 61.33 C ATOM 553 CG PRO A 39 -28.450 57.353 -24.446 1.00 73.21 C ATOM 554 CD PRO A 39 -28.336 57.936 -25.827 1.00 51.45 C ATOM 0 HA PRO A 39 -25.845 59.402 -24.321 1.00 71.42 H new ATOM 0 HB2 PRO A 39 -27.139 57.506 -22.759 1.00 61.33 H new ATOM 0 HB3 PRO A 39 -27.934 59.007 -23.187 1.00 61.33 H new ATOM 0 HG2 PRO A 39 -28.217 56.288 -24.451 1.00 73.21 H new ATOM 0 HG3 PRO A 39 -29.465 57.455 -24.062 1.00 73.21 H new ATOM 0 HD2 PRO A 39 -28.507 57.183 -26.596 1.00 51.45 H new ATOM 0 HD3 PRO A 39 -29.065 58.729 -25.990 1.00 51.45 H new ATOM 562 N GLU A 40 -24.658 57.276 -23.233 1.00 44.11 N ATOM 563 CA GLU A 40 -23.586 56.314 -22.994 1.00 54.15 C ATOM 564 C GLU A 40 -24.022 54.906 -23.388 1.00 33.44 C ATOM 565 O GLU A 40 -25.211 54.605 -23.497 1.00 52.42 O ATOM 566 CB GLU A 40 -23.169 56.339 -21.523 1.00 50.13 C ATOM 567 CG GLU A 40 -22.170 57.436 -21.192 1.00 34.34 C ATOM 568 CD GLU A 40 -20.782 57.142 -21.728 1.00 31.35 C ATOM 569 OE1 GLU A 40 -20.651 56.936 -22.951 1.00 51.24 O ATOM 570 OE2 GLU A 40 -19.828 57.116 -20.922 1.00 15.25 O ATOM 0 H GLU A 40 -24.927 57.821 -22.414 1.00 44.11 H new ATOM 0 HA GLU A 40 -22.733 56.597 -23.611 1.00 54.15 H new ATOM 0 HB2 GLU A 40 -24.057 56.469 -20.904 1.00 50.13 H new ATOM 0 HB3 GLU A 40 -22.736 55.374 -21.260 1.00 50.13 H new ATOM 0 HG2 GLU A 40 -22.523 58.381 -21.606 1.00 34.34 H new ATOM 0 HG3 GLU A 40 -22.119 57.561 -20.110 1.00 34.34 H new ATOM 577 N PRO A 41 -23.039 54.021 -23.605 1.00 44.22 N ATOM 578 CA PRO A 41 -23.295 52.630 -23.989 1.00 63.02 C ATOM 579 C PRO A 41 -23.906 51.818 -22.852 1.00 33.42 C ATOM 580 O PRO A 41 -24.075 50.604 -22.964 1.00 45.01 O ATOM 581 CB PRO A 41 -21.903 52.097 -24.340 1.00 13.14 C ATOM 582 CG PRO A 41 -20.963 52.949 -23.560 1.00 14.23 C ATOM 583 CD PRO A 41 -21.599 54.311 -23.492 1.00 21.31 C ATOM 0 HA PRO A 41 -24.012 52.558 -24.807 1.00 63.02 H new ATOM 0 HB2 PRO A 41 -21.802 51.046 -24.070 1.00 13.14 H new ATOM 0 HB3 PRO A 41 -21.709 52.171 -25.410 1.00 13.14 H new ATOM 0 HG2 PRO A 41 -20.804 52.542 -22.561 1.00 14.23 H new ATOM 0 HG3 PRO A 41 -19.987 52.997 -24.043 1.00 14.23 H new ATOM 0 HD2 PRO A 41 -21.363 54.818 -22.556 1.00 21.31 H new ATOM 0 HD3 PRO A 41 -21.254 54.956 -24.300 1.00 21.31 H new ATOM 591 N ASP A 42 -24.236 52.496 -21.758 1.00 41.01 N ATOM 592 CA ASP A 42 -24.831 51.837 -20.601 1.00 64.23 C ATOM 593 C ASP A 42 -26.072 52.587 -20.128 1.00 32.11 C ATOM 594 O ASP A 42 -25.972 53.627 -19.479 1.00 5.44 O ATOM 595 CB ASP A 42 -23.813 51.742 -19.463 1.00 61.25 C ATOM 596 CG ASP A 42 -22.946 52.981 -19.357 1.00 0.22 C ATOM 597 OD1 ASP A 42 -23.460 54.028 -18.910 1.00 43.14 O ATOM 598 OD2 ASP A 42 -21.754 52.903 -19.719 1.00 1.12 O ATOM 0 H ASP A 42 -24.102 53.501 -21.648 1.00 41.01 H new ATOM 0 HA ASP A 42 -25.127 50.831 -20.898 1.00 64.23 H new ATOM 0 HB2 ASP A 42 -24.339 51.588 -18.521 1.00 61.25 H new ATOM 0 HB3 ASP A 42 -23.178 50.870 -19.619 1.00 61.25 H new ATOM 603 N GLN A 43 -27.243 52.050 -20.457 1.00 65.33 N ATOM 604 CA GLN A 43 -28.503 52.668 -20.069 1.00 10.25 C ATOM 605 C GLN A 43 -28.530 52.955 -18.570 1.00 62.24 C ATOM 606 O GLN A 43 -29.352 53.736 -18.092 1.00 53.02 O ATOM 607 CB GLN A 43 -29.678 51.765 -20.447 1.00 53.22 C ATOM 608 CG GLN A 43 -29.490 50.315 -20.031 1.00 50.30 C ATOM 609 CD GLN A 43 -30.269 49.961 -18.780 1.00 51.23 C ATOM 610 OE1 GLN A 43 -29.739 50.342 -17.625 1.00 61.24 O flip ATOM 611 NE2 GLN A 43 -31.336 49.351 -18.852 1.00 54.23 N flip ATOM 0 H GLN A 43 -27.344 51.187 -20.992 1.00 65.33 H new ATOM 0 HA GLN A 43 -28.594 53.613 -20.604 1.00 10.25 H new ATOM 0 HB2 GLN A 43 -30.586 52.152 -19.985 1.00 53.22 H new ATOM 0 HB3 GLN A 43 -29.826 51.808 -21.526 1.00 53.22 H new ATOM 0 HG2 GLN A 43 -29.804 49.663 -20.846 1.00 50.30 H new ATOM 0 HG3 GLN A 43 -28.430 50.124 -19.861 1.00 50.30 H new ATOM 0 HE21 GLN A 43 -31.707 49.077 -19.762 1.00 54.23 H new ATOM 0 HE22 GLN A 43 -31.849 49.119 -18.002 1.00 54.23 H new ATOM 620 N ARG A 44 -27.625 52.317 -17.835 1.00 64.44 N ATOM 621 CA ARG A 44 -27.545 52.501 -16.391 1.00 42.25 C ATOM 622 C ARG A 44 -27.936 53.924 -16.003 1.00 53.53 C ATOM 623 O ARG A 44 -28.627 54.139 -15.008 1.00 52.34 O ATOM 624 CB ARG A 44 -26.131 52.197 -15.895 1.00 24.32 C ATOM 625 CG ARG A 44 -25.952 50.770 -15.403 1.00 24.10 C ATOM 626 CD ARG A 44 -24.505 50.318 -15.516 1.00 45.43 C ATOM 627 NE ARG A 44 -24.092 49.509 -14.373 1.00 4.45 N ATOM 628 CZ ARG A 44 -23.700 50.025 -13.212 1.00 35.12 C ATOM 629 NH1 ARG A 44 -23.669 51.339 -13.043 1.00 21.33 N ATOM 630 NH2 ARG A 44 -23.340 49.223 -12.217 1.00 52.03 N ATOM 0 H ARG A 44 -26.937 51.668 -18.216 1.00 64.44 H new ATOM 0 HA ARG A 44 -28.244 51.809 -15.922 1.00 42.25 H new ATOM 0 HB2 ARG A 44 -25.423 52.385 -16.702 1.00 24.32 H new ATOM 0 HB3 ARG A 44 -25.883 52.885 -15.087 1.00 24.32 H new ATOM 0 HG2 ARG A 44 -26.276 50.699 -14.365 1.00 24.10 H new ATOM 0 HG3 ARG A 44 -26.589 50.102 -15.982 1.00 24.10 H new ATOM 0 HD2 ARG A 44 -24.376 49.742 -16.433 1.00 45.43 H new ATOM 0 HD3 ARG A 44 -23.858 51.192 -15.594 1.00 45.43 H new ATOM 0 HE ARG A 44 -24.105 48.494 -14.470 1.00 4.45 H new ATOM 0 HH11 ARG A 44 -23.946 51.958 -13.805 1.00 21.33 H new ATOM 0 HH12 ARG A 44 -23.368 51.732 -12.151 1.00 21.33 H new ATOM 0 HH21 ARG A 44 -23.364 48.211 -12.343 1.00 52.03 H new ATOM 0 HH22 ARG A 44 -23.039 49.619 -11.326 1.00 52.03 H new ATOM 644 N LYS A 45 -27.489 54.893 -16.796 1.00 33.11 N ATOM 645 CA LYS A 45 -27.793 56.295 -16.537 1.00 13.34 C ATOM 646 C LYS A 45 -27.793 57.099 -17.833 1.00 12.22 C ATOM 647 O LYS A 45 -26.738 57.448 -18.360 1.00 74.41 O ATOM 648 CB LYS A 45 -26.775 56.886 -15.557 1.00 50.44 C ATOM 649 CG LYS A 45 -26.966 58.372 -15.306 1.00 4.02 C ATOM 650 CD LYS A 45 -26.615 58.745 -13.876 1.00 53.12 C ATOM 651 CE LYS A 45 -27.861 59.040 -13.055 1.00 54.11 C ATOM 652 NZ LYS A 45 -27.650 60.175 -12.116 1.00 21.23 N ATOM 0 H LYS A 45 -26.915 54.732 -17.624 1.00 33.11 H new ATOM 0 HA LYS A 45 -28.788 56.351 -16.095 1.00 13.34 H new ATOM 0 HB2 LYS A 45 -26.845 56.354 -14.608 1.00 50.44 H new ATOM 0 HB3 LYS A 45 -25.770 56.717 -15.944 1.00 50.44 H new ATOM 0 HG2 LYS A 45 -26.342 58.941 -15.995 1.00 4.02 H new ATOM 0 HG3 LYS A 45 -28.001 58.647 -15.511 1.00 4.02 H new ATOM 0 HD2 LYS A 45 -26.057 57.931 -13.413 1.00 53.12 H new ATOM 0 HD3 LYS A 45 -25.963 59.618 -13.876 1.00 53.12 H new ATOM 0 HE2 LYS A 45 -28.690 59.271 -13.724 1.00 54.11 H new ATOM 0 HE3 LYS A 45 -28.144 58.151 -12.492 1.00 54.11 H new ATOM 0 HZ1 LYS A 45 -28.522 60.345 -11.575 1.00 21.23 H new ATOM 0 HZ2 LYS A 45 -26.876 59.945 -11.461 1.00 21.23 H new ATOM 0 HZ3 LYS A 45 -27.405 61.030 -12.655 1.00 21.23 H new ATOM 666 N VAL A 46 -28.986 57.394 -18.340 1.00 41.23 N ATOM 667 CA VAL A 46 -29.126 58.161 -19.573 1.00 22.43 C ATOM 668 C VAL A 46 -29.794 59.505 -19.311 1.00 11.14 C ATOM 669 O VAL A 46 -30.983 59.571 -18.994 1.00 63.05 O ATOM 670 CB VAL A 46 -29.944 57.388 -20.625 1.00 3.04 C ATOM 671 CG1 VAL A 46 -30.464 58.335 -21.696 1.00 33.13 C ATOM 672 CG2 VAL A 46 -29.106 56.279 -21.242 1.00 62.44 C ATOM 0 H VAL A 46 -29.870 57.113 -17.916 1.00 41.23 H new ATOM 0 HA VAL A 46 -28.120 58.328 -19.958 1.00 22.43 H new ATOM 0 HB VAL A 46 -30.801 56.931 -20.131 1.00 3.04 H new ATOM 0 HG11 VAL A 46 -31.040 57.772 -22.431 1.00 33.13 H new ATOM 0 HG12 VAL A 46 -31.102 59.090 -21.236 1.00 33.13 H new ATOM 0 HG13 VAL A 46 -29.623 58.823 -22.190 1.00 33.13 H new ATOM 0 HG21 VAL A 46 -29.700 55.743 -21.983 1.00 62.44 H new ATOM 0 HG22 VAL A 46 -28.229 56.711 -21.724 1.00 62.44 H new ATOM 0 HG23 VAL A 46 -28.788 55.587 -20.462 1.00 62.44 H new ATOM 682 N THR A 47 -29.022 60.580 -19.446 1.00 32.01 N ATOM 683 CA THR A 47 -29.539 61.924 -19.225 1.00 2.12 C ATOM 684 C THR A 47 -29.926 62.589 -20.541 1.00 31.21 C ATOM 685 O THR A 47 -29.110 62.623 -21.461 1.00 14.25 O ATOM 686 CB THR A 47 -28.508 62.810 -18.500 1.00 12.01 C ATOM 687 OG1 THR A 47 -28.008 62.131 -17.340 1.00 52.43 O ATOM 688 CG2 THR A 47 -29.128 64.136 -18.089 1.00 2.11 C ATOM 0 H THR A 47 -28.037 60.545 -19.707 1.00 32.01 H new ATOM 0 HA THR A 47 -30.425 61.822 -18.599 1.00 2.12 H new ATOM 0 HB THR A 47 -27.686 63.009 -19.187 1.00 12.01 H new ATOM 0 HG1 THR A 47 -27.352 62.700 -16.885 1.00 52.43 H new ATOM 0 HG21 THR A 47 -28.381 64.744 -17.579 1.00 2.11 H new ATOM 0 HG22 THR A 47 -29.481 64.663 -18.975 1.00 2.11 H new ATOM 0 HG23 THR A 47 -29.967 63.953 -17.417 1.00 2.11 H new ATOM 696 N CYS A 48 -31.148 63.096 -20.603 1.00 51.44 N ATOM 697 CA CYS A 48 -31.626 63.753 -21.807 1.00 1.40 C ATOM 698 C CYS A 48 -30.831 65.047 -21.996 1.00 61.01 C ATOM 699 O CYS A 48 -30.543 65.478 -23.112 1.00 24.44 O ATOM 700 CB CYS A 48 -33.133 64.013 -21.751 1.00 70.14 C ATOM 701 SG CYS A 48 -33.531 65.576 -22.615 1.00 73.22 S ATOM 0 H CYS A 48 -31.822 63.065 -19.838 1.00 51.44 H new ATOM 0 HA CYS A 48 -31.468 63.101 -22.666 1.00 1.40 H new ATOM 0 HB2 CYS A 48 -33.671 63.185 -22.213 1.00 70.14 H new ATOM 0 HB3 CYS A 48 -33.463 64.067 -20.713 1.00 70.14 H new ATOM 706 N GLU A 49 -30.480 65.661 -20.870 1.00 1.13 N ATOM 707 CA GLU A 49 -29.720 66.905 -20.883 1.00 13.53 C ATOM 708 C GLU A 49 -28.340 66.693 -21.499 1.00 62.41 C ATOM 709 O GLU A 49 -27.946 67.400 -22.425 1.00 12.24 O ATOM 710 CB GLU A 49 -29.578 67.456 -19.463 1.00 12.41 C ATOM 711 CG GLU A 49 -28.260 68.171 -19.217 1.00 13.42 C ATOM 712 CD GLU A 49 -28.419 69.408 -18.352 1.00 15.12 C ATOM 713 OE1 GLU A 49 -29.223 69.363 -17.397 1.00 53.11 O ATOM 714 OE2 GLU A 49 -27.742 70.418 -18.630 1.00 10.13 O ATOM 0 H GLU A 49 -30.710 65.317 -19.938 1.00 1.13 H new ATOM 0 HA GLU A 49 -30.264 67.627 -21.492 1.00 13.53 H new ATOM 0 HB2 GLU A 49 -30.398 68.146 -19.266 1.00 12.41 H new ATOM 0 HB3 GLU A 49 -29.675 66.635 -18.752 1.00 12.41 H new ATOM 0 HG2 GLU A 49 -27.562 67.484 -18.738 1.00 13.42 H new ATOM 0 HG3 GLU A 49 -27.821 68.455 -20.173 1.00 13.42 H new ATOM 721 N GLY A 50 -27.608 65.713 -20.975 1.00 15.43 N ATOM 722 CA GLY A 50 -26.281 65.426 -21.483 1.00 34.21 C ATOM 723 C GLY A 50 -25.511 66.682 -21.837 1.00 3.21 C ATOM 724 O GLY A 50 -25.514 67.654 -21.083 1.00 70.05 O ATOM 0 H GLY A 50 -27.912 65.114 -20.208 1.00 15.43 H new ATOM 0 HA2 GLY A 50 -25.724 64.861 -20.736 1.00 34.21 H new ATOM 0 HA3 GLY A 50 -26.363 64.793 -22.366 1.00 34.21 H new ATOM 728 N GLY A 51 -24.845 66.663 -22.988 1.00 71.43 N ATOM 729 CA GLY A 51 -24.074 67.814 -23.419 1.00 75.05 C ATOM 730 C GLY A 51 -24.504 68.324 -24.781 1.00 60.10 C ATOM 731 O GLY A 51 -23.669 68.709 -25.598 1.00 51.35 O ATOM 0 H GLY A 51 -24.826 65.870 -23.630 1.00 71.43 H new ATOM 0 HA2 GLY A 51 -24.179 68.613 -22.685 1.00 75.05 H new ATOM 0 HA3 GLY A 51 -23.017 67.548 -23.451 1.00 75.05 H new ATOM 735 N ASN A 52 -25.811 68.321 -25.027 1.00 3.32 N ATOM 736 CA ASN A 52 -26.348 68.784 -26.300 1.00 41.33 C ATOM 737 C ASN A 52 -26.829 70.228 -26.195 1.00 3.21 C ATOM 738 O ASN A 52 -26.488 71.070 -27.025 1.00 62.24 O ATOM 739 CB ASN A 52 -27.501 67.882 -26.749 1.00 13.03 C ATOM 740 CG ASN A 52 -27.301 67.345 -28.152 1.00 74.15 C ATOM 741 OD1 ASN A 52 -27.071 66.151 -28.345 1.00 21.12 O ATOM 742 ND2 ASN A 52 -27.392 68.226 -29.141 1.00 63.32 N ATOM 0 H ASN A 52 -26.516 68.003 -24.362 1.00 3.32 H new ATOM 0 HA ASN A 52 -25.550 68.739 -27.041 1.00 41.33 H new ATOM 0 HB2 ASN A 52 -27.598 67.048 -26.054 1.00 13.03 H new ATOM 0 HB3 ASN A 52 -28.435 68.442 -26.707 1.00 13.03 H new ATOM 0 HD21 ASN A 52 -27.270 67.923 -30.107 1.00 63.32 H new ATOM 0 HD22 ASN A 52 -27.584 69.206 -28.935 1.00 63.32 H new ATOM 749 N GLY A 53 -27.625 70.508 -25.167 1.00 53.33 N ATOM 750 CA GLY A 53 -28.140 71.850 -24.971 1.00 43.14 C ATOM 751 C GLY A 53 -29.228 71.907 -23.918 1.00 1.03 C ATOM 752 O GLY A 53 -28.995 72.368 -22.799 1.00 40.13 O ATOM 0 H GLY A 53 -27.922 69.829 -24.467 1.00 53.33 H new ATOM 0 HA2 GLY A 53 -27.323 72.510 -24.680 1.00 43.14 H new ATOM 0 HA3 GLY A 53 -28.533 72.226 -25.915 1.00 43.14 H new ATOM 756 N LEU A 54 -30.418 71.438 -24.273 1.00 75.41 N ATOM 757 CA LEU A 54 -31.548 71.438 -23.349 1.00 64.13 C ATOM 758 C LEU A 54 -31.357 70.389 -22.257 1.00 4.42 C ATOM 759 O LEU A 54 -30.397 69.622 -22.279 1.00 42.31 O ATOM 760 CB LEU A 54 -32.850 71.172 -24.105 1.00 73.43 C ATOM 761 CG LEU A 54 -33.309 72.273 -25.061 1.00 33.11 C ATOM 762 CD1 LEU A 54 -32.563 72.177 -26.383 1.00 11.23 C ATOM 763 CD2 LEU A 54 -34.811 72.191 -25.287 1.00 54.31 C ATOM 0 H LEU A 54 -30.627 71.052 -25.194 1.00 75.41 H new ATOM 0 HA LEU A 54 -31.602 72.420 -22.879 1.00 64.13 H new ATOM 0 HB2 LEU A 54 -32.734 70.250 -24.674 1.00 73.43 H new ATOM 0 HB3 LEU A 54 -33.641 70.999 -23.376 1.00 73.43 H new ATOM 0 HG LEU A 54 -33.082 73.238 -24.609 1.00 33.11 H new ATOM 0 HD11 LEU A 54 -32.903 72.969 -27.051 1.00 11.23 H new ATOM 0 HD12 LEU A 54 -31.493 72.286 -26.206 1.00 11.23 H new ATOM 0 HD13 LEU A 54 -32.758 71.207 -26.841 1.00 11.23 H new ATOM 0 HD21 LEU A 54 -35.120 72.982 -25.970 1.00 54.31 H new ATOM 0 HD22 LEU A 54 -35.062 71.222 -25.718 1.00 54.31 H new ATOM 0 HD23 LEU A 54 -35.329 72.310 -24.335 1.00 54.31 H new ATOM 775 N GLY A 55 -32.282 70.364 -21.301 1.00 3.10 N ATOM 776 CA GLY A 55 -32.199 69.406 -20.215 1.00 11.25 C ATOM 777 C GLY A 55 -33.544 69.149 -19.563 1.00 61.10 C ATOM 778 O GLY A 55 -34.096 70.062 -18.951 1.00 51.11 O ATOM 0 H GLY A 55 -33.086 70.990 -21.260 1.00 3.10 H new ATOM 0 HA2 GLY A 55 -31.797 68.466 -20.594 1.00 11.25 H new ATOM 0 HA3 GLY A 55 -31.499 69.773 -19.464 1.00 11.25 H new ATOM 782 N CYS A 56 -34.043 67.931 -19.705 1.00 61.01 N ATOM 783 CA CYS A 56 -35.326 67.576 -19.124 1.00 61.22 C ATOM 784 C CYS A 56 -35.168 67.528 -17.604 1.00 13.15 C ATOM 785 O CYS A 56 -36.027 67.973 -16.843 1.00 73.13 O ATOM 786 CB CYS A 56 -35.854 66.254 -19.685 1.00 74.12 C ATOM 787 SG CYS A 56 -36.759 66.553 -21.246 1.00 55.40 S ATOM 0 H CYS A 56 -33.582 67.177 -20.214 1.00 61.01 H new ATOM 0 HA CYS A 56 -36.068 68.329 -19.387 1.00 61.22 H new ATOM 0 HB2 CYS A 56 -35.026 65.568 -19.861 1.00 74.12 H new ATOM 0 HB3 CYS A 56 -36.513 65.779 -18.958 1.00 74.12 H new ATOM 792 N GLY A 57 -34.039 66.974 -17.173 1.00 71.13 N ATOM 793 CA GLY A 57 -33.760 66.864 -15.753 1.00 13.22 C ATOM 794 C GLY A 57 -34.171 65.521 -15.184 1.00 55.30 C ATOM 795 O GLY A 57 -34.083 65.297 -13.976 1.00 41.54 O ATOM 0 H GLY A 57 -33.312 66.599 -17.782 1.00 71.13 H new ATOM 0 HA2 GLY A 57 -32.694 67.017 -15.582 1.00 13.22 H new ATOM 0 HA3 GLY A 57 -34.285 67.657 -15.220 1.00 13.22 H new ATOM 799 N PHE A 58 -34.623 64.624 -16.053 1.00 54.35 N ATOM 800 CA PHE A 58 -35.052 63.296 -15.631 1.00 21.44 C ATOM 801 C PHE A 58 -34.532 62.227 -16.586 1.00 65.35 C ATOM 802 O PHE A 58 -35.074 62.037 -17.675 1.00 63.44 O ATOM 803 CB PHE A 58 -36.578 63.230 -15.554 1.00 30.51 C ATOM 804 CG PHE A 58 -37.094 61.943 -14.977 1.00 30.23 C ATOM 805 CD1 PHE A 58 -37.108 60.784 -15.737 1.00 13.51 C ATOM 806 CD2 PHE A 58 -37.565 61.891 -13.675 1.00 54.11 C ATOM 807 CE1 PHE A 58 -37.582 59.597 -15.209 1.00 44.10 C ATOM 808 CE2 PHE A 58 -38.040 60.708 -13.142 1.00 72.34 C ATOM 809 CZ PHE A 58 -38.049 59.559 -13.911 1.00 13.15 C ATOM 0 H PHE A 58 -34.702 64.793 -17.056 1.00 54.35 H new ATOM 0 HA PHE A 58 -34.637 63.105 -14.641 1.00 21.44 H new ATOM 0 HB2 PHE A 58 -36.940 64.061 -14.948 1.00 30.51 H new ATOM 0 HB3 PHE A 58 -36.990 63.361 -16.554 1.00 30.51 H new ATOM 0 HD1 PHE A 58 -36.744 60.808 -16.754 1.00 13.51 H new ATOM 0 HD2 PHE A 58 -37.561 62.785 -13.070 1.00 54.11 H new ATOM 0 HE1 PHE A 58 -37.587 58.701 -15.812 1.00 44.10 H new ATOM 0 HE2 PHE A 58 -38.404 60.681 -12.126 1.00 72.34 H new ATOM 0 HZ PHE A 58 -38.421 58.634 -13.497 1.00 13.15 H new ATOM 819 N ALA A 59 -33.478 61.532 -16.172 1.00 33.43 N ATOM 820 CA ALA A 59 -32.886 60.480 -16.990 1.00 14.22 C ATOM 821 C ALA A 59 -33.908 59.397 -17.316 1.00 11.11 C ATOM 822 O ALA A 59 -34.970 59.323 -16.695 1.00 0.04 O ATOM 823 CB ALA A 59 -31.681 59.876 -16.283 1.00 51.01 C ATOM 0 H ALA A 59 -33.016 61.678 -15.274 1.00 33.43 H new ATOM 0 HA ALA A 59 -32.557 60.926 -17.928 1.00 14.22 H new ATOM 0 HB1 ALA A 59 -31.249 59.092 -16.905 1.00 51.01 H new ATOM 0 HB2 ALA A 59 -30.936 60.652 -16.107 1.00 51.01 H new ATOM 0 HB3 ALA A 59 -31.994 59.451 -15.329 1.00 51.01 H new ATOM 829 N PHE A 60 -33.584 58.557 -18.294 1.00 1.31 N ATOM 830 CA PHE A 60 -34.476 57.479 -18.703 1.00 64.01 C ATOM 831 C PHE A 60 -33.685 56.214 -19.028 1.00 35.45 C ATOM 832 O PHE A 60 -32.459 56.227 -18.927 1.00 61.44 O ATOM 833 CB PHE A 60 -35.300 57.904 -19.919 1.00 53.23 C ATOM 834 CG PHE A 60 -34.471 58.464 -21.039 1.00 14.51 C ATOM 835 CD1 PHE A 60 -33.790 59.660 -20.884 1.00 15.30 C ATOM 836 CD2 PHE A 60 -34.376 57.796 -22.249 1.00 64.33 C ATOM 837 CE1 PHE A 60 -33.027 60.179 -21.912 1.00 64.44 C ATOM 838 CE2 PHE A 60 -33.613 58.309 -23.281 1.00 71.03 C ATOM 839 CZ PHE A 60 -32.939 59.503 -23.113 1.00 34.12 C ATOM 0 H PHE A 60 -32.710 58.603 -18.818 1.00 1.31 H new ATOM 0 HA PHE A 60 -35.150 57.264 -17.874 1.00 64.01 H new ATOM 0 HB2 PHE A 60 -35.860 57.044 -20.287 1.00 53.23 H new ATOM 0 HB3 PHE A 60 -36.031 58.651 -19.610 1.00 53.23 H new ATOM 0 HD1 PHE A 60 -33.856 60.194 -19.947 1.00 15.30 H new ATOM 0 HD2 PHE A 60 -34.904 56.864 -22.387 1.00 64.33 H new ATOM 0 HE1 PHE A 60 -32.500 61.112 -21.777 1.00 64.44 H new ATOM 0 HE2 PHE A 60 -33.544 57.777 -24.218 1.00 71.03 H new ATOM 0 HZ PHE A 60 -32.345 59.907 -23.919 1.00 34.12 H new ATOM 849 N CYS A 61 -34.395 55.161 -19.405 1.00 15.22 N ATOM 850 CA CYS A 61 -33.751 53.903 -19.738 1.00 73.32 C ATOM 851 C CYS A 61 -33.822 53.713 -21.254 1.00 54.33 C ATOM 852 O CYS A 61 -34.896 53.629 -21.851 1.00 22.02 O ATOM 853 CB CYS A 61 -34.380 52.729 -18.986 1.00 34.45 C ATOM 854 SG CYS A 61 -33.555 51.165 -19.462 1.00 43.44 S ATOM 0 H CYS A 61 -35.412 55.154 -19.487 1.00 15.22 H new ATOM 0 HA CYS A 61 -32.707 53.932 -19.425 1.00 73.32 H new ATOM 0 HB2 CYS A 61 -34.289 52.885 -17.911 1.00 34.45 H new ATOM 0 HB3 CYS A 61 -35.445 52.671 -19.211 1.00 34.45 H new ATOM 859 N ARG A 62 -32.646 53.649 -21.868 1.00 61.41 N ATOM 860 CA ARG A 62 -32.546 53.470 -23.311 1.00 41.12 C ATOM 861 C ARG A 62 -33.011 52.075 -23.721 1.00 41.34 C ATOM 862 O ARG A 62 -33.639 51.903 -24.765 1.00 53.24 O ATOM 863 CB ARG A 62 -31.107 53.696 -23.777 1.00 63.21 C ATOM 864 CG ARG A 62 -30.536 52.536 -24.575 1.00 43.33 C ATOM 865 CD ARG A 62 -29.214 52.907 -25.230 1.00 5.45 C ATOM 866 NE ARG A 62 -28.119 52.952 -24.263 1.00 53.33 N ATOM 867 CZ ARG A 62 -27.525 51.870 -23.775 1.00 61.01 C ATOM 868 NH1 ARG A 62 -27.919 50.663 -24.159 1.00 25.40 N ATOM 869 NH2 ARG A 62 -26.535 51.992 -22.900 1.00 43.30 N ATOM 0 H ARG A 62 -31.748 53.718 -21.389 1.00 61.41 H new ATOM 0 HA ARG A 62 -33.195 54.205 -23.787 1.00 41.12 H new ATOM 0 HB2 ARG A 62 -31.069 54.599 -24.387 1.00 63.21 H new ATOM 0 HB3 ARG A 62 -30.476 53.873 -22.906 1.00 63.21 H new ATOM 0 HG2 ARG A 62 -30.390 51.678 -23.918 1.00 43.33 H new ATOM 0 HG3 ARG A 62 -31.250 52.233 -25.341 1.00 43.33 H new ATOM 0 HD2 ARG A 62 -28.980 52.183 -26.010 1.00 5.45 H new ATOM 0 HD3 ARG A 62 -29.310 53.878 -25.715 1.00 5.45 H new ATOM 0 HE ARG A 62 -27.793 53.865 -23.946 1.00 53.33 H new ATOM 0 HH11 ARG A 62 -28.680 50.565 -24.831 1.00 25.40 H new ATOM 0 HH12 ARG A 62 -27.461 49.833 -23.782 1.00 25.40 H new ATOM 0 HH21 ARG A 62 -26.229 52.918 -22.601 1.00 43.30 H new ATOM 0 HH22 ARG A 62 -26.080 51.160 -22.526 1.00 43.30 H new ATOM 883 N GLU A 63 -32.699 51.085 -22.891 1.00 4.32 N ATOM 884 CA GLU A 63 -33.083 49.706 -23.170 1.00 34.14 C ATOM 885 C GLU A 63 -34.572 49.612 -23.491 1.00 43.11 C ATOM 886 O GLU A 63 -34.947 48.867 -24.395 1.00 44.21 O ATOM 887 CB GLU A 63 -32.750 48.811 -21.975 1.00 34.33 C ATOM 888 CG GLU A 63 -31.522 47.943 -22.188 1.00 24.13 C ATOM 889 CD GLU A 63 -31.750 46.848 -23.211 1.00 55.24 C ATOM 890 OE1 GLU A 63 -32.491 47.094 -24.187 1.00 22.02 O ATOM 891 OE2 GLU A 63 -31.191 45.746 -23.038 1.00 64.21 O ATOM 0 H GLU A 63 -32.182 51.212 -22.021 1.00 4.32 H new ATOM 0 HA GLU A 63 -32.519 49.365 -24.039 1.00 34.14 H new ATOM 0 HB2 GLU A 63 -32.594 49.436 -21.096 1.00 34.33 H new ATOM 0 HB3 GLU A 63 -33.605 48.170 -21.763 1.00 34.33 H new ATOM 0 HG2 GLU A 63 -30.691 48.570 -22.512 1.00 24.13 H new ATOM 0 HG3 GLU A 63 -31.231 47.493 -21.239 1.00 24.13 H new ATOM 898 N CYS A 64 -35.379 50.359 -22.751 1.00 63.42 N ATOM 899 CA CYS A 64 -36.815 50.350 -22.967 1.00 61.32 C ATOM 900 C CYS A 64 -37.248 51.758 -23.376 1.00 53.21 C ATOM 901 O CYS A 64 -38.430 52.050 -23.565 1.00 73.31 O ATOM 902 CB CYS A 64 -37.568 49.857 -21.731 1.00 75.52 C ATOM 903 SG CYS A 64 -37.035 50.798 -20.255 1.00 51.40 S ATOM 0 H CYS A 64 -35.065 50.975 -22.001 1.00 63.42 H new ATOM 0 HA CYS A 64 -37.062 49.650 -23.765 1.00 61.32 H new ATOM 0 HB2 CYS A 64 -38.642 49.974 -21.879 1.00 75.52 H new ATOM 0 HB3 CYS A 64 -37.381 48.794 -21.581 1.00 75.52 H new ATOM 908 N LYS A 65 -36.259 52.633 -23.512 1.00 70.15 N ATOM 909 CA LYS A 65 -36.507 54.017 -23.900 1.00 53.14 C ATOM 910 C LYS A 65 -37.684 54.596 -23.123 1.00 33.04 C ATOM 911 O LYS A 65 -38.420 55.441 -23.631 1.00 50.12 O ATOM 912 CB LYS A 65 -36.782 54.107 -25.403 1.00 61.31 C ATOM 913 CG LYS A 65 -37.548 52.917 -25.952 1.00 53.24 C ATOM 914 CD LYS A 65 -37.644 52.966 -27.468 1.00 72.12 C ATOM 915 CE LYS A 65 -38.977 53.538 -27.924 1.00 72.12 C ATOM 916 NZ LYS A 65 -39.078 53.595 -29.408 1.00 52.44 N ATOM 0 H LYS A 65 -35.276 52.409 -23.359 1.00 70.15 H new ATOM 0 HA LYS A 65 -35.616 54.599 -23.665 1.00 53.14 H new ATOM 0 HB2 LYS A 65 -37.346 55.017 -25.607 1.00 61.31 H new ATOM 0 HB3 LYS A 65 -35.834 54.194 -25.933 1.00 61.31 H new ATOM 0 HG2 LYS A 65 -37.055 51.994 -25.648 1.00 53.24 H new ATOM 0 HG3 LYS A 65 -38.550 52.899 -25.524 1.00 53.24 H new ATOM 0 HD2 LYS A 65 -36.831 53.574 -27.866 1.00 72.12 H new ATOM 0 HD3 LYS A 65 -37.520 51.962 -27.874 1.00 72.12 H new ATOM 0 HE2 LYS A 65 -39.789 52.927 -27.528 1.00 72.12 H new ATOM 0 HE3 LYS A 65 -39.102 54.540 -27.513 1.00 72.12 H new ATOM 0 HZ1 LYS A 65 -40.001 53.991 -29.678 1.00 52.44 H new ATOM 0 HZ2 LYS A 65 -38.319 54.198 -29.785 1.00 52.44 H new ATOM 0 HZ3 LYS A 65 -38.984 52.636 -29.799 1.00 52.44 H new ATOM 930 N GLU A 66 -37.855 54.136 -21.887 1.00 13.24 N ATOM 931 CA GLU A 66 -38.944 54.610 -21.039 1.00 5.24 C ATOM 932 C GLU A 66 -38.400 55.280 -19.780 1.00 22.21 C ATOM 933 O GLU A 66 -37.190 55.334 -19.566 1.00 24.00 O ATOM 934 CB GLU A 66 -39.864 53.450 -20.658 1.00 11.31 C ATOM 935 CG GLU A 66 -41.313 53.664 -21.064 1.00 45.42 C ATOM 936 CD GLU A 66 -41.588 53.230 -22.491 1.00 30.10 C ATOM 937 OE1 GLU A 66 -40.812 52.406 -23.021 1.00 35.41 O ATOM 938 OE2 GLU A 66 -42.578 53.714 -23.079 1.00 10.03 O ATOM 0 H GLU A 66 -37.254 53.436 -21.451 1.00 13.24 H new ATOM 0 HA GLU A 66 -39.516 55.347 -21.602 1.00 5.24 H new ATOM 0 HB2 GLU A 66 -39.496 52.537 -21.125 1.00 11.31 H new ATOM 0 HB3 GLU A 66 -39.816 53.298 -19.580 1.00 11.31 H new ATOM 0 HG2 GLU A 66 -41.962 53.108 -20.387 1.00 45.42 H new ATOM 0 HG3 GLU A 66 -41.566 54.719 -20.954 1.00 45.42 H new ATOM 945 N ALA A 67 -39.306 55.787 -18.949 1.00 45.14 N ATOM 946 CA ALA A 67 -38.919 56.452 -17.712 1.00 32.35 C ATOM 947 C ALA A 67 -37.985 55.573 -16.886 1.00 24.53 C ATOM 948 O ALA A 67 -38.221 54.374 -16.730 1.00 43.02 O ATOM 949 CB ALA A 67 -40.153 56.819 -16.902 1.00 1.31 C ATOM 0 H ALA A 67 -40.312 55.749 -19.111 1.00 45.14 H new ATOM 0 HA ALA A 67 -38.383 57.365 -17.971 1.00 32.35 H new ATOM 0 HB1 ALA A 67 -39.849 57.315 -15.980 1.00 1.31 H new ATOM 0 HB2 ALA A 67 -40.784 57.490 -17.484 1.00 1.31 H new ATOM 0 HB3 ALA A 67 -40.712 55.915 -16.660 1.00 1.31 H new ATOM 955 N TYR A 68 -36.925 56.175 -16.359 1.00 64.42 N ATOM 956 CA TYR A 68 -35.953 55.446 -15.552 1.00 53.13 C ATOM 957 C TYR A 68 -36.646 54.671 -14.435 1.00 45.32 C ATOM 958 O TYR A 68 -37.039 55.243 -13.418 1.00 63.14 O ATOM 959 CB TYR A 68 -34.926 56.411 -14.958 1.00 32.24 C ATOM 960 CG TYR A 68 -33.670 55.729 -14.464 1.00 75.33 C ATOM 961 CD1 TYR A 68 -32.651 55.388 -15.344 1.00 64.40 C ATOM 962 CD2 TYR A 68 -33.504 55.425 -13.119 1.00 54.42 C ATOM 963 CE1 TYR A 68 -31.501 54.763 -14.897 1.00 40.04 C ATOM 964 CE2 TYR A 68 -32.358 54.802 -12.663 1.00 13.31 C ATOM 965 CZ TYR A 68 -31.359 54.473 -13.557 1.00 14.13 C ATOM 966 OH TYR A 68 -30.217 53.852 -13.107 1.00 32.34 O ATOM 0 H TYR A 68 -36.716 57.167 -16.476 1.00 64.42 H new ATOM 0 HA TYR A 68 -35.440 54.735 -16.200 1.00 53.13 H new ATOM 0 HB2 TYR A 68 -34.656 57.150 -15.712 1.00 32.24 H new ATOM 0 HB3 TYR A 68 -35.385 56.953 -14.131 1.00 32.24 H new ATOM 0 HD1 TYR A 68 -32.758 55.615 -16.394 1.00 64.40 H new ATOM 0 HD2 TYR A 68 -34.284 55.680 -12.417 1.00 54.42 H new ATOM 0 HE1 TYR A 68 -30.718 54.504 -15.594 1.00 40.04 H new ATOM 0 HE2 TYR A 68 -32.245 54.574 -11.613 1.00 13.31 H new ATOM 0 HH TYR A 68 -29.473 54.059 -13.710 1.00 32.34 H new ATOM 976 N HIS A 69 -36.791 53.364 -14.633 1.00 22.44 N ATOM 977 CA HIS A 69 -37.434 52.508 -13.642 1.00 11.40 C ATOM 978 C HIS A 69 -36.397 51.848 -12.738 1.00 42.43 C ATOM 979 O HIS A 69 -35.351 51.398 -13.205 1.00 74.53 O ATOM 980 CB HIS A 69 -38.280 51.439 -14.334 1.00 31.12 C ATOM 981 CG HIS A 69 -37.585 50.777 -15.484 1.00 4.24 C ATOM 982 ND1 HIS A 69 -38.238 49.979 -16.399 1.00 64.32 N ATOM 983 CD2 HIS A 69 -36.287 50.801 -15.866 1.00 24.15 C ATOM 984 CE1 HIS A 69 -37.370 49.539 -17.294 1.00 54.41 C ATOM 985 NE2 HIS A 69 -36.179 50.023 -16.994 1.00 10.54 N ATOM 0 H HIS A 69 -36.472 52.875 -15.470 1.00 22.44 H new ATOM 0 HA HIS A 69 -38.082 53.131 -13.025 1.00 11.40 H new ATOM 0 HB2 HIS A 69 -38.560 50.680 -13.604 1.00 31.12 H new ATOM 0 HB3 HIS A 69 -39.204 51.894 -14.691 1.00 31.12 H new ATOM 0 HD1 HIS A 69 -39.235 49.762 -16.387 1.00 64.32 H new ATOM 0 HD2 HIS A 69 -35.485 51.333 -15.376 1.00 24.15 H new ATOM 0 HE1 HIS A 69 -37.597 48.893 -18.129 1.00 54.41 H new ATOM 993 N GLU A 70 -36.695 51.797 -11.444 1.00 30.43 N ATOM 994 CA GLU A 70 -35.787 51.194 -10.476 1.00 35.43 C ATOM 995 C GLU A 70 -35.821 49.670 -10.572 1.00 13.31 C ATOM 996 O GLU A 70 -36.746 49.027 -10.080 1.00 21.32 O ATOM 997 CB GLU A 70 -36.153 51.632 -9.057 1.00 2.23 C ATOM 998 CG GLU A 70 -35.954 53.118 -8.809 1.00 43.24 C ATOM 999 CD GLU A 70 -36.637 53.595 -7.542 1.00 4.41 C ATOM 1000 OE1 GLU A 70 -36.708 52.811 -6.574 1.00 73.21 O ATOM 1001 OE2 GLU A 70 -37.098 54.756 -7.519 1.00 53.33 O ATOM 0 H GLU A 70 -37.557 52.165 -11.042 1.00 30.43 H new ATOM 0 HA GLU A 70 -34.777 51.534 -10.705 1.00 35.43 H new ATOM 0 HB2 GLU A 70 -37.195 51.376 -8.864 1.00 2.23 H new ATOM 0 HB3 GLU A 70 -35.549 51.069 -8.345 1.00 2.23 H new ATOM 0 HG2 GLU A 70 -34.887 53.332 -8.745 1.00 43.24 H new ATOM 0 HG3 GLU A 70 -36.341 53.679 -9.659 1.00 43.24 H new ATOM 1008 N GLY A 71 -34.804 49.101 -11.214 1.00 31.55 N ATOM 1009 CA GLY A 71 -34.737 47.659 -11.364 1.00 53.11 C ATOM 1010 C GLY A 71 -34.174 47.243 -12.708 1.00 52.11 C ATOM 1011 O GLY A 71 -32.969 47.343 -12.941 1.00 14.33 O ATOM 0 H GLY A 71 -34.027 49.612 -11.632 1.00 31.55 H new ATOM 0 HA2 GLY A 71 -34.118 47.242 -10.569 1.00 53.11 H new ATOM 0 HA3 GLY A 71 -35.735 47.237 -11.245 1.00 53.11 H new ATOM 1015 N GLU A 72 -35.046 46.772 -13.594 1.00 72.20 N ATOM 1016 CA GLU A 72 -34.627 46.337 -14.921 1.00 61.24 C ATOM 1017 C GLU A 72 -35.831 46.161 -15.842 1.00 33.02 C ATOM 1018 O GLU A 72 -36.940 45.956 -15.352 1.00 74.21 O ATOM 1019 CB GLU A 72 -33.846 45.024 -14.829 1.00 22.30 C ATOM 1020 CG GLU A 72 -32.571 45.013 -15.656 1.00 13.21 C ATOM 1021 CD GLU A 72 -31.416 44.345 -14.939 1.00 2.13 C ATOM 1022 OE1 GLU A 72 -31.675 43.527 -14.031 1.00 12.25 O ATOM 1023 OE2 GLU A 72 -30.253 44.638 -15.283 1.00 53.43 O ATOM 0 H GLU A 72 -36.046 46.682 -13.417 1.00 72.20 H new ATOM 0 HA GLU A 72 -33.980 47.108 -15.340 1.00 61.24 H new ATOM 0 HB2 GLU A 72 -33.594 44.834 -13.786 1.00 22.30 H new ATOM 0 HB3 GLU A 72 -34.488 44.206 -15.156 1.00 22.30 H new ATOM 0 HG2 GLU A 72 -32.757 44.496 -16.597 1.00 13.21 H new ATOM 0 HG3 GLU A 72 -32.295 46.038 -15.905 1.00 13.21 H new ATOM 1030 N CYS A 73 -35.589 46.245 -17.142 1.00 45.43 N ATOM 1031 CA CYS A 73 -36.660 46.096 -18.114 1.00 22.31 C ATOM 1032 C CYS A 73 -37.344 44.750 -17.870 1.00 31.40 C ATOM 1033 O CYS A 73 -38.565 44.650 -17.757 1.00 62.12 O ATOM 1034 CB CYS A 73 -36.143 46.222 -19.548 1.00 24.34 C ATOM 1035 SG CYS A 73 -34.995 47.641 -19.676 1.00 63.35 S ATOM 0 H CYS A 73 -34.667 46.414 -17.545 1.00 45.43 H new ATOM 0 HA CYS A 73 -37.385 46.900 -17.987 1.00 22.31 H new ATOM 0 HB2 CYS A 73 -35.634 45.304 -19.842 1.00 24.34 H new ATOM 0 HB3 CYS A 73 -36.979 46.357 -20.234 1.00 24.34 H new ATOM 1040 N SER A 74 -36.522 43.708 -17.792 1.00 1.12 N ATOM 1041 CA SER A 74 -37.020 42.355 -17.566 1.00 13.34 C ATOM 1042 C SER A 74 -37.307 42.122 -16.086 1.00 32.31 C ATOM 1043 O SER A 74 -37.525 40.990 -15.655 1.00 73.11 O ATOM 1044 CB SER A 74 -36.009 41.325 -18.071 1.00 13.44 C ATOM 1045 OG SER A 74 -35.761 41.489 -19.456 1.00 31.24 O ATOM 0 H SER A 74 -35.508 43.774 -17.882 1.00 1.12 H new ATOM 0 HA SER A 74 -37.951 42.240 -18.121 1.00 13.34 H new ATOM 0 HB2 SER A 74 -35.076 41.425 -17.517 1.00 13.44 H new ATOM 0 HB3 SER A 74 -36.385 40.319 -17.882 1.00 13.44 H new ATOM 0 HG SER A 74 -35.110 40.819 -19.753 1.00 31.24 H new ATOM 1051 N ALA A 75 -37.305 43.202 -15.312 1.00 4.31 N ATOM 1052 CA ALA A 75 -37.566 43.117 -13.880 1.00 25.30 C ATOM 1053 C ALA A 75 -38.641 44.111 -13.458 1.00 1.44 C ATOM 1054 O ALA A 75 -38.376 45.306 -13.317 1.00 71.40 O ATOM 1055 CB ALA A 75 -36.285 43.355 -13.094 1.00 5.22 C ATOM 0 H ALA A 75 -37.125 44.147 -15.652 1.00 4.31 H new ATOM 0 HA ALA A 75 -37.931 42.113 -13.662 1.00 25.30 H new ATOM 0 HB1 ALA A 75 -36.495 43.288 -12.027 1.00 5.22 H new ATOM 0 HB2 ALA A 75 -35.546 42.601 -13.366 1.00 5.22 H new ATOM 0 HB3 ALA A 75 -35.895 44.346 -13.326 1.00 5.22 H new ATOM 1061 N VAL A 76 -39.857 43.613 -13.257 1.00 31.44 N ATOM 1062 CA VAL A 76 -40.974 44.458 -12.850 1.00 64.42 C ATOM 1063 C VAL A 76 -40.770 44.994 -11.438 1.00 74.32 C ATOM 1064 O VAL A 76 -41.584 45.767 -10.932 1.00 22.02 O ATOM 1065 CB VAL A 76 -42.307 43.691 -12.909 1.00 55.13 C ATOM 1066 CG1 VAL A 76 -42.580 42.988 -11.588 1.00 22.01 C ATOM 1067 CG2 VAL A 76 -43.448 44.634 -13.265 1.00 12.23 C ATOM 0 H VAL A 76 -40.094 42.627 -13.370 1.00 31.44 H new ATOM 0 HA VAL A 76 -41.013 45.293 -13.550 1.00 64.42 H new ATOM 0 HB VAL A 76 -42.234 42.932 -13.688 1.00 55.13 H new ATOM 0 HG11 VAL A 76 -43.527 42.452 -11.650 1.00 22.01 H new ATOM 0 HG12 VAL A 76 -41.776 42.282 -11.378 1.00 22.01 H new ATOM 0 HG13 VAL A 76 -42.633 43.726 -10.787 1.00 22.01 H new ATOM 0 HG21 VAL A 76 -44.383 44.076 -13.303 1.00 12.23 H new ATOM 0 HG22 VAL A 76 -43.523 45.416 -12.510 1.00 12.23 H new ATOM 0 HG23 VAL A 76 -43.256 45.086 -14.238 1.00 12.23 H new ATOM 1077 N PHE A 77 -39.677 44.580 -10.805 1.00 20.14 N ATOM 1078 CA PHE A 77 -39.366 45.018 -9.449 1.00 1.23 C ATOM 1079 C PHE A 77 -39.383 46.541 -9.352 1.00 44.22 C ATOM 1080 O PHE A 77 -38.561 47.220 -9.968 1.00 72.21 O ATOM 1081 CB PHE A 77 -37.998 44.484 -9.019 1.00 12.22 C ATOM 1082 CG PHE A 77 -38.076 43.210 -8.226 1.00 40.13 C ATOM 1083 CD1 PHE A 77 -38.230 41.989 -8.865 1.00 2.43 C ATOM 1084 CD2 PHE A 77 -37.995 43.231 -6.843 1.00 52.33 C ATOM 1085 CE1 PHE A 77 -38.301 40.815 -8.140 1.00 10.04 C ATOM 1086 CE2 PHE A 77 -38.065 42.061 -6.113 1.00 61.04 C ATOM 1087 CZ PHE A 77 -38.219 40.851 -6.762 1.00 73.02 C ATOM 0 H PHE A 77 -38.992 43.942 -11.209 1.00 20.14 H new ATOM 0 HA PHE A 77 -40.130 44.620 -8.781 1.00 1.23 H new ATOM 0 HB2 PHE A 77 -37.388 44.314 -9.906 1.00 12.22 H new ATOM 0 HB3 PHE A 77 -37.491 45.243 -8.424 1.00 12.22 H new ATOM 0 HD1 PHE A 77 -38.295 41.955 -9.943 1.00 2.43 H new ATOM 0 HD2 PHE A 77 -37.876 44.174 -6.330 1.00 52.33 H new ATOM 0 HE1 PHE A 77 -38.420 39.871 -8.650 1.00 10.04 H new ATOM 0 HE2 PHE A 77 -37.999 42.092 -5.035 1.00 61.04 H new ATOM 0 HZ PHE A 77 -38.275 39.935 -6.193 1.00 73.02 H new ATOM 1097 N GLU A 78 -40.324 47.069 -8.578 1.00 24.14 N ATOM 1098 CA GLU A 78 -40.448 48.511 -8.402 1.00 14.11 C ATOM 1099 C GLU A 78 -39.892 48.944 -7.048 1.00 24.53 C ATOM 1100 O GLU A 78 -39.381 50.055 -6.902 1.00 62.34 O ATOM 1101 CB GLU A 78 -41.913 48.938 -8.524 1.00 23.43 C ATOM 1102 CG GLU A 78 -42.530 48.615 -9.873 1.00 73.14 C ATOM 1103 CD GLU A 78 -43.944 48.079 -9.755 1.00 54.13 C ATOM 1104 OE1 GLU A 78 -44.756 48.699 -9.038 1.00 52.20 O ATOM 1105 OE2 GLU A 78 -44.238 47.038 -10.380 1.00 22.20 O ATOM 0 H GLU A 78 -41.012 46.520 -8.062 1.00 24.14 H new ATOM 0 HA GLU A 78 -39.868 48.998 -9.186 1.00 14.11 H new ATOM 0 HB2 GLU A 78 -42.492 48.447 -7.742 1.00 23.43 H new ATOM 0 HB3 GLU A 78 -41.986 50.011 -8.348 1.00 23.43 H new ATOM 0 HG2 GLU A 78 -42.536 49.514 -10.490 1.00 73.14 H new ATOM 0 HG3 GLU A 78 -41.909 47.881 -10.386 1.00 73.14 H new ATOM 1112 N ALA A 79 -39.996 48.060 -6.063 1.00 20.24 N ATOM 1113 CA ALA A 79 -39.501 48.350 -4.720 1.00 55.04 C ATOM 1114 C ALA A 79 -38.379 47.395 -4.332 1.00 10.12 C ATOM 1115 O ALA A 79 -38.167 46.371 -4.983 1.00 30.44 O ATOM 1116 CB ALA A 79 -40.639 48.269 -3.711 1.00 44.54 C ATOM 0 H ALA A 79 -40.418 47.137 -6.167 1.00 20.24 H new ATOM 0 HA ALA A 79 -39.098 49.363 -4.717 1.00 55.04 H new ATOM 0 HB1 ALA A 79 -40.257 48.487 -2.714 1.00 44.54 H new ATOM 0 HB2 ALA A 79 -41.409 48.995 -3.972 1.00 44.54 H new ATOM 0 HB3 ALA A 79 -41.067 47.266 -3.725 1.00 44.54 H new ATOM 1122 N SER A 80 -37.660 47.737 -3.267 1.00 4.51 N ATOM 1123 CA SER A 80 -36.554 46.912 -2.795 1.00 34.35 C ATOM 1124 C SER A 80 -37.003 45.470 -2.587 1.00 75.33 C ATOM 1125 O SER A 80 -36.201 44.540 -2.676 1.00 45.14 O ATOM 1126 CB SER A 80 -35.993 47.476 -1.488 1.00 21.05 C ATOM 1127 OG SER A 80 -37.009 47.610 -0.510 1.00 73.23 O ATOM 0 H SER A 80 -37.824 48.579 -2.715 1.00 4.51 H new ATOM 0 HA SER A 80 -35.772 46.925 -3.555 1.00 34.35 H new ATOM 0 HB2 SER A 80 -35.208 46.819 -1.113 1.00 21.05 H new ATOM 0 HB3 SER A 80 -35.534 48.447 -1.675 1.00 21.05 H new ATOM 0 HG SER A 80 -36.623 47.971 0.315 1.00 73.23 H new TER 1133 SER A 80 HETATM 1134 ZN ZN A 201 -35.757 65.814 -23.171 1.00 70.21 ZN HETATM 1135 ZN ZN A 401 -35.357 49.800 -19.026 1.00 33.22 ZN