USER MOD reduce.3.24.130724 H: found=0, std=0, add=671, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 671 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 13 ASN : amide:sc= 0.328 X(o=0.49,f=0.81) USER MOD Set 1.2: A 54 GLN : amide:sc= -0.0984 K(o=0.49,f=-1.1) USER MOD Set 1.3: A 59 TYR OH : rot 15:sc= 0.259 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -110:sc= 0.0948 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 7 GLN : amide:sc= 0.326 K(o=0.33,f=-4.5!) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 80:sc= 1.26 USER MOD Single : A 17 SER OG : rot 66:sc= 0.252 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 171:sc= 0.25 USER MOD Single : A 37 ASN : amide:sc= -2.17! C(o=-2.2!,f=-2.8!) USER MOD Single : A 40 GLN : amide:sc= 0.0786 K(o=0.079,f=-9.2!) USER MOD Single : A 44 HIS : no HE2:sc= -3.27 K(o=-3.3,f=-6.9!) USER MOD Single : A 45 SER OG : rot 144:sc= 0.762 USER MOD Single : A 47 LYS NZ :NH3+ -165:sc= 0.139 (180deg=-0.022) USER MOD Single : A 49 MET CE :methyl 151:sc= -0.754 (180deg=-3.03!) USER MOD Single : A 56 HIS : no HD1:sc= -0.0125 X(o=-0.013,f=0) USER MOD Single : A 60 GLN : amide:sc= -1.09 K(o=-1.1,f=-4.9!) USER MOD Single : A 66 LYS NZ :NH3+ -160:sc= 0.82 (180deg=-0.158!) USER MOD Single : A 71 GLN : amide:sc= -6.41! C(o=-6.4!,f=-7.6!) USER MOD Single : A 73 THR OG1 : rot 59:sc= 0.733 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 129:sc= 0.652 USER MOD Single : A 85 SER OG : rot -22:sc= 0.549 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.530 -3.202 1.181 1.00 0.00 N ATOM 2 CA MET A 1 8.281 -2.284 2.313 1.00 0.00 C ATOM 3 C MET A 1 9.602 -1.789 2.870 1.00 0.00 C ATOM 4 O MET A 1 10.639 -2.419 2.667 1.00 0.00 O ATOM 5 CB MET A 1 7.484 -2.988 3.410 1.00 0.00 C ATOM 6 CG MET A 1 5.981 -2.953 3.188 1.00 0.00 C ATOM 7 SD MET A 1 5.188 -4.531 3.554 1.00 0.00 S ATOM 8 CE MET A 1 4.596 -4.238 5.219 1.00 0.00 C ATOM 0 H1 MET A 1 8.237 -2.746 0.293 1.00 0.00 H new ATOM 0 H2 MET A 1 9.544 -3.429 1.135 1.00 0.00 H new ATOM 0 H3 MET A 1 7.985 -4.077 1.317 1.00 0.00 H new ATOM 0 HA MET A 1 7.699 -1.435 1.954 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.809 -4.026 3.474 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.712 -2.523 4.369 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.543 -2.177 3.815 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.777 -2.680 2.153 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.082 -5.127 5.584 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.440 -4.014 5.871 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.906 -3.395 5.217 1.00 0.00 H new ATOM 20 N GLY A 2 9.560 -0.669 3.574 1.00 0.00 N ATOM 21 CA GLY A 2 10.771 -0.086 4.106 1.00 0.00 C ATOM 22 C GLY A 2 11.114 1.215 3.420 1.00 0.00 C ATOM 23 O GLY A 2 10.236 1.880 2.864 1.00 0.00 O ATOM 0 H GLY A 2 8.706 -0.153 3.786 1.00 0.00 H new ATOM 0 HA2 GLY A 2 10.652 0.087 5.176 1.00 0.00 H new ATOM 0 HA3 GLY A 2 11.596 -0.789 3.987 1.00 0.00 H new ATOM 27 N VAL A 3 12.385 1.579 3.452 1.00 0.00 N ATOM 28 CA VAL A 3 12.840 2.812 2.836 1.00 0.00 C ATOM 29 C VAL A 3 14.295 2.683 2.383 1.00 0.00 C ATOM 30 O VAL A 3 15.203 2.523 3.200 1.00 0.00 O ATOM 31 CB VAL A 3 12.684 4.015 3.800 1.00 0.00 C ATOM 32 CG1 VAL A 3 13.135 3.658 5.208 1.00 0.00 C ATOM 33 CG2 VAL A 3 13.438 5.234 3.289 1.00 0.00 C ATOM 0 H VAL A 3 13.122 1.035 3.900 1.00 0.00 H new ATOM 0 HA VAL A 3 12.214 2.995 1.962 1.00 0.00 H new ATOM 0 HB VAL A 3 11.624 4.264 3.838 1.00 0.00 H new ATOM 0 HG11 VAL A 3 13.013 4.523 5.860 1.00 0.00 H new ATOM 0 HG12 VAL A 3 12.532 2.832 5.585 1.00 0.00 H new ATOM 0 HG13 VAL A 3 14.184 3.363 5.190 1.00 0.00 H new ATOM 0 HG21 VAL A 3 13.309 6.061 3.987 1.00 0.00 H new ATOM 0 HG22 VAL A 3 14.498 4.996 3.201 1.00 0.00 H new ATOM 0 HG23 VAL A 3 13.048 5.520 2.312 1.00 0.00 H new ATOM 43 N THR A 4 14.505 2.706 1.077 1.00 0.00 N ATOM 44 CA THR A 4 15.847 2.661 0.515 1.00 0.00 C ATOM 45 C THR A 4 15.873 3.329 -0.854 1.00 0.00 C ATOM 46 O THR A 4 15.405 2.765 -1.844 1.00 0.00 O ATOM 47 CB THR A 4 16.366 1.213 0.384 1.00 0.00 C ATOM 48 OG1 THR A 4 16.206 0.516 1.627 1.00 0.00 O ATOM 49 CG2 THR A 4 17.834 1.200 -0.023 1.00 0.00 C ATOM 0 H THR A 4 13.760 2.756 0.382 1.00 0.00 H new ATOM 0 HA THR A 4 16.500 3.199 1.201 1.00 0.00 H new ATOM 0 HB THR A 4 15.783 0.712 -0.389 1.00 0.00 H new ATOM 0 HG1 THR A 4 16.537 -0.402 1.532 1.00 0.00 H new ATOM 0 HG21 THR A 4 18.179 0.169 -0.109 1.00 0.00 H new ATOM 0 HG22 THR A 4 17.950 1.703 -0.983 1.00 0.00 H new ATOM 0 HG23 THR A 4 18.425 1.718 0.732 1.00 0.00 H new ATOM 57 N GLU A 5 16.401 4.542 -0.900 1.00 0.00 N ATOM 58 CA GLU A 5 16.531 5.267 -2.153 1.00 0.00 C ATOM 59 C GLU A 5 17.938 5.829 -2.303 1.00 0.00 C ATOM 60 O GLU A 5 18.161 7.028 -2.177 1.00 0.00 O ATOM 61 CB GLU A 5 15.498 6.393 -2.239 1.00 0.00 C ATOM 62 CG GLU A 5 15.132 6.998 -0.891 1.00 0.00 C ATOM 63 CD GLU A 5 13.645 7.218 -0.734 1.00 0.00 C ATOM 64 OE1 GLU A 5 13.001 7.674 -1.704 1.00 0.00 O ATOM 65 OE2 GLU A 5 13.104 6.927 0.350 1.00 0.00 O ATOM 0 H GLU A 5 16.747 5.045 -0.083 1.00 0.00 H new ATOM 0 HA GLU A 5 16.347 4.568 -2.969 1.00 0.00 H new ATOM 0 HB2 GLU A 5 15.886 7.180 -2.886 1.00 0.00 H new ATOM 0 HB3 GLU A 5 14.594 6.008 -2.711 1.00 0.00 H new ATOM 0 HG2 GLU A 5 15.484 6.341 -0.095 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.650 7.949 -0.772 1.00 0.00 H new ATOM 72 N ALA A 6 18.890 4.946 -2.561 1.00 0.00 N ATOM 73 CA ALA A 6 20.276 5.354 -2.767 1.00 0.00 C ATOM 74 C ALA A 6 20.468 5.916 -4.172 1.00 0.00 C ATOM 75 O ALA A 6 21.502 6.510 -4.487 1.00 0.00 O ATOM 76 CB ALA A 6 21.216 4.182 -2.531 1.00 0.00 C ATOM 0 H ALA A 6 18.731 3.941 -2.633 1.00 0.00 H new ATOM 0 HA ALA A 6 20.513 6.138 -2.048 1.00 0.00 H new ATOM 0 HB1 ALA A 6 22.245 4.504 -2.689 1.00 0.00 H new ATOM 0 HB2 ALA A 6 21.101 3.823 -1.508 1.00 0.00 H new ATOM 0 HB3 ALA A 6 20.977 3.378 -3.227 1.00 0.00 H new ATOM 82 N GLN A 7 19.458 5.719 -5.010 1.00 0.00 N ATOM 83 CA GLN A 7 19.472 6.216 -6.380 1.00 0.00 C ATOM 84 C GLN A 7 19.021 7.674 -6.435 1.00 0.00 C ATOM 85 O GLN A 7 19.097 8.320 -7.476 1.00 0.00 O ATOM 86 CB GLN A 7 18.553 5.366 -7.255 1.00 0.00 C ATOM 87 CG GLN A 7 17.124 5.276 -6.741 1.00 0.00 C ATOM 88 CD GLN A 7 16.822 3.960 -6.059 1.00 0.00 C ATOM 89 OE1 GLN A 7 17.560 3.520 -5.177 1.00 0.00 O ATOM 90 NE2 GLN A 7 15.728 3.330 -6.453 1.00 0.00 N ATOM 0 H GLN A 7 18.609 5.212 -4.760 1.00 0.00 H new ATOM 0 HA GLN A 7 20.494 6.152 -6.753 1.00 0.00 H new ATOM 0 HB2 GLN A 7 18.541 5.781 -8.263 1.00 0.00 H new ATOM 0 HB3 GLN A 7 18.966 4.360 -7.329 1.00 0.00 H new ATOM 0 HG2 GLN A 7 16.944 6.091 -6.041 1.00 0.00 H new ATOM 0 HG3 GLN A 7 16.435 5.413 -7.574 1.00 0.00 H new ATOM 0 HE21 GLN A 7 15.145 3.731 -7.188 1.00 0.00 H new ATOM 0 HE22 GLN A 7 15.467 2.443 -6.022 1.00 0.00 H new ATOM 99 N TYR A 8 18.531 8.166 -5.309 1.00 0.00 N ATOM 100 CA TYR A 8 18.080 9.544 -5.192 1.00 0.00 C ATOM 101 C TYR A 8 19.261 10.500 -5.355 1.00 0.00 C ATOM 102 O TYR A 8 20.046 10.680 -4.427 1.00 0.00 O ATOM 103 CB TYR A 8 17.388 9.735 -3.834 1.00 0.00 C ATOM 104 CG TYR A 8 17.175 11.176 -3.410 1.00 0.00 C ATOM 105 CD1 TYR A 8 16.201 11.962 -4.007 1.00 0.00 C ATOM 106 CD2 TYR A 8 17.946 11.741 -2.401 1.00 0.00 C ATOM 107 CE1 TYR A 8 16.002 13.272 -3.616 1.00 0.00 C ATOM 108 CE2 TYR A 8 17.753 13.049 -2.003 1.00 0.00 C ATOM 109 CZ TYR A 8 16.781 13.810 -2.613 1.00 0.00 C ATOM 110 OH TYR A 8 16.588 15.116 -2.219 1.00 0.00 O ATOM 0 H TYR A 8 18.435 7.623 -4.451 1.00 0.00 H new ATOM 0 HA TYR A 8 17.363 9.768 -5.982 1.00 0.00 H new ATOM 0 HB2 TYR A 8 16.419 9.236 -3.865 1.00 0.00 H new ATOM 0 HB3 TYR A 8 17.981 9.233 -3.069 1.00 0.00 H new ATOM 0 HD1 TYR A 8 15.588 11.543 -4.791 1.00 0.00 H new ATOM 0 HD2 TYR A 8 18.709 11.147 -1.920 1.00 0.00 H new ATOM 0 HE1 TYR A 8 15.241 13.871 -4.093 1.00 0.00 H new ATOM 0 HE2 TYR A 8 18.361 13.473 -1.218 1.00 0.00 H new ATOM 0 HH TYR A 8 17.218 15.338 -1.502 1.00 0.00 H new ATOM 120 N VAL A 9 19.359 11.087 -6.557 1.00 0.00 N ATOM 121 CA VAL A 9 20.437 12.013 -6.945 1.00 0.00 C ATOM 122 C VAL A 9 21.788 11.650 -6.307 1.00 0.00 C ATOM 123 O VAL A 9 22.194 12.203 -5.283 1.00 0.00 O ATOM 124 CB VAL A 9 20.062 13.503 -6.675 1.00 0.00 C ATOM 125 CG1 VAL A 9 19.699 13.757 -5.217 1.00 0.00 C ATOM 126 CG2 VAL A 9 21.184 14.429 -7.119 1.00 0.00 C ATOM 0 H VAL A 9 18.680 10.930 -7.301 1.00 0.00 H new ATOM 0 HA VAL A 9 20.555 11.899 -8.022 1.00 0.00 H new ATOM 0 HB VAL A 9 19.172 13.719 -7.266 1.00 0.00 H new ATOM 0 HG11 VAL A 9 19.446 14.809 -5.083 1.00 0.00 H new ATOM 0 HG12 VAL A 9 18.843 13.140 -4.942 1.00 0.00 H new ATOM 0 HG13 VAL A 9 20.548 13.504 -4.581 1.00 0.00 H new ATOM 0 HG21 VAL A 9 20.902 15.463 -6.922 1.00 0.00 H new ATOM 0 HG22 VAL A 9 22.093 14.189 -6.568 1.00 0.00 H new ATOM 0 HG23 VAL A 9 21.362 14.299 -8.186 1.00 0.00 H new ATOM 136 N ALA A 10 22.480 10.707 -6.931 1.00 0.00 N ATOM 137 CA ALA A 10 23.757 10.227 -6.422 1.00 0.00 C ATOM 138 C ALA A 10 24.916 11.033 -7.006 1.00 0.00 C ATOM 139 O ALA A 10 25.247 10.891 -8.180 1.00 0.00 O ATOM 140 CB ALA A 10 23.927 8.748 -6.734 1.00 0.00 C ATOM 0 H ALA A 10 22.177 10.257 -7.795 1.00 0.00 H new ATOM 0 HA ALA A 10 23.765 10.360 -5.340 1.00 0.00 H new ATOM 0 HB1 ALA A 10 24.886 8.403 -6.348 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.122 8.182 -6.265 1.00 0.00 H new ATOM 0 HB3 ALA A 10 23.895 8.598 -7.813 1.00 0.00 H new ATOM 146 N PRO A 11 25.541 11.890 -6.189 1.00 0.00 N ATOM 147 CA PRO A 11 26.652 12.733 -6.602 1.00 0.00 C ATOM 148 C PRO A 11 28.011 12.122 -6.250 1.00 0.00 C ATOM 149 O PRO A 11 28.107 10.913 -6.016 1.00 0.00 O ATOM 150 CB PRO A 11 26.392 13.997 -5.793 1.00 0.00 C ATOM 151 CG PRO A 11 25.701 13.536 -4.539 1.00 0.00 C ATOM 152 CD PRO A 11 25.206 12.130 -4.782 1.00 0.00 C ATOM 0 HA PRO A 11 26.700 12.886 -7.680 1.00 0.00 H new ATOM 0 HB2 PRO A 11 27.324 14.513 -5.561 1.00 0.00 H new ATOM 0 HB3 PRO A 11 25.770 14.698 -6.349 1.00 0.00 H new ATOM 0 HG2 PRO A 11 26.387 13.560 -3.693 1.00 0.00 H new ATOM 0 HG3 PRO A 11 24.870 14.198 -4.294 1.00 0.00 H new ATOM 0 HD2 PRO A 11 25.696 11.412 -4.124 1.00 0.00 H new ATOM 0 HD3 PRO A 11 24.134 12.045 -4.604 1.00 0.00 H new ATOM 160 N THR A 12 29.054 12.947 -6.188 1.00 0.00 N ATOM 161 CA THR A 12 30.392 12.436 -5.930 1.00 0.00 C ATOM 162 C THR A 12 31.117 13.266 -4.876 1.00 0.00 C ATOM 163 O THR A 12 31.279 12.830 -3.734 1.00 0.00 O ATOM 164 CB THR A 12 31.242 12.405 -7.217 1.00 0.00 C ATOM 165 OG1 THR A 12 30.398 12.206 -8.359 1.00 0.00 O ATOM 166 CG2 THR A 12 32.284 11.301 -7.150 1.00 0.00 C ATOM 0 H THR A 12 28.998 13.958 -6.311 1.00 0.00 H new ATOM 0 HA THR A 12 30.268 11.419 -5.558 1.00 0.00 H new ATOM 0 HB THR A 12 31.756 13.362 -7.310 1.00 0.00 H new ATOM 0 HG1 THR A 12 29.975 13.055 -8.605 1.00 0.00 H new ATOM 0 HG21 THR A 12 32.871 11.299 -8.068 1.00 0.00 H new ATOM 0 HG22 THR A 12 32.943 11.473 -6.299 1.00 0.00 H new ATOM 0 HG23 THR A 12 31.787 10.338 -7.035 1.00 0.00 H new ATOM 174 N ASN A 13 31.536 14.463 -5.258 1.00 0.00 N ATOM 175 CA ASN A 13 32.296 15.323 -4.369 1.00 0.00 C ATOM 176 C ASN A 13 31.373 16.372 -3.791 1.00 0.00 C ATOM 177 O ASN A 13 30.407 16.754 -4.434 1.00 0.00 O ATOM 178 CB ASN A 13 33.461 15.997 -5.112 1.00 0.00 C ATOM 179 CG ASN A 13 33.731 15.392 -6.478 1.00 0.00 C ATOM 180 OD1 ASN A 13 34.237 14.278 -6.593 1.00 0.00 O ATOM 181 ND2 ASN A 13 33.396 16.128 -7.528 1.00 0.00 N ATOM 0 H ASN A 13 31.361 14.860 -6.181 1.00 0.00 H new ATOM 0 HA ASN A 13 32.718 14.717 -3.568 1.00 0.00 H new ATOM 0 HB2 ASN A 13 33.243 17.059 -5.229 1.00 0.00 H new ATOM 0 HB3 ASN A 13 34.363 15.922 -4.504 1.00 0.00 H new ATOM 0 HD21 ASN A 13 33.556 15.774 -8.471 1.00 0.00 H new ATOM 0 HD22 ASN A 13 32.978 17.049 -7.393 1.00 0.00 H new ATOM 188 N ALA A 14 31.686 16.830 -2.588 1.00 0.00 N ATOM 189 CA ALA A 14 30.854 17.789 -1.855 1.00 0.00 C ATOM 190 C ALA A 14 30.404 18.961 -2.725 1.00 0.00 C ATOM 191 O ALA A 14 29.249 19.383 -2.655 1.00 0.00 O ATOM 192 CB ALA A 14 31.605 18.302 -0.639 1.00 0.00 C ATOM 0 H ALA A 14 32.528 16.549 -2.085 1.00 0.00 H new ATOM 0 HA ALA A 14 29.954 17.260 -1.540 1.00 0.00 H new ATOM 0 HB1 ALA A 14 30.981 19.014 -0.099 1.00 0.00 H new ATOM 0 HB2 ALA A 14 31.851 17.466 0.016 1.00 0.00 H new ATOM 0 HB3 ALA A 14 32.523 18.795 -0.959 1.00 0.00 H new ATOM 198 N VAL A 15 31.318 19.485 -3.532 1.00 0.00 N ATOM 199 CA VAL A 15 30.995 20.573 -4.451 1.00 0.00 C ATOM 200 C VAL A 15 29.906 20.139 -5.433 1.00 0.00 C ATOM 201 O VAL A 15 28.901 20.827 -5.607 1.00 0.00 O ATOM 202 CB VAL A 15 32.241 21.030 -5.241 1.00 0.00 C ATOM 203 CG1 VAL A 15 31.878 22.114 -6.253 1.00 0.00 C ATOM 204 CG2 VAL A 15 33.325 21.530 -4.296 1.00 0.00 C ATOM 0 H VAL A 15 32.289 19.175 -3.570 1.00 0.00 H new ATOM 0 HA VAL A 15 30.635 21.410 -3.852 1.00 0.00 H new ATOM 0 HB VAL A 15 32.627 20.168 -5.786 1.00 0.00 H new ATOM 0 HG11 VAL A 15 32.772 22.419 -6.796 1.00 0.00 H new ATOM 0 HG12 VAL A 15 31.142 21.724 -6.956 1.00 0.00 H new ATOM 0 HG13 VAL A 15 31.460 22.974 -5.730 1.00 0.00 H new ATOM 0 HG21 VAL A 15 34.193 21.847 -4.874 1.00 0.00 H new ATOM 0 HG22 VAL A 15 32.945 22.374 -3.720 1.00 0.00 H new ATOM 0 HG23 VAL A 15 33.614 20.728 -3.617 1.00 0.00 H new ATOM 214 N GLU A 16 30.101 18.975 -6.038 1.00 0.00 N ATOM 215 CA GLU A 16 29.177 18.459 -7.034 1.00 0.00 C ATOM 216 C GLU A 16 27.860 18.048 -6.381 1.00 0.00 C ATOM 217 O GLU A 16 26.793 18.335 -6.909 1.00 0.00 O ATOM 218 CB GLU A 16 29.804 17.274 -7.767 1.00 0.00 C ATOM 219 CG GLU A 16 29.056 16.862 -9.022 1.00 0.00 C ATOM 220 CD GLU A 16 28.725 15.386 -9.032 1.00 0.00 C ATOM 221 OE1 GLU A 16 29.417 14.608 -8.344 1.00 0.00 O ATOM 222 OE2 GLU A 16 27.773 14.999 -9.739 1.00 0.00 O ATOM 0 H GLU A 16 30.899 18.367 -5.853 1.00 0.00 H new ATOM 0 HA GLU A 16 28.968 19.247 -7.758 1.00 0.00 H new ATOM 0 HB2 GLU A 16 30.830 17.526 -8.034 1.00 0.00 H new ATOM 0 HB3 GLU A 16 29.851 16.423 -7.088 1.00 0.00 H new ATOM 0 HG2 GLU A 16 28.135 17.440 -9.100 1.00 0.00 H new ATOM 0 HG3 GLU A 16 29.659 17.103 -9.898 1.00 0.00 H new ATOM 229 N SER A 17 27.952 17.368 -5.242 1.00 0.00 N ATOM 230 CA SER A 17 26.784 16.995 -4.463 1.00 0.00 C ATOM 231 C SER A 17 25.875 18.196 -4.182 1.00 0.00 C ATOM 232 O SER A 17 24.684 18.175 -4.503 1.00 0.00 O ATOM 233 CB SER A 17 27.232 16.375 -3.142 1.00 0.00 C ATOM 234 OG SER A 17 28.219 15.377 -3.347 1.00 0.00 O ATOM 0 H SER A 17 28.837 17.063 -4.837 1.00 0.00 H new ATOM 0 HA SER A 17 26.211 16.274 -5.046 1.00 0.00 H new ATOM 0 HB2 SER A 17 27.629 17.153 -2.489 1.00 0.00 H new ATOM 0 HB3 SER A 17 26.372 15.939 -2.633 1.00 0.00 H new ATOM 0 HG SER A 17 29.034 15.791 -3.701 1.00 0.00 H new ATOM 240 N LYS A 18 26.447 19.244 -3.596 1.00 0.00 N ATOM 241 CA LYS A 18 25.680 20.418 -3.191 1.00 0.00 C ATOM 242 C LYS A 18 25.060 21.111 -4.396 1.00 0.00 C ATOM 243 O LYS A 18 23.929 21.589 -4.340 1.00 0.00 O ATOM 244 CB LYS A 18 26.566 21.396 -2.421 1.00 0.00 C ATOM 245 CG LYS A 18 26.454 21.253 -0.913 1.00 0.00 C ATOM 246 CD LYS A 18 26.794 22.553 -0.207 1.00 0.00 C ATOM 247 CE LYS A 18 25.701 22.959 0.769 1.00 0.00 C ATOM 248 NZ LYS A 18 25.416 24.418 0.717 1.00 0.00 N ATOM 0 H LYS A 18 27.444 19.304 -3.390 1.00 0.00 H new ATOM 0 HA LYS A 18 24.874 20.082 -2.539 1.00 0.00 H new ATOM 0 HB2 LYS A 18 27.604 21.244 -2.717 1.00 0.00 H new ATOM 0 HB3 LYS A 18 26.300 22.415 -2.703 1.00 0.00 H new ATOM 0 HG2 LYS A 18 25.441 20.948 -0.649 1.00 0.00 H new ATOM 0 HG3 LYS A 18 27.124 20.465 -0.570 1.00 0.00 H new ATOM 0 HD2 LYS A 18 27.738 22.442 0.327 1.00 0.00 H new ATOM 0 HD3 LYS A 18 26.936 23.343 -0.945 1.00 0.00 H new ATOM 0 HE2 LYS A 18 24.790 22.404 0.543 1.00 0.00 H new ATOM 0 HE3 LYS A 18 25.999 22.684 1.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 24.665 24.650 1.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 26.277 24.949 0.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 25.106 24.677 -0.241 1.00 0.00 H new ATOM 262 N LEU A 19 25.798 21.168 -5.491 1.00 0.00 N ATOM 263 CA LEU A 19 25.275 21.781 -6.698 1.00 0.00 C ATOM 264 C LEU A 19 24.141 20.947 -7.257 1.00 0.00 C ATOM 265 O LEU A 19 23.106 21.483 -7.625 1.00 0.00 O ATOM 266 CB LEU A 19 26.366 21.957 -7.753 1.00 0.00 C ATOM 267 CG LEU A 19 26.841 23.396 -7.955 1.00 0.00 C ATOM 268 CD1 LEU A 19 28.239 23.582 -7.388 1.00 0.00 C ATOM 269 CD2 LEU A 19 26.806 23.763 -9.431 1.00 0.00 C ATOM 0 H LEU A 19 26.747 20.803 -5.569 1.00 0.00 H new ATOM 0 HA LEU A 19 24.899 22.770 -6.435 1.00 0.00 H new ATOM 0 HB2 LEU A 19 27.222 21.343 -7.475 1.00 0.00 H new ATOM 0 HB3 LEU A 19 25.996 21.575 -8.704 1.00 0.00 H new ATOM 0 HG LEU A 19 26.165 24.062 -7.419 1.00 0.00 H new ATOM 0 HD11 LEU A 19 28.560 24.612 -7.541 1.00 0.00 H new ATOM 0 HD12 LEU A 19 28.232 23.359 -6.321 1.00 0.00 H new ATOM 0 HD13 LEU A 19 28.930 22.908 -7.895 1.00 0.00 H new ATOM 0 HD21 LEU A 19 27.147 24.790 -9.559 1.00 0.00 H new ATOM 0 HD22 LEU A 19 27.460 23.092 -9.988 1.00 0.00 H new ATOM 0 HD23 LEU A 19 25.786 23.670 -9.805 1.00 0.00 H new ATOM 281 N ALA A 20 24.335 19.632 -7.276 1.00 0.00 N ATOM 282 CA ALA A 20 23.358 18.702 -7.827 1.00 0.00 C ATOM 283 C ALA A 20 21.981 18.913 -7.217 1.00 0.00 C ATOM 284 O ALA A 20 20.973 18.891 -7.922 1.00 0.00 O ATOM 285 CB ALA A 20 23.812 17.267 -7.608 1.00 0.00 C ATOM 0 H ALA A 20 25.174 19.182 -6.910 1.00 0.00 H new ATOM 0 HA ALA A 20 23.284 18.895 -8.897 1.00 0.00 H new ATOM 0 HB1 ALA A 20 23.072 16.584 -8.025 1.00 0.00 H new ATOM 0 HB2 ALA A 20 24.771 17.109 -8.102 1.00 0.00 H new ATOM 0 HB3 ALA A 20 23.919 17.078 -6.540 1.00 0.00 H new ATOM 291 N GLU A 21 21.942 19.147 -5.910 1.00 0.00 N ATOM 292 CA GLU A 21 20.672 19.322 -5.220 1.00 0.00 C ATOM 293 C GLU A 21 20.129 20.739 -5.408 1.00 0.00 C ATOM 294 O GLU A 21 18.919 20.954 -5.325 1.00 0.00 O ATOM 295 CB GLU A 21 20.790 18.987 -3.726 1.00 0.00 C ATOM 296 CG GLU A 21 22.072 19.476 -3.073 1.00 0.00 C ATOM 297 CD GLU A 21 22.106 19.214 -1.580 1.00 0.00 C ATOM 298 OE1 GLU A 21 21.225 19.729 -0.860 1.00 0.00 O ATOM 299 OE2 GLU A 21 23.016 18.496 -1.115 1.00 0.00 O ATOM 0 H GLU A 21 22.766 19.219 -5.313 1.00 0.00 H new ATOM 0 HA GLU A 21 19.966 18.622 -5.667 1.00 0.00 H new ATOM 0 HB2 GLU A 21 19.940 19.422 -3.200 1.00 0.00 H new ATOM 0 HB3 GLU A 21 20.723 17.906 -3.602 1.00 0.00 H new ATOM 0 HG2 GLU A 21 22.924 18.985 -3.543 1.00 0.00 H new ATOM 0 HG3 GLU A 21 22.181 20.546 -3.252 1.00 0.00 H new ATOM 306 N ILE A 22 21.012 21.710 -5.663 1.00 0.00 N ATOM 307 CA ILE A 22 20.573 23.101 -5.794 1.00 0.00 C ATOM 308 C ILE A 22 20.785 23.671 -7.209 1.00 0.00 C ATOM 309 O ILE A 22 21.009 24.870 -7.371 1.00 0.00 O ATOM 310 CB ILE A 22 21.268 24.025 -4.757 1.00 0.00 C ATOM 311 CG1 ILE A 22 21.554 23.268 -3.451 1.00 0.00 C ATOM 312 CG2 ILE A 22 20.413 25.259 -4.478 1.00 0.00 C ATOM 313 CD1 ILE A 22 20.325 23.016 -2.601 1.00 0.00 C ATOM 0 H ILE A 22 22.014 21.563 -5.781 1.00 0.00 H new ATOM 0 HA ILE A 22 19.501 23.083 -5.598 1.00 0.00 H new ATOM 0 HB ILE A 22 22.219 24.349 -5.180 1.00 0.00 H new ATOM 0 HG12 ILE A 22 22.018 22.312 -3.692 1.00 0.00 H new ATOM 0 HG13 ILE A 22 22.278 23.835 -2.866 1.00 0.00 H new ATOM 0 HG21 ILE A 22 20.917 25.894 -3.749 1.00 0.00 H new ATOM 0 HG22 ILE A 22 20.265 25.816 -5.403 1.00 0.00 H new ATOM 0 HG23 ILE A 22 19.446 24.950 -4.082 1.00 0.00 H new ATOM 0 HD11 ILE A 22 20.612 22.477 -1.698 1.00 0.00 H new ATOM 0 HD12 ILE A 22 19.871 23.968 -2.327 1.00 0.00 H new ATOM 0 HD13 ILE A 22 19.608 22.421 -3.166 1.00 0.00 H new ATOM 325 N TRP A 23 20.719 22.823 -8.237 1.00 0.00 N ATOM 326 CA TRP A 23 20.706 23.322 -9.616 1.00 0.00 C ATOM 327 C TRP A 23 19.635 22.616 -10.451 1.00 0.00 C ATOM 328 O TRP A 23 18.994 23.247 -11.291 1.00 0.00 O ATOM 329 CB TRP A 23 22.107 23.272 -10.276 1.00 0.00 C ATOM 330 CG TRP A 23 22.653 21.911 -10.656 1.00 0.00 C ATOM 331 CD1 TRP A 23 22.219 20.686 -10.256 1.00 0.00 C ATOM 332 CD2 TRP A 23 23.786 21.665 -11.502 1.00 0.00 C ATOM 333 NE1 TRP A 23 22.992 19.697 -10.812 1.00 0.00 N ATOM 334 CE2 TRP A 23 23.964 20.272 -11.578 1.00 0.00 C ATOM 335 CE3 TRP A 23 24.663 22.490 -12.208 1.00 0.00 C ATOM 336 CZ2 TRP A 23 24.979 19.687 -12.327 1.00 0.00 C ATOM 337 CZ3 TRP A 23 25.673 21.909 -12.951 1.00 0.00 C ATOM 338 CH2 TRP A 23 25.825 20.519 -13.005 1.00 0.00 C ATOM 0 H TRP A 23 20.675 21.808 -8.147 1.00 0.00 H new ATOM 0 HA TRP A 23 20.436 24.377 -9.577 1.00 0.00 H new ATOM 0 HB2 TRP A 23 22.077 23.886 -11.176 1.00 0.00 H new ATOM 0 HB3 TRP A 23 22.817 23.741 -9.594 1.00 0.00 H new ATOM 0 HD1 TRP A 23 21.383 20.515 -9.594 1.00 0.00 H new ATOM 0 HE1 TRP A 23 22.861 18.695 -10.675 1.00 0.00 H new ATOM 0 HE3 TRP A 23 24.554 23.564 -12.174 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 25.095 18.614 -12.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 26.357 22.539 -13.500 1.00 0.00 H new ATOM 0 HH2 TRP A 23 26.626 20.096 -13.593 1.00 0.00 H new ATOM 349 N GLU A 24 19.443 21.321 -10.195 1.00 0.00 N ATOM 350 CA GLU A 24 18.361 20.518 -10.766 1.00 0.00 C ATOM 351 C GLU A 24 18.425 20.415 -12.293 1.00 0.00 C ATOM 352 O GLU A 24 18.721 19.357 -12.848 1.00 0.00 O ATOM 353 CB GLU A 24 17.021 21.083 -10.316 1.00 0.00 C ATOM 354 CG GLU A 24 15.912 20.054 -10.315 1.00 0.00 C ATOM 355 CD GLU A 24 14.805 20.375 -9.338 1.00 0.00 C ATOM 356 OE1 GLU A 24 15.076 21.024 -8.311 1.00 0.00 O ATOM 357 OE2 GLU A 24 13.652 19.973 -9.600 1.00 0.00 O ATOM 0 H GLU A 24 20.049 20.789 -9.571 1.00 0.00 H new ATOM 0 HA GLU A 24 18.479 19.500 -10.395 1.00 0.00 H new ATOM 0 HB2 GLU A 24 17.126 21.496 -9.313 1.00 0.00 H new ATOM 0 HB3 GLU A 24 16.743 21.908 -10.972 1.00 0.00 H new ATOM 0 HG2 GLU A 24 15.493 19.980 -11.318 1.00 0.00 H new ATOM 0 HG3 GLU A 24 16.331 19.078 -10.072 1.00 0.00 H new ATOM 364 N ARG A 25 18.129 21.509 -12.967 1.00 0.00 N ATOM 365 CA ARG A 25 18.134 21.537 -14.417 1.00 0.00 C ATOM 366 C ARG A 25 19.060 22.635 -14.912 1.00 0.00 C ATOM 367 O ARG A 25 19.259 22.783 -16.112 1.00 0.00 O ATOM 368 CB ARG A 25 16.719 21.776 -14.950 1.00 0.00 C ATOM 369 CG ARG A 25 16.127 20.575 -15.669 1.00 0.00 C ATOM 370 CD ARG A 25 15.792 20.899 -17.114 1.00 0.00 C ATOM 371 NE ARG A 25 14.359 20.794 -17.390 1.00 0.00 N ATOM 372 CZ ARG A 25 13.834 20.018 -18.343 1.00 0.00 C ATOM 373 NH1 ARG A 25 14.607 19.199 -19.045 1.00 0.00 N ATOM 374 NH2 ARG A 25 12.529 20.043 -18.585 1.00 0.00 N ATOM 0 H ARG A 25 17.880 22.396 -12.530 1.00 0.00 H new ATOM 0 HA ARG A 25 18.491 20.574 -14.782 1.00 0.00 H new ATOM 0 HB2 ARG A 25 16.068 22.048 -14.119 1.00 0.00 H new ATOM 0 HB3 ARG A 25 16.736 22.625 -15.633 1.00 0.00 H new ATOM 0 HG2 ARG A 25 16.833 19.746 -15.636 1.00 0.00 H new ATOM 0 HG3 ARG A 25 15.226 20.247 -15.150 1.00 0.00 H new ATOM 0 HD2 ARG A 25 16.131 21.909 -17.345 1.00 0.00 H new ATOM 0 HD3 ARG A 25 16.337 20.221 -17.771 1.00 0.00 H new ATOM 0 HE ARG A 25 13.721 21.348 -16.819 1.00 0.00 H new ATOM 0 HH11 ARG A 25 15.609 19.159 -18.859 1.00 0.00 H new ATOM 0 HH12 ARG A 25 14.199 18.610 -19.771 1.00 0.00 H new ATOM 0 HH21 ARG A 25 11.921 20.657 -18.042 1.00 0.00 H new ATOM 0 HH22 ARG A 25 12.134 19.449 -19.314 1.00 0.00 H new ATOM 388 N VAL A 26 19.592 23.411 -13.960 1.00 0.00 N ATOM 389 CA VAL A 26 20.484 24.552 -14.233 1.00 0.00 C ATOM 390 C VAL A 26 19.768 25.712 -14.951 1.00 0.00 C ATOM 391 O VAL A 26 20.339 26.796 -15.126 1.00 0.00 O ATOM 392 CB VAL A 26 21.760 24.119 -15.012 1.00 0.00 C ATOM 393 CG1 VAL A 26 21.720 24.528 -16.480 1.00 0.00 C ATOM 394 CG2 VAL A 26 23.002 24.689 -14.339 1.00 0.00 C ATOM 0 H VAL A 26 19.415 23.265 -12.966 1.00 0.00 H new ATOM 0 HA VAL A 26 20.796 24.926 -13.258 1.00 0.00 H new ATOM 0 HB VAL A 26 21.796 23.030 -14.988 1.00 0.00 H new ATOM 0 HG11 VAL A 26 22.635 24.201 -16.974 1.00 0.00 H new ATOM 0 HG12 VAL A 26 20.860 24.064 -16.964 1.00 0.00 H new ATOM 0 HG13 VAL A 26 21.636 25.612 -16.553 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.889 24.380 -14.892 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.942 25.777 -14.327 1.00 0.00 H new ATOM 0 HG23 VAL A 26 23.064 24.318 -13.316 1.00 0.00 H new ATOM 404 N LEU A 27 18.510 25.505 -15.329 1.00 0.00 N ATOM 405 CA LEU A 27 17.753 26.523 -16.056 1.00 0.00 C ATOM 406 C LEU A 27 16.296 26.561 -15.616 1.00 0.00 C ATOM 407 O LEU A 27 15.763 27.620 -15.284 1.00 0.00 O ATOM 408 CB LEU A 27 17.815 26.261 -17.561 1.00 0.00 C ATOM 409 CG LEU A 27 17.678 24.795 -17.965 1.00 0.00 C ATOM 410 CD1 LEU A 27 16.399 24.569 -18.757 1.00 0.00 C ATOM 411 CD2 LEU A 27 18.887 24.359 -18.780 1.00 0.00 C ATOM 0 H LEU A 27 17.993 24.645 -15.145 1.00 0.00 H new ATOM 0 HA LEU A 27 18.209 27.487 -15.829 1.00 0.00 H new ATOM 0 HB2 LEU A 27 17.024 26.832 -18.047 1.00 0.00 H new ATOM 0 HB3 LEU A 27 18.763 26.641 -17.942 1.00 0.00 H new ATOM 0 HG LEU A 27 17.628 24.193 -17.058 1.00 0.00 H new ATOM 0 HD11 LEU A 27 16.323 23.517 -19.034 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.539 24.846 -18.147 1.00 0.00 H new ATOM 0 HD13 LEU A 27 16.417 25.181 -19.659 1.00 0.00 H new ATOM 0 HD21 LEU A 27 18.777 23.312 -19.062 1.00 0.00 H new ATOM 0 HD22 LEU A 27 18.960 24.971 -19.679 1.00 0.00 H new ATOM 0 HD23 LEU A 27 19.791 24.481 -18.184 1.00 0.00 H new ATOM 423 N GLY A 28 15.652 25.400 -15.616 1.00 0.00 N ATOM 424 CA GLY A 28 14.240 25.344 -15.311 1.00 0.00 C ATOM 425 C GLY A 28 13.978 24.610 -14.027 1.00 0.00 C ATOM 426 O GLY A 28 12.825 24.430 -13.638 1.00 0.00 O ATOM 0 H GLY A 28 16.084 24.499 -15.822 1.00 0.00 H new ATOM 0 HA2 GLY A 28 13.843 26.356 -15.239 1.00 0.00 H new ATOM 0 HA3 GLY A 28 13.711 24.851 -16.127 1.00 0.00 H new ATOM 430 N VAL A 29 15.071 24.204 -13.374 1.00 0.00 N ATOM 431 CA VAL A 29 15.031 23.449 -12.109 1.00 0.00 C ATOM 432 C VAL A 29 13.853 22.470 -12.057 1.00 0.00 C ATOM 433 O VAL A 29 12.868 22.697 -11.353 1.00 0.00 O ATOM 434 CB VAL A 29 14.994 24.364 -10.852 1.00 0.00 C ATOM 435 CG1 VAL A 29 16.402 24.713 -10.403 1.00 0.00 C ATOM 436 CG2 VAL A 29 14.184 25.634 -11.084 1.00 0.00 C ATOM 0 H VAL A 29 16.017 24.389 -13.707 1.00 0.00 H new ATOM 0 HA VAL A 29 15.964 22.886 -12.089 1.00 0.00 H new ATOM 0 HB VAL A 29 14.496 23.800 -10.063 1.00 0.00 H new ATOM 0 HG11 VAL A 29 16.355 25.354 -9.522 1.00 0.00 H new ATOM 0 HG12 VAL A 29 16.943 23.799 -10.158 1.00 0.00 H new ATOM 0 HG13 VAL A 29 16.920 25.237 -11.206 1.00 0.00 H new ATOM 0 HG21 VAL A 29 14.188 26.239 -10.177 1.00 0.00 H new ATOM 0 HG22 VAL A 29 14.626 26.203 -11.902 1.00 0.00 H new ATOM 0 HG23 VAL A 29 13.158 25.370 -11.339 1.00 0.00 H new ATOM 446 N SER A 30 13.972 21.369 -12.787 1.00 0.00 N ATOM 447 CA SER A 30 12.870 20.437 -12.941 1.00 0.00 C ATOM 448 C SER A 30 13.389 19.029 -13.220 1.00 0.00 C ATOM 449 O SER A 30 13.182 18.483 -14.302 1.00 0.00 O ATOM 450 CB SER A 30 11.961 20.899 -14.084 1.00 0.00 C ATOM 451 OG SER A 30 12.680 21.705 -15.012 1.00 0.00 O ATOM 0 H SER A 30 14.823 21.102 -13.281 1.00 0.00 H new ATOM 0 HA SER A 30 12.299 20.413 -12.013 1.00 0.00 H new ATOM 0 HB2 SER A 30 11.545 20.031 -14.596 1.00 0.00 H new ATOM 0 HB3 SER A 30 11.121 21.464 -13.680 1.00 0.00 H new ATOM 0 HG SER A 30 12.125 21.868 -15.803 1.00 0.00 H new ATOM 457 N GLY A 31 14.093 18.460 -12.255 1.00 0.00 N ATOM 458 CA GLY A 31 14.584 17.106 -12.412 1.00 0.00 C ATOM 459 C GLY A 31 15.599 16.705 -11.360 1.00 0.00 C ATOM 460 O GLY A 31 16.751 16.428 -11.677 1.00 0.00 O ATOM 0 H GLY A 31 14.333 18.907 -11.370 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.741 16.416 -12.374 1.00 0.00 H new ATOM 0 HA3 GLY A 31 15.036 17.004 -13.399 1.00 0.00 H new ATOM 464 N ILE A 32 15.183 16.708 -10.102 1.00 0.00 N ATOM 465 CA ILE A 32 15.989 16.154 -9.031 1.00 0.00 C ATOM 466 C ILE A 32 15.119 15.280 -8.141 1.00 0.00 C ATOM 467 O ILE A 32 14.160 15.752 -7.525 1.00 0.00 O ATOM 468 CB ILE A 32 16.683 17.260 -8.197 1.00 0.00 C ATOM 469 CG1 ILE A 32 17.986 17.693 -8.869 1.00 0.00 C ATOM 470 CG2 ILE A 32 16.962 16.801 -6.772 1.00 0.00 C ATOM 471 CD1 ILE A 32 18.974 16.565 -9.074 1.00 0.00 C ATOM 0 H ILE A 32 14.287 17.091 -9.800 1.00 0.00 H new ATOM 0 HA ILE A 32 16.778 15.549 -9.478 1.00 0.00 H new ATOM 0 HB ILE A 32 16.001 18.109 -8.148 1.00 0.00 H new ATOM 0 HG12 ILE A 32 17.754 18.140 -9.836 1.00 0.00 H new ATOM 0 HG13 ILE A 32 18.455 18.469 -8.264 1.00 0.00 H new ATOM 0 HG21 ILE A 32 17.449 17.605 -6.220 1.00 0.00 H new ATOM 0 HG22 ILE A 32 16.023 16.542 -6.283 1.00 0.00 H new ATOM 0 HG23 ILE A 32 17.614 15.928 -6.792 1.00 0.00 H new ATOM 0 HD11 ILE A 32 19.872 16.951 -9.556 1.00 0.00 H new ATOM 0 HD12 ILE A 32 19.237 16.132 -8.109 1.00 0.00 H new ATOM 0 HD13 ILE A 32 18.525 15.798 -9.705 1.00 0.00 H new ATOM 483 N GLY A 33 15.439 14.001 -8.103 1.00 0.00 N ATOM 484 CA GLY A 33 14.671 13.069 -7.317 1.00 0.00 C ATOM 485 C GLY A 33 15.341 11.720 -7.227 1.00 0.00 C ATOM 486 O GLY A 33 16.569 11.635 -7.218 1.00 0.00 O ATOM 0 H GLY A 33 16.224 13.589 -8.607 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.529 13.471 -6.314 1.00 0.00 H new ATOM 0 HA3 GLY A 33 13.680 12.953 -7.757 1.00 0.00 H new ATOM 490 N ILE A 34 14.538 10.664 -7.215 1.00 0.00 N ATOM 491 CA ILE A 34 15.040 9.303 -7.037 1.00 0.00 C ATOM 492 C ILE A 34 15.687 8.759 -8.314 1.00 0.00 C ATOM 493 O ILE A 34 15.833 7.548 -8.474 1.00 0.00 O ATOM 494 CB ILE A 34 13.918 8.345 -6.581 1.00 0.00 C ATOM 495 CG1 ILE A 34 12.720 8.402 -7.548 1.00 0.00 C ATOM 496 CG2 ILE A 34 13.495 8.666 -5.153 1.00 0.00 C ATOM 497 CD1 ILE A 34 11.575 9.291 -7.096 1.00 0.00 C ATOM 0 H ILE A 34 13.526 10.723 -7.327 1.00 0.00 H new ATOM 0 HA ILE A 34 15.802 9.355 -6.260 1.00 0.00 H new ATOM 0 HB ILE A 34 14.304 7.326 -6.598 1.00 0.00 H new ATOM 0 HG12 ILE A 34 13.071 8.752 -8.518 1.00 0.00 H new ATOM 0 HG13 ILE A 34 12.340 7.391 -7.693 1.00 0.00 H new ATOM 0 HG21 ILE A 34 12.704 7.982 -4.846 1.00 0.00 H new ATOM 0 HG22 ILE A 34 14.350 8.554 -4.486 1.00 0.00 H new ATOM 0 HG23 ILE A 34 13.128 9.691 -5.104 1.00 0.00 H new ATOM 0 HD11 ILE A 34 10.780 9.267 -7.841 1.00 0.00 H new ATOM 0 HD12 ILE A 34 11.190 8.931 -6.142 1.00 0.00 H new ATOM 0 HD13 ILE A 34 11.933 10.314 -6.980 1.00 0.00 H new ATOM 509 N LEU A 35 16.054 9.662 -9.215 1.00 0.00 N ATOM 510 CA LEU A 35 16.773 9.312 -10.440 1.00 0.00 C ATOM 511 C LEU A 35 17.332 10.573 -11.093 1.00 0.00 C ATOM 512 O LEU A 35 17.529 10.611 -12.307 1.00 0.00 O ATOM 513 CB LEU A 35 15.862 8.572 -11.430 1.00 0.00 C ATOM 514 CG LEU A 35 14.412 9.055 -11.484 1.00 0.00 C ATOM 515 CD1 LEU A 35 14.101 9.672 -12.840 1.00 0.00 C ATOM 516 CD2 LEU A 35 13.462 7.903 -11.192 1.00 0.00 C ATOM 0 H LEU A 35 15.863 10.659 -9.120 1.00 0.00 H new ATOM 0 HA LEU A 35 17.593 8.646 -10.171 1.00 0.00 H new ATOM 0 HB2 LEU A 35 16.293 8.660 -12.427 1.00 0.00 H new ATOM 0 HB3 LEU A 35 15.864 7.512 -11.175 1.00 0.00 H new ATOM 0 HG LEU A 35 14.275 9.822 -10.722 1.00 0.00 H new ATOM 0 HD11 LEU A 35 13.065 10.009 -12.857 1.00 0.00 H new ATOM 0 HD12 LEU A 35 14.762 10.521 -13.013 1.00 0.00 H new ATOM 0 HD13 LEU A 35 14.254 8.928 -13.622 1.00 0.00 H new ATOM 0 HD21 LEU A 35 12.433 8.260 -11.234 1.00 0.00 H new ATOM 0 HD22 LEU A 35 13.604 7.118 -11.934 1.00 0.00 H new ATOM 0 HD23 LEU A 35 13.668 7.505 -10.199 1.00 0.00 H new ATOM 528 N ASP A 36 17.585 11.590 -10.251 1.00 0.00 N ATOM 529 CA ASP A 36 18.055 12.921 -10.680 1.00 0.00 C ATOM 530 C ASP A 36 17.509 13.319 -12.055 1.00 0.00 C ATOM 531 O ASP A 36 16.307 13.556 -12.200 1.00 0.00 O ATOM 532 CB ASP A 36 19.592 13.030 -10.641 1.00 0.00 C ATOM 533 CG ASP A 36 20.317 11.831 -11.222 1.00 0.00 C ATOM 534 OD1 ASP A 36 20.521 11.796 -12.456 1.00 0.00 O ATOM 535 OD2 ASP A 36 20.666 10.916 -10.448 1.00 0.00 O ATOM 0 H ASP A 36 17.468 11.511 -9.241 1.00 0.00 H new ATOM 0 HA ASP A 36 17.654 13.632 -9.957 1.00 0.00 H new ATOM 0 HB2 ASP A 36 19.895 13.923 -11.187 1.00 0.00 H new ATOM 0 HB3 ASP A 36 19.909 13.166 -9.607 1.00 0.00 H new ATOM 540 N ASN A 37 18.376 13.374 -13.059 1.00 0.00 N ATOM 541 CA ASN A 37 17.976 13.813 -14.387 1.00 0.00 C ATOM 542 C ASN A 37 18.801 13.097 -15.440 1.00 0.00 C ATOM 543 O ASN A 37 19.157 13.680 -16.464 1.00 0.00 O ATOM 544 CB ASN A 37 18.139 15.327 -14.527 1.00 0.00 C ATOM 545 CG ASN A 37 16.881 16.000 -15.038 1.00 0.00 C ATOM 546 OD1 ASN A 37 15.996 15.352 -15.597 1.00 0.00 O ATOM 547 ND2 ASN A 37 16.783 17.305 -14.835 1.00 0.00 N ATOM 0 H ASN A 37 19.360 13.120 -12.977 1.00 0.00 H new ATOM 0 HA ASN A 37 16.924 13.567 -14.532 1.00 0.00 H new ATOM 0 HB2 ASN A 37 18.407 15.752 -13.560 1.00 0.00 H new ATOM 0 HB3 ASN A 37 18.963 15.539 -15.208 1.00 0.00 H new ATOM 0 HD21 ASN A 37 15.952 17.809 -15.146 1.00 0.00 H new ATOM 0 HD22 ASN A 37 17.538 17.807 -14.368 1.00 0.00 H new ATOM 554 N PHE A 38 19.096 11.826 -15.156 1.00 0.00 N ATOM 555 CA PHE A 38 19.869 10.942 -16.041 1.00 0.00 C ATOM 556 C PHE A 38 21.061 11.658 -16.678 1.00 0.00 C ATOM 557 O PHE A 38 22.104 11.819 -16.046 1.00 0.00 O ATOM 558 CB PHE A 38 18.994 10.285 -17.131 1.00 0.00 C ATOM 559 CG PHE A 38 17.594 10.825 -17.257 1.00 0.00 C ATOM 560 CD1 PHE A 38 16.590 10.396 -16.403 1.00 0.00 C ATOM 561 CD2 PHE A 38 17.288 11.755 -18.236 1.00 0.00 C ATOM 562 CE1 PHE A 38 15.304 10.888 -16.523 1.00 0.00 C ATOM 563 CE2 PHE A 38 16.004 12.250 -18.360 1.00 0.00 C ATOM 564 CZ PHE A 38 15.012 11.815 -17.502 1.00 0.00 C ATOM 0 H PHE A 38 18.801 11.372 -14.291 1.00 0.00 H new ATOM 0 HA PHE A 38 20.254 10.149 -15.400 1.00 0.00 H new ATOM 0 HB2 PHE A 38 19.496 10.399 -18.092 1.00 0.00 H new ATOM 0 HB3 PHE A 38 18.935 9.216 -16.928 1.00 0.00 H new ATOM 0 HD1 PHE A 38 16.815 9.670 -15.636 1.00 0.00 H new ATOM 0 HD2 PHE A 38 18.060 12.097 -18.909 1.00 0.00 H new ATOM 0 HE1 PHE A 38 14.529 10.547 -15.852 1.00 0.00 H new ATOM 0 HE2 PHE A 38 15.776 12.976 -19.126 1.00 0.00 H new ATOM 0 HZ PHE A 38 14.008 12.201 -17.598 1.00 0.00 H new ATOM 574 N PHE A 39 20.909 12.100 -17.921 1.00 0.00 N ATOM 575 CA PHE A 39 22.024 12.688 -18.645 1.00 0.00 C ATOM 576 C PHE A 39 21.711 14.100 -19.112 1.00 0.00 C ATOM 577 O PHE A 39 22.115 14.512 -20.195 1.00 0.00 O ATOM 578 CB PHE A 39 22.419 11.819 -19.845 1.00 0.00 C ATOM 579 CG PHE A 39 22.348 10.340 -19.593 1.00 0.00 C ATOM 580 CD1 PHE A 39 23.301 9.713 -18.806 1.00 0.00 C ATOM 581 CD2 PHE A 39 21.324 9.577 -20.130 1.00 0.00 C ATOM 582 CE1 PHE A 39 23.235 8.358 -18.559 1.00 0.00 C ATOM 583 CE2 PHE A 39 21.253 8.220 -19.889 1.00 0.00 C ATOM 584 CZ PHE A 39 22.226 7.600 -19.151 1.00 0.00 C ATOM 0 H PHE A 39 20.033 12.062 -18.442 1.00 0.00 H new ATOM 0 HA PHE A 39 22.863 12.737 -17.951 1.00 0.00 H new ATOM 0 HB2 PHE A 39 21.768 12.063 -20.684 1.00 0.00 H new ATOM 0 HB3 PHE A 39 23.435 12.075 -20.144 1.00 0.00 H new ATOM 0 HD1 PHE A 39 24.106 10.293 -18.380 1.00 0.00 H new ATOM 0 HD2 PHE A 39 20.572 10.050 -20.745 1.00 0.00 H new ATOM 0 HE1 PHE A 39 23.960 7.887 -17.911 1.00 0.00 H new ATOM 0 HE2 PHE A 39 20.428 7.645 -20.283 1.00 0.00 H new ATOM 0 HZ PHE A 39 22.212 6.527 -19.028 1.00 0.00 H new ATOM 594 N GLN A 40 21.004 14.838 -18.286 1.00 0.00 N ATOM 595 CA GLN A 40 20.701 16.229 -18.580 1.00 0.00 C ATOM 596 C GLN A 40 20.622 17.037 -17.297 1.00 0.00 C ATOM 597 O GLN A 40 19.609 17.665 -16.994 1.00 0.00 O ATOM 598 CB GLN A 40 19.402 16.360 -19.381 1.00 0.00 C ATOM 599 CG GLN A 40 18.221 15.634 -18.767 1.00 0.00 C ATOM 600 CD GLN A 40 16.961 16.472 -18.759 1.00 0.00 C ATOM 601 OE1 GLN A 40 17.001 17.696 -18.924 1.00 0.00 O ATOM 602 NE2 GLN A 40 15.836 15.818 -18.560 1.00 0.00 N ATOM 0 H GLN A 40 20.625 14.501 -17.401 1.00 0.00 H new ATOM 0 HA GLN A 40 21.510 16.626 -19.193 1.00 0.00 H new ATOM 0 HB2 GLN A 40 19.154 17.417 -19.480 1.00 0.00 H new ATOM 0 HB3 GLN A 40 19.568 15.976 -20.387 1.00 0.00 H new ATOM 0 HG2 GLN A 40 18.037 14.714 -19.322 1.00 0.00 H new ATOM 0 HG3 GLN A 40 18.468 15.346 -17.745 1.00 0.00 H new ATOM 0 HE21 GLN A 40 15.850 14.807 -18.428 1.00 0.00 H new ATOM 0 HE22 GLN A 40 14.950 16.323 -18.537 1.00 0.00 H new ATOM 611 N ILE A 41 21.720 17.058 -16.564 1.00 0.00 N ATOM 612 CA ILE A 41 21.727 17.697 -15.258 1.00 0.00 C ATOM 613 C ILE A 41 22.393 19.070 -15.304 1.00 0.00 C ATOM 614 O ILE A 41 21.965 19.998 -14.623 1.00 0.00 O ATOM 615 CB ILE A 41 22.404 16.790 -14.197 1.00 0.00 C ATOM 616 CG1 ILE A 41 22.056 17.261 -12.785 1.00 0.00 C ATOM 617 CG2 ILE A 41 23.915 16.736 -14.384 1.00 0.00 C ATOM 618 CD1 ILE A 41 20.844 16.570 -12.204 1.00 0.00 C ATOM 0 H ILE A 41 22.610 16.646 -16.845 1.00 0.00 H new ATOM 0 HA ILE A 41 20.688 17.846 -14.965 1.00 0.00 H new ATOM 0 HB ILE A 41 22.018 15.780 -14.335 1.00 0.00 H new ATOM 0 HG12 ILE A 41 22.911 17.089 -12.131 1.00 0.00 H new ATOM 0 HG13 ILE A 41 21.879 18.336 -12.802 1.00 0.00 H new ATOM 0 HG21 ILE A 41 24.353 16.091 -13.622 1.00 0.00 H new ATOM 0 HG22 ILE A 41 24.145 16.338 -15.372 1.00 0.00 H new ATOM 0 HG23 ILE A 41 24.329 17.740 -14.291 1.00 0.00 H new ATOM 0 HD11 ILE A 41 20.654 16.952 -11.201 1.00 0.00 H new ATOM 0 HD12 ILE A 41 19.977 16.763 -12.836 1.00 0.00 H new ATOM 0 HD13 ILE A 41 21.026 15.496 -12.155 1.00 0.00 H new ATOM 630 N GLY A 42 23.413 19.213 -16.139 1.00 0.00 N ATOM 631 CA GLY A 42 24.135 20.466 -16.194 1.00 0.00 C ATOM 632 C GLY A 42 24.130 21.086 -17.574 1.00 0.00 C ATOM 633 O GLY A 42 23.500 22.112 -17.795 1.00 0.00 O ATOM 0 H GLY A 42 23.751 18.490 -16.774 1.00 0.00 H new ATOM 0 HA2 GLY A 42 23.693 21.166 -15.485 1.00 0.00 H new ATOM 0 HA3 GLY A 42 25.165 20.300 -15.879 1.00 0.00 H new ATOM 637 N GLY A 43 24.817 20.444 -18.510 1.00 0.00 N ATOM 638 CA GLY A 43 24.952 20.995 -19.842 1.00 0.00 C ATOM 639 C GLY A 43 23.680 20.868 -20.646 1.00 0.00 C ATOM 640 O GLY A 43 22.809 21.720 -20.550 1.00 0.00 O ATOM 0 H GLY A 43 25.284 19.548 -18.368 1.00 0.00 H new ATOM 0 HA2 GLY A 43 25.231 22.046 -19.771 1.00 0.00 H new ATOM 0 HA3 GLY A 43 25.762 20.485 -20.364 1.00 0.00 H new ATOM 644 N HIS A 44 23.618 19.807 -21.458 1.00 0.00 N ATOM 645 CA HIS A 44 22.443 19.400 -22.267 1.00 0.00 C ATOM 646 C HIS A 44 22.020 20.435 -23.313 1.00 0.00 C ATOM 647 O HIS A 44 21.706 20.067 -24.438 1.00 0.00 O ATOM 648 CB HIS A 44 21.225 18.918 -21.430 1.00 0.00 C ATOM 649 CG HIS A 44 20.778 19.787 -20.286 1.00 0.00 C ATOM 650 ND1 HIS A 44 21.180 19.578 -18.985 1.00 0.00 N ATOM 651 CD2 HIS A 44 19.940 20.852 -20.246 1.00 0.00 C ATOM 652 CE1 HIS A 44 20.609 20.466 -18.195 1.00 0.00 C ATOM 653 NE2 HIS A 44 19.852 21.255 -18.933 1.00 0.00 N ATOM 0 H HIS A 44 24.411 19.178 -21.581 1.00 0.00 H new ATOM 0 HA HIS A 44 22.807 18.529 -22.812 1.00 0.00 H new ATOM 0 HB2 HIS A 44 20.380 18.794 -22.107 1.00 0.00 H new ATOM 0 HB3 HIS A 44 21.461 17.932 -21.030 1.00 0.00 H new ATOM 0 HD1 HIS A 44 21.822 18.847 -18.679 1.00 0.00 H new ATOM 0 HD2 HIS A 44 19.435 21.301 -21.088 1.00 0.00 H new ATOM 0 HE1 HIS A 44 20.739 20.536 -17.125 1.00 0.00 H new ATOM 662 N SER A 45 22.039 21.710 -22.972 1.00 0.00 N ATOM 663 CA SER A 45 21.635 22.747 -23.899 1.00 0.00 C ATOM 664 C SER A 45 22.844 23.225 -24.692 1.00 0.00 C ATOM 665 O SER A 45 23.095 22.767 -25.807 1.00 0.00 O ATOM 666 CB SER A 45 21.003 23.896 -23.121 1.00 0.00 C ATOM 667 OG SER A 45 21.752 24.179 -21.951 1.00 0.00 O ATOM 0 H SER A 45 22.331 22.052 -22.056 1.00 0.00 H new ATOM 0 HA SER A 45 20.900 22.355 -24.602 1.00 0.00 H new ATOM 0 HB2 SER A 45 20.953 24.784 -23.751 1.00 0.00 H new ATOM 0 HB3 SER A 45 19.979 23.639 -22.850 1.00 0.00 H new ATOM 0 HG SER A 45 21.755 25.146 -21.790 1.00 0.00 H new ATOM 673 N LEU A 46 23.614 24.119 -24.089 1.00 0.00 N ATOM 674 CA LEU A 46 24.852 24.593 -24.686 1.00 0.00 C ATOM 675 C LEU A 46 25.941 23.531 -24.540 1.00 0.00 C ATOM 676 O LEU A 46 27.003 23.622 -25.155 1.00 0.00 O ATOM 677 CB LEU A 46 25.284 25.906 -24.021 1.00 0.00 C ATOM 678 CG LEU A 46 26.713 26.355 -24.326 1.00 0.00 C ATOM 679 CD1 LEU A 46 26.786 27.002 -25.702 1.00 0.00 C ATOM 680 CD2 LEU A 46 27.209 27.315 -23.257 1.00 0.00 C ATOM 0 H LEU A 46 23.401 24.532 -23.181 1.00 0.00 H new ATOM 0 HA LEU A 46 24.691 24.779 -25.748 1.00 0.00 H new ATOM 0 HB2 LEU A 46 24.599 26.694 -24.333 1.00 0.00 H new ATOM 0 HB3 LEU A 46 25.177 25.799 -22.942 1.00 0.00 H new ATOM 0 HG LEU A 46 27.358 25.477 -24.325 1.00 0.00 H new ATOM 0 HD11 LEU A 46 27.810 27.316 -25.903 1.00 0.00 H new ATOM 0 HD12 LEU A 46 26.472 26.284 -26.459 1.00 0.00 H new ATOM 0 HD13 LEU A 46 26.128 27.871 -25.731 1.00 0.00 H new ATOM 0 HD21 LEU A 46 28.228 27.624 -23.490 1.00 0.00 H new ATOM 0 HD22 LEU A 46 26.562 28.191 -23.226 1.00 0.00 H new ATOM 0 HD23 LEU A 46 27.194 26.819 -22.287 1.00 0.00 H new ATOM 692 N LYS A 47 25.643 22.510 -23.732 1.00 0.00 N ATOM 693 CA LYS A 47 26.587 21.429 -23.461 1.00 0.00 C ATOM 694 C LYS A 47 27.869 21.982 -22.857 1.00 0.00 C ATOM 695 O LYS A 47 28.964 21.739 -23.356 1.00 0.00 O ATOM 696 CB LYS A 47 26.894 20.626 -24.734 1.00 0.00 C ATOM 697 CG LYS A 47 25.687 20.393 -25.634 1.00 0.00 C ATOM 698 CD LYS A 47 25.018 19.064 -25.335 1.00 0.00 C ATOM 699 CE LYS A 47 23.950 18.715 -26.368 1.00 0.00 C ATOM 700 NZ LYS A 47 23.305 19.921 -26.962 1.00 0.00 N ATOM 0 H LYS A 47 24.748 22.412 -23.252 1.00 0.00 H new ATOM 0 HA LYS A 47 26.125 20.752 -22.742 1.00 0.00 H new ATOM 0 HB2 LYS A 47 27.662 21.150 -25.304 1.00 0.00 H new ATOM 0 HB3 LYS A 47 27.312 19.660 -24.449 1.00 0.00 H new ATOM 0 HG2 LYS A 47 24.969 21.202 -25.498 1.00 0.00 H new ATOM 0 HG3 LYS A 47 26.000 20.417 -26.678 1.00 0.00 H new ATOM 0 HD2 LYS A 47 25.771 18.276 -25.312 1.00 0.00 H new ATOM 0 HD3 LYS A 47 24.565 19.101 -24.344 1.00 0.00 H new ATOM 0 HE2 LYS A 47 24.400 18.121 -27.163 1.00 0.00 H new ATOM 0 HE3 LYS A 47 23.187 18.094 -25.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 22.432 19.641 -27.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 23.075 20.599 -26.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 23.957 20.365 -27.640 1.00 0.00 H new ATOM 714 N ALA A 48 27.704 22.699 -21.753 1.00 0.00 N ATOM 715 CA ALA A 48 28.803 23.412 -21.107 1.00 0.00 C ATOM 716 C ALA A 48 28.315 24.160 -19.872 1.00 0.00 C ATOM 717 O ALA A 48 29.115 24.674 -19.098 1.00 0.00 O ATOM 718 CB ALA A 48 29.459 24.389 -22.076 1.00 0.00 C ATOM 0 H ALA A 48 26.807 22.804 -21.279 1.00 0.00 H new ATOM 0 HA ALA A 48 29.542 22.672 -20.799 1.00 0.00 H new ATOM 0 HB1 ALA A 48 30.274 24.908 -21.573 1.00 0.00 H new ATOM 0 HB2 ALA A 48 29.851 23.843 -22.934 1.00 0.00 H new ATOM 0 HB3 ALA A 48 28.721 25.116 -22.415 1.00 0.00 H new ATOM 724 N MET A 49 26.997 24.202 -19.685 1.00 0.00 N ATOM 725 CA MET A 49 26.399 24.913 -18.555 1.00 0.00 C ATOM 726 C MET A 49 26.924 24.382 -17.225 1.00 0.00 C ATOM 727 O MET A 49 27.066 25.131 -16.268 1.00 0.00 O ATOM 728 CB MET A 49 24.874 24.803 -18.592 1.00 0.00 C ATOM 729 CG MET A 49 24.274 25.055 -19.965 1.00 0.00 C ATOM 730 SD MET A 49 22.927 26.261 -19.944 1.00 0.00 S ATOM 731 CE MET A 49 23.558 27.475 -18.786 1.00 0.00 C ATOM 0 H MET A 49 26.321 23.751 -20.302 1.00 0.00 H new ATOM 0 HA MET A 49 26.682 25.962 -18.642 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.583 23.808 -18.256 1.00 0.00 H new ATOM 0 HB3 MET A 49 24.450 25.516 -17.884 1.00 0.00 H new ATOM 0 HG2 MET A 49 25.057 25.406 -20.637 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.904 24.114 -20.371 1.00 0.00 H new ATOM 0 HE1 MET A 49 23.155 28.457 -19.033 1.00 0.00 H new ATOM 0 HE2 MET A 49 23.258 27.203 -17.774 1.00 0.00 H new ATOM 0 HE3 MET A 49 24.646 27.504 -18.846 1.00 0.00 H new ATOM 741 N ALA A 50 27.225 23.090 -17.179 1.00 0.00 N ATOM 742 CA ALA A 50 27.768 22.468 -15.979 1.00 0.00 C ATOM 743 C ALA A 50 29.232 22.836 -15.815 1.00 0.00 C ATOM 744 O ALA A 50 29.740 22.955 -14.696 1.00 0.00 O ATOM 745 CB ALA A 50 27.608 20.957 -16.040 1.00 0.00 C ATOM 0 H ALA A 50 27.101 22.450 -17.964 1.00 0.00 H new ATOM 0 HA ALA A 50 27.213 22.838 -15.117 1.00 0.00 H new ATOM 0 HB1 ALA A 50 28.020 20.511 -15.135 1.00 0.00 H new ATOM 0 HB2 ALA A 50 26.550 20.706 -16.120 1.00 0.00 H new ATOM 0 HB3 ALA A 50 28.139 20.570 -16.909 1.00 0.00 H new ATOM 751 N VAL A 51 29.899 23.031 -16.945 1.00 0.00 N ATOM 752 CA VAL A 51 31.295 23.431 -16.954 1.00 0.00 C ATOM 753 C VAL A 51 31.434 24.865 -16.449 1.00 0.00 C ATOM 754 O VAL A 51 32.481 25.259 -15.949 1.00 0.00 O ATOM 755 CB VAL A 51 31.903 23.307 -18.369 1.00 0.00 C ATOM 756 CG1 VAL A 51 33.357 23.756 -18.391 1.00 0.00 C ATOM 757 CG2 VAL A 51 31.784 21.876 -18.867 1.00 0.00 C ATOM 0 H VAL A 51 29.490 22.917 -17.872 1.00 0.00 H new ATOM 0 HA VAL A 51 31.842 22.762 -16.290 1.00 0.00 H new ATOM 0 HB VAL A 51 31.342 23.964 -19.034 1.00 0.00 H new ATOM 0 HG11 VAL A 51 33.754 23.656 -19.401 1.00 0.00 H new ATOM 0 HG12 VAL A 51 33.421 24.798 -18.078 1.00 0.00 H new ATOM 0 HG13 VAL A 51 33.940 23.136 -17.709 1.00 0.00 H new ATOM 0 HG21 VAL A 51 32.216 21.801 -19.865 1.00 0.00 H new ATOM 0 HG22 VAL A 51 32.318 21.209 -18.190 1.00 0.00 H new ATOM 0 HG23 VAL A 51 30.733 21.590 -18.904 1.00 0.00 H new ATOM 767 N ALA A 52 30.362 25.633 -16.551 1.00 0.00 N ATOM 768 CA ALA A 52 30.384 27.015 -16.108 1.00 0.00 C ATOM 769 C ALA A 52 29.715 27.160 -14.749 1.00 0.00 C ATOM 770 O ALA A 52 29.902 28.159 -14.057 1.00 0.00 O ATOM 771 CB ALA A 52 29.711 27.916 -17.134 1.00 0.00 C ATOM 0 H ALA A 52 29.469 25.324 -16.935 1.00 0.00 H new ATOM 0 HA ALA A 52 31.425 27.323 -16.008 1.00 0.00 H new ATOM 0 HB1 ALA A 52 29.737 28.948 -16.785 1.00 0.00 H new ATOM 0 HB2 ALA A 52 30.238 27.841 -18.085 1.00 0.00 H new ATOM 0 HB3 ALA A 52 28.675 27.604 -17.268 1.00 0.00 H new ATOM 777 N ALA A 53 28.935 26.157 -14.370 1.00 0.00 N ATOM 778 CA ALA A 53 28.236 26.180 -13.093 1.00 0.00 C ATOM 779 C ALA A 53 29.184 25.914 -11.927 1.00 0.00 C ATOM 780 O ALA A 53 29.233 26.682 -10.970 1.00 0.00 O ATOM 781 CB ALA A 53 27.104 25.166 -13.092 1.00 0.00 C ATOM 0 H ALA A 53 28.771 25.319 -14.928 1.00 0.00 H new ATOM 0 HA ALA A 53 27.821 27.179 -12.962 1.00 0.00 H new ATOM 0 HB1 ALA A 53 26.591 25.195 -12.131 1.00 0.00 H new ATOM 0 HB2 ALA A 53 26.399 25.407 -13.887 1.00 0.00 H new ATOM 0 HB3 ALA A 53 27.510 24.168 -13.257 1.00 0.00 H new ATOM 787 N GLN A 54 29.947 24.828 -12.020 1.00 0.00 N ATOM 788 CA GLN A 54 30.831 24.429 -10.932 1.00 0.00 C ATOM 789 C GLN A 54 32.274 24.353 -11.412 1.00 0.00 C ATOM 790 O GLN A 54 33.193 24.816 -10.734 1.00 0.00 O ATOM 791 CB GLN A 54 30.399 23.077 -10.349 1.00 0.00 C ATOM 792 CG GLN A 54 29.946 22.058 -11.388 1.00 0.00 C ATOM 793 CD GLN A 54 29.996 20.631 -10.873 1.00 0.00 C ATOM 794 OE1 GLN A 54 30.342 20.385 -9.720 1.00 0.00 O ATOM 795 NE2 GLN A 54 29.662 19.680 -11.730 1.00 0.00 N ATOM 0 H GLN A 54 29.970 24.213 -12.833 1.00 0.00 H new ATOM 0 HA GLN A 54 30.762 25.184 -10.149 1.00 0.00 H new ATOM 0 HB2 GLN A 54 31.231 22.656 -9.784 1.00 0.00 H new ATOM 0 HB3 GLN A 54 29.586 23.243 -9.642 1.00 0.00 H new ATOM 0 HG2 GLN A 54 28.928 22.292 -11.699 1.00 0.00 H new ATOM 0 HG3 GLN A 54 30.577 22.143 -12.273 1.00 0.00 H new ATOM 0 HE21 GLN A 54 29.380 19.925 -12.679 1.00 0.00 H new ATOM 0 HE22 GLN A 54 29.686 18.702 -11.442 1.00 0.00 H new ATOM 804 N VAL A 55 32.466 23.785 -12.597 1.00 0.00 N ATOM 805 CA VAL A 55 33.801 23.566 -13.136 1.00 0.00 C ATOM 806 C VAL A 55 34.565 24.880 -13.272 1.00 0.00 C ATOM 807 O VAL A 55 35.727 24.963 -12.888 1.00 0.00 O ATOM 808 CB VAL A 55 33.743 22.851 -14.505 1.00 0.00 C ATOM 809 CG1 VAL A 55 35.143 22.544 -15.019 1.00 0.00 C ATOM 810 CG2 VAL A 55 32.917 21.580 -14.407 1.00 0.00 C ATOM 0 H VAL A 55 31.710 23.467 -13.204 1.00 0.00 H new ATOM 0 HA VAL A 55 34.330 22.926 -12.430 1.00 0.00 H new ATOM 0 HB VAL A 55 33.262 23.521 -15.218 1.00 0.00 H new ATOM 0 HG11 VAL A 55 35.074 22.041 -15.984 1.00 0.00 H new ATOM 0 HG12 VAL A 55 35.701 23.474 -15.133 1.00 0.00 H new ATOM 0 HG13 VAL A 55 35.658 21.897 -14.308 1.00 0.00 H new ATOM 0 HG21 VAL A 55 32.887 21.090 -15.380 1.00 0.00 H new ATOM 0 HG22 VAL A 55 33.368 20.909 -13.676 1.00 0.00 H new ATOM 0 HG23 VAL A 55 31.903 21.828 -14.094 1.00 0.00 H new ATOM 820 N HIS A 56 33.876 25.901 -13.767 1.00 0.00 N ATOM 821 CA HIS A 56 34.463 27.212 -14.053 1.00 0.00 C ATOM 822 C HIS A 56 35.390 27.712 -12.941 1.00 0.00 C ATOM 823 O HIS A 56 36.457 28.257 -13.219 1.00 0.00 O ATOM 824 CB HIS A 56 33.343 28.235 -14.274 1.00 0.00 C ATOM 825 CG HIS A 56 33.757 29.439 -15.068 1.00 0.00 C ATOM 826 ND1 HIS A 56 32.869 30.416 -15.470 1.00 0.00 N ATOM 827 CD2 HIS A 56 34.967 29.822 -15.534 1.00 0.00 C ATOM 828 CE1 HIS A 56 33.517 31.345 -16.148 1.00 0.00 C ATOM 829 NE2 HIS A 56 34.790 31.008 -16.201 1.00 0.00 N ATOM 0 H HIS A 56 32.881 25.845 -13.985 1.00 0.00 H new ATOM 0 HA HIS A 56 35.071 27.098 -14.951 1.00 0.00 H new ATOM 0 HB2 HIS A 56 32.514 27.745 -14.784 1.00 0.00 H new ATOM 0 HB3 HIS A 56 32.970 28.564 -13.304 1.00 0.00 H new ATOM 0 HD2 HIS A 56 35.900 29.293 -15.405 1.00 0.00 H new ATOM 0 HE1 HIS A 56 33.079 32.230 -16.585 1.00 0.00 H new ATOM 0 HE2 HIS A 56 35.525 31.543 -16.663 1.00 0.00 H new ATOM 838 N ARG A 57 34.994 27.525 -11.691 1.00 0.00 N ATOM 839 CA ARG A 57 35.721 28.127 -10.581 1.00 0.00 C ATOM 840 C ARG A 57 36.326 27.097 -9.646 1.00 0.00 C ATOM 841 O ARG A 57 37.235 27.400 -8.881 1.00 0.00 O ATOM 842 CB ARG A 57 34.800 29.061 -9.793 1.00 0.00 C ATOM 843 CG ARG A 57 33.456 28.432 -9.453 1.00 0.00 C ATOM 844 CD ARG A 57 32.900 28.963 -8.144 1.00 0.00 C ATOM 845 NE ARG A 57 32.622 27.889 -7.190 1.00 0.00 N ATOM 846 CZ ARG A 57 31.397 27.447 -6.886 1.00 0.00 C ATOM 847 NH1 ARG A 57 30.330 27.945 -7.498 1.00 0.00 N ATOM 848 NH2 ARG A 57 31.240 26.484 -5.990 1.00 0.00 N ATOM 0 H ARG A 57 34.183 26.968 -11.420 1.00 0.00 H new ATOM 0 HA ARG A 57 36.545 28.693 -11.015 1.00 0.00 H new ATOM 0 HB2 ARG A 57 35.298 29.359 -8.870 1.00 0.00 H new ATOM 0 HB3 ARG A 57 34.633 29.969 -10.372 1.00 0.00 H new ATOM 0 HG2 ARG A 57 32.747 28.632 -10.257 1.00 0.00 H new ATOM 0 HG3 ARG A 57 33.567 27.350 -9.388 1.00 0.00 H new ATOM 0 HD2 ARG A 57 33.612 29.662 -7.705 1.00 0.00 H new ATOM 0 HD3 ARG A 57 31.984 29.521 -8.339 1.00 0.00 H new ATOM 0 HE ARG A 57 33.416 27.448 -6.726 1.00 0.00 H new ATOM 0 HH11 ARG A 57 30.441 28.671 -8.206 1.00 0.00 H new ATOM 0 HH12 ARG A 57 29.399 27.602 -7.260 1.00 0.00 H new ATOM 0 HH21 ARG A 57 32.055 26.078 -5.530 1.00 0.00 H new ATOM 0 HH22 ARG A 57 30.304 26.149 -5.760 1.00 0.00 H new ATOM 862 N GLU A 58 35.839 25.884 -9.724 1.00 0.00 N ATOM 863 CA GLU A 58 36.200 24.862 -8.756 1.00 0.00 C ATOM 864 C GLU A 58 36.981 23.708 -9.381 1.00 0.00 C ATOM 865 O GLU A 58 37.796 23.068 -8.718 1.00 0.00 O ATOM 866 CB GLU A 58 34.933 24.332 -8.100 1.00 0.00 C ATOM 867 CG GLU A 58 35.016 24.275 -6.592 1.00 0.00 C ATOM 868 CD GLU A 58 34.468 25.520 -5.922 1.00 0.00 C ATOM 869 OE1 GLU A 58 34.997 26.624 -6.168 1.00 0.00 O ATOM 870 OE2 GLU A 58 33.502 25.404 -5.145 1.00 0.00 O ATOM 0 H GLU A 58 35.190 25.573 -10.447 1.00 0.00 H new ATOM 0 HA GLU A 58 36.854 25.322 -8.016 1.00 0.00 H new ATOM 0 HB2 GLU A 58 34.093 24.964 -8.386 1.00 0.00 H new ATOM 0 HB3 GLU A 58 34.725 23.333 -8.483 1.00 0.00 H new ATOM 0 HG2 GLU A 58 34.465 23.405 -6.236 1.00 0.00 H new ATOM 0 HG3 GLU A 58 36.056 24.137 -6.296 1.00 0.00 H new ATOM 877 N TYR A 59 36.751 23.453 -10.657 1.00 0.00 N ATOM 878 CA TYR A 59 37.310 22.273 -11.296 1.00 0.00 C ATOM 879 C TYR A 59 38.293 22.675 -12.378 1.00 0.00 C ATOM 880 O TYR A 59 39.221 21.938 -12.678 1.00 0.00 O ATOM 881 CB TYR A 59 36.208 21.392 -11.883 1.00 0.00 C ATOM 882 CG TYR A 59 35.311 20.745 -10.851 1.00 0.00 C ATOM 883 CD1 TYR A 59 34.198 21.412 -10.362 1.00 0.00 C ATOM 884 CD2 TYR A 59 35.571 19.465 -10.373 1.00 0.00 C ATOM 885 CE1 TYR A 59 33.368 20.828 -9.427 1.00 0.00 C ATOM 886 CE2 TYR A 59 34.742 18.871 -9.439 1.00 0.00 C ATOM 887 CZ TYR A 59 33.642 19.560 -8.970 1.00 0.00 C ATOM 888 OH TYR A 59 32.803 18.977 -8.045 1.00 0.00 O ATOM 0 H TYR A 59 36.185 24.042 -11.268 1.00 0.00 H new ATOM 0 HA TYR A 59 37.838 21.696 -10.537 1.00 0.00 H new ATOM 0 HB2 TYR A 59 35.595 21.995 -12.553 1.00 0.00 H new ATOM 0 HB3 TYR A 59 36.668 20.611 -12.488 1.00 0.00 H new ATOM 0 HD1 TYR A 59 33.977 22.407 -10.719 1.00 0.00 H new ATOM 0 HD2 TYR A 59 36.434 18.927 -10.737 1.00 0.00 H new ATOM 0 HE1 TYR A 59 32.507 21.364 -9.056 1.00 0.00 H new ATOM 0 HE2 TYR A 59 34.954 17.875 -9.079 1.00 0.00 H new ATOM 0 HH TYR A 59 31.962 19.479 -8.004 1.00 0.00 H new ATOM 898 N GLN A 60 38.087 23.855 -12.956 1.00 0.00 N ATOM 899 CA GLN A 60 39.037 24.426 -13.901 1.00 0.00 C ATOM 900 C GLN A 60 40.378 24.605 -13.214 1.00 0.00 C ATOM 901 O GLN A 60 41.425 24.666 -13.858 1.00 0.00 O ATOM 902 CB GLN A 60 38.537 25.778 -14.419 1.00 0.00 C ATOM 903 CG GLN A 60 38.471 25.864 -15.933 1.00 0.00 C ATOM 904 CD GLN A 60 37.319 25.068 -16.508 1.00 0.00 C ATOM 905 OE1 GLN A 60 36.154 25.415 -16.323 1.00 0.00 O ATOM 906 NE2 GLN A 60 37.639 23.987 -17.200 1.00 0.00 N ATOM 0 H GLN A 60 37.266 24.435 -12.784 1.00 0.00 H new ATOM 0 HA GLN A 60 39.142 23.750 -14.749 1.00 0.00 H new ATOM 0 HB2 GLN A 60 37.545 25.970 -14.009 1.00 0.00 H new ATOM 0 HB3 GLN A 60 39.193 26.565 -14.047 1.00 0.00 H new ATOM 0 HG2 GLN A 60 38.372 26.908 -16.231 1.00 0.00 H new ATOM 0 HG3 GLN A 60 39.407 25.500 -16.356 1.00 0.00 H new ATOM 0 HE21 GLN A 60 38.619 23.736 -17.329 1.00 0.00 H new ATOM 0 HE22 GLN A 60 36.906 23.405 -17.604 1.00 0.00 H new ATOM 915 N VAL A 61 40.324 24.691 -11.889 1.00 0.00 N ATOM 916 CA VAL A 61 41.527 24.789 -11.073 1.00 0.00 C ATOM 917 C VAL A 61 42.391 23.533 -11.220 1.00 0.00 C ATOM 918 O VAL A 61 43.622 23.608 -11.218 1.00 0.00 O ATOM 919 CB VAL A 61 41.176 24.993 -9.583 1.00 0.00 C ATOM 920 CG1 VAL A 61 42.430 25.226 -8.756 1.00 0.00 C ATOM 921 CG2 VAL A 61 40.204 26.148 -9.418 1.00 0.00 C ATOM 0 H VAL A 61 39.454 24.695 -11.356 1.00 0.00 H new ATOM 0 HA VAL A 61 42.087 25.654 -11.427 1.00 0.00 H new ATOM 0 HB VAL A 61 40.697 24.084 -9.220 1.00 0.00 H new ATOM 0 HG11 VAL A 61 42.155 25.367 -7.711 1.00 0.00 H new ATOM 0 HG12 VAL A 61 43.090 24.363 -8.845 1.00 0.00 H new ATOM 0 HG13 VAL A 61 42.945 26.115 -9.119 1.00 0.00 H new ATOM 0 HG21 VAL A 61 39.968 26.277 -8.362 1.00 0.00 H new ATOM 0 HG22 VAL A 61 40.656 27.062 -9.803 1.00 0.00 H new ATOM 0 HG23 VAL A 61 39.289 25.935 -9.971 1.00 0.00 H new ATOM 931 N GLU A 62 41.743 22.387 -11.364 1.00 0.00 N ATOM 932 CA GLU A 62 42.446 21.115 -11.464 1.00 0.00 C ATOM 933 C GLU A 62 42.178 20.453 -12.815 1.00 0.00 C ATOM 934 O GLU A 62 43.012 20.507 -13.722 1.00 0.00 O ATOM 935 CB GLU A 62 42.014 20.189 -10.323 1.00 0.00 C ATOM 936 CG GLU A 62 42.878 18.946 -10.179 1.00 0.00 C ATOM 937 CD GLU A 62 44.153 19.207 -9.407 1.00 0.00 C ATOM 938 OE1 GLU A 62 45.046 19.895 -9.943 1.00 0.00 O ATOM 939 OE2 GLU A 62 44.269 18.732 -8.258 1.00 0.00 O ATOM 0 H GLU A 62 40.727 22.311 -11.414 1.00 0.00 H new ATOM 0 HA GLU A 62 43.517 21.303 -11.384 1.00 0.00 H new ATOM 0 HB2 GLU A 62 42.038 20.747 -9.387 1.00 0.00 H new ATOM 0 HB3 GLU A 62 40.980 19.884 -10.487 1.00 0.00 H new ATOM 0 HG2 GLU A 62 42.306 18.167 -9.675 1.00 0.00 H new ATOM 0 HG3 GLU A 62 43.129 18.566 -11.169 1.00 0.00 H new ATOM 946 N LEU A 63 41.010 19.838 -12.944 1.00 0.00 N ATOM 947 CA LEU A 63 40.620 19.164 -14.174 1.00 0.00 C ATOM 948 C LEU A 63 39.097 19.101 -14.281 1.00 0.00 C ATOM 949 O LEU A 63 38.404 18.920 -13.277 1.00 0.00 O ATOM 950 CB LEU A 63 41.209 17.747 -14.226 1.00 0.00 C ATOM 951 CG LEU A 63 40.956 16.882 -12.988 1.00 0.00 C ATOM 952 CD1 LEU A 63 39.925 15.803 -13.284 1.00 0.00 C ATOM 953 CD2 LEU A 63 42.253 16.258 -12.504 1.00 0.00 C ATOM 0 H LEU A 63 40.310 19.792 -12.203 1.00 0.00 H new ATOM 0 HA LEU A 63 41.012 19.734 -15.016 1.00 0.00 H new ATOM 0 HB2 LEU A 63 40.799 17.234 -15.096 1.00 0.00 H new ATOM 0 HB3 LEU A 63 42.285 17.825 -14.379 1.00 0.00 H new ATOM 0 HG LEU A 63 40.562 17.522 -12.199 1.00 0.00 H new ATOM 0 HD11 LEU A 63 39.761 15.201 -12.390 1.00 0.00 H new ATOM 0 HD12 LEU A 63 38.987 16.269 -13.584 1.00 0.00 H new ATOM 0 HD13 LEU A 63 40.287 15.165 -14.090 1.00 0.00 H new ATOM 0 HD21 LEU A 63 42.056 15.646 -11.624 1.00 0.00 H new ATOM 0 HD22 LEU A 63 42.673 15.634 -13.293 1.00 0.00 H new ATOM 0 HD23 LEU A 63 42.962 17.045 -12.248 1.00 0.00 H new ATOM 965 N PRO A 64 38.556 19.277 -15.495 1.00 0.00 N ATOM 966 CA PRO A 64 37.122 19.145 -15.737 1.00 0.00 C ATOM 967 C PRO A 64 36.681 17.683 -15.716 1.00 0.00 C ATOM 968 O PRO A 64 37.153 16.870 -16.513 1.00 0.00 O ATOM 969 CB PRO A 64 36.935 19.751 -17.128 1.00 0.00 C ATOM 970 CG PRO A 64 38.253 19.584 -17.803 1.00 0.00 C ATOM 971 CD PRO A 64 39.299 19.629 -16.719 1.00 0.00 C ATOM 0 HA PRO A 64 36.523 19.638 -14.971 1.00 0.00 H new ATOM 0 HB2 PRO A 64 36.143 19.241 -17.677 1.00 0.00 H new ATOM 0 HB3 PRO A 64 36.654 20.802 -17.066 1.00 0.00 H new ATOM 0 HG2 PRO A 64 38.295 18.638 -18.343 1.00 0.00 H new ATOM 0 HG3 PRO A 64 38.418 20.376 -18.534 1.00 0.00 H new ATOM 0 HD2 PRO A 64 40.106 18.923 -16.913 1.00 0.00 H new ATOM 0 HD3 PRO A 64 39.752 20.617 -16.641 1.00 0.00 H new ATOM 979 N LEU A 65 35.778 17.359 -14.796 1.00 0.00 N ATOM 980 CA LEU A 65 35.304 15.987 -14.629 1.00 0.00 C ATOM 981 C LEU A 65 34.516 15.522 -15.855 1.00 0.00 C ATOM 982 O LEU A 65 34.617 14.363 -16.261 1.00 0.00 O ATOM 983 CB LEU A 65 34.446 15.870 -13.360 1.00 0.00 C ATOM 984 CG LEU A 65 33.113 16.628 -13.378 1.00 0.00 C ATOM 985 CD1 LEU A 65 32.071 15.883 -12.561 1.00 0.00 C ATOM 986 CD2 LEU A 65 33.288 18.041 -12.844 1.00 0.00 C ATOM 0 H LEU A 65 35.358 18.029 -14.152 1.00 0.00 H new ATOM 0 HA LEU A 65 36.174 15.338 -14.525 1.00 0.00 H new ATOM 0 HB2 LEU A 65 34.239 14.815 -13.181 1.00 0.00 H new ATOM 0 HB3 LEU A 65 35.033 16.227 -12.514 1.00 0.00 H new ATOM 0 HG LEU A 65 32.771 16.692 -14.411 1.00 0.00 H new ATOM 0 HD11 LEU A 65 31.130 16.433 -12.583 1.00 0.00 H new ATOM 0 HD12 LEU A 65 31.920 14.889 -12.983 1.00 0.00 H new ATOM 0 HD13 LEU A 65 32.414 15.792 -11.530 1.00 0.00 H new ATOM 0 HD21 LEU A 65 32.330 18.560 -12.866 1.00 0.00 H new ATOM 0 HD22 LEU A 65 33.654 18.000 -11.818 1.00 0.00 H new ATOM 0 HD23 LEU A 65 34.006 18.578 -13.464 1.00 0.00 H new ATOM 998 N LYS A 66 33.735 16.441 -16.429 1.00 0.00 N ATOM 999 CA LYS A 66 32.958 16.174 -17.645 1.00 0.00 C ATOM 1000 C LYS A 66 31.949 15.043 -17.423 1.00 0.00 C ATOM 1001 O LYS A 66 31.585 14.745 -16.289 1.00 0.00 O ATOM 1002 CB LYS A 66 33.884 15.828 -18.825 1.00 0.00 C ATOM 1003 CG LYS A 66 35.010 16.829 -19.046 1.00 0.00 C ATOM 1004 CD LYS A 66 35.963 16.368 -20.140 1.00 0.00 C ATOM 1005 CE LYS A 66 37.365 16.119 -19.600 1.00 0.00 C ATOM 1006 NZ LYS A 66 38.420 16.529 -20.568 1.00 0.00 N ATOM 0 H LYS A 66 33.623 17.388 -16.067 1.00 0.00 H new ATOM 0 HA LYS A 66 32.408 17.084 -17.886 1.00 0.00 H new ATOM 0 HB2 LYS A 66 34.317 14.842 -18.656 1.00 0.00 H new ATOM 0 HB3 LYS A 66 33.287 15.763 -19.734 1.00 0.00 H new ATOM 0 HG2 LYS A 66 34.589 17.798 -19.314 1.00 0.00 H new ATOM 0 HG3 LYS A 66 35.562 16.968 -18.116 1.00 0.00 H new ATOM 0 HD2 LYS A 66 35.581 15.454 -20.594 1.00 0.00 H new ATOM 0 HD3 LYS A 66 36.005 17.121 -20.927 1.00 0.00 H new ATOM 0 HE2 LYS A 66 37.496 16.668 -18.667 1.00 0.00 H new ATOM 0 HE3 LYS A 66 37.480 15.061 -19.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 39.313 16.051 -20.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 38.130 16.263 -21.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 38.555 17.559 -20.519 1.00 0.00 H new ATOM 1020 N VAL A 67 31.500 14.434 -18.528 1.00 0.00 N ATOM 1021 CA VAL A 67 30.587 13.282 -18.503 1.00 0.00 C ATOM 1022 C VAL A 67 29.206 13.661 -17.949 1.00 0.00 C ATOM 1023 O VAL A 67 28.439 12.806 -17.511 1.00 0.00 O ATOM 1024 CB VAL A 67 31.169 12.075 -17.706 1.00 0.00 C ATOM 1025 CG1 VAL A 67 30.501 10.771 -18.118 1.00 0.00 C ATOM 1026 CG2 VAL A 67 32.676 11.959 -17.904 1.00 0.00 C ATOM 0 H VAL A 67 31.761 14.727 -19.469 1.00 0.00 H new ATOM 0 HA VAL A 67 30.472 12.971 -19.541 1.00 0.00 H new ATOM 0 HB VAL A 67 30.965 12.259 -16.651 1.00 0.00 H new ATOM 0 HG11 VAL A 67 30.927 9.947 -17.546 1.00 0.00 H new ATOM 0 HG12 VAL A 67 29.430 10.833 -17.923 1.00 0.00 H new ATOM 0 HG13 VAL A 67 30.666 10.598 -19.181 1.00 0.00 H new ATOM 0 HG21 VAL A 67 33.053 11.108 -17.336 1.00 0.00 H new ATOM 0 HG22 VAL A 67 32.894 11.814 -18.962 1.00 0.00 H new ATOM 0 HG23 VAL A 67 33.160 12.871 -17.555 1.00 0.00 H new ATOM 1036 N LEU A 68 28.876 14.946 -18.002 1.00 0.00 N ATOM 1037 CA LEU A 68 27.577 15.416 -17.530 1.00 0.00 C ATOM 1038 C LEU A 68 27.274 16.821 -18.040 1.00 0.00 C ATOM 1039 O LEU A 68 26.829 17.692 -17.293 1.00 0.00 O ATOM 1040 CB LEU A 68 27.493 15.385 -15.997 1.00 0.00 C ATOM 1041 CG LEU A 68 28.775 15.758 -15.248 1.00 0.00 C ATOM 1042 CD1 LEU A 68 28.679 17.169 -14.687 1.00 0.00 C ATOM 1043 CD2 LEU A 68 29.044 14.758 -14.135 1.00 0.00 C ATOM 0 H LEU A 68 29.486 15.679 -18.365 1.00 0.00 H new ATOM 0 HA LEU A 68 26.827 14.734 -17.931 1.00 0.00 H new ATOM 0 HB2 LEU A 68 26.701 16.065 -15.682 1.00 0.00 H new ATOM 0 HB3 LEU A 68 27.194 14.383 -15.689 1.00 0.00 H new ATOM 0 HG LEU A 68 29.607 15.728 -15.951 1.00 0.00 H new ATOM 0 HD11 LEU A 68 29.600 17.414 -14.159 1.00 0.00 H new ATOM 0 HD12 LEU A 68 28.530 17.876 -15.503 1.00 0.00 H new ATOM 0 HD13 LEU A 68 27.838 17.230 -13.997 1.00 0.00 H new ATOM 0 HD21 LEU A 68 29.958 15.035 -13.610 1.00 0.00 H new ATOM 0 HD22 LEU A 68 28.209 14.760 -13.434 1.00 0.00 H new ATOM 0 HD23 LEU A 68 29.158 13.761 -14.561 1.00 0.00 H new ATOM 1055 N PHE A 69 27.480 17.031 -19.329 1.00 0.00 N ATOM 1056 CA PHE A 69 27.282 18.347 -19.914 1.00 0.00 C ATOM 1057 C PHE A 69 27.101 18.257 -21.424 1.00 0.00 C ATOM 1058 O PHE A 69 26.181 18.858 -21.975 1.00 0.00 O ATOM 1059 CB PHE A 69 28.453 19.282 -19.556 1.00 0.00 C ATOM 1060 CG PHE A 69 29.738 18.974 -20.274 1.00 0.00 C ATOM 1061 CD1 PHE A 69 30.404 17.783 -20.050 1.00 0.00 C ATOM 1062 CD2 PHE A 69 30.278 19.881 -21.170 1.00 0.00 C ATOM 1063 CE1 PHE A 69 31.586 17.500 -20.707 1.00 0.00 C ATOM 1064 CE2 PHE A 69 31.459 19.604 -21.831 1.00 0.00 C ATOM 1065 CZ PHE A 69 32.114 18.411 -21.598 1.00 0.00 C ATOM 0 H PHE A 69 27.782 16.313 -19.987 1.00 0.00 H new ATOM 0 HA PHE A 69 26.368 18.767 -19.495 1.00 0.00 H new ATOM 0 HB2 PHE A 69 28.163 20.309 -19.780 1.00 0.00 H new ATOM 0 HB3 PHE A 69 28.630 19.228 -18.482 1.00 0.00 H new ATOM 0 HD1 PHE A 69 29.995 17.066 -19.353 1.00 0.00 H new ATOM 0 HD2 PHE A 69 29.770 20.816 -21.354 1.00 0.00 H new ATOM 0 HE1 PHE A 69 32.096 16.566 -20.523 1.00 0.00 H new ATOM 0 HE2 PHE A 69 31.869 20.319 -22.529 1.00 0.00 H new ATOM 0 HZ PHE A 69 33.038 18.192 -22.112 1.00 0.00 H new ATOM 1075 N ALA A 70 27.956 17.482 -22.078 1.00 0.00 N ATOM 1076 CA ALA A 70 27.954 17.377 -23.530 1.00 0.00 C ATOM 1077 C ALA A 70 27.023 16.269 -23.999 1.00 0.00 C ATOM 1078 O ALA A 70 27.389 15.441 -24.833 1.00 0.00 O ATOM 1079 CB ALA A 70 29.368 17.136 -24.044 1.00 0.00 C ATOM 0 H ALA A 70 28.667 16.912 -21.620 1.00 0.00 H new ATOM 0 HA ALA A 70 27.587 18.319 -23.937 1.00 0.00 H new ATOM 0 HB1 ALA A 70 29.352 17.059 -25.131 1.00 0.00 H new ATOM 0 HB2 ALA A 70 30.009 17.966 -23.748 1.00 0.00 H new ATOM 0 HB3 ALA A 70 29.756 16.209 -23.621 1.00 0.00 H new ATOM 1085 N GLN A 71 25.820 16.252 -23.452 1.00 0.00 N ATOM 1086 CA GLN A 71 24.820 15.278 -23.840 1.00 0.00 C ATOM 1087 C GLN A 71 23.431 15.772 -23.454 1.00 0.00 C ATOM 1088 O GLN A 71 23.259 16.398 -22.406 1.00 0.00 O ATOM 1089 CB GLN A 71 25.115 13.924 -23.180 1.00 0.00 C ATOM 1090 CG GLN A 71 24.649 13.823 -21.737 1.00 0.00 C ATOM 1091 CD GLN A 71 25.706 14.227 -20.722 1.00 0.00 C ATOM 1092 OE1 GLN A 71 26.735 14.812 -21.060 1.00 0.00 O ATOM 1093 NE2 GLN A 71 25.456 13.918 -19.460 1.00 0.00 N ATOM 0 H GLN A 71 25.513 16.907 -22.733 1.00 0.00 H new ATOM 0 HA GLN A 71 24.853 15.148 -24.922 1.00 0.00 H new ATOM 0 HB2 GLN A 71 24.636 13.136 -23.761 1.00 0.00 H new ATOM 0 HB3 GLN A 71 26.189 13.740 -23.218 1.00 0.00 H new ATOM 0 HG2 GLN A 71 23.770 14.454 -21.604 1.00 0.00 H new ATOM 0 HG3 GLN A 71 24.339 12.798 -21.536 1.00 0.00 H new ATOM 0 HE21 GLN A 71 24.593 13.433 -19.215 1.00 0.00 H new ATOM 0 HE22 GLN A 71 26.126 14.165 -18.732 1.00 0.00 H new ATOM 1102 N PRO A 72 22.434 15.551 -24.322 1.00 0.00 N ATOM 1103 CA PRO A 72 21.036 15.838 -24.010 1.00 0.00 C ATOM 1104 C PRO A 72 20.429 14.765 -23.109 1.00 0.00 C ATOM 1105 O PRO A 72 19.666 15.085 -22.207 1.00 0.00 O ATOM 1106 CB PRO A 72 20.342 15.847 -25.381 1.00 0.00 C ATOM 1107 CG PRO A 72 21.433 15.711 -26.396 1.00 0.00 C ATOM 1108 CD PRO A 72 22.586 15.060 -25.693 1.00 0.00 C ATOM 0 HA PRO A 72 20.923 16.777 -23.468 1.00 0.00 H new ATOM 0 HB2 PRO A 72 19.629 15.027 -25.463 1.00 0.00 H new ATOM 0 HB3 PRO A 72 19.784 16.771 -25.530 1.00 0.00 H new ATOM 0 HG2 PRO A 72 21.103 15.108 -27.242 1.00 0.00 H new ATOM 0 HG3 PRO A 72 21.719 16.686 -26.791 1.00 0.00 H new ATOM 0 HD2 PRO A 72 22.531 13.973 -25.744 1.00 0.00 H new ATOM 0 HD3 PRO A 72 23.543 15.352 -26.126 1.00 0.00 H new ATOM 1116 N THR A 73 20.798 13.503 -23.387 1.00 0.00 N ATOM 1117 CA THR A 73 20.396 12.310 -22.631 1.00 0.00 C ATOM 1118 C THR A 73 20.512 11.096 -23.562 1.00 0.00 C ATOM 1119 O THR A 73 19.539 10.611 -24.143 1.00 0.00 O ATOM 1120 CB THR A 73 18.974 12.394 -21.986 1.00 0.00 C ATOM 1121 OG1 THR A 73 19.040 13.152 -20.774 1.00 0.00 O ATOM 1122 CG2 THR A 73 18.415 11.022 -21.644 1.00 0.00 C ATOM 0 H THR A 73 21.407 13.280 -24.174 1.00 0.00 H new ATOM 0 HA THR A 73 21.069 12.220 -21.779 1.00 0.00 H new ATOM 0 HB THR A 73 18.321 12.868 -22.719 1.00 0.00 H new ATOM 0 HG1 THR A 73 19.384 14.049 -20.967 1.00 0.00 H new ATOM 0 HG21 THR A 73 17.426 11.133 -21.199 1.00 0.00 H new ATOM 0 HG22 THR A 73 18.339 10.423 -22.552 1.00 0.00 H new ATOM 0 HG23 THR A 73 19.078 10.525 -20.936 1.00 0.00 H new ATOM 1130 N ILE A 74 21.749 10.675 -23.777 1.00 0.00 N ATOM 1131 CA ILE A 74 22.043 9.485 -24.552 1.00 0.00 C ATOM 1132 C ILE A 74 23.212 8.761 -23.900 1.00 0.00 C ATOM 1133 O ILE A 74 23.128 8.339 -22.748 1.00 0.00 O ATOM 1134 CB ILE A 74 22.418 9.821 -26.015 1.00 0.00 C ATOM 1135 CG1 ILE A 74 21.702 11.079 -26.512 1.00 0.00 C ATOM 1136 CG2 ILE A 74 22.109 8.645 -26.930 1.00 0.00 C ATOM 1137 CD1 ILE A 74 22.514 11.890 -27.499 1.00 0.00 C ATOM 0 H ILE A 74 22.576 11.151 -23.418 1.00 0.00 H new ATOM 0 HA ILE A 74 21.148 8.863 -24.571 1.00 0.00 H new ATOM 0 HB ILE A 74 23.490 10.018 -26.038 1.00 0.00 H new ATOM 0 HG12 ILE A 74 20.761 10.790 -26.980 1.00 0.00 H new ATOM 0 HG13 ILE A 74 21.453 11.707 -25.657 1.00 0.00 H new ATOM 0 HG21 ILE A 74 22.379 8.900 -27.955 1.00 0.00 H new ATOM 0 HG22 ILE A 74 22.682 7.775 -26.610 1.00 0.00 H new ATOM 0 HG23 ILE A 74 21.044 8.417 -26.882 1.00 0.00 H new ATOM 0 HD11 ILE A 74 21.943 12.766 -27.807 1.00 0.00 H new ATOM 0 HD12 ILE A 74 23.444 12.210 -27.029 1.00 0.00 H new ATOM 0 HD13 ILE A 74 22.741 11.279 -28.373 1.00 0.00 H new ATOM 1149 N LYS A 75 24.308 8.646 -24.624 1.00 0.00 N ATOM 1150 CA LYS A 75 25.534 8.095 -24.082 1.00 0.00 C ATOM 1151 C LYS A 75 26.702 8.962 -24.525 1.00 0.00 C ATOM 1152 O LYS A 75 27.864 8.566 -24.447 1.00 0.00 O ATOM 1153 CB LYS A 75 25.724 6.641 -24.527 1.00 0.00 C ATOM 1154 CG LYS A 75 25.795 6.464 -26.032 1.00 0.00 C ATOM 1155 CD LYS A 75 25.818 4.994 -26.416 1.00 0.00 C ATOM 1156 CE LYS A 75 27.228 4.427 -26.378 1.00 0.00 C ATOM 1157 NZ LYS A 75 27.235 2.949 -26.538 1.00 0.00 N ATOM 0 H LYS A 75 24.374 8.931 -25.601 1.00 0.00 H new ATOM 0 HA LYS A 75 25.481 8.093 -22.993 1.00 0.00 H new ATOM 0 HB2 LYS A 75 26.639 6.251 -24.081 1.00 0.00 H new ATOM 0 HB3 LYS A 75 24.900 6.042 -24.139 1.00 0.00 H new ATOM 0 HG2 LYS A 75 24.938 6.950 -26.498 1.00 0.00 H new ATOM 0 HG3 LYS A 75 26.688 6.956 -26.416 1.00 0.00 H new ATOM 0 HD2 LYS A 75 25.180 4.430 -25.736 1.00 0.00 H new ATOM 0 HD3 LYS A 75 25.403 4.872 -27.417 1.00 0.00 H new ATOM 0 HE2 LYS A 75 27.823 4.881 -27.170 1.00 0.00 H new ATOM 0 HE3 LYS A 75 27.701 4.692 -25.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 28.215 2.601 -26.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 26.688 2.514 -25.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 26.807 2.697 -27.452 1.00 0.00 H new ATOM 1171 N ALA A 76 26.365 10.168 -24.970 1.00 0.00 N ATOM 1172 CA ALA A 76 27.345 11.119 -25.473 1.00 0.00 C ATOM 1173 C ALA A 76 28.302 11.551 -24.373 1.00 0.00 C ATOM 1174 O ALA A 76 29.400 12.015 -24.651 1.00 0.00 O ATOM 1175 CB ALA A 76 26.644 12.327 -26.071 1.00 0.00 C ATOM 0 H ALA A 76 25.405 10.512 -24.991 1.00 0.00 H new ATOM 0 HA ALA A 76 27.928 10.628 -26.252 1.00 0.00 H new ATOM 0 HB1 ALA A 76 27.387 13.031 -26.444 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.004 12.006 -26.893 1.00 0.00 H new ATOM 0 HB3 ALA A 76 26.037 12.811 -25.306 1.00 0.00 H new ATOM 1181 N LEU A 77 27.875 11.397 -23.121 1.00 0.00 N ATOM 1182 CA LEU A 77 28.747 11.666 -21.988 1.00 0.00 C ATOM 1183 C LEU A 77 30.032 10.836 -22.093 1.00 0.00 C ATOM 1184 O LEU A 77 31.135 11.344 -21.874 1.00 0.00 O ATOM 1185 CB LEU A 77 28.052 11.436 -20.614 1.00 0.00 C ATOM 1186 CG LEU A 77 26.968 10.327 -20.472 1.00 0.00 C ATOM 1187 CD1 LEU A 77 25.732 10.613 -21.310 1.00 0.00 C ATOM 1188 CD2 LEU A 77 27.515 8.944 -20.791 1.00 0.00 C ATOM 0 H LEU A 77 26.936 11.089 -22.870 1.00 0.00 H new ATOM 0 HA LEU A 77 28.999 12.726 -22.031 1.00 0.00 H new ATOM 0 HB2 LEU A 77 28.834 11.222 -19.886 1.00 0.00 H new ATOM 0 HB3 LEU A 77 27.593 12.380 -20.320 1.00 0.00 H new ATOM 0 HG LEU A 77 26.669 10.338 -19.424 1.00 0.00 H new ATOM 0 HD11 LEU A 77 25.007 9.810 -21.175 1.00 0.00 H new ATOM 0 HD12 LEU A 77 25.289 11.558 -20.995 1.00 0.00 H new ATOM 0 HD13 LEU A 77 26.012 10.676 -22.362 1.00 0.00 H new ATOM 0 HD21 LEU A 77 26.722 8.204 -20.678 1.00 0.00 H new ATOM 0 HD22 LEU A 77 27.884 8.926 -21.816 1.00 0.00 H new ATOM 0 HD23 LEU A 77 28.331 8.709 -20.107 1.00 0.00 H new ATOM 1200 N ALA A 78 29.885 9.574 -22.471 1.00 0.00 N ATOM 1201 CA ALA A 78 31.024 8.688 -22.635 1.00 0.00 C ATOM 1202 C ALA A 78 31.563 8.786 -24.050 1.00 0.00 C ATOM 1203 O ALA A 78 32.760 8.652 -24.283 1.00 0.00 O ATOM 1204 CB ALA A 78 30.639 7.255 -22.310 1.00 0.00 C ATOM 0 H ALA A 78 28.983 9.141 -22.670 1.00 0.00 H new ATOM 0 HA ALA A 78 31.806 8.996 -21.941 1.00 0.00 H new ATOM 0 HB1 ALA A 78 31.506 6.607 -22.439 1.00 0.00 H new ATOM 0 HB2 ALA A 78 30.293 7.196 -21.278 1.00 0.00 H new ATOM 0 HB3 ALA A 78 29.842 6.932 -22.979 1.00 0.00 H new ATOM 1210 N GLN A 79 30.670 9.053 -24.993 1.00 0.00 N ATOM 1211 CA GLN A 79 31.051 9.199 -26.393 1.00 0.00 C ATOM 1212 C GLN A 79 31.809 10.503 -26.619 1.00 0.00 C ATOM 1213 O GLN A 79 32.191 10.831 -27.740 1.00 0.00 O ATOM 1214 CB GLN A 79 29.810 9.142 -27.285 1.00 0.00 C ATOM 1215 CG GLN A 79 29.953 8.206 -28.473 1.00 0.00 C ATOM 1216 CD GLN A 79 29.508 8.846 -29.771 1.00 0.00 C ATOM 1217 OE1 GLN A 79 28.473 8.481 -30.330 1.00 0.00 O ATOM 1218 NE2 GLN A 79 30.285 9.802 -30.263 1.00 0.00 N ATOM 0 H GLN A 79 29.673 9.173 -24.814 1.00 0.00 H new ATOM 0 HA GLN A 79 31.713 8.374 -26.656 1.00 0.00 H new ATOM 0 HB2 GLN A 79 28.957 8.825 -26.685 1.00 0.00 H new ATOM 0 HB3 GLN A 79 29.589 10.145 -27.649 1.00 0.00 H new ATOM 0 HG2 GLN A 79 30.994 7.895 -28.563 1.00 0.00 H new ATOM 0 HG3 GLN A 79 29.365 7.306 -28.295 1.00 0.00 H new ATOM 0 HE21 GLN A 79 31.134 10.074 -29.768 1.00 0.00 H new ATOM 0 HE22 GLN A 79 30.033 10.265 -31.136 1.00 0.00 H new ATOM 1227 N TYR A 80 31.994 11.255 -25.551 1.00 0.00 N ATOM 1228 CA TYR A 80 32.827 12.438 -25.587 1.00 0.00 C ATOM 1229 C TYR A 80 34.101 12.196 -24.789 1.00 0.00 C ATOM 1230 O TYR A 80 35.205 12.427 -25.276 1.00 0.00 O ATOM 1231 CB TYR A 80 32.068 13.637 -25.018 1.00 0.00 C ATOM 1232 CG TYR A 80 32.907 14.889 -24.906 1.00 0.00 C ATOM 1233 CD1 TYR A 80 33.270 15.608 -26.037 1.00 0.00 C ATOM 1234 CD2 TYR A 80 33.346 15.345 -23.668 1.00 0.00 C ATOM 1235 CE1 TYR A 80 34.047 16.746 -25.940 1.00 0.00 C ATOM 1236 CE2 TYR A 80 34.124 16.480 -23.563 1.00 0.00 C ATOM 1237 CZ TYR A 80 34.470 17.179 -24.702 1.00 0.00 C ATOM 1238 OH TYR A 80 35.246 18.311 -24.599 1.00 0.00 O ATOM 0 H TYR A 80 31.574 11.064 -24.641 1.00 0.00 H new ATOM 0 HA TYR A 80 33.091 12.654 -26.622 1.00 0.00 H new ATOM 0 HB2 TYR A 80 31.205 13.844 -25.651 1.00 0.00 H new ATOM 0 HB3 TYR A 80 31.684 13.378 -24.031 1.00 0.00 H new ATOM 0 HD1 TYR A 80 32.939 15.272 -27.009 1.00 0.00 H new ATOM 0 HD2 TYR A 80 33.074 14.803 -22.775 1.00 0.00 H new ATOM 0 HE1 TYR A 80 34.321 17.293 -26.830 1.00 0.00 H new ATOM 0 HE2 TYR A 80 34.460 16.820 -22.595 1.00 0.00 H new ATOM 0 HH TYR A 80 35.457 18.478 -23.657 1.00 0.00 H new ATOM 1248 N VAL A 81 33.946 11.695 -23.572 1.00 0.00 N ATOM 1249 CA VAL A 81 35.079 11.505 -22.675 1.00 0.00 C ATOM 1250 C VAL A 81 35.961 10.340 -23.118 1.00 0.00 C ATOM 1251 O VAL A 81 37.134 10.265 -22.760 1.00 0.00 O ATOM 1252 CB VAL A 81 34.605 11.302 -21.218 1.00 0.00 C ATOM 1253 CG1 VAL A 81 34.325 9.835 -20.907 1.00 0.00 C ATOM 1254 CG2 VAL A 81 35.621 11.878 -20.241 1.00 0.00 C ATOM 0 H VAL A 81 33.047 11.412 -23.182 1.00 0.00 H new ATOM 0 HA VAL A 81 35.681 12.413 -22.719 1.00 0.00 H new ATOM 0 HB VAL A 81 33.664 11.840 -21.102 1.00 0.00 H new ATOM 0 HG11 VAL A 81 33.995 9.739 -19.873 1.00 0.00 H new ATOM 0 HG12 VAL A 81 33.546 9.464 -21.573 1.00 0.00 H new ATOM 0 HG13 VAL A 81 35.234 9.252 -21.053 1.00 0.00 H new ATOM 0 HG21 VAL A 81 35.271 11.726 -19.220 1.00 0.00 H new ATOM 0 HG22 VAL A 81 36.579 11.376 -20.374 1.00 0.00 H new ATOM 0 HG23 VAL A 81 35.741 12.945 -20.428 1.00 0.00 H new ATOM 1264 N ALA A 82 35.404 9.438 -23.910 1.00 0.00 N ATOM 1265 CA ALA A 82 36.177 8.321 -24.429 1.00 0.00 C ATOM 1266 C ALA A 82 36.546 8.553 -25.884 1.00 0.00 C ATOM 1267 O ALA A 82 37.073 7.670 -26.559 1.00 0.00 O ATOM 1268 CB ALA A 82 35.420 7.014 -24.262 1.00 0.00 C ATOM 0 H ALA A 82 34.428 9.456 -24.206 1.00 0.00 H new ATOM 0 HA ALA A 82 37.100 8.250 -23.853 1.00 0.00 H new ATOM 0 HB1 ALA A 82 36.019 6.194 -24.658 1.00 0.00 H new ATOM 0 HB2 ALA A 82 35.221 6.841 -23.204 1.00 0.00 H new ATOM 0 HB3 ALA A 82 34.476 7.068 -24.804 1.00 0.00 H new ATOM 1274 N THR A 83 36.259 9.748 -26.366 1.00 0.00 N ATOM 1275 CA THR A 83 36.606 10.114 -27.731 1.00 0.00 C ATOM 1276 C THR A 83 37.563 11.304 -27.741 1.00 0.00 C ATOM 1277 O THR A 83 38.491 11.365 -28.546 1.00 0.00 O ATOM 1278 CB THR A 83 35.344 10.443 -28.553 1.00 0.00 C ATOM 1279 OG1 THR A 83 34.479 9.302 -28.581 1.00 0.00 O ATOM 1280 CG2 THR A 83 35.698 10.848 -29.975 1.00 0.00 C ATOM 0 H THR A 83 35.788 10.481 -25.836 1.00 0.00 H new ATOM 0 HA THR A 83 37.102 9.259 -28.190 1.00 0.00 H new ATOM 0 HB THR A 83 34.839 11.283 -28.077 1.00 0.00 H new ATOM 0 HG1 THR A 83 33.575 9.570 -28.314 1.00 0.00 H new ATOM 0 HG21 THR A 83 34.785 11.073 -30.527 1.00 0.00 H new ATOM 0 HG22 THR A 83 36.336 11.731 -29.954 1.00 0.00 H new ATOM 0 HG23 THR A 83 36.226 10.030 -30.465 1.00 0.00 H new ATOM 1288 N ARG A 84 37.336 12.244 -26.838 1.00 0.00 N ATOM 1289 CA ARG A 84 38.186 13.418 -26.725 1.00 0.00 C ATOM 1290 C ARG A 84 38.871 13.452 -25.366 1.00 0.00 C ATOM 1291 O ARG A 84 39.892 14.115 -25.194 1.00 0.00 O ATOM 1292 CB ARG A 84 37.368 14.698 -26.929 1.00 0.00 C ATOM 1293 CG ARG A 84 36.431 14.649 -28.126 1.00 0.00 C ATOM 1294 CD ARG A 84 37.181 14.456 -29.437 1.00 0.00 C ATOM 1295 NE ARG A 84 38.582 14.852 -29.333 1.00 0.00 N ATOM 1296 CZ ARG A 84 39.403 14.992 -30.374 1.00 0.00 C ATOM 1297 NH1 ARG A 84 38.979 14.733 -31.607 1.00 0.00 N ATOM 1298 NH2 ARG A 84 40.655 15.374 -30.163 1.00 0.00 N ATOM 0 H ARG A 84 36.566 12.216 -26.169 1.00 0.00 H new ATOM 0 HA ARG A 84 38.948 13.361 -27.502 1.00 0.00 H new ATOM 0 HB2 ARG A 84 36.783 14.890 -26.030 1.00 0.00 H new ATOM 0 HB3 ARG A 84 38.052 15.538 -27.050 1.00 0.00 H new ATOM 0 HG2 ARG A 84 35.718 13.835 -27.994 1.00 0.00 H new ATOM 0 HG3 ARG A 84 35.855 15.573 -28.172 1.00 0.00 H new ATOM 0 HD2 ARG A 84 37.122 13.410 -29.737 1.00 0.00 H new ATOM 0 HD3 ARG A 84 36.697 15.040 -30.220 1.00 0.00 H new ATOM 0 HE ARG A 84 38.958 15.034 -28.402 1.00 0.00 H new ATOM 0 HH11 ARG A 84 38.019 14.425 -31.762 1.00 0.00 H new ATOM 0 HH12 ARG A 84 39.614 14.843 -32.398 1.00 0.00 H new ATOM 0 HH21 ARG A 84 40.979 15.557 -29.213 1.00 0.00 H new ATOM 0 HH22 ARG A 84 41.294 15.485 -30.950 1.00 0.00 H new ATOM 1312 N SER A 85 38.294 12.722 -24.416 1.00 0.00 N ATOM 1313 CA SER A 85 38.799 12.673 -23.055 1.00 0.00 C ATOM 1314 C SER A 85 38.898 14.076 -22.458 1.00 0.00 C ATOM 1315 O SER A 85 38.022 14.910 -22.763 1.00 0.00 O ATOM 1316 CB SER A 85 40.145 11.957 -23.040 1.00 0.00 C ATOM 1317 OG SER A 85 39.990 10.593 -23.411 1.00 0.00 O ATOM 1318 OXT SER A 85 39.837 14.340 -21.679 1.00 0.00 O ATOM 0 H SER A 85 37.464 12.150 -24.572 1.00 0.00 H new ATOM 0 HA SER A 85 38.102 12.113 -22.432 1.00 0.00 H new ATOM 0 HB2 SER A 85 40.833 12.450 -23.726 1.00 0.00 H new ATOM 0 HB3 SER A 85 40.586 12.021 -22.045 1.00 0.00 H new ATOM 0 HG SER A 85 39.064 10.314 -23.251 1.00 0.00 H new TER 1324 SER A 85