USER MOD reduce.3.24.130724 H: found=0, std=0, add=1018, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1025 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 113 MET CE :methyl -167:sc= -0.256 (180deg=-0.489) USER MOD Set 1.2: A 115 MET CE :methyl -160:sc= 0 (180deg=-0.15) USER MOD Set 2.1: A 19 TYR OH : rot 13:sc= 1.27 USER MOD Set 2.2: A 102 THR OG1 : rot 23:sc= 1.57 USER MOD Set 3.1: A 80 CYS SG : rot -171:sc= -0.737 USER MOD Set 3.2: A 82 SER OG : rot 84:sc= 1.29 USER MOD Set 3.3: A 93 HIS : no HD1:sc= 0.167 K(o=1.2,f=-1) USER MOD Set 3.4: A 95 GLN : amide:sc= 0.434 K(o=1.2,f=-0.66) USER MOD Set 4.1: A 36 THR OG1 : rot 117:sc= 1.11 USER MOD Set 4.2: A 56 THR OG1 : rot 103:sc= 1.62 USER MOD Single : A 5 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -68:sc= 1.27 USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 13 SER OG : rot 28:sc= 0.924 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.0841 X(o=-0.084,f=0) USER MOD Single : A 20 MET CE :methyl -177:sc= 0 (180deg=-0.0167) USER MOD Single : A 21 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0736) USER MOD Single : A 29 THR OG1 : rot -105:sc= 1.3 USER MOD Single : A 31 GLN : amide:sc=0.000659 X(o=0.00066,f=0) USER MOD Single : A 34 ASN : amide:sc= 0.658 K(o=0.66,f=-1.1) USER MOD Single : A 37 LYS NZ :NH3+ -172:sc= 0.732 (180deg=0.692) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot -38:sc= 1.91 USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= -0.183 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 60 THR OG1 : rot 149:sc= 1.21 USER MOD Single : A 63 SER OG : rot 28:sc= 0.755 USER MOD Single : A 65 GLN : amide:sc= -0.777 X(o=-0.78,f=-1.3!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -79:sc= 0.0122 USER MOD Single : A 79 ASN : amide:sc= 0.686 K(o=0.69,f=-0.67) USER MOD Single : A 81 LYS NZ :NH3+ 166:sc= 0.631 (180deg=0.524) USER MOD Single : A 85 SER OG : rot 37:sc= 0.347 USER MOD Single : A 90 LYS NZ :NH3+ -139:sc= 0.127 (180deg=-0.261) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ -174:sc= 0.0169 (180deg=-0.0203) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HE2:sc= 0.00667 X(o=0.0067,f=-0.082) USER MOD Single : A 128 TYR OH : rot -16:sc= 1.3 USER MOD Single : A 130 LYS NZ :NH3+ -122:sc= 0.129 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N GLU A 2 0.012 1.098 -2.216 1.00 0.00 N ATOM 19 CA GLU A 2 -0.867 2.154 -1.621 1.00 0.00 C ATOM 20 C GLU A 2 -0.146 3.499 -1.273 1.00 0.00 C ATOM 21 O GLU A 2 -0.541 4.554 -1.775 1.00 0.00 O ATOM 22 CB GLU A 2 -1.829 1.603 -0.531 1.00 0.00 C ATOM 23 CG GLU A 2 -3.081 2.480 -0.309 1.00 0.00 C ATOM 24 CD GLU A 2 -4.052 1.917 0.724 1.00 0.00 C ATOM 25 OE1 GLU A 2 -5.067 1.290 0.437 1.00 0.00 O ATOM 26 OE2 GLU A 2 -3.668 2.187 2.001 1.00 0.00 O ATOM 0 HA GLU A 2 -1.528 2.463 -2.431 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -2.145 0.598 -0.812 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -1.286 1.515 0.410 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -2.765 3.474 0.007 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -3.603 2.598 -1.258 1.00 0.00 H new ATOM 34 N ALA A 3 0.955 3.451 -0.501 1.00 0.00 N ATOM 35 CA ALA A 3 1.952 4.563 -0.428 1.00 0.00 C ATOM 36 C ALA A 3 2.557 5.090 -1.780 1.00 0.00 C ATOM 37 O ALA A 3 2.864 6.279 -1.900 1.00 0.00 O ATOM 38 CB ALA A 3 3.067 4.079 0.521 1.00 0.00 C ATOM 0 H ALA A 3 1.188 2.653 0.089 1.00 0.00 H new ATOM 0 HA ALA A 3 1.415 5.442 -0.071 1.00 0.00 H new ATOM 0 HB1 ALA A 3 3.828 4.854 0.614 1.00 0.00 H new ATOM 0 HB2 ALA A 3 2.643 3.868 1.503 1.00 0.00 H new ATOM 0 HB3 ALA A 3 3.519 3.173 0.118 1.00 0.00 H new ATOM 44 N PHE A 4 2.693 4.216 -2.792 1.00 0.00 N ATOM 45 CA PHE A 4 3.001 4.614 -4.193 1.00 0.00 C ATOM 46 C PHE A 4 1.847 5.281 -5.023 1.00 0.00 C ATOM 47 O PHE A 4 2.166 5.873 -6.054 1.00 0.00 O ATOM 48 CB PHE A 4 3.498 3.350 -4.954 1.00 0.00 C ATOM 49 CG PHE A 4 4.868 2.779 -4.558 1.00 0.00 C ATOM 50 CD1 PHE A 4 6.041 3.327 -5.088 1.00 0.00 C ATOM 51 CD2 PHE A 4 4.951 1.666 -3.716 1.00 0.00 C ATOM 52 CE1 PHE A 4 7.278 2.768 -4.780 1.00 0.00 C ATOM 53 CE2 PHE A 4 6.188 1.103 -3.412 1.00 0.00 C ATOM 54 CZ PHE A 4 7.347 1.652 -3.949 1.00 0.00 C ATOM 0 H PHE A 4 2.594 3.208 -2.670 1.00 0.00 H new ATOM 0 HA PHE A 4 3.750 5.401 -4.101 1.00 0.00 H new ATOM 0 HB2 PHE A 4 2.755 2.564 -4.822 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.527 3.587 -6.018 1.00 0.00 H new ATOM 0 HD1 PHE A 4 5.987 4.187 -5.739 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.050 1.240 -3.299 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.182 3.198 -5.184 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.247 0.243 -2.761 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.306 1.211 -3.721 1.00 0.00 H new ATOM 64 N CYS A 5 0.548 5.173 -4.670 1.00 0.00 N ATOM 65 CA CYS A 5 -0.573 5.599 -5.557 1.00 0.00 C ATOM 66 C CYS A 5 -0.775 7.152 -5.633 1.00 0.00 C ATOM 67 O CYS A 5 -1.481 7.754 -4.818 1.00 0.00 O ATOM 68 CB CYS A 5 -1.821 4.829 -5.075 1.00 0.00 C ATOM 69 SG CYS A 5 -3.212 5.114 -6.220 1.00 0.00 S ATOM 0 H CYS A 5 0.242 4.793 -3.774 1.00 0.00 H new ATOM 0 HA CYS A 5 -0.349 5.350 -6.594 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -1.600 3.763 -5.016 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -2.093 5.154 -4.071 1.00 0.00 H new ATOM 0 HG CYS A 5 -4.256 4.460 -5.806 1.00 0.00 H new ATOM 75 N ALA A 6 -0.107 7.796 -6.610 1.00 0.00 N ATOM 76 CA ALA A 6 -0.020 9.280 -6.732 1.00 0.00 C ATOM 77 C ALA A 6 0.563 9.720 -8.121 1.00 0.00 C ATOM 78 O ALA A 6 1.105 8.917 -8.895 1.00 0.00 O ATOM 79 CB ALA A 6 0.845 9.833 -5.567 1.00 0.00 C ATOM 0 H ALA A 6 0.395 7.303 -7.348 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.026 9.694 -6.671 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.914 10.918 -5.648 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.385 9.569 -4.615 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.844 9.401 -5.619 1.00 0.00 H new ATOM 85 N THR A 7 0.503 11.033 -8.419 1.00 0.00 N ATOM 86 CA THR A 7 1.367 11.660 -9.464 1.00 0.00 C ATOM 87 C THR A 7 2.804 11.876 -8.881 1.00 0.00 C ATOM 88 O THR A 7 2.965 12.329 -7.745 1.00 0.00 O ATOM 89 CB THR A 7 0.687 12.974 -9.963 1.00 0.00 C ATOM 90 OG1 THR A 7 -0.549 12.668 -10.602 1.00 0.00 O ATOM 91 CG2 THR A 7 1.485 13.805 -10.983 1.00 0.00 C ATOM 0 H THR A 7 -0.130 11.686 -7.958 1.00 0.00 H new ATOM 0 HA THR A 7 1.478 11.013 -10.334 1.00 0.00 H new ATOM 0 HB THR A 7 0.588 13.567 -9.054 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.971 13.497 -10.911 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.914 14.692 -11.256 1.00 0.00 H new ATOM 0 HG22 THR A 7 2.435 14.106 -10.543 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.672 13.206 -11.874 1.00 0.00 H new ATOM 99 N TRP A 8 3.858 11.541 -9.643 1.00 0.00 N ATOM 100 CA TRP A 8 5.262 11.695 -9.162 1.00 0.00 C ATOM 101 C TRP A 8 6.035 12.663 -10.103 1.00 0.00 C ATOM 102 O TRP A 8 6.251 12.381 -11.287 1.00 0.00 O ATOM 103 CB TRP A 8 5.954 10.316 -9.000 1.00 0.00 C ATOM 104 CG TRP A 8 5.368 9.432 -7.889 1.00 0.00 C ATOM 105 CD1 TRP A 8 4.355 8.468 -8.062 1.00 0.00 C ATOM 106 CD2 TRP A 8 5.588 9.495 -6.523 1.00 0.00 C ATOM 107 NE1 TRP A 8 3.946 7.918 -6.837 1.00 0.00 N ATOM 108 CE2 TRP A 8 4.709 8.580 -5.897 1.00 0.00 C ATOM 109 CE3 TRP A 8 6.436 10.320 -5.741 1.00 0.00 C ATOM 110 CZ2 TRP A 8 4.644 8.503 -4.489 1.00 0.00 C ATOM 111 CZ3 TRP A 8 6.378 10.209 -4.349 1.00 0.00 C ATOM 112 CH2 TRP A 8 5.482 9.326 -3.733 1.00 0.00 C ATOM 0 H TRP A 8 3.778 11.164 -10.587 1.00 0.00 H new ATOM 0 HA TRP A 8 5.260 12.142 -8.168 1.00 0.00 H new ATOM 0 HB2 TRP A 8 5.889 9.778 -9.946 1.00 0.00 H new ATOM 0 HB3 TRP A 8 7.013 10.477 -8.797 1.00 0.00 H new ATOM 0 HD1 TRP A 8 3.944 8.187 -9.020 1.00 0.00 H new ATOM 0 HE1 TRP A 8 3.245 7.194 -6.678 1.00 0.00 H new ATOM 0 HE3 TRP A 8 7.112 11.019 -6.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 3.960 7.821 -4.006 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 7.034 10.813 -3.739 1.00 0.00 H new ATOM 0 HH2 TRP A 8 5.438 9.281 -2.655 1.00 0.00 H new ATOM 123 N LYS A 9 6.475 13.805 -9.552 1.00 0.00 N ATOM 124 CA LYS A 9 7.121 14.900 -10.327 1.00 0.00 C ATOM 125 C LYS A 9 8.672 14.868 -10.132 1.00 0.00 C ATOM 126 O LYS A 9 9.174 14.829 -9.002 1.00 0.00 O ATOM 127 CB LYS A 9 6.499 16.248 -9.866 1.00 0.00 C ATOM 128 CG LYS A 9 5.016 16.463 -10.274 1.00 0.00 C ATOM 129 CD LYS A 9 4.344 17.708 -9.648 1.00 0.00 C ATOM 130 CE LYS A 9 4.842 19.083 -10.131 1.00 0.00 C ATOM 131 NZ LYS A 9 4.445 19.357 -11.528 1.00 0.00 N ATOM 0 H LYS A 9 6.397 14.005 -8.555 1.00 0.00 H new ATOM 0 HA LYS A 9 6.942 14.774 -11.395 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.574 16.313 -8.780 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.094 17.064 -10.276 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.961 16.545 -11.359 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.445 15.579 -9.992 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.273 17.648 -9.840 1.00 0.00 H new ATOM 0 HD3 LYS A 9 4.478 17.659 -8.567 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.443 19.862 -9.481 1.00 0.00 H new ATOM 0 HE3 LYS A 9 5.928 19.125 -10.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 4.800 20.292 -11.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 4.847 18.629 -12.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.408 19.343 -11.603 1.00 0.00 H new ATOM 144 N LEU A 10 9.436 14.867 -11.244 1.00 0.00 N ATOM 145 CA LEU A 10 10.924 14.720 -11.207 1.00 0.00 C ATOM 146 C LEU A 10 11.645 15.978 -10.607 1.00 0.00 C ATOM 147 O LEU A 10 11.575 17.078 -11.163 1.00 0.00 O ATOM 148 CB LEU A 10 11.444 14.399 -12.643 1.00 0.00 C ATOM 149 CG LEU A 10 12.763 13.578 -12.765 1.00 0.00 C ATOM 150 CD1 LEU A 10 13.093 13.378 -14.252 1.00 0.00 C ATOM 151 CD2 LEU A 10 14.001 14.175 -12.081 1.00 0.00 C ATOM 0 H LEU A 10 9.055 14.966 -12.185 1.00 0.00 H new ATOM 0 HA LEU A 10 11.165 13.894 -10.538 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.660 13.856 -13.171 1.00 0.00 H new ATOM 0 HB3 LEU A 10 11.586 15.344 -13.168 1.00 0.00 H new ATOM 0 HG LEU A 10 12.556 12.646 -12.238 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.015 12.804 -14.346 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.279 12.839 -14.736 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.220 14.349 -14.730 1.00 0.00 H new ATOM 0 HD21 LEU A 10 14.855 13.515 -12.235 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.217 15.154 -12.509 1.00 0.00 H new ATOM 0 HD23 LEU A 10 13.811 14.280 -11.013 1.00 0.00 H new ATOM 163 N THR A 11 12.354 15.791 -9.483 1.00 0.00 N ATOM 164 CA THR A 11 13.111 16.880 -8.783 1.00 0.00 C ATOM 165 C THR A 11 14.641 16.934 -9.113 1.00 0.00 C ATOM 166 O THR A 11 15.172 18.029 -9.315 1.00 0.00 O ATOM 167 CB THR A 11 12.861 16.855 -7.240 1.00 0.00 C ATOM 168 OG1 THR A 11 13.395 15.685 -6.625 1.00 0.00 O ATOM 169 CG2 THR A 11 11.394 16.970 -6.819 1.00 0.00 C ATOM 0 H THR A 11 12.429 14.885 -9.021 1.00 0.00 H new ATOM 0 HA THR A 11 12.702 17.806 -9.188 1.00 0.00 H new ATOM 0 HB THR A 11 13.381 17.749 -6.896 1.00 0.00 H new ATOM 0 HG1 THR A 11 12.886 14.900 -6.918 1.00 0.00 H new ATOM 0 HG21 THR A 11 11.324 16.943 -5.732 1.00 0.00 H new ATOM 0 HG22 THR A 11 10.983 17.911 -7.186 1.00 0.00 H new ATOM 0 HG23 THR A 11 10.829 16.138 -7.239 1.00 0.00 H new ATOM 177 N ASN A 12 15.357 15.791 -9.134 1.00 0.00 N ATOM 178 CA ASN A 12 16.826 15.746 -9.390 1.00 0.00 C ATOM 179 C ASN A 12 17.205 14.424 -10.132 1.00 0.00 C ATOM 180 O ASN A 12 17.043 13.326 -9.586 1.00 0.00 O ATOM 181 CB ASN A 12 17.585 15.915 -8.040 1.00 0.00 C ATOM 182 CG ASN A 12 19.117 15.983 -8.135 1.00 0.00 C ATOM 183 OD1 ASN A 12 19.705 16.353 -9.145 1.00 0.00 O ATOM 184 ND2 ASN A 12 19.818 15.627 -7.087 1.00 0.00 N ATOM 0 H ASN A 12 14.943 14.873 -8.976 1.00 0.00 H new ATOM 0 HA ASN A 12 17.122 16.567 -10.044 1.00 0.00 H new ATOM 0 HB2 ASN A 12 17.230 16.825 -7.557 1.00 0.00 H new ATOM 0 HB3 ASN A 12 17.317 15.083 -7.388 1.00 0.00 H new ATOM 0 HD21 ASN A 12 20.837 15.660 -7.120 1.00 0.00 H new ATOM 0 HD22 ASN A 12 19.345 15.317 -6.238 1.00 0.00 H new ATOM 191 N SER A 13 17.747 14.537 -11.358 1.00 0.00 N ATOM 192 CA SER A 13 18.267 13.375 -12.130 1.00 0.00 C ATOM 193 C SER A 13 19.814 13.221 -11.982 1.00 0.00 C ATOM 194 O SER A 13 20.591 13.838 -12.722 1.00 0.00 O ATOM 195 CB SER A 13 17.833 13.530 -13.607 1.00 0.00 C ATOM 196 OG SER A 13 18.526 14.597 -14.257 1.00 0.00 O ATOM 0 H SER A 13 17.840 15.428 -11.846 1.00 0.00 H new ATOM 0 HA SER A 13 17.842 12.455 -11.728 1.00 0.00 H new ATOM 0 HB2 SER A 13 18.020 12.598 -14.140 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.760 13.713 -13.653 1.00 0.00 H new ATOM 0 HG SER A 13 19.403 14.720 -13.838 1.00 0.00 H new ATOM 202 N GLN A 14 20.250 12.367 -11.046 1.00 0.00 N ATOM 203 CA GLN A 14 21.689 12.065 -10.815 1.00 0.00 C ATOM 204 C GLN A 14 22.222 11.035 -11.865 1.00 0.00 C ATOM 205 O GLN A 14 21.748 9.898 -11.912 1.00 0.00 O ATOM 206 CB GLN A 14 21.786 11.524 -9.363 1.00 0.00 C ATOM 207 CG GLN A 14 23.216 11.290 -8.811 1.00 0.00 C ATOM 208 CD GLN A 14 23.244 10.458 -7.524 1.00 0.00 C ATOM 209 OE1 GLN A 14 23.427 9.246 -7.541 1.00 0.00 O ATOM 210 NE2 GLN A 14 23.058 11.060 -6.375 1.00 0.00 N ATOM 0 H GLN A 14 19.623 11.860 -10.422 1.00 0.00 H new ATOM 0 HA GLN A 14 22.311 12.952 -10.935 1.00 0.00 H new ATOM 0 HB2 GLN A 14 21.275 12.224 -8.702 1.00 0.00 H new ATOM 0 HB3 GLN A 14 21.241 10.581 -9.312 1.00 0.00 H new ATOM 0 HG2 GLN A 14 23.813 10.788 -9.572 1.00 0.00 H new ATOM 0 HG3 GLN A 14 23.686 12.255 -8.621 1.00 0.00 H new ATOM 0 HE21 GLN A 14 22.905 12.068 -6.346 1.00 0.00 H new ATOM 0 HE22 GLN A 14 23.067 10.521 -5.509 1.00 0.00 H new ATOM 219 N ASN A 15 23.206 11.428 -12.701 1.00 0.00 N ATOM 220 CA ASN A 15 23.859 10.525 -13.713 1.00 0.00 C ATOM 221 C ASN A 15 22.945 9.890 -14.839 1.00 0.00 C ATOM 222 O ASN A 15 23.304 8.879 -15.452 1.00 0.00 O ATOM 223 CB ASN A 15 24.771 9.508 -12.952 1.00 0.00 C ATOM 224 CG ASN A 15 25.957 8.922 -13.724 1.00 0.00 C ATOM 225 OD1 ASN A 15 27.069 9.436 -13.697 1.00 0.00 O ATOM 226 ND2 ASN A 15 25.771 7.840 -14.433 1.00 0.00 N ATOM 0 H ASN A 15 23.581 12.377 -12.705 1.00 0.00 H new ATOM 0 HA ASN A 15 24.467 11.167 -14.350 1.00 0.00 H new ATOM 0 HB2 ASN A 15 25.158 10.002 -12.061 1.00 0.00 H new ATOM 0 HB3 ASN A 15 24.147 8.682 -12.613 1.00 0.00 H new ATOM 0 HD21 ASN A 15 26.547 7.433 -14.956 1.00 0.00 H new ATOM 0 HD22 ASN A 15 24.850 7.402 -14.464 1.00 0.00 H new ATOM 233 N PHE A 16 21.788 10.497 -15.164 1.00 0.00 N ATOM 234 CA PHE A 16 20.812 9.932 -16.145 1.00 0.00 C ATOM 235 C PHE A 16 21.296 9.853 -17.636 1.00 0.00 C ATOM 236 O PHE A 16 21.049 8.843 -18.300 1.00 0.00 O ATOM 237 CB PHE A 16 19.474 10.695 -15.917 1.00 0.00 C ATOM 238 CG PHE A 16 18.213 10.207 -16.663 1.00 0.00 C ATOM 239 CD1 PHE A 16 17.871 8.849 -16.718 1.00 0.00 C ATOM 240 CD2 PHE A 16 17.364 11.146 -17.261 1.00 0.00 C ATOM 241 CE1 PHE A 16 16.722 8.437 -17.388 1.00 0.00 C ATOM 242 CE2 PHE A 16 16.208 10.734 -17.920 1.00 0.00 C ATOM 243 CZ PHE A 16 15.891 9.380 -17.987 1.00 0.00 C ATOM 0 H PHE A 16 21.495 11.388 -14.763 1.00 0.00 H new ATOM 0 HA PHE A 16 20.679 8.867 -15.953 1.00 0.00 H new ATOM 0 HB2 PHE A 16 19.257 10.673 -14.849 1.00 0.00 H new ATOM 0 HB3 PHE A 16 19.637 11.738 -16.188 1.00 0.00 H new ATOM 0 HD1 PHE A 16 18.503 8.117 -16.237 1.00 0.00 H new ATOM 0 HD2 PHE A 16 17.607 12.197 -17.211 1.00 0.00 H new ATOM 0 HE1 PHE A 16 16.476 7.387 -17.443 1.00 0.00 H new ATOM 0 HE2 PHE A 16 15.558 11.464 -18.379 1.00 0.00 H new ATOM 0 HZ PHE A 16 14.999 9.060 -18.505 1.00 0.00 H new ATOM 253 N ASP A 17 22.030 10.867 -18.131 1.00 0.00 N ATOM 254 CA ASP A 17 22.712 10.840 -19.459 1.00 0.00 C ATOM 255 C ASP A 17 23.653 9.618 -19.736 1.00 0.00 C ATOM 256 O ASP A 17 23.465 8.906 -20.727 1.00 0.00 O ATOM 257 CB ASP A 17 23.469 12.191 -19.570 1.00 0.00 C ATOM 258 CG ASP A 17 23.921 12.572 -20.981 1.00 0.00 C ATOM 259 OD1 ASP A 17 23.260 12.365 -21.996 1.00 0.00 O ATOM 260 OD2 ASP A 17 25.137 13.182 -20.983 1.00 0.00 O ATOM 0 H ASP A 17 22.174 11.740 -17.624 1.00 0.00 H new ATOM 0 HA ASP A 17 21.953 10.710 -20.230 1.00 0.00 H new ATOM 0 HB2 ASP A 17 22.825 12.982 -19.186 1.00 0.00 H new ATOM 0 HB3 ASP A 17 24.346 12.152 -18.923 1.00 0.00 H new ATOM 266 N GLU A 18 24.646 9.382 -18.857 1.00 0.00 N ATOM 267 CA GLU A 18 25.533 8.185 -18.945 1.00 0.00 C ATOM 268 C GLU A 18 24.843 6.806 -18.689 1.00 0.00 C ATOM 269 O GLU A 18 25.201 5.841 -19.368 1.00 0.00 O ATOM 270 CB GLU A 18 26.773 8.379 -18.033 1.00 0.00 C ATOM 271 CG GLU A 18 27.996 7.477 -18.360 1.00 0.00 C ATOM 272 CD GLU A 18 28.667 7.762 -19.707 1.00 0.00 C ATOM 273 OE1 GLU A 18 28.352 7.200 -20.752 1.00 0.00 O ATOM 274 OE2 GLU A 18 29.637 8.719 -19.607 1.00 0.00 O ATOM 0 H GLU A 18 24.861 9.999 -18.074 1.00 0.00 H new ATOM 0 HA GLU A 18 25.838 8.127 -19.990 1.00 0.00 H new ATOM 0 HB2 GLU A 18 27.087 9.421 -18.094 1.00 0.00 H new ATOM 0 HB3 GLU A 18 26.475 8.195 -17.001 1.00 0.00 H new ATOM 0 HG2 GLU A 18 28.737 7.595 -17.570 1.00 0.00 H new ATOM 0 HG3 GLU A 18 27.675 6.435 -18.344 1.00 0.00 H new ATOM 282 N TYR A 19 23.837 6.699 -17.790 1.00 0.00 N ATOM 283 CA TYR A 19 22.897 5.540 -17.798 1.00 0.00 C ATOM 284 C TYR A 19 22.210 5.294 -19.189 1.00 0.00 C ATOM 285 O TYR A 19 22.320 4.184 -19.709 1.00 0.00 O ATOM 286 CB TYR A 19 21.902 5.648 -16.603 1.00 0.00 C ATOM 287 CG TYR A 19 20.786 4.578 -16.571 1.00 0.00 C ATOM 288 CD1 TYR A 19 21.035 3.292 -16.079 1.00 0.00 C ATOM 289 CD2 TYR A 19 19.549 4.854 -17.170 1.00 0.00 C ATOM 290 CE1 TYR A 19 20.066 2.297 -16.202 1.00 0.00 C ATOM 291 CE2 TYR A 19 18.588 3.854 -17.295 1.00 0.00 C ATOM 292 CZ TYR A 19 18.849 2.575 -16.813 1.00 0.00 C ATOM 293 OH TYR A 19 17.888 1.601 -16.892 1.00 0.00 O ATOM 0 H TYR A 19 23.652 7.386 -17.059 1.00 0.00 H new ATOM 0 HA TYR A 19 23.483 4.633 -17.649 1.00 0.00 H new ATOM 0 HB2 TYR A 19 22.468 5.586 -15.674 1.00 0.00 H new ATOM 0 HB3 TYR A 19 21.437 6.633 -16.627 1.00 0.00 H new ATOM 0 HD1 TYR A 19 21.979 3.070 -15.603 1.00 0.00 H new ATOM 0 HD2 TYR A 19 19.340 5.848 -17.537 1.00 0.00 H new ATOM 0 HE1 TYR A 19 20.262 1.306 -15.821 1.00 0.00 H new ATOM 0 HE2 TYR A 19 17.641 4.071 -17.766 1.00 0.00 H new ATOM 0 HH TYR A 19 18.128 0.856 -16.303 1.00 0.00 H new ATOM 303 N MET A 20 21.549 6.298 -19.796 1.00 0.00 N ATOM 304 CA MET A 20 20.969 6.172 -21.165 1.00 0.00 C ATOM 305 C MET A 20 21.985 5.792 -22.298 1.00 0.00 C ATOM 306 O MET A 20 21.705 4.871 -23.071 1.00 0.00 O ATOM 307 CB MET A 20 20.152 7.450 -21.501 1.00 0.00 C ATOM 308 CG MET A 20 18.847 7.656 -20.699 1.00 0.00 C ATOM 309 SD MET A 20 17.894 9.043 -21.362 1.00 0.00 S ATOM 310 CE MET A 20 18.824 10.458 -20.742 1.00 0.00 C ATOM 0 H MET A 20 21.398 7.211 -19.366 1.00 0.00 H new ATOM 0 HA MET A 20 20.305 5.308 -21.138 1.00 0.00 H new ATOM 0 HB2 MET A 20 20.792 8.318 -21.342 1.00 0.00 H new ATOM 0 HB3 MET A 20 19.902 7.428 -22.562 1.00 0.00 H new ATOM 0 HG2 MET A 20 18.246 6.747 -20.734 1.00 0.00 H new ATOM 0 HG3 MET A 20 19.085 7.841 -19.651 1.00 0.00 H new ATOM 0 HE1 MET A 20 18.319 11.380 -21.030 1.00 0.00 H new ATOM 0 HE2 MET A 20 18.888 10.404 -19.655 1.00 0.00 H new ATOM 0 HE3 MET A 20 19.828 10.447 -21.165 1.00 0.00 H new ATOM 320 N LYS A 21 23.166 6.438 -22.378 1.00 0.00 N ATOM 321 CA LYS A 21 24.285 5.979 -23.256 1.00 0.00 C ATOM 322 C LYS A 21 24.797 4.515 -23.006 1.00 0.00 C ATOM 323 O LYS A 21 24.912 3.752 -23.970 1.00 0.00 O ATOM 324 CB LYS A 21 25.394 7.067 -23.184 1.00 0.00 C ATOM 325 CG LYS A 21 26.632 6.895 -24.101 1.00 0.00 C ATOM 326 CD LYS A 21 26.333 6.696 -25.605 1.00 0.00 C ATOM 327 CE LYS A 21 27.585 6.746 -26.500 1.00 0.00 C ATOM 328 NZ LYS A 21 27.933 8.126 -26.904 1.00 0.00 N ATOM 0 H LYS A 21 23.379 7.283 -21.847 1.00 0.00 H new ATOM 0 HA LYS A 21 23.912 5.883 -24.276 1.00 0.00 H new ATOM 0 HB2 LYS A 21 24.936 8.029 -23.416 1.00 0.00 H new ATOM 0 HB3 LYS A 21 25.745 7.121 -22.153 1.00 0.00 H new ATOM 0 HG2 LYS A 21 27.268 7.773 -23.989 1.00 0.00 H new ATOM 0 HG3 LYS A 21 27.206 6.039 -23.748 1.00 0.00 H new ATOM 0 HD2 LYS A 21 25.837 5.735 -25.743 1.00 0.00 H new ATOM 0 HD3 LYS A 21 25.633 7.465 -25.932 1.00 0.00 H new ATOM 0 HE2 LYS A 21 28.427 6.303 -25.968 1.00 0.00 H new ATOM 0 HE3 LYS A 21 27.416 6.141 -27.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 28.695 8.099 -27.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 27.097 8.589 -27.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 28.252 8.662 -26.071 1.00 0.00 H new ATOM 341 N ALA A 22 25.042 4.101 -21.747 1.00 0.00 N ATOM 342 CA ALA A 22 25.343 2.680 -21.402 1.00 0.00 C ATOM 343 C ALA A 22 24.213 1.636 -21.700 1.00 0.00 C ATOM 344 O ALA A 22 24.495 0.568 -22.245 1.00 0.00 O ATOM 345 CB ALA A 22 25.756 2.661 -19.919 1.00 0.00 C ATOM 0 H ALA A 22 25.039 4.727 -20.942 1.00 0.00 H new ATOM 0 HA ALA A 22 26.142 2.346 -22.064 1.00 0.00 H new ATOM 0 HB1 ALA A 22 25.987 1.639 -19.619 1.00 0.00 H new ATOM 0 HB2 ALA A 22 26.636 3.288 -19.778 1.00 0.00 H new ATOM 0 HB3 ALA A 22 24.938 3.042 -19.308 1.00 0.00 H new ATOM 351 N LEU A 23 22.943 1.972 -21.410 1.00 0.00 N ATOM 352 CA LEU A 23 21.740 1.210 -21.859 1.00 0.00 C ATOM 353 C LEU A 23 21.551 0.990 -23.408 1.00 0.00 C ATOM 354 O LEU A 23 20.769 0.125 -23.816 1.00 0.00 O ATOM 355 CB LEU A 23 20.554 2.021 -21.242 1.00 0.00 C ATOM 356 CG LEU A 23 19.140 1.395 -21.275 1.00 0.00 C ATOM 357 CD1 LEU A 23 19.020 0.246 -20.275 1.00 0.00 C ATOM 358 CD2 LEU A 23 18.069 2.450 -20.952 1.00 0.00 C ATOM 0 H LEU A 23 22.709 2.791 -20.849 1.00 0.00 H new ATOM 0 HA LEU A 23 21.825 0.176 -21.525 1.00 0.00 H new ATOM 0 HB2 LEU A 23 20.801 2.230 -20.201 1.00 0.00 H new ATOM 0 HB3 LEU A 23 20.505 2.981 -21.757 1.00 0.00 H new ATOM 0 HG LEU A 23 18.982 1.010 -22.282 1.00 0.00 H new ATOM 0 HD11 LEU A 23 18.015 -0.173 -20.322 1.00 0.00 H new ATOM 0 HD12 LEU A 23 19.748 -0.527 -20.520 1.00 0.00 H new ATOM 0 HD13 LEU A 23 19.211 0.618 -19.269 1.00 0.00 H new ATOM 0 HD21 LEU A 23 17.082 1.988 -20.981 1.00 0.00 H new ATOM 0 HD22 LEU A 23 18.249 2.859 -19.958 1.00 0.00 H new ATOM 0 HD23 LEU A 23 18.115 3.253 -21.688 1.00 0.00 H new ATOM 370 N GLY A 24 22.220 1.785 -24.261 1.00 0.00 N ATOM 371 CA GLY A 24 22.069 1.724 -25.733 1.00 0.00 C ATOM 372 C GLY A 24 20.908 2.566 -26.288 1.00 0.00 C ATOM 373 O GLY A 24 19.998 2.010 -26.909 1.00 0.00 O ATOM 0 H GLY A 24 22.885 2.493 -23.951 1.00 0.00 H new ATOM 0 HA2 GLY A 24 22.998 2.058 -26.195 1.00 0.00 H new ATOM 0 HA3 GLY A 24 21.922 0.685 -26.028 1.00 0.00 H new ATOM 377 N VAL A 25 20.935 3.890 -26.067 1.00 0.00 N ATOM 378 CA VAL A 25 20.027 4.846 -26.777 1.00 0.00 C ATOM 379 C VAL A 25 20.712 5.472 -28.042 1.00 0.00 C ATOM 380 O VAL A 25 21.932 5.667 -28.095 1.00 0.00 O ATOM 381 CB VAL A 25 19.431 5.960 -25.840 1.00 0.00 C ATOM 382 CG1 VAL A 25 18.608 5.429 -24.646 1.00 0.00 C ATOM 383 CG2 VAL A 25 20.423 7.041 -25.364 1.00 0.00 C ATOM 0 H VAL A 25 21.570 4.336 -25.405 1.00 0.00 H new ATOM 0 HA VAL A 25 19.180 4.248 -27.113 1.00 0.00 H new ATOM 0 HB VAL A 25 18.742 6.455 -26.525 1.00 0.00 H new ATOM 0 HG11 VAL A 25 18.238 6.268 -24.057 1.00 0.00 H new ATOM 0 HG12 VAL A 25 17.765 4.846 -25.016 1.00 0.00 H new ATOM 0 HG13 VAL A 25 19.239 4.798 -24.021 1.00 0.00 H new ATOM 0 HG21 VAL A 25 19.904 7.755 -24.725 1.00 0.00 H new ATOM 0 HG22 VAL A 25 21.230 6.572 -24.802 1.00 0.00 H new ATOM 0 HG23 VAL A 25 20.837 7.561 -26.228 1.00 0.00 H new ATOM 393 N GLY A 26 19.891 5.914 -29.010 1.00 0.00 N ATOM 394 CA GLY A 26 20.304 6.990 -29.949 1.00 0.00 C ATOM 395 C GLY A 26 20.291 8.414 -29.333 1.00 0.00 C ATOM 396 O GLY A 26 19.672 8.672 -28.294 1.00 0.00 O ATOM 0 H GLY A 26 18.950 5.554 -29.168 1.00 0.00 H new ATOM 0 HA2 GLY A 26 21.308 6.773 -30.313 1.00 0.00 H new ATOM 0 HA3 GLY A 26 19.642 6.975 -30.814 1.00 0.00 H new ATOM 400 N PHE A 27 20.951 9.363 -30.017 1.00 0.00 N ATOM 401 CA PHE A 27 21.017 10.787 -29.561 1.00 0.00 C ATOM 402 C PHE A 27 19.643 11.503 -29.312 1.00 0.00 C ATOM 403 O PHE A 27 19.538 12.247 -28.336 1.00 0.00 O ATOM 404 CB PHE A 27 21.946 11.569 -30.537 1.00 0.00 C ATOM 405 CG PHE A 27 22.354 12.979 -30.061 1.00 0.00 C ATOM 406 CD1 PHE A 27 23.495 13.155 -29.271 1.00 0.00 C ATOM 407 CD2 PHE A 27 21.564 14.090 -30.380 1.00 0.00 C ATOM 408 CE1 PHE A 27 23.828 14.421 -28.789 1.00 0.00 C ATOM 409 CE2 PHE A 27 21.898 15.353 -29.896 1.00 0.00 C ATOM 410 CZ PHE A 27 23.026 15.516 -29.099 1.00 0.00 C ATOM 0 H PHE A 27 21.450 9.184 -30.888 1.00 0.00 H new ATOM 0 HA PHE A 27 21.438 10.778 -28.556 1.00 0.00 H new ATOM 0 HB2 PHE A 27 22.850 10.982 -30.703 1.00 0.00 H new ATOM 0 HB3 PHE A 27 21.443 11.659 -31.500 1.00 0.00 H new ATOM 0 HD1 PHE A 27 24.121 12.307 -29.033 1.00 0.00 H new ATOM 0 HD2 PHE A 27 20.691 13.967 -31.004 1.00 0.00 H new ATOM 0 HE1 PHE A 27 24.707 14.552 -28.176 1.00 0.00 H new ATOM 0 HE2 PHE A 27 21.281 16.205 -30.140 1.00 0.00 H new ATOM 0 HZ PHE A 27 23.281 16.495 -28.720 1.00 0.00 H new ATOM 420 N ALA A 28 18.606 11.259 -30.137 1.00 0.00 N ATOM 421 CA ALA A 28 17.230 11.773 -29.893 1.00 0.00 C ATOM 422 C ALA A 28 16.604 11.471 -28.490 1.00 0.00 C ATOM 423 O ALA A 28 16.145 12.409 -27.836 1.00 0.00 O ATOM 424 CB ALA A 28 16.349 11.279 -31.055 1.00 0.00 C ATOM 0 H ALA A 28 18.690 10.704 -30.989 1.00 0.00 H new ATOM 0 HA ALA A 28 17.291 12.861 -29.864 1.00 0.00 H new ATOM 0 HB1 ALA A 28 15.328 11.635 -30.915 1.00 0.00 H new ATOM 0 HB2 ALA A 28 16.741 11.663 -31.997 1.00 0.00 H new ATOM 0 HB3 ALA A 28 16.353 10.189 -31.077 1.00 0.00 H new ATOM 430 N THR A 29 16.640 10.216 -27.993 1.00 0.00 N ATOM 431 CA THR A 29 16.183 9.877 -26.610 1.00 0.00 C ATOM 432 C THR A 29 17.039 10.511 -25.460 1.00 0.00 C ATOM 433 O THR A 29 16.435 10.986 -24.495 1.00 0.00 O ATOM 434 CB THR A 29 15.983 8.335 -26.473 1.00 0.00 C ATOM 435 OG1 THR A 29 14.999 7.872 -27.394 1.00 0.00 O ATOM 436 CG2 THR A 29 15.512 7.847 -25.091 1.00 0.00 C ATOM 0 H THR A 29 16.980 9.413 -28.523 1.00 0.00 H new ATOM 0 HA THR A 29 15.213 10.355 -26.471 1.00 0.00 H new ATOM 0 HB THR A 29 16.980 7.938 -26.661 1.00 0.00 H new ATOM 0 HG1 THR A 29 14.167 7.679 -26.914 1.00 0.00 H new ATOM 0 HG21 THR A 29 15.405 6.762 -25.105 1.00 0.00 H new ATOM 0 HG22 THR A 29 16.246 8.129 -24.336 1.00 0.00 H new ATOM 0 HG23 THR A 29 14.551 8.303 -24.852 1.00 0.00 H new ATOM 444 N ARG A 30 18.390 10.565 -25.528 1.00 0.00 N ATOM 445 CA ARG A 30 19.192 11.373 -24.553 1.00 0.00 C ATOM 446 C ARG A 30 18.995 12.926 -24.635 1.00 0.00 C ATOM 447 O ARG A 30 18.863 13.580 -23.597 1.00 0.00 O ATOM 448 CB ARG A 30 20.673 10.903 -24.491 1.00 0.00 C ATOM 449 CG ARG A 30 21.715 11.532 -25.446 1.00 0.00 C ATOM 450 CD ARG A 30 23.088 10.859 -25.276 1.00 0.00 C ATOM 451 NE ARG A 30 24.130 11.573 -26.062 1.00 0.00 N ATOM 452 CZ ARG A 30 25.425 11.247 -26.084 1.00 0.00 C ATOM 453 NH1 ARG A 30 25.929 10.250 -25.402 1.00 0.00 N ATOM 454 NH2 ARG A 30 26.234 11.951 -26.820 1.00 0.00 N ATOM 0 H ARG A 30 18.946 10.074 -26.228 1.00 0.00 H new ATOM 0 HA ARG A 30 18.762 11.153 -23.576 1.00 0.00 H new ATOM 0 HB2 ARG A 30 21.024 11.066 -23.472 1.00 0.00 H new ATOM 0 HB3 ARG A 30 20.681 9.827 -24.663 1.00 0.00 H new ATOM 0 HG2 ARG A 30 21.379 11.428 -26.478 1.00 0.00 H new ATOM 0 HG3 ARG A 30 21.801 12.600 -25.245 1.00 0.00 H new ATOM 0 HD2 ARG A 30 23.365 10.849 -24.222 1.00 0.00 H new ATOM 0 HD3 ARG A 30 23.031 9.820 -25.600 1.00 0.00 H new ATOM 0 HE ARG A 30 23.834 12.370 -26.625 1.00 0.00 H new ATOM 0 HH11 ARG A 30 25.324 9.676 -24.815 1.00 0.00 H new ATOM 0 HH12 ARG A 30 26.927 10.047 -25.457 1.00 0.00 H new ATOM 0 HH21 ARG A 30 25.876 12.735 -27.366 1.00 0.00 H new ATOM 0 HH22 ARG A 30 27.227 11.719 -26.851 1.00 0.00 H new ATOM 468 N GLN A 31 18.934 13.513 -25.846 1.00 0.00 N ATOM 469 CA GLN A 31 18.561 14.939 -26.049 1.00 0.00 C ATOM 470 C GLN A 31 17.140 15.329 -25.516 1.00 0.00 C ATOM 471 O GLN A 31 17.039 16.301 -24.766 1.00 0.00 O ATOM 472 CB GLN A 31 18.796 15.263 -27.553 1.00 0.00 C ATOM 473 CG GLN A 31 18.614 16.740 -27.991 1.00 0.00 C ATOM 474 CD GLN A 31 19.589 17.750 -27.376 1.00 0.00 C ATOM 475 OE1 GLN A 31 20.626 18.085 -27.938 1.00 0.00 O ATOM 476 NE2 GLN A 31 19.290 18.255 -26.202 1.00 0.00 N ATOM 0 H GLN A 31 19.140 13.019 -26.714 1.00 0.00 H new ATOM 0 HA GLN A 31 19.198 15.572 -25.431 1.00 0.00 H new ATOM 0 HB2 GLN A 31 19.809 14.955 -27.812 1.00 0.00 H new ATOM 0 HB3 GLN A 31 18.116 14.648 -28.142 1.00 0.00 H new ATOM 0 HG2 GLN A 31 18.707 16.790 -29.076 1.00 0.00 H new ATOM 0 HG3 GLN A 31 17.598 17.049 -27.743 1.00 0.00 H new ATOM 0 HE21 GLN A 31 18.428 17.978 -25.732 1.00 0.00 H new ATOM 0 HE22 GLN A 31 19.920 18.924 -25.759 1.00 0.00 H new ATOM 485 N VAL A 32 16.088 14.553 -25.843 1.00 0.00 N ATOM 486 CA VAL A 32 14.744 14.631 -25.186 1.00 0.00 C ATOM 487 C VAL A 32 14.801 14.396 -23.634 1.00 0.00 C ATOM 488 O VAL A 32 14.432 15.300 -22.880 1.00 0.00 O ATOM 489 CB VAL A 32 13.754 13.693 -25.979 1.00 0.00 C ATOM 490 CG1 VAL A 32 12.453 13.295 -25.247 1.00 0.00 C ATOM 491 CG2 VAL A 32 13.343 14.293 -27.345 1.00 0.00 C ATOM 0 H VAL A 32 16.135 13.845 -26.575 1.00 0.00 H new ATOM 0 HA VAL A 32 14.354 15.647 -25.246 1.00 0.00 H new ATOM 0 HB VAL A 32 14.353 12.790 -26.096 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.855 12.651 -25.892 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.700 12.761 -24.329 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.884 14.192 -25.003 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.661 13.610 -27.852 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.847 15.250 -27.187 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.231 14.442 -27.959 1.00 0.00 H new ATOM 501 N GLY A 33 15.266 13.221 -23.164 1.00 0.00 N ATOM 502 CA GLY A 33 15.314 12.871 -21.714 1.00 0.00 C ATOM 503 C GLY A 33 16.034 13.800 -20.708 1.00 0.00 C ATOM 504 O GLY A 33 15.623 13.853 -19.548 1.00 0.00 O ATOM 0 H GLY A 33 15.621 12.483 -23.772 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.284 12.765 -21.374 1.00 0.00 H new ATOM 0 HA3 GLY A 33 15.779 11.888 -21.635 1.00 0.00 H new ATOM 508 N ASN A 34 17.084 14.519 -21.135 1.00 0.00 N ATOM 509 CA ASN A 34 17.691 15.614 -20.324 1.00 0.00 C ATOM 510 C ASN A 34 16.910 16.972 -20.334 1.00 0.00 C ATOM 511 O ASN A 34 16.803 17.592 -19.273 1.00 0.00 O ATOM 512 CB ASN A 34 19.176 15.820 -20.732 1.00 0.00 C ATOM 513 CG ASN A 34 20.144 14.677 -20.394 1.00 0.00 C ATOM 514 OD1 ASN A 34 20.539 14.464 -19.252 1.00 0.00 O ATOM 515 ND2 ASN A 34 20.585 13.927 -21.372 1.00 0.00 N ATOM 0 H ASN A 34 17.538 14.370 -22.036 1.00 0.00 H new ATOM 0 HA ASN A 34 17.627 15.276 -19.290 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.214 15.992 -21.808 1.00 0.00 H new ATOM 0 HB3 ASN A 34 19.539 16.728 -20.251 1.00 0.00 H new ATOM 0 HD21 ASN A 34 21.249 13.177 -21.180 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.265 14.093 -22.326 1.00 0.00 H new ATOM 522 N VAL A 35 16.388 17.461 -21.481 1.00 0.00 N ATOM 523 CA VAL A 35 15.604 18.742 -21.527 1.00 0.00 C ATOM 524 C VAL A 35 14.158 18.660 -20.924 1.00 0.00 C ATOM 525 O VAL A 35 13.748 19.596 -20.231 1.00 0.00 O ATOM 526 CB VAL A 35 15.625 19.453 -22.927 1.00 0.00 C ATOM 527 CG1 VAL A 35 17.046 19.768 -23.444 1.00 0.00 C ATOM 528 CG2 VAL A 35 14.821 18.756 -24.048 1.00 0.00 C ATOM 0 H VAL A 35 16.487 17.002 -22.386 1.00 0.00 H new ATOM 0 HA VAL A 35 16.157 19.388 -20.845 1.00 0.00 H new ATOM 0 HB VAL A 35 15.109 20.387 -22.702 1.00 0.00 H new ATOM 0 HG11 VAL A 35 16.979 20.258 -24.415 1.00 0.00 H new ATOM 0 HG12 VAL A 35 17.552 20.427 -22.739 1.00 0.00 H new ATOM 0 HG13 VAL A 35 17.611 18.841 -23.543 1.00 0.00 H new ATOM 0 HG21 VAL A 35 14.906 19.333 -24.969 1.00 0.00 H new ATOM 0 HG22 VAL A 35 15.217 17.753 -24.210 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.773 18.689 -23.757 1.00 0.00 H new ATOM 538 N THR A 36 13.385 17.587 -21.196 1.00 0.00 N ATOM 539 CA THR A 36 12.009 17.424 -20.637 1.00 0.00 C ATOM 540 C THR A 36 12.020 16.642 -19.286 1.00 0.00 C ATOM 541 O THR A 36 12.847 15.751 -19.062 1.00 0.00 O ATOM 542 CB THR A 36 11.024 16.850 -21.702 1.00 0.00 C ATOM 543 OG1 THR A 36 9.686 17.126 -21.293 1.00 0.00 O ATOM 544 CG2 THR A 36 11.082 15.342 -22.000 1.00 0.00 C ATOM 0 H THR A 36 13.682 16.818 -21.797 1.00 0.00 H new ATOM 0 HA THR A 36 11.623 18.413 -20.388 1.00 0.00 H new ATOM 0 HB THR A 36 11.342 17.345 -22.619 1.00 0.00 H new ATOM 0 HG1 THR A 36 9.257 17.712 -21.951 1.00 0.00 H new ATOM 0 HG21 THR A 36 10.341 15.092 -22.759 1.00 0.00 H new ATOM 0 HG22 THR A 36 12.076 15.081 -22.364 1.00 0.00 H new ATOM 0 HG23 THR A 36 10.871 14.783 -21.089 1.00 0.00 H new ATOM 552 N LYS A 37 11.076 16.969 -18.390 1.00 0.00 N ATOM 553 CA LYS A 37 10.955 16.305 -17.063 1.00 0.00 C ATOM 554 C LYS A 37 9.822 15.218 -17.122 1.00 0.00 C ATOM 555 O LYS A 37 8.649 15.591 -16.976 1.00 0.00 O ATOM 556 CB LYS A 37 10.725 17.380 -15.959 1.00 0.00 C ATOM 557 CG LYS A 37 11.992 18.045 -15.358 1.00 0.00 C ATOM 558 CD LYS A 37 12.864 18.908 -16.299 1.00 0.00 C ATOM 559 CE LYS A 37 12.164 20.170 -16.831 1.00 0.00 C ATOM 560 NZ LYS A 37 13.090 20.946 -17.678 1.00 0.00 N ATOM 0 H LYS A 37 10.376 17.693 -18.553 1.00 0.00 H new ATOM 0 HA LYS A 37 11.877 15.785 -16.805 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.094 18.165 -16.375 1.00 0.00 H new ATOM 0 HB3 LYS A 37 10.165 16.918 -15.146 1.00 0.00 H new ATOM 0 HG2 LYS A 37 11.678 18.671 -14.523 1.00 0.00 H new ATOM 0 HG3 LYS A 37 12.622 17.256 -14.946 1.00 0.00 H new ATOM 0 HD2 LYS A 37 13.768 19.205 -15.767 1.00 0.00 H new ATOM 0 HD3 LYS A 37 13.179 18.297 -17.145 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.281 19.890 -17.406 1.00 0.00 H new ATOM 0 HE3 LYS A 37 11.821 20.783 -15.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 12.656 21.859 -17.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 13.977 21.111 -17.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 13.290 20.415 -18.550 1.00 0.00 H new ATOM 573 N PRO A 38 10.082 13.885 -17.309 1.00 0.00 N ATOM 574 CA PRO A 38 9.005 12.861 -17.374 1.00 0.00 C ATOM 575 C PRO A 38 8.283 12.622 -16.012 1.00 0.00 C ATOM 576 O PRO A 38 8.890 12.188 -15.027 1.00 0.00 O ATOM 577 CB PRO A 38 9.753 11.612 -17.874 1.00 0.00 C ATOM 578 CG PRO A 38 11.202 11.826 -17.439 1.00 0.00 C ATOM 579 CD PRO A 38 11.412 13.326 -17.631 1.00 0.00 C ATOM 0 HA PRO A 38 8.184 13.164 -18.024 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.339 10.702 -17.439 1.00 0.00 H new ATOM 0 HB3 PRO A 38 9.676 11.511 -18.957 1.00 0.00 H new ATOM 0 HG2 PRO A 38 11.358 11.528 -16.402 1.00 0.00 H new ATOM 0 HG3 PRO A 38 11.894 11.243 -18.046 1.00 0.00 H new ATOM 0 HD2 PRO A 38 12.186 13.714 -16.969 1.00 0.00 H new ATOM 0 HD3 PRO A 38 11.716 13.565 -18.650 1.00 0.00 H new ATOM 587 N THR A 39 6.980 12.916 -15.995 1.00 0.00 N ATOM 588 CA THR A 39 6.120 12.832 -14.782 1.00 0.00 C ATOM 589 C THR A 39 5.466 11.418 -14.710 1.00 0.00 C ATOM 590 O THR A 39 4.845 10.942 -15.667 1.00 0.00 O ATOM 591 CB THR A 39 5.087 13.997 -14.832 1.00 0.00 C ATOM 592 OG1 THR A 39 5.774 15.246 -14.892 1.00 0.00 O ATOM 593 CG2 THR A 39 4.158 14.083 -13.611 1.00 0.00 C ATOM 0 H THR A 39 6.474 13.224 -16.826 1.00 0.00 H new ATOM 0 HA THR A 39 6.698 12.949 -13.865 1.00 0.00 H new ATOM 0 HB THR A 39 4.480 13.791 -15.714 1.00 0.00 H new ATOM 0 HG1 THR A 39 5.122 15.977 -14.925 1.00 0.00 H new ATOM 0 HG21 THR A 39 3.474 14.922 -13.733 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.587 13.159 -13.523 1.00 0.00 H new ATOM 0 HG23 THR A 39 4.754 14.229 -12.710 1.00 0.00 H new ATOM 601 N VAL A 40 5.653 10.732 -13.577 1.00 0.00 N ATOM 602 CA VAL A 40 5.367 9.271 -13.459 1.00 0.00 C ATOM 603 C VAL A 40 4.088 9.082 -12.582 1.00 0.00 C ATOM 604 O VAL A 40 4.164 9.134 -11.354 1.00 0.00 O ATOM 605 CB VAL A 40 6.674 8.552 -12.960 1.00 0.00 C ATOM 606 CG1 VAL A 40 6.483 7.065 -12.603 1.00 0.00 C ATOM 607 CG2 VAL A 40 7.818 8.588 -14.006 1.00 0.00 C ATOM 0 H VAL A 40 6.002 11.155 -12.717 1.00 0.00 H new ATOM 0 HA VAL A 40 5.125 8.795 -14.409 1.00 0.00 H new ATOM 0 HB VAL A 40 6.929 9.122 -12.066 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.432 6.646 -12.269 1.00 0.00 H new ATOM 0 HG12 VAL A 40 5.745 6.974 -11.806 1.00 0.00 H new ATOM 0 HG13 VAL A 40 6.136 6.521 -13.482 1.00 0.00 H new ATOM 0 HG21 VAL A 40 8.693 8.077 -13.606 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.492 8.089 -14.919 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.074 9.624 -14.230 1.00 0.00 H new ATOM 617 N ILE A 41 2.906 8.851 -13.185 1.00 0.00 N ATOM 618 CA ILE A 41 1.638 8.646 -12.407 1.00 0.00 C ATOM 619 C ILE A 41 1.482 7.120 -12.116 1.00 0.00 C ATOM 620 O ILE A 41 1.184 6.337 -13.024 1.00 0.00 O ATOM 621 CB ILE A 41 0.357 9.275 -13.071 1.00 0.00 C ATOM 622 CG1 ILE A 41 0.529 10.760 -13.511 1.00 0.00 C ATOM 623 CG2 ILE A 41 -0.872 9.161 -12.122 1.00 0.00 C ATOM 624 CD1 ILE A 41 -0.616 11.357 -14.348 1.00 0.00 C ATOM 0 H ILE A 41 2.788 8.799 -14.197 1.00 0.00 H new ATOM 0 HA ILE A 41 1.724 9.195 -11.469 1.00 0.00 H new ATOM 0 HB ILE A 41 0.194 8.693 -13.978 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.654 11.370 -12.616 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.452 10.843 -14.085 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -1.745 9.602 -12.603 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.069 8.111 -11.906 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -0.664 9.690 -11.192 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.385 12.393 -14.594 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.733 10.783 -15.267 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.543 11.318 -13.776 1.00 0.00 H new ATOM 636 N ILE A 42 1.651 6.709 -10.846 1.00 0.00 N ATOM 637 CA ILE A 42 1.411 5.297 -10.417 1.00 0.00 C ATOM 638 C ILE A 42 -0.097 5.189 -10.013 1.00 0.00 C ATOM 639 O ILE A 42 -0.523 5.751 -9.000 1.00 0.00 O ATOM 640 CB ILE A 42 2.391 4.834 -9.280 1.00 0.00 C ATOM 641 CG1 ILE A 42 3.902 5.034 -9.614 1.00 0.00 C ATOM 642 CG2 ILE A 42 2.115 3.361 -8.862 1.00 0.00 C ATOM 643 CD1 ILE A 42 4.884 4.740 -8.468 1.00 0.00 C ATOM 0 H ILE A 42 1.952 7.325 -10.091 1.00 0.00 H new ATOM 0 HA ILE A 42 1.623 4.611 -11.238 1.00 0.00 H new ATOM 0 HB ILE A 42 2.181 5.493 -8.438 1.00 0.00 H new ATOM 0 HG12 ILE A 42 4.156 4.394 -10.459 1.00 0.00 H new ATOM 0 HG13 ILE A 42 4.050 6.064 -9.939 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.809 3.070 -8.074 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.092 3.272 -8.496 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.250 2.707 -9.723 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.905 4.911 -8.810 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.668 5.398 -7.626 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.776 3.702 -8.154 1.00 0.00 H new ATOM 655 N SER A 43 -0.891 4.472 -10.822 1.00 0.00 N ATOM 656 CA SER A 43 -2.371 4.424 -10.672 1.00 0.00 C ATOM 657 C SER A 43 -2.891 2.961 -10.535 1.00 0.00 C ATOM 658 O SER A 43 -2.759 2.149 -11.454 1.00 0.00 O ATOM 659 CB SER A 43 -3.011 5.173 -11.866 1.00 0.00 C ATOM 660 OG SER A 43 -2.687 4.596 -13.135 1.00 0.00 O ATOM 0 H SER A 43 -0.538 3.909 -11.596 1.00 0.00 H new ATOM 0 HA SER A 43 -2.663 4.922 -9.747 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.094 5.180 -11.743 1.00 0.00 H new ATOM 0 HB3 SER A 43 -2.682 6.212 -11.853 1.00 0.00 H new ATOM 0 HG SER A 43 -1.756 4.291 -13.128 1.00 0.00 H new ATOM 666 N GLN A 44 -3.508 2.626 -9.392 1.00 0.00 N ATOM 667 CA GLN A 44 -4.088 1.272 -9.153 1.00 0.00 C ATOM 668 C GLN A 44 -5.539 1.163 -9.723 1.00 0.00 C ATOM 669 O GLN A 44 -6.425 1.932 -9.336 1.00 0.00 O ATOM 670 CB GLN A 44 -4.061 0.961 -7.632 1.00 0.00 C ATOM 671 CG GLN A 44 -2.648 0.714 -7.037 1.00 0.00 C ATOM 672 CD GLN A 44 -2.596 0.378 -5.543 1.00 0.00 C ATOM 673 OE1 GLN A 44 -2.049 1.114 -4.729 1.00 0.00 O ATOM 674 NE2 GLN A 44 -3.110 -0.758 -5.133 1.00 0.00 N ATOM 0 H GLN A 44 -3.624 3.269 -8.609 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.483 0.534 -9.680 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -4.523 1.792 -7.098 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -4.676 0.081 -7.446 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.181 -0.102 -7.589 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.042 1.604 -7.210 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -3.568 -1.380 -5.799 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -3.051 -1.018 -4.149 1.00 0.00 H new ATOM 683 N GLU A 45 -5.780 0.203 -10.636 1.00 0.00 N ATOM 684 CA GLU A 45 -7.113 0.011 -11.280 1.00 0.00 C ATOM 685 C GLU A 45 -7.565 -1.479 -11.179 1.00 0.00 C ATOM 686 O GLU A 45 -7.274 -2.303 -12.054 1.00 0.00 O ATOM 687 CB GLU A 45 -7.094 0.628 -12.710 1.00 0.00 C ATOM 688 CG GLU A 45 -6.171 0.008 -13.783 1.00 0.00 C ATOM 689 CD GLU A 45 -6.839 -0.755 -14.928 1.00 0.00 C ATOM 690 OE1 GLU A 45 -6.802 -0.375 -16.095 1.00 0.00 O ATOM 691 OE2 GLU A 45 -7.455 -1.899 -14.508 1.00 0.00 O ATOM 0 H GLU A 45 -5.071 -0.459 -10.952 1.00 0.00 H new ATOM 0 HA GLU A 45 -7.892 0.555 -10.746 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -8.113 0.596 -13.095 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -6.823 1.679 -12.611 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -5.572 0.809 -14.216 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.481 -0.671 -13.282 1.00 0.00 H new ATOM 699 N GLY A 46 -8.273 -1.824 -10.088 1.00 0.00 N ATOM 700 CA GLY A 46 -8.702 -3.221 -9.813 1.00 0.00 C ATOM 701 C GLY A 46 -7.586 -4.104 -9.218 1.00 0.00 C ATOM 702 O GLY A 46 -7.220 -3.934 -8.053 1.00 0.00 O ATOM 0 H GLY A 46 -8.565 -1.155 -9.375 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -9.546 -3.204 -9.124 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -9.056 -3.673 -10.740 1.00 0.00 H new ATOM 706 N ASP A 47 -7.043 -5.023 -10.030 1.00 0.00 N ATOM 707 CA ASP A 47 -5.828 -5.813 -9.658 1.00 0.00 C ATOM 708 C ASP A 47 -4.473 -5.232 -10.194 1.00 0.00 C ATOM 709 O ASP A 47 -3.455 -5.379 -9.513 1.00 0.00 O ATOM 710 CB ASP A 47 -6.061 -7.295 -10.074 1.00 0.00 C ATOM 711 CG ASP A 47 -5.173 -8.303 -9.331 1.00 0.00 C ATOM 712 OD1 ASP A 47 -5.117 -8.360 -8.106 1.00 0.00 O ATOM 713 OD2 ASP A 47 -4.476 -9.132 -10.165 1.00 0.00 O ATOM 0 H ASP A 47 -7.416 -5.248 -10.952 1.00 0.00 H new ATOM 0 HA ASP A 47 -5.705 -5.745 -8.577 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -7.106 -7.550 -9.899 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -5.884 -7.392 -11.145 1.00 0.00 H new ATOM 719 N LYS A 48 -4.418 -4.619 -11.396 1.00 0.00 N ATOM 720 CA LYS A 48 -3.156 -4.112 -11.992 1.00 0.00 C ATOM 721 C LYS A 48 -2.761 -2.666 -11.542 1.00 0.00 C ATOM 722 O LYS A 48 -3.587 -1.767 -11.338 1.00 0.00 O ATOM 723 CB LYS A 48 -3.255 -4.275 -13.532 1.00 0.00 C ATOM 724 CG LYS A 48 -4.275 -3.362 -14.248 1.00 0.00 C ATOM 725 CD LYS A 48 -4.759 -3.894 -15.610 1.00 0.00 C ATOM 726 CE LYS A 48 -5.821 -5.001 -15.496 1.00 0.00 C ATOM 727 NZ LYS A 48 -6.209 -5.465 -16.842 1.00 0.00 N ATOM 0 H LYS A 48 -5.239 -4.461 -11.980 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.328 -4.710 -11.612 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.270 -4.091 -13.960 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -3.509 -5.312 -13.752 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.139 -3.223 -13.598 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.825 -2.380 -14.394 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.169 -3.067 -16.189 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.904 -4.278 -16.165 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.429 -5.835 -14.913 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.696 -4.625 -14.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.927 -6.213 -16.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -6.601 -4.669 -17.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.373 -5.841 -17.334 1.00 0.00 H new ATOM 740 N VAL A 49 -1.444 -2.472 -11.452 1.00 0.00 N ATOM 741 CA VAL A 49 -0.802 -1.159 -11.173 1.00 0.00 C ATOM 742 C VAL A 49 -0.405 -0.554 -12.562 1.00 0.00 C ATOM 743 O VAL A 49 0.430 -1.118 -13.283 1.00 0.00 O ATOM 744 CB VAL A 49 0.431 -1.359 -10.220 1.00 0.00 C ATOM 745 CG1 VAL A 49 1.153 -0.034 -9.888 1.00 0.00 C ATOM 746 CG2 VAL A 49 0.126 -2.054 -8.868 1.00 0.00 C ATOM 0 H VAL A 49 -0.770 -3.228 -11.571 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.472 -0.471 -10.657 1.00 0.00 H new ATOM 0 HB VAL A 49 1.064 -2.020 -10.812 1.00 0.00 H new ATOM 0 HG11 VAL A 49 1.996 -0.235 -9.227 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.515 0.424 -10.809 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.458 0.645 -9.394 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.045 -2.142 -8.289 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.600 -1.462 -8.310 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.282 -3.048 -9.054 1.00 0.00 H new ATOM 756 N VAL A 50 -1.013 0.583 -12.940 1.00 0.00 N ATOM 757 CA VAL A 50 -0.760 1.246 -14.253 1.00 0.00 C ATOM 758 C VAL A 50 0.195 2.456 -14.000 1.00 0.00 C ATOM 759 O VAL A 50 -0.245 3.508 -13.514 1.00 0.00 O ATOM 760 CB VAL A 50 -2.081 1.634 -15.004 1.00 0.00 C ATOM 761 CG1 VAL A 50 -1.815 2.164 -16.434 1.00 0.00 C ATOM 762 CG2 VAL A 50 -3.101 0.482 -15.137 1.00 0.00 C ATOM 0 H VAL A 50 -1.691 1.074 -12.357 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.275 0.547 -14.934 1.00 0.00 H new ATOM 0 HB VAL A 50 -2.504 2.412 -14.369 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.762 2.418 -16.910 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.185 3.052 -16.382 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.310 1.395 -17.019 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.984 0.837 -15.668 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.650 -0.341 -15.692 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.390 0.135 -14.145 1.00 0.00 H new ATOM 772 N ILE A 51 1.492 2.299 -14.331 1.00 0.00 N ATOM 773 CA ILE A 51 2.504 3.395 -14.203 1.00 0.00 C ATOM 774 C ILE A 51 2.562 4.174 -15.559 1.00 0.00 C ATOM 775 O ILE A 51 2.933 3.613 -16.594 1.00 0.00 O ATOM 776 CB ILE A 51 3.910 2.890 -13.706 1.00 0.00 C ATOM 777 CG1 ILE A 51 3.839 2.181 -12.320 1.00 0.00 C ATOM 778 CG2 ILE A 51 4.930 4.057 -13.648 1.00 0.00 C ATOM 779 CD1 ILE A 51 5.167 1.702 -11.693 1.00 0.00 C ATOM 0 H ILE A 51 1.876 1.425 -14.691 1.00 0.00 H new ATOM 0 HA ILE A 51 2.190 4.081 -13.416 1.00 0.00 H new ATOM 0 HB ILE A 51 4.245 2.152 -14.435 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.363 2.864 -11.617 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.183 1.316 -12.418 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.893 3.682 -13.302 1.00 0.00 H new ATOM 0 HG22 ILE A 51 5.045 4.489 -14.642 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.570 4.821 -12.959 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.966 1.228 -10.732 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.645 0.984 -12.359 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.828 2.556 -11.545 1.00 0.00 H new ATOM 791 N ARG A 52 2.227 5.473 -15.522 1.00 0.00 N ATOM 792 CA ARG A 52 2.094 6.323 -16.741 1.00 0.00 C ATOM 793 C ARG A 52 3.269 7.341 -16.790 1.00 0.00 C ATOM 794 O ARG A 52 3.306 8.298 -16.010 1.00 0.00 O ATOM 795 CB ARG A 52 0.720 7.051 -16.730 1.00 0.00 C ATOM 796 CG ARG A 52 -0.531 6.141 -16.661 1.00 0.00 C ATOM 797 CD ARG A 52 -1.820 6.898 -16.286 1.00 0.00 C ATOM 798 NE ARG A 52 -2.797 5.977 -15.644 1.00 0.00 N ATOM 799 CZ ARG A 52 -3.805 5.348 -16.243 1.00 0.00 C ATOM 800 NH1 ARG A 52 -4.049 5.410 -17.527 1.00 0.00 N ATOM 801 NH2 ARG A 52 -4.580 4.614 -15.499 1.00 0.00 N ATOM 0 H ARG A 52 2.039 5.974 -14.654 1.00 0.00 H new ATOM 0 HA ARG A 52 2.138 5.700 -17.634 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.698 7.730 -15.878 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.649 7.664 -17.628 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.672 5.656 -17.627 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.357 5.351 -15.930 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.583 7.717 -15.607 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.261 7.341 -17.179 1.00 0.00 H new ATOM 0 HE ARG A 52 -2.682 5.811 -14.644 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.447 5.967 -18.134 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.841 4.902 -17.921 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -4.403 4.538 -14.497 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -5.365 4.114 -15.917 1.00 0.00 H new ATOM 815 N THR A 53 4.227 7.134 -17.705 1.00 0.00 N ATOM 816 CA THR A 53 5.386 8.061 -17.893 1.00 0.00 C ATOM 817 C THR A 53 5.013 9.158 -18.943 1.00 0.00 C ATOM 818 O THR A 53 5.020 8.914 -20.155 1.00 0.00 O ATOM 819 CB THR A 53 6.651 7.230 -18.268 1.00 0.00 C ATOM 820 OG1 THR A 53 6.876 6.222 -17.286 1.00 0.00 O ATOM 821 CG2 THR A 53 7.948 8.049 -18.343 1.00 0.00 C ATOM 0 H THR A 53 4.234 6.333 -18.336 1.00 0.00 H new ATOM 0 HA THR A 53 5.623 8.590 -16.970 1.00 0.00 H new ATOM 0 HB THR A 53 6.436 6.827 -19.258 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.671 5.702 -17.527 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.777 7.394 -18.609 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.844 8.827 -19.099 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.145 8.508 -17.374 1.00 0.00 H new ATOM 829 N LEU A 54 4.657 10.355 -18.448 1.00 0.00 N ATOM 830 CA LEU A 54 4.051 11.436 -19.271 1.00 0.00 C ATOM 831 C LEU A 54 5.008 12.664 -19.319 1.00 0.00 C ATOM 832 O LEU A 54 5.340 13.257 -18.288 1.00 0.00 O ATOM 833 CB LEU A 54 2.668 11.839 -18.680 1.00 0.00 C ATOM 834 CG LEU A 54 1.573 10.746 -18.536 1.00 0.00 C ATOM 835 CD1 LEU A 54 0.292 11.363 -17.956 1.00 0.00 C ATOM 836 CD2 LEU A 54 1.236 10.035 -19.857 1.00 0.00 C ATOM 0 H LEU A 54 4.778 10.609 -17.467 1.00 0.00 H new ATOM 0 HA LEU A 54 3.900 11.074 -20.288 1.00 0.00 H new ATOM 0 HB2 LEU A 54 2.842 12.265 -17.692 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.261 12.635 -19.304 1.00 0.00 H new ATOM 0 HG LEU A 54 1.982 9.992 -17.863 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.471 10.591 -17.858 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.505 11.790 -16.976 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.068 12.147 -18.622 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.465 9.286 -19.680 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.874 10.765 -20.581 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.131 9.550 -20.248 1.00 0.00 H new ATOM 848 N SER A 55 5.458 13.044 -20.521 1.00 0.00 N ATOM 849 CA SER A 55 6.398 14.186 -20.721 1.00 0.00 C ATOM 850 C SER A 55 5.790 15.287 -21.657 1.00 0.00 C ATOM 851 O SER A 55 4.681 15.159 -22.188 1.00 0.00 O ATOM 852 CB SER A 55 7.710 13.593 -21.309 1.00 0.00 C ATOM 853 OG SER A 55 8.163 12.431 -20.622 1.00 0.00 O ATOM 0 H SER A 55 5.190 12.579 -21.388 1.00 0.00 H new ATOM 0 HA SER A 55 6.594 14.687 -19.773 1.00 0.00 H new ATOM 0 HB2 SER A 55 7.550 13.346 -22.359 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.490 14.353 -21.276 1.00 0.00 H new ATOM 0 HG SER A 55 8.988 12.105 -21.039 1.00 0.00 H new ATOM 859 N THR A 56 6.565 16.349 -21.954 1.00 0.00 N ATOM 860 CA THR A 56 6.319 17.203 -23.169 1.00 0.00 C ATOM 861 C THR A 56 6.435 16.471 -24.558 1.00 0.00 C ATOM 862 O THR A 56 5.781 16.887 -25.517 1.00 0.00 O ATOM 863 CB THR A 56 7.220 18.480 -23.182 1.00 0.00 C ATOM 864 OG1 THR A 56 8.600 18.145 -23.309 1.00 0.00 O ATOM 865 CG2 THR A 56 7.078 19.407 -21.965 1.00 0.00 C ATOM 0 H THR A 56 7.360 16.646 -21.388 1.00 0.00 H new ATOM 0 HA THR A 56 5.270 17.480 -23.061 1.00 0.00 H new ATOM 0 HB THR A 56 6.855 19.028 -24.051 1.00 0.00 H new ATOM 0 HG1 THR A 56 8.895 18.316 -24.228 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.747 20.260 -22.077 1.00 0.00 H new ATOM 0 HG22 THR A 56 6.049 19.760 -21.894 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.337 18.860 -21.059 1.00 0.00 H new ATOM 873 N PHE A 57 7.286 15.432 -24.670 1.00 0.00 N ATOM 874 CA PHE A 57 7.572 14.717 -25.951 1.00 0.00 C ATOM 875 C PHE A 57 7.217 13.188 -25.869 1.00 0.00 C ATOM 876 O PHE A 57 6.466 12.692 -26.711 1.00 0.00 O ATOM 877 CB PHE A 57 9.044 14.985 -26.410 1.00 0.00 C ATOM 878 CG PHE A 57 9.537 16.454 -26.425 1.00 0.00 C ATOM 879 CD1 PHE A 57 8.885 17.421 -27.200 1.00 0.00 C ATOM 880 CD2 PHE A 57 10.576 16.853 -25.576 1.00 0.00 C ATOM 881 CE1 PHE A 57 9.243 18.765 -27.097 1.00 0.00 C ATOM 882 CE2 PHE A 57 10.944 18.191 -25.488 1.00 0.00 C ATOM 883 CZ PHE A 57 10.269 19.148 -26.236 1.00 0.00 C ATOM 0 H PHE A 57 7.802 15.055 -23.875 1.00 0.00 H new ATOM 0 HA PHE A 57 6.917 15.122 -26.722 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.707 14.415 -25.759 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.160 14.582 -27.416 1.00 0.00 H new ATOM 0 HD1 PHE A 57 8.101 17.125 -27.881 1.00 0.00 H new ATOM 0 HD2 PHE A 57 11.097 16.115 -24.984 1.00 0.00 H new ATOM 0 HE1 PHE A 57 8.725 19.509 -27.685 1.00 0.00 H new ATOM 0 HE2 PHE A 57 11.755 18.486 -24.838 1.00 0.00 H new ATOM 0 HZ PHE A 57 10.540 20.190 -26.150 1.00 0.00 H new ATOM 893 N LYS A 58 7.745 12.439 -24.877 1.00 0.00 N ATOM 894 CA LYS A 58 7.453 10.994 -24.676 1.00 0.00 C ATOM 895 C LYS A 58 6.130 10.723 -23.883 1.00 0.00 C ATOM 896 O LYS A 58 5.841 11.343 -22.855 1.00 0.00 O ATOM 897 CB LYS A 58 8.641 10.341 -23.911 1.00 0.00 C ATOM 898 CG LYS A 58 10.026 10.302 -24.601 1.00 0.00 C ATOM 899 CD LYS A 58 10.137 9.392 -25.845 1.00 0.00 C ATOM 900 CE LYS A 58 9.971 10.126 -27.186 1.00 0.00 C ATOM 901 NZ LYS A 58 10.148 9.177 -28.302 1.00 0.00 N ATOM 0 H LYS A 58 8.391 12.819 -24.185 1.00 0.00 H new ATOM 0 HA LYS A 58 7.321 10.559 -25.667 1.00 0.00 H new ATOM 0 HB2 LYS A 58 8.756 10.868 -22.964 1.00 0.00 H new ATOM 0 HB3 LYS A 58 8.359 9.315 -23.673 1.00 0.00 H new ATOM 0 HG2 LYS A 58 10.293 11.318 -24.893 1.00 0.00 H new ATOM 0 HG3 LYS A 58 10.765 9.976 -23.870 1.00 0.00 H new ATOM 0 HD2 LYS A 58 11.108 8.898 -25.833 1.00 0.00 H new ATOM 0 HD3 LYS A 58 9.381 8.610 -25.777 1.00 0.00 H new ATOM 0 HE2 LYS A 58 8.984 10.585 -27.240 1.00 0.00 H new ATOM 0 HE3 LYS A 58 10.701 10.932 -27.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 10.035 9.679 -29.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 11.099 8.759 -28.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 9.435 8.423 -28.233 1.00 0.00 H new ATOM 914 N ASN A 59 5.368 9.722 -24.346 1.00 0.00 N ATOM 915 CA ASN A 59 4.169 9.198 -23.633 1.00 0.00 C ATOM 916 C ASN A 59 4.182 7.635 -23.707 1.00 0.00 C ATOM 917 O ASN A 59 3.944 7.061 -24.774 1.00 0.00 O ATOM 918 CB ASN A 59 2.910 9.850 -24.276 1.00 0.00 C ATOM 919 CG ASN A 59 1.558 9.554 -23.610 1.00 0.00 C ATOM 920 OD1 ASN A 59 1.395 8.693 -22.751 1.00 0.00 O ATOM 921 ND2 ASN A 59 0.524 10.255 -24.005 1.00 0.00 N ATOM 0 H ASN A 59 5.557 9.244 -25.227 1.00 0.00 H new ATOM 0 HA ASN A 59 4.164 9.456 -22.574 1.00 0.00 H new ATOM 0 HB2 ASN A 59 3.055 10.930 -24.285 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.854 9.527 -25.316 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.395 10.080 -23.600 1.00 0.00 H new ATOM 0 HD22 ASN A 59 0.639 10.975 -24.718 1.00 0.00 H new ATOM 928 N THR A 60 4.452 6.948 -22.580 1.00 0.00 N ATOM 929 CA THR A 60 4.362 5.453 -22.501 1.00 0.00 C ATOM 930 C THR A 60 3.813 4.983 -21.110 1.00 0.00 C ATOM 931 O THR A 60 4.139 5.558 -20.066 1.00 0.00 O ATOM 932 CB THR A 60 5.695 4.769 -22.946 1.00 0.00 C ATOM 933 OG1 THR A 60 5.480 3.370 -23.111 1.00 0.00 O ATOM 934 CG2 THR A 60 6.910 4.938 -22.020 1.00 0.00 C ATOM 0 H THR A 60 4.735 7.392 -21.706 1.00 0.00 H new ATOM 0 HA THR A 60 3.622 5.112 -23.225 1.00 0.00 H new ATOM 0 HB THR A 60 5.950 5.289 -23.869 1.00 0.00 H new ATOM 0 HG1 THR A 60 6.076 3.028 -23.809 1.00 0.00 H new ATOM 0 HG21 THR A 60 7.767 4.415 -22.445 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.145 5.997 -21.918 1.00 0.00 H new ATOM 0 HG23 THR A 60 6.681 4.521 -21.039 1.00 0.00 H new ATOM 942 N GLU A 61 2.956 3.941 -21.091 1.00 0.00 N ATOM 943 CA GLU A 61 2.261 3.474 -19.853 1.00 0.00 C ATOM 944 C GLU A 61 2.246 1.918 -19.703 1.00 0.00 C ATOM 945 O GLU A 61 2.022 1.191 -20.675 1.00 0.00 O ATOM 946 CB GLU A 61 0.852 4.127 -19.741 1.00 0.00 C ATOM 947 CG GLU A 61 -0.216 3.736 -20.797 1.00 0.00 C ATOM 948 CD GLU A 61 -1.503 4.567 -20.750 1.00 0.00 C ATOM 949 OE1 GLU A 61 -2.003 5.031 -19.727 1.00 0.00 O ATOM 950 OE2 GLU A 61 -2.045 4.729 -21.989 1.00 0.00 O ATOM 0 H GLU A 61 2.721 3.397 -21.922 1.00 0.00 H new ATOM 0 HA GLU A 61 2.843 3.815 -18.997 1.00 0.00 H new ATOM 0 HB2 GLU A 61 0.451 3.889 -18.756 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.981 5.209 -19.780 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.224 3.830 -21.790 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.474 2.686 -20.661 1.00 0.00 H new ATOM 958 N ILE A 62 2.488 1.413 -18.476 1.00 0.00 N ATOM 959 CA ILE A 62 2.723 -0.047 -18.221 1.00 0.00 C ATOM 960 C ILE A 62 1.718 -0.635 -17.181 1.00 0.00 C ATOM 961 O ILE A 62 1.629 -0.150 -16.051 1.00 0.00 O ATOM 962 CB ILE A 62 4.208 -0.355 -17.820 1.00 0.00 C ATOM 963 CG1 ILE A 62 4.758 0.414 -16.584 1.00 0.00 C ATOM 964 CG2 ILE A 62 5.134 -0.204 -19.047 1.00 0.00 C ATOM 965 CD1 ILE A 62 6.003 -0.211 -15.938 1.00 0.00 C ATOM 0 H ILE A 62 2.528 1.988 -17.634 1.00 0.00 H new ATOM 0 HA ILE A 62 2.538 -0.552 -19.169 1.00 0.00 H new ATOM 0 HB ILE A 62 4.200 -1.392 -17.484 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.996 1.434 -16.885 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.970 0.478 -15.834 1.00 0.00 H new ATOM 0 HG21 ILE A 62 6.162 -0.420 -18.756 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.823 -0.901 -19.825 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.071 0.816 -19.427 1.00 0.00 H new ATOM 0 HD11 ILE A 62 6.313 0.394 -15.086 1.00 0.00 H new ATOM 0 HD12 ILE A 62 5.770 -1.221 -15.601 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.811 -0.250 -16.668 1.00 0.00 H new ATOM 977 N SER A 63 1.000 -1.704 -17.562 1.00 0.00 N ATOM 978 CA SER A 63 -0.082 -2.312 -16.731 1.00 0.00 C ATOM 979 C SER A 63 0.309 -3.720 -16.179 1.00 0.00 C ATOM 980 O SER A 63 0.332 -4.706 -16.933 1.00 0.00 O ATOM 981 CB SER A 63 -1.373 -2.369 -17.586 1.00 0.00 C ATOM 982 OG SER A 63 -1.269 -3.315 -18.652 1.00 0.00 O ATOM 0 H SER A 63 1.144 -2.180 -18.453 1.00 0.00 H new ATOM 0 HA SER A 63 -0.247 -1.692 -15.850 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.218 -2.632 -16.949 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.579 -1.381 -17.997 1.00 0.00 H new ATOM 0 HG SER A 63 -0.644 -4.026 -18.399 1.00 0.00 H new ATOM 988 N PHE A 64 0.604 -3.815 -14.869 1.00 0.00 N ATOM 989 CA PHE A 64 1.203 -5.041 -14.264 1.00 0.00 C ATOM 990 C PHE A 64 0.530 -5.492 -12.932 1.00 0.00 C ATOM 991 O PHE A 64 0.222 -4.680 -12.056 1.00 0.00 O ATOM 992 CB PHE A 64 2.745 -4.888 -14.143 1.00 0.00 C ATOM 993 CG PHE A 64 3.272 -3.768 -13.233 1.00 0.00 C ATOM 994 CD1 PHE A 64 3.414 -3.977 -11.857 1.00 0.00 C ATOM 995 CD2 PHE A 64 3.553 -2.510 -13.772 1.00 0.00 C ATOM 996 CE1 PHE A 64 3.815 -2.935 -11.028 1.00 0.00 C ATOM 997 CE2 PHE A 64 3.958 -1.472 -12.943 1.00 0.00 C ATOM 998 CZ PHE A 64 4.083 -1.683 -11.571 1.00 0.00 C ATOM 0 H PHE A 64 0.441 -3.062 -14.201 1.00 0.00 H new ATOM 0 HA PHE A 64 0.996 -5.862 -14.950 1.00 0.00 H new ATOM 0 HB2 PHE A 64 3.151 -5.834 -13.784 1.00 0.00 H new ATOM 0 HB3 PHE A 64 3.148 -4.728 -15.143 1.00 0.00 H new ATOM 0 HD1 PHE A 64 3.211 -4.951 -11.437 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.455 -2.345 -14.835 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.918 -3.098 -9.965 1.00 0.00 H new ATOM 0 HE2 PHE A 64 4.176 -0.501 -13.362 1.00 0.00 H new ATOM 0 HZ PHE A 64 4.389 -0.872 -10.927 1.00 0.00 H new ATOM 1008 N GLN A 65 0.366 -6.813 -12.762 1.00 0.00 N ATOM 1009 CA GLN A 65 -0.244 -7.411 -11.532 1.00 0.00 C ATOM 1010 C GLN A 65 0.793 -8.025 -10.517 1.00 0.00 C ATOM 1011 O GLN A 65 0.511 -9.050 -9.893 1.00 0.00 O ATOM 1012 CB GLN A 65 -1.304 -8.443 -12.024 1.00 0.00 C ATOM 1013 CG GLN A 65 -2.510 -7.842 -12.797 1.00 0.00 C ATOM 1014 CD GLN A 65 -3.547 -8.846 -13.292 1.00 0.00 C ATOM 1015 OE1 GLN A 65 -4.597 -9.038 -12.687 1.00 0.00 O ATOM 1016 NE2 GLN A 65 -3.302 -9.488 -14.408 1.00 0.00 N ATOM 0 H GLN A 65 0.645 -7.504 -13.458 1.00 0.00 H new ATOM 0 HA GLN A 65 -0.709 -6.624 -10.938 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.808 -9.170 -12.667 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.683 -8.989 -11.160 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -3.010 -7.121 -12.150 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.128 -7.289 -13.655 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -2.428 -9.326 -14.908 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -3.985 -10.150 -14.776 1.00 0.00 H new ATOM 1025 N LEU A 66 1.964 -7.379 -10.311 1.00 0.00 N ATOM 1026 CA LEU A 66 3.028 -7.811 -9.344 1.00 0.00 C ATOM 1027 C LEU A 66 3.627 -9.233 -9.634 1.00 0.00 C ATOM 1028 O LEU A 66 3.033 -10.256 -9.284 1.00 0.00 O ATOM 1029 CB LEU A 66 2.607 -7.609 -7.856 1.00 0.00 C ATOM 1030 CG LEU A 66 2.211 -6.176 -7.397 1.00 0.00 C ATOM 1031 CD1 LEU A 66 1.773 -6.195 -5.923 1.00 0.00 C ATOM 1032 CD2 LEU A 66 3.350 -5.155 -7.573 1.00 0.00 C ATOM 0 H LEU A 66 2.211 -6.527 -10.815 1.00 0.00 H new ATOM 0 HA LEU A 66 3.861 -7.130 -9.519 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.763 -8.269 -7.655 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.431 -7.945 -7.227 1.00 0.00 H new ATOM 0 HG LEU A 66 1.386 -5.862 -8.036 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.498 -5.187 -5.612 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.915 -6.857 -5.807 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.595 -6.554 -5.304 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.015 -4.174 -7.236 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.212 -5.466 -6.983 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.631 -5.101 -8.625 1.00 0.00 H new ATOM 1044 N GLY A 67 4.786 -9.302 -10.315 1.00 0.00 N ATOM 1045 CA GLY A 67 5.277 -10.576 -10.927 1.00 0.00 C ATOM 1046 C GLY A 67 4.843 -10.929 -12.379 1.00 0.00 C ATOM 1047 O GLY A 67 5.283 -11.954 -12.902 1.00 0.00 O ATOM 0 H GLY A 67 5.404 -8.504 -10.461 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.367 -10.554 -10.905 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.962 -11.395 -10.281 1.00 0.00 H new ATOM 1051 N GLU A 68 4.030 -10.092 -13.045 1.00 0.00 N ATOM 1052 CA GLU A 68 3.661 -10.242 -14.476 1.00 0.00 C ATOM 1053 C GLU A 68 4.865 -9.927 -15.423 1.00 0.00 C ATOM 1054 O GLU A 68 5.433 -8.833 -15.360 1.00 0.00 O ATOM 1055 CB GLU A 68 2.477 -9.259 -14.708 1.00 0.00 C ATOM 1056 CG GLU A 68 1.794 -9.316 -16.100 1.00 0.00 C ATOM 1057 CD GLU A 68 0.806 -8.166 -16.308 1.00 0.00 C ATOM 1058 OE1 GLU A 68 -0.264 -8.073 -15.711 1.00 0.00 O ATOM 1059 OE2 GLU A 68 1.286 -7.218 -17.166 1.00 0.00 O ATOM 0 H GLU A 68 3.601 -9.278 -12.604 1.00 0.00 H new ATOM 0 HA GLU A 68 3.378 -11.269 -14.706 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.720 -9.451 -13.948 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.840 -8.244 -14.547 1.00 0.00 H new ATOM 0 HG2 GLU A 68 2.556 -9.283 -16.878 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.271 -10.266 -16.207 1.00 0.00 H new ATOM 1067 N GLU A 69 5.214 -10.872 -16.313 1.00 0.00 N ATOM 1068 CA GLU A 69 6.185 -10.622 -17.418 1.00 0.00 C ATOM 1069 C GLU A 69 5.440 -10.149 -18.712 1.00 0.00 C ATOM 1070 O GLU A 69 4.538 -10.832 -19.208 1.00 0.00 O ATOM 1071 CB GLU A 69 7.072 -11.882 -17.624 1.00 0.00 C ATOM 1072 CG GLU A 69 8.375 -11.655 -18.444 1.00 0.00 C ATOM 1073 CD GLU A 69 8.219 -11.592 -19.965 1.00 0.00 C ATOM 1074 OE1 GLU A 69 8.259 -10.548 -20.610 1.00 0.00 O ATOM 1075 OE2 GLU A 69 8.040 -12.829 -20.513 1.00 0.00 O ATOM 0 H GLU A 69 4.843 -11.822 -16.297 1.00 0.00 H new ATOM 0 HA GLU A 69 6.857 -9.805 -17.154 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.343 -12.278 -16.645 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.477 -12.646 -18.124 1.00 0.00 H new ATOM 0 HG2 GLU A 69 8.832 -10.724 -18.109 1.00 0.00 H new ATOM 0 HG3 GLU A 69 9.073 -12.457 -18.205 1.00 0.00 H new ATOM 1083 N PHE A 70 5.815 -8.973 -19.244 1.00 0.00 N ATOM 1084 CA PHE A 70 5.087 -8.311 -20.370 1.00 0.00 C ATOM 1085 C PHE A 70 6.056 -7.508 -21.304 1.00 0.00 C ATOM 1086 O PHE A 70 6.986 -6.849 -20.833 1.00 0.00 O ATOM 1087 CB PHE A 70 3.925 -7.420 -19.808 1.00 0.00 C ATOM 1088 CG PHE A 70 4.326 -6.232 -18.904 1.00 0.00 C ATOM 1089 CD1 PHE A 70 4.588 -4.975 -19.456 1.00 0.00 C ATOM 1090 CD2 PHE A 70 4.579 -6.447 -17.546 1.00 0.00 C ATOM 1091 CE1 PHE A 70 5.157 -3.973 -18.675 1.00 0.00 C ATOM 1092 CE2 PHE A 70 5.176 -5.454 -16.775 1.00 0.00 C ATOM 1093 CZ PHE A 70 5.478 -4.220 -17.344 1.00 0.00 C ATOM 0 H PHE A 70 6.625 -8.447 -18.916 1.00 0.00 H new ATOM 0 HA PHE A 70 4.644 -9.086 -20.996 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.360 -7.027 -20.653 1.00 0.00 H new ATOM 0 HB3 PHE A 70 3.249 -8.062 -19.244 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.348 -4.781 -20.491 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.310 -7.389 -17.092 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.350 -3.001 -19.104 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.405 -5.641 -15.736 1.00 0.00 H new ATOM 0 HZ PHE A 70 5.961 -3.456 -16.753 1.00 0.00 H new ATOM 1103 N ASP A 71 5.800 -7.478 -22.626 1.00 0.00 N ATOM 1104 CA ASP A 71 6.479 -6.517 -23.551 1.00 0.00 C ATOM 1105 C ASP A 71 5.931 -5.058 -23.410 1.00 0.00 C ATOM 1106 O ASP A 71 4.726 -4.836 -23.246 1.00 0.00 O ATOM 1107 CB ASP A 71 6.343 -6.987 -25.024 1.00 0.00 C ATOM 1108 CG ASP A 71 7.322 -8.073 -25.454 1.00 0.00 C ATOM 1109 OD1 ASP A 71 8.297 -7.857 -26.167 1.00 0.00 O ATOM 1110 OD2 ASP A 71 6.988 -9.302 -24.973 1.00 0.00 O ATOM 0 H ASP A 71 5.134 -8.099 -23.086 1.00 0.00 H new ATOM 0 HA ASP A 71 7.531 -6.502 -23.267 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.328 -7.354 -25.179 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.473 -6.124 -25.677 1.00 0.00 H new ATOM 1116 N GLU A 72 6.829 -4.063 -23.509 1.00 0.00 N ATOM 1117 CA GLU A 72 6.466 -2.625 -23.348 1.00 0.00 C ATOM 1118 C GLU A 72 7.366 -1.682 -24.199 1.00 0.00 C ATOM 1119 O GLU A 72 8.594 -1.826 -24.241 1.00 0.00 O ATOM 1120 CB GLU A 72 6.437 -2.229 -21.848 1.00 0.00 C ATOM 1121 CG GLU A 72 7.752 -2.327 -21.028 1.00 0.00 C ATOM 1122 CD GLU A 72 8.628 -1.085 -20.909 1.00 0.00 C ATOM 1123 OE1 GLU A 72 8.395 0.008 -21.418 1.00 0.00 O ATOM 1124 OE2 GLU A 72 9.719 -1.336 -20.139 1.00 0.00 O ATOM 0 H GLU A 72 7.819 -4.219 -23.700 1.00 0.00 H new ATOM 0 HA GLU A 72 5.457 -2.496 -23.740 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.083 -1.200 -21.784 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.692 -2.854 -21.355 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.491 -2.647 -20.019 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.358 -3.120 -21.467 1.00 0.00 H new ATOM 1132 N THR A 73 6.740 -0.685 -24.848 1.00 0.00 N ATOM 1133 CA THR A 73 7.452 0.285 -25.725 1.00 0.00 C ATOM 1134 C THR A 73 8.093 1.420 -24.865 1.00 0.00 C ATOM 1135 O THR A 73 7.422 2.348 -24.397 1.00 0.00 O ATOM 1136 CB THR A 73 6.476 0.823 -26.819 1.00 0.00 C ATOM 1137 OG1 THR A 73 5.903 -0.251 -27.557 1.00 0.00 O ATOM 1138 CG2 THR A 73 7.133 1.723 -27.878 1.00 0.00 C ATOM 0 H THR A 73 5.735 -0.522 -24.786 1.00 0.00 H new ATOM 0 HA THR A 73 8.271 -0.212 -26.245 1.00 0.00 H new ATOM 0 HB THR A 73 5.747 1.399 -26.250 1.00 0.00 H new ATOM 0 HG1 THR A 73 5.294 0.107 -28.236 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.380 2.049 -28.596 1.00 0.00 H new ATOM 0 HG22 THR A 73 7.573 2.594 -27.393 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.912 1.165 -28.398 1.00 0.00 H new ATOM 1146 N THR A 74 9.416 1.325 -24.682 1.00 0.00 N ATOM 1147 CA THR A 74 10.209 2.333 -23.913 1.00 0.00 C ATOM 1148 C THR A 74 10.414 3.705 -24.655 1.00 0.00 C ATOM 1149 O THR A 74 10.110 3.860 -25.842 1.00 0.00 O ATOM 1150 CB THR A 74 11.593 1.705 -23.540 1.00 0.00 C ATOM 1151 OG1 THR A 74 12.304 1.360 -24.719 1.00 0.00 O ATOM 1152 CG2 THR A 74 11.559 0.469 -22.629 1.00 0.00 C ATOM 0 H THR A 74 9.977 0.559 -25.054 1.00 0.00 H new ATOM 0 HA THR A 74 9.631 2.575 -23.021 1.00 0.00 H new ATOM 0 HB THR A 74 12.085 2.489 -22.963 1.00 0.00 H new ATOM 0 HG1 THR A 74 11.957 0.516 -25.075 1.00 0.00 H new ATOM 0 HG21 THR A 74 12.577 0.126 -22.442 1.00 0.00 H new ATOM 0 HG22 THR A 74 11.084 0.727 -21.683 1.00 0.00 H new ATOM 0 HG23 THR A 74 10.992 -0.325 -23.115 1.00 0.00 H new ATOM 1160 N ALA A 75 11.029 4.690 -23.968 1.00 0.00 N ATOM 1161 CA ALA A 75 11.470 5.972 -24.592 1.00 0.00 C ATOM 1162 C ALA A 75 12.513 5.949 -25.773 1.00 0.00 C ATOM 1163 O ALA A 75 12.709 6.989 -26.411 1.00 0.00 O ATOM 1164 CB ALA A 75 11.961 6.846 -23.421 1.00 0.00 C ATOM 0 H ALA A 75 11.237 4.628 -22.971 1.00 0.00 H new ATOM 0 HA ALA A 75 10.606 6.359 -25.132 1.00 0.00 H new ATOM 0 HB1 ALA A 75 12.302 7.808 -23.803 1.00 0.00 H new ATOM 0 HB2 ALA A 75 11.144 7.004 -22.717 1.00 0.00 H new ATOM 0 HB3 ALA A 75 12.785 6.344 -22.913 1.00 0.00 H new ATOM 1170 N ASP A 76 13.155 4.808 -26.105 1.00 0.00 N ATOM 1171 CA ASP A 76 13.791 4.610 -27.448 1.00 0.00 C ATOM 1172 C ASP A 76 13.065 3.556 -28.366 1.00 0.00 C ATOM 1173 O ASP A 76 13.684 3.053 -29.308 1.00 0.00 O ATOM 1174 CB ASP A 76 15.293 4.275 -27.204 1.00 0.00 C ATOM 1175 CG ASP A 76 16.252 4.631 -28.346 1.00 0.00 C ATOM 1176 OD1 ASP A 76 17.149 5.460 -28.229 1.00 0.00 O ATOM 1177 OD2 ASP A 76 16.015 3.921 -29.487 1.00 0.00 O ATOM 0 H ASP A 76 13.252 4.011 -25.476 1.00 0.00 H new ATOM 0 HA ASP A 76 13.695 5.531 -28.023 1.00 0.00 H new ATOM 0 HB2 ASP A 76 15.620 4.797 -26.305 1.00 0.00 H new ATOM 0 HB3 ASP A 76 15.379 3.207 -27.002 1.00 0.00 H new ATOM 1183 N ASP A 77 11.779 3.214 -28.137 1.00 0.00 N ATOM 1184 CA ASP A 77 11.043 2.139 -28.882 1.00 0.00 C ATOM 1185 C ASP A 77 11.686 0.700 -28.915 1.00 0.00 C ATOM 1186 O ASP A 77 11.452 -0.070 -29.849 1.00 0.00 O ATOM 1187 CB ASP A 77 10.564 2.659 -30.271 1.00 0.00 C ATOM 1188 CG ASP A 77 9.523 3.780 -30.235 1.00 0.00 C ATOM 1189 OD1 ASP A 77 8.314 3.582 -30.317 1.00 0.00 O ATOM 1190 OD2 ASP A 77 10.097 5.010 -30.094 1.00 0.00 O ATOM 0 H ASP A 77 11.207 3.672 -27.427 1.00 0.00 H new ATOM 0 HA ASP A 77 10.167 1.936 -28.266 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.433 3.012 -30.826 1.00 0.00 H new ATOM 0 HB3 ASP A 77 10.149 1.820 -30.829 1.00 0.00 H new ATOM 1196 N ARG A 78 12.417 0.299 -27.853 1.00 0.00 N ATOM 1197 CA ARG A 78 12.799 -1.122 -27.621 1.00 0.00 C ATOM 1198 C ARG A 78 11.656 -1.832 -26.824 1.00 0.00 C ATOM 1199 O ARG A 78 11.210 -1.328 -25.782 1.00 0.00 O ATOM 1200 CB ARG A 78 14.210 -1.247 -26.962 1.00 0.00 C ATOM 1201 CG ARG A 78 14.400 -0.627 -25.553 1.00 0.00 C ATOM 1202 CD ARG A 78 15.691 -0.987 -24.790 1.00 0.00 C ATOM 1203 NE ARG A 78 16.822 -0.038 -24.998 1.00 0.00 N ATOM 1204 CZ ARG A 78 16.923 1.178 -24.462 1.00 0.00 C ATOM 1205 NH1 ARG A 78 16.017 1.702 -23.671 1.00 0.00 N ATOM 1206 NH2 ARG A 78 17.978 1.883 -24.738 1.00 0.00 N ATOM 0 H ARG A 78 12.759 0.939 -27.136 1.00 0.00 H new ATOM 0 HA ARG A 78 12.903 -1.639 -28.575 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.459 -2.306 -26.900 1.00 0.00 H new ATOM 0 HB3 ARG A 78 14.936 -0.787 -27.632 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.359 0.458 -25.653 1.00 0.00 H new ATOM 0 HG3 ARG A 78 13.551 -0.923 -24.937 1.00 0.00 H new ATOM 0 HD2 ARG A 78 15.466 -1.035 -23.725 1.00 0.00 H new ATOM 0 HD3 ARG A 78 16.010 -1.984 -25.094 1.00 0.00 H new ATOM 0 HE ARG A 78 17.584 -0.346 -25.602 1.00 0.00 H new ATOM 0 HH11 ARG A 78 15.178 1.172 -23.435 1.00 0.00 H new ATOM 0 HH12 ARG A 78 16.152 2.639 -23.292 1.00 0.00 H new ATOM 0 HH21 ARG A 78 18.700 1.502 -25.350 1.00 0.00 H new ATOM 0 HH22 ARG A 78 18.085 2.817 -24.343 1.00 0.00 H new ATOM 1220 N ASN A 79 11.188 -2.989 -27.326 1.00 0.00 N ATOM 1221 CA ASN A 79 10.131 -3.802 -26.663 1.00 0.00 C ATOM 1222 C ASN A 79 10.712 -4.648 -25.484 1.00 0.00 C ATOM 1223 O ASN A 79 11.226 -5.757 -25.672 1.00 0.00 O ATOM 1224 CB ASN A 79 9.343 -4.621 -27.726 1.00 0.00 C ATOM 1225 CG ASN A 79 10.122 -5.616 -28.605 1.00 0.00 C ATOM 1226 OD1 ASN A 79 10.898 -5.234 -29.474 1.00 0.00 O ATOM 1227 ND2 ASN A 79 9.945 -6.902 -28.428 1.00 0.00 N ATOM 0 H ASN A 79 11.525 -3.393 -28.200 1.00 0.00 H new ATOM 0 HA ASN A 79 9.404 -3.142 -26.190 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.563 -5.177 -27.206 1.00 0.00 H new ATOM 0 HB3 ASN A 79 8.843 -3.913 -28.388 1.00 0.00 H new ATOM 0 HD21 ASN A 79 10.450 -7.571 -29.009 1.00 0.00 H new ATOM 0 HD22 ASN A 79 9.303 -7.234 -27.709 1.00 0.00 H new ATOM 1234 N CYS A 80 10.665 -4.087 -24.266 1.00 0.00 N ATOM 1235 CA CYS A 80 11.338 -4.689 -23.090 1.00 0.00 C ATOM 1236 C CYS A 80 10.459 -5.753 -22.373 1.00 0.00 C ATOM 1237 O CYS A 80 9.400 -5.434 -21.822 1.00 0.00 O ATOM 1238 CB CYS A 80 11.739 -3.540 -22.149 1.00 0.00 C ATOM 1239 SG CYS A 80 13.126 -2.594 -22.857 1.00 0.00 S ATOM 0 H CYS A 80 10.170 -3.218 -24.063 1.00 0.00 H new ATOM 0 HA CYS A 80 12.223 -5.236 -23.416 1.00 0.00 H new ATOM 0 HB2 CYS A 80 10.886 -2.881 -21.986 1.00 0.00 H new ATOM 0 HB3 CYS A 80 12.023 -3.941 -21.176 1.00 0.00 H new ATOM 0 HG CYS A 80 13.578 -1.758 -21.970 1.00 0.00 H new ATOM 1245 N LYS A 81 10.947 -7.005 -22.335 1.00 0.00 N ATOM 1246 CA LYS A 81 10.305 -8.130 -21.602 1.00 0.00 C ATOM 1247 C LYS A 81 10.436 -7.894 -20.063 1.00 0.00 C ATOM 1248 O LYS A 81 11.506 -8.048 -19.468 1.00 0.00 O ATOM 1249 CB LYS A 81 10.967 -9.465 -22.062 1.00 0.00 C ATOM 1250 CG LYS A 81 10.477 -10.088 -23.394 1.00 0.00 C ATOM 1251 CD LYS A 81 10.794 -9.316 -24.696 1.00 0.00 C ATOM 1252 CE LYS A 81 12.275 -9.351 -25.111 1.00 0.00 C ATOM 1253 NZ LYS A 81 12.519 -8.412 -26.223 1.00 0.00 N ATOM 0 H LYS A 81 11.806 -7.276 -22.814 1.00 0.00 H new ATOM 0 HA LYS A 81 9.240 -8.188 -21.826 1.00 0.00 H new ATOM 0 HB2 LYS A 81 12.041 -9.296 -22.145 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.820 -10.202 -21.273 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.909 -11.085 -23.479 1.00 0.00 H new ATOM 0 HG3 LYS A 81 9.396 -10.213 -23.331 1.00 0.00 H new ATOM 0 HD2 LYS A 81 10.193 -9.730 -25.505 1.00 0.00 H new ATOM 0 HD3 LYS A 81 10.489 -8.277 -24.572 1.00 0.00 H new ATOM 0 HE2 LYS A 81 12.904 -9.089 -24.260 1.00 0.00 H new ATOM 0 HE3 LYS A 81 12.551 -10.361 -25.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 13.543 -8.267 -26.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 12.126 -8.805 -27.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 12.061 -7.502 -26.015 1.00 0.00 H new ATOM 1266 N SER A 82 9.358 -7.388 -19.458 1.00 0.00 N ATOM 1267 CA SER A 82 9.439 -6.618 -18.194 1.00 0.00 C ATOM 1268 C SER A 82 8.720 -7.347 -17.037 1.00 0.00 C ATOM 1269 O SER A 82 7.513 -7.581 -17.115 1.00 0.00 O ATOM 1270 CB SER A 82 8.818 -5.226 -18.438 1.00 0.00 C ATOM 1271 OG SER A 82 9.598 -4.453 -19.351 1.00 0.00 O ATOM 0 H SER A 82 8.410 -7.494 -19.818 1.00 0.00 H new ATOM 0 HA SER A 82 10.483 -6.517 -17.897 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.808 -5.342 -18.830 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.733 -4.694 -17.490 1.00 0.00 H new ATOM 0 HG SER A 82 9.357 -4.692 -20.270 1.00 0.00 H new ATOM 1277 N VAL A 83 9.452 -7.674 -15.960 1.00 0.00 N ATOM 1278 CA VAL A 83 8.868 -8.302 -14.736 1.00 0.00 C ATOM 1279 C VAL A 83 9.062 -7.349 -13.509 1.00 0.00 C ATOM 1280 O VAL A 83 10.194 -7.050 -13.113 1.00 0.00 O ATOM 1281 CB VAL A 83 9.374 -9.777 -14.568 1.00 0.00 C ATOM 1282 CG1 VAL A 83 10.884 -9.960 -14.301 1.00 0.00 C ATOM 1283 CG2 VAL A 83 8.581 -10.550 -13.493 1.00 0.00 C ATOM 0 H VAL A 83 10.458 -7.517 -15.900 1.00 0.00 H new ATOM 0 HA VAL A 83 7.788 -8.416 -14.829 1.00 0.00 H new ATOM 0 HB VAL A 83 9.190 -10.194 -15.558 1.00 0.00 H new ATOM 0 HG11 VAL A 83 11.110 -11.022 -14.204 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.454 -9.542 -15.131 1.00 0.00 H new ATOM 0 HG13 VAL A 83 11.156 -9.445 -13.379 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.969 -11.566 -13.415 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.685 -10.046 -12.532 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.528 -10.585 -13.772 1.00 0.00 H new ATOM 1293 N VAL A 84 7.955 -6.851 -12.918 1.00 0.00 N ATOM 1294 CA VAL A 84 8.016 -5.857 -11.802 1.00 0.00 C ATOM 1295 C VAL A 84 7.734 -6.583 -10.444 1.00 0.00 C ATOM 1296 O VAL A 84 6.611 -7.037 -10.189 1.00 0.00 O ATOM 1297 CB VAL A 84 7.087 -4.614 -12.023 1.00 0.00 C ATOM 1298 CG1 VAL A 84 7.387 -3.507 -10.984 1.00 0.00 C ATOM 1299 CG2 VAL A 84 7.170 -3.945 -13.415 1.00 0.00 C ATOM 0 H VAL A 84 7.007 -7.114 -13.187 1.00 0.00 H new ATOM 0 HA VAL A 84 9.024 -5.442 -11.778 1.00 0.00 H new ATOM 0 HB VAL A 84 6.087 -5.036 -11.919 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.729 -2.656 -11.159 1.00 0.00 H new ATOM 0 HG12 VAL A 84 7.218 -3.895 -9.980 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.425 -3.189 -11.081 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.485 -3.098 -13.453 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.188 -3.597 -13.591 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.896 -4.668 -14.183 1.00 0.00 H new ATOM 1309 N SER A 85 8.754 -6.663 -9.574 1.00 0.00 N ATOM 1310 CA SER A 85 8.675 -7.387 -8.274 1.00 0.00 C ATOM 1311 C SER A 85 8.772 -6.403 -7.068 1.00 0.00 C ATOM 1312 O SER A 85 9.775 -5.688 -6.946 1.00 0.00 O ATOM 1313 CB SER A 85 9.824 -8.427 -8.241 1.00 0.00 C ATOM 1314 OG SER A 85 11.110 -7.803 -8.171 1.00 0.00 O ATOM 0 H SER A 85 9.662 -6.230 -9.743 1.00 0.00 H new ATOM 0 HA SER A 85 7.711 -7.889 -8.186 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.693 -9.085 -7.382 1.00 0.00 H new ATOM 0 HB3 SER A 85 9.773 -9.053 -9.132 1.00 0.00 H new ATOM 0 HG SER A 85 11.055 -7.003 -7.608 1.00 0.00 H new ATOM 1320 N LEU A 86 7.778 -6.385 -6.158 1.00 0.00 N ATOM 1321 CA LEU A 86 7.806 -5.487 -4.966 1.00 0.00 C ATOM 1322 C LEU A 86 8.505 -6.172 -3.745 1.00 0.00 C ATOM 1323 O LEU A 86 7.894 -6.954 -3.011 1.00 0.00 O ATOM 1324 CB LEU A 86 6.373 -4.957 -4.675 1.00 0.00 C ATOM 1325 CG LEU A 86 6.299 -3.579 -3.961 1.00 0.00 C ATOM 1326 CD1 LEU A 86 4.882 -2.994 -4.074 1.00 0.00 C ATOM 1327 CD2 LEU A 86 6.697 -3.611 -2.475 1.00 0.00 C ATOM 0 H LEU A 86 6.948 -6.974 -6.217 1.00 0.00 H new ATOM 0 HA LEU A 86 8.423 -4.614 -5.177 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.832 -4.886 -5.619 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.851 -5.692 -4.063 1.00 0.00 H new ATOM 0 HG LEU A 86 7.029 -2.954 -4.474 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.846 -2.029 -3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.625 -2.864 -5.125 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.169 -3.674 -3.608 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.617 -2.608 -2.055 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.032 -4.285 -1.935 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.724 -3.963 -2.381 1.00 0.00 H new ATOM 1339 N ASP A 87 9.791 -5.852 -3.524 1.00 0.00 N ATOM 1340 CA ASP A 87 10.609 -6.453 -2.433 1.00 0.00 C ATOM 1341 C ASP A 87 10.657 -5.534 -1.161 1.00 0.00 C ATOM 1342 O ASP A 87 11.723 -5.007 -0.824 1.00 0.00 O ATOM 1343 CB ASP A 87 11.993 -6.743 -3.091 1.00 0.00 C ATOM 1344 CG ASP A 87 12.990 -7.556 -2.264 1.00 0.00 C ATOM 1345 OD1 ASP A 87 13.359 -8.685 -2.575 1.00 0.00 O ATOM 1346 OD2 ASP A 87 13.436 -6.875 -1.166 1.00 0.00 O ATOM 0 H ASP A 87 10.300 -5.173 -4.089 1.00 0.00 H new ATOM 0 HA ASP A 87 10.185 -7.376 -2.038 1.00 0.00 H new ATOM 0 HB2 ASP A 87 11.820 -7.270 -4.029 1.00 0.00 H new ATOM 0 HB3 ASP A 87 12.457 -5.789 -3.342 1.00 0.00 H new ATOM 1352 N GLY A 88 9.529 -5.370 -0.440 1.00 0.00 N ATOM 1353 CA GLY A 88 9.487 -4.591 0.837 1.00 0.00 C ATOM 1354 C GLY A 88 9.731 -3.068 0.713 1.00 0.00 C ATOM 1355 O GLY A 88 10.867 -2.620 0.872 1.00 0.00 O ATOM 0 H GLY A 88 8.628 -5.763 -0.712 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.513 -4.746 1.302 1.00 0.00 H new ATOM 0 HA3 GLY A 88 10.233 -5.004 1.516 1.00 0.00 H new ATOM 1359 N ASP A 89 8.693 -2.283 0.363 1.00 0.00 N ATOM 1360 CA ASP A 89 8.853 -0.866 -0.122 1.00 0.00 C ATOM 1361 C ASP A 89 9.635 -0.649 -1.480 1.00 0.00 C ATOM 1362 O ASP A 89 9.770 0.497 -1.904 1.00 0.00 O ATOM 1363 CB ASP A 89 9.313 0.074 1.042 1.00 0.00 C ATOM 1364 CG ASP A 89 9.147 1.588 0.832 1.00 0.00 C ATOM 1365 OD1 ASP A 89 8.225 2.097 0.201 1.00 0.00 O ATOM 1366 OD2 ASP A 89 10.143 2.306 1.430 1.00 0.00 O ATOM 0 H ASP A 89 7.722 -2.594 0.402 1.00 0.00 H new ATOM 0 HA ASP A 89 7.850 -0.567 -0.427 1.00 0.00 H new ATOM 0 HB2 ASP A 89 8.761 -0.205 1.939 1.00 0.00 H new ATOM 0 HB3 ASP A 89 10.366 -0.126 1.241 1.00 0.00 H new ATOM 1372 N LYS A 90 10.126 -1.693 -2.175 1.00 0.00 N ATOM 1373 CA LYS A 90 11.010 -1.549 -3.367 1.00 0.00 C ATOM 1374 C LYS A 90 10.325 -2.160 -4.628 1.00 0.00 C ATOM 1375 O LYS A 90 10.378 -3.373 -4.848 1.00 0.00 O ATOM 1376 CB LYS A 90 12.370 -2.243 -3.063 1.00 0.00 C ATOM 1377 CG LYS A 90 13.251 -1.585 -1.973 1.00 0.00 C ATOM 1378 CD LYS A 90 14.482 -2.449 -1.628 1.00 0.00 C ATOM 1379 CE LYS A 90 15.389 -1.862 -0.531 1.00 0.00 C ATOM 1380 NZ LYS A 90 16.261 -0.783 -1.039 1.00 0.00 N ATOM 0 H LYS A 90 9.926 -2.663 -1.933 1.00 0.00 H new ATOM 0 HA LYS A 90 11.189 -0.495 -3.577 1.00 0.00 H new ATOM 0 HB2 LYS A 90 12.169 -3.272 -2.765 1.00 0.00 H new ATOM 0 HB3 LYS A 90 12.946 -2.286 -3.988 1.00 0.00 H new ATOM 0 HG2 LYS A 90 13.581 -0.604 -2.316 1.00 0.00 H new ATOM 0 HG3 LYS A 90 12.656 -1.425 -1.074 1.00 0.00 H new ATOM 0 HD2 LYS A 90 14.141 -3.434 -1.310 1.00 0.00 H new ATOM 0 HD3 LYS A 90 15.074 -2.593 -2.532 1.00 0.00 H new ATOM 0 HE2 LYS A 90 14.771 -1.475 0.279 1.00 0.00 H new ATOM 0 HE3 LYS A 90 16.006 -2.656 -0.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 17.211 -0.881 -0.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 16.326 -0.848 -2.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 15.862 0.140 -0.774 1.00 0.00 H new ATOM 1393 N LEU A 91 9.719 -1.320 -5.486 1.00 0.00 N ATOM 1394 CA LEU A 91 9.178 -1.742 -6.812 1.00 0.00 C ATOM 1395 C LEU A 91 10.337 -1.925 -7.851 1.00 0.00 C ATOM 1396 O LEU A 91 10.841 -0.950 -8.412 1.00 0.00 O ATOM 1397 CB LEU A 91 8.112 -0.685 -7.271 1.00 0.00 C ATOM 1398 CG LEU A 91 6.620 -0.999 -6.982 1.00 0.00 C ATOM 1399 CD1 LEU A 91 5.736 0.201 -7.366 1.00 0.00 C ATOM 1400 CD2 LEU A 91 6.102 -2.236 -7.739 1.00 0.00 C ATOM 0 H LEU A 91 9.585 -0.328 -5.290 1.00 0.00 H new ATOM 0 HA LEU A 91 8.689 -2.713 -6.734 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.354 0.265 -6.795 1.00 0.00 H new ATOM 0 HB3 LEU A 91 8.223 -0.540 -8.346 1.00 0.00 H new ATOM 0 HG LEU A 91 6.562 -1.205 -5.913 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.692 -0.034 -7.158 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.034 1.073 -6.785 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.854 0.415 -8.428 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.053 -2.400 -7.493 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.202 -2.074 -8.812 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.684 -3.111 -7.448 1.00 0.00 H new ATOM 1412 N VAL A 92 10.784 -3.169 -8.096 1.00 0.00 N ATOM 1413 CA VAL A 92 11.993 -3.443 -8.934 1.00 0.00 C ATOM 1414 C VAL A 92 11.515 -3.845 -10.367 1.00 0.00 C ATOM 1415 O VAL A 92 11.127 -4.992 -10.609 1.00 0.00 O ATOM 1416 CB VAL A 92 12.932 -4.494 -8.241 1.00 0.00 C ATOM 1417 CG1 VAL A 92 14.240 -4.732 -9.030 1.00 0.00 C ATOM 1418 CG2 VAL A 92 13.353 -4.129 -6.796 1.00 0.00 C ATOM 0 H VAL A 92 10.335 -4.009 -7.731 1.00 0.00 H new ATOM 0 HA VAL A 92 12.612 -2.551 -9.035 1.00 0.00 H new ATOM 0 HB VAL A 92 12.312 -5.390 -8.219 1.00 0.00 H new ATOM 0 HG11 VAL A 92 14.852 -5.467 -8.507 1.00 0.00 H new ATOM 0 HG12 VAL A 92 14.001 -5.102 -10.027 1.00 0.00 H new ATOM 0 HG13 VAL A 92 14.790 -3.795 -9.113 1.00 0.00 H new ATOM 0 HG21 VAL A 92 14.000 -4.911 -6.397 1.00 0.00 H new ATOM 0 HG22 VAL A 92 13.891 -3.181 -6.802 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.465 -4.038 -6.170 1.00 0.00 H new ATOM 1428 N HIS A 93 11.546 -2.884 -11.310 1.00 0.00 N ATOM 1429 CA HIS A 93 11.137 -3.113 -12.727 1.00 0.00 C ATOM 1430 C HIS A 93 12.324 -3.678 -13.561 1.00 0.00 C ATOM 1431 O HIS A 93 13.204 -2.928 -13.989 1.00 0.00 O ATOM 1432 CB HIS A 93 10.579 -1.763 -13.256 1.00 0.00 C ATOM 1433 CG HIS A 93 10.112 -1.653 -14.717 1.00 0.00 C ATOM 1434 ND1 HIS A 93 9.907 -2.697 -15.613 1.00 0.00 N ATOM 1435 CD2 HIS A 93 9.848 -0.424 -15.340 1.00 0.00 C ATOM 1436 CE1 HIS A 93 9.539 -1.975 -16.719 1.00 0.00 C ATOM 1437 NE2 HIS A 93 9.499 -0.609 -16.663 1.00 0.00 N ATOM 0 H HIS A 93 11.852 -1.929 -11.122 1.00 0.00 H new ATOM 0 HA HIS A 93 10.358 -3.871 -12.811 1.00 0.00 H new ATOM 0 HB2 HIS A 93 9.735 -1.489 -12.623 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.351 -1.009 -13.103 1.00 0.00 H new ATOM 0 HD2 HIS A 93 9.909 0.537 -14.851 1.00 0.00 H new ATOM 0 HE1 HIS A 93 9.281 -2.485 -17.635 1.00 0.00 H new ATOM 0 HE2 HIS A 93 9.276 0.074 -17.387 1.00 0.00 H new ATOM 1445 N ILE A 94 12.321 -4.999 -13.788 1.00 0.00 N ATOM 1446 CA ILE A 94 13.419 -5.720 -14.496 1.00 0.00 C ATOM 1447 C ILE A 94 13.086 -5.749 -16.024 1.00 0.00 C ATOM 1448 O ILE A 94 12.235 -6.537 -16.445 1.00 0.00 O ATOM 1449 CB ILE A 94 13.581 -7.152 -13.859 1.00 0.00 C ATOM 1450 CG1 ILE A 94 14.004 -7.134 -12.357 1.00 0.00 C ATOM 1451 CG2 ILE A 94 14.558 -8.058 -14.651 1.00 0.00 C ATOM 1452 CD1 ILE A 94 13.640 -8.399 -11.558 1.00 0.00 C ATOM 0 H ILE A 94 11.561 -5.610 -13.490 1.00 0.00 H new ATOM 0 HA ILE A 94 14.379 -5.216 -14.385 1.00 0.00 H new ATOM 0 HB ILE A 94 12.578 -7.574 -13.918 1.00 0.00 H new ATOM 0 HG12 ILE A 94 15.083 -6.987 -12.302 1.00 0.00 H new ATOM 0 HG13 ILE A 94 13.540 -6.273 -11.876 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.628 -9.031 -14.164 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.190 -8.188 -15.669 1.00 0.00 H new ATOM 0 HG23 ILE A 94 15.544 -7.594 -14.678 1.00 0.00 H new ATOM 0 HD11 ILE A 94 13.976 -8.288 -10.527 1.00 0.00 H new ATOM 0 HD12 ILE A 94 12.559 -8.541 -11.574 1.00 0.00 H new ATOM 0 HD13 ILE A 94 14.126 -9.265 -12.007 1.00 0.00 H new ATOM 1464 N GLN A 95 13.773 -4.935 -16.845 1.00 0.00 N ATOM 1465 CA GLN A 95 13.587 -4.928 -18.323 1.00 0.00 C ATOM 1466 C GLN A 95 14.619 -5.872 -19.018 1.00 0.00 C ATOM 1467 O GLN A 95 15.830 -5.676 -18.884 1.00 0.00 O ATOM 1468 CB GLN A 95 13.764 -3.483 -18.860 1.00 0.00 C ATOM 1469 CG GLN A 95 12.641 -2.469 -18.531 1.00 0.00 C ATOM 1470 CD GLN A 95 12.812 -1.085 -19.181 1.00 0.00 C ATOM 1471 OE1 GLN A 95 13.616 -0.836 -20.074 1.00 0.00 O ATOM 1472 NE2 GLN A 95 12.049 -0.112 -18.750 1.00 0.00 N ATOM 0 H GLN A 95 14.469 -4.266 -16.515 1.00 0.00 H new ATOM 0 HA GLN A 95 12.583 -5.288 -18.547 1.00 0.00 H new ATOM 0 HB2 GLN A 95 14.702 -3.089 -18.469 1.00 0.00 H new ATOM 0 HB3 GLN A 95 13.867 -3.535 -19.944 1.00 0.00 H new ATOM 0 HG2 GLN A 95 11.687 -2.889 -18.849 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.589 -2.343 -17.450 1.00 0.00 H new ATOM 0 HE21 GLN A 95 11.370 -0.286 -18.009 1.00 0.00 H new ATOM 0 HE22 GLN A 95 12.133 0.820 -19.156 1.00 0.00 H new ATOM 1481 N LYS A 96 14.135 -6.856 -19.792 1.00 0.00 N ATOM 1482 CA LYS A 96 14.992 -7.812 -20.556 1.00 0.00 C ATOM 1483 C LYS A 96 14.847 -7.569 -22.093 1.00 0.00 C ATOM 1484 O LYS A 96 13.733 -7.449 -22.611 1.00 0.00 O ATOM 1485 CB LYS A 96 14.545 -9.256 -20.187 1.00 0.00 C ATOM 1486 CG LYS A 96 14.920 -9.722 -18.759 1.00 0.00 C ATOM 1487 CD LYS A 96 14.252 -11.039 -18.312 1.00 0.00 C ATOM 1488 CE LYS A 96 12.738 -10.914 -18.044 1.00 0.00 C ATOM 1489 NZ LYS A 96 12.210 -12.176 -17.494 1.00 0.00 N ATOM 0 H LYS A 96 13.136 -7.022 -19.914 1.00 0.00 H new ATOM 0 HA LYS A 96 16.041 -7.666 -20.298 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.463 -9.324 -20.301 1.00 0.00 H new ATOM 0 HB3 LYS A 96 14.985 -9.949 -20.904 1.00 0.00 H new ATOM 0 HG2 LYS A 96 16.002 -9.843 -18.704 1.00 0.00 H new ATOM 0 HG3 LYS A 96 14.650 -8.936 -18.053 1.00 0.00 H new ATOM 0 HD2 LYS A 96 14.414 -11.795 -19.080 1.00 0.00 H new ATOM 0 HD3 LYS A 96 14.743 -11.394 -17.406 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.552 -10.099 -17.345 1.00 0.00 H new ATOM 0 HE3 LYS A 96 12.217 -10.666 -18.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 11.190 -12.078 -17.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.372 -12.946 -18.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.696 -12.396 -16.601 1.00 0.00 H new ATOM 1502 N TRP A 97 15.963 -7.498 -22.841 1.00 0.00 N ATOM 1503 CA TRP A 97 15.931 -7.312 -24.324 1.00 0.00 C ATOM 1504 C TRP A 97 17.259 -7.823 -24.964 1.00 0.00 C ATOM 1505 O TRP A 97 18.342 -7.365 -24.593 1.00 0.00 O ATOM 1506 CB TRP A 97 15.571 -5.847 -24.738 1.00 0.00 C ATOM 1507 CG TRP A 97 16.651 -4.764 -24.558 1.00 0.00 C ATOM 1508 CD1 TRP A 97 17.475 -4.271 -25.593 1.00 0.00 C ATOM 1509 CD2 TRP A 97 17.129 -4.183 -23.395 1.00 0.00 C ATOM 1510 NE1 TRP A 97 18.445 -3.371 -25.107 1.00 0.00 N ATOM 1511 CE2 TRP A 97 18.232 -3.358 -23.739 1.00 0.00 C ATOM 1512 CE3 TRP A 97 16.774 -4.371 -22.036 1.00 0.00 C ATOM 1513 CZ2 TRP A 97 19.008 -2.754 -22.722 1.00 0.00 C ATOM 1514 CZ3 TRP A 97 17.548 -3.760 -21.054 1.00 0.00 C ATOM 1515 CH2 TRP A 97 18.661 -2.984 -21.390 1.00 0.00 C ATOM 0 H TRP A 97 16.904 -7.565 -22.453 1.00 0.00 H new ATOM 0 HA TRP A 97 15.121 -7.923 -24.724 1.00 0.00 H new ATOM 0 HB2 TRP A 97 15.279 -5.858 -25.788 1.00 0.00 H new ATOM 0 HB3 TRP A 97 14.694 -5.543 -24.167 1.00 0.00 H new ATOM 0 HD1 TRP A 97 17.374 -4.550 -26.632 1.00 0.00 H new ATOM 0 HE1 TRP A 97 19.142 -2.850 -25.639 1.00 0.00 H new ATOM 0 HE3 TRP A 97 15.920 -4.976 -21.768 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 19.852 -2.128 -22.971 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 17.284 -3.888 -20.015 1.00 0.00 H new ATOM 0 HH2 TRP A 97 19.264 -2.554 -20.604 1.00 0.00 H new ATOM 1526 N ASP A 98 17.200 -8.745 -25.946 1.00 0.00 N ATOM 1527 CA ASP A 98 18.405 -9.175 -26.746 1.00 0.00 C ATOM 1528 C ASP A 98 19.637 -9.779 -25.959 1.00 0.00 C ATOM 1529 O ASP A 98 20.772 -9.713 -26.442 1.00 0.00 O ATOM 1530 CB ASP A 98 18.836 -8.016 -27.708 1.00 0.00 C ATOM 1531 CG ASP A 98 17.798 -7.558 -28.733 1.00 0.00 C ATOM 1532 OD1 ASP A 98 17.028 -6.622 -28.537 1.00 0.00 O ATOM 1533 OD2 ASP A 98 17.826 -8.313 -29.871 1.00 0.00 O ATOM 0 H ASP A 98 16.338 -9.217 -26.218 1.00 0.00 H new ATOM 0 HA ASP A 98 18.060 -10.044 -27.305 1.00 0.00 H new ATOM 0 HB2 ASP A 98 19.118 -7.156 -27.101 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.729 -8.334 -28.246 1.00 0.00 H new ATOM 1539 N GLY A 99 19.438 -10.355 -24.757 1.00 0.00 N ATOM 1540 CA GLY A 99 20.558 -10.606 -23.797 1.00 0.00 C ATOM 1541 C GLY A 99 20.912 -9.496 -22.765 1.00 0.00 C ATOM 1542 O GLY A 99 21.495 -9.813 -21.727 1.00 0.00 O ATOM 0 H GLY A 99 18.524 -10.657 -24.420 1.00 0.00 H new ATOM 0 HA2 GLY A 99 20.321 -11.513 -23.241 1.00 0.00 H new ATOM 0 HA3 GLY A 99 21.455 -10.815 -24.380 1.00 0.00 H new ATOM 1546 N LYS A 100 20.595 -8.219 -23.033 1.00 0.00 N ATOM 1547 CA LYS A 100 20.832 -7.089 -22.095 1.00 0.00 C ATOM 1548 C LYS A 100 19.697 -6.959 -21.025 1.00 0.00 C ATOM 1549 O LYS A 100 18.513 -7.189 -21.306 1.00 0.00 O ATOM 1550 CB LYS A 100 20.921 -5.782 -22.930 1.00 0.00 C ATOM 1551 CG LYS A 100 22.137 -5.617 -23.864 1.00 0.00 C ATOM 1552 CD LYS A 100 22.173 -4.185 -24.434 1.00 0.00 C ATOM 1553 CE LYS A 100 23.361 -3.870 -25.345 1.00 0.00 C ATOM 1554 NZ LYS A 100 24.630 -3.723 -24.605 1.00 0.00 N ATOM 0 H LYS A 100 20.163 -7.930 -23.911 1.00 0.00 H new ATOM 0 HA LYS A 100 21.759 -7.274 -21.552 1.00 0.00 H new ATOM 0 HB2 LYS A 100 20.018 -5.708 -23.536 1.00 0.00 H new ATOM 0 HB3 LYS A 100 20.911 -4.939 -22.239 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.057 -5.823 -23.317 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.082 -6.340 -24.678 1.00 0.00 H new ATOM 0 HD2 LYS A 100 21.253 -4.011 -24.992 1.00 0.00 H new ATOM 0 HD3 LYS A 100 22.179 -3.481 -23.602 1.00 0.00 H new ATOM 0 HE2 LYS A 100 23.467 -4.665 -26.083 1.00 0.00 H new ATOM 0 HE3 LYS A 100 23.158 -2.950 -25.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 25.399 -3.511 -25.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 24.543 -2.947 -23.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 24.843 -4.608 -24.102 1.00 0.00 H new ATOM 1567 N GLU A 101 20.072 -6.561 -19.795 1.00 0.00 N ATOM 1568 CA GLU A 101 19.109 -6.390 -18.672 1.00 0.00 C ATOM 1569 C GLU A 101 19.425 -5.108 -17.835 1.00 0.00 C ATOM 1570 O GLU A 101 20.552 -4.907 -17.375 1.00 0.00 O ATOM 1571 CB GLU A 101 19.093 -7.678 -17.802 1.00 0.00 C ATOM 1572 CG GLU A 101 17.908 -7.759 -16.804 1.00 0.00 C ATOM 1573 CD GLU A 101 17.943 -8.982 -15.892 1.00 0.00 C ATOM 1574 OE1 GLU A 101 18.317 -8.949 -14.724 1.00 0.00 O ATOM 1575 OE2 GLU A 101 17.499 -10.110 -16.512 1.00 0.00 O ATOM 0 H GLU A 101 21.038 -6.349 -19.545 1.00 0.00 H new ATOM 0 HA GLU A 101 18.109 -6.243 -19.079 1.00 0.00 H new ATOM 0 HB2 GLU A 101 19.059 -8.546 -18.460 1.00 0.00 H new ATOM 0 HB3 GLU A 101 20.028 -7.737 -17.244 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.904 -6.860 -16.188 1.00 0.00 H new ATOM 0 HG3 GLU A 101 16.974 -7.765 -17.366 1.00 0.00 H new ATOM 1583 N THR A 102 18.397 -4.275 -17.598 1.00 0.00 N ATOM 1584 CA THR A 102 18.432 -3.190 -16.570 1.00 0.00 C ATOM 1585 C THR A 102 17.341 -3.439 -15.477 1.00 0.00 C ATOM 1586 O THR A 102 16.296 -4.045 -15.753 1.00 0.00 O ATOM 1587 CB THR A 102 18.309 -1.777 -17.228 1.00 0.00 C ATOM 1588 OG1 THR A 102 18.570 -0.786 -16.241 1.00 0.00 O ATOM 1589 CG2 THR A 102 16.960 -1.430 -17.878 1.00 0.00 C ATOM 0 H THR A 102 17.514 -4.325 -18.106 1.00 0.00 H new ATOM 0 HA THR A 102 19.402 -3.213 -16.073 1.00 0.00 H new ATOM 0 HB THR A 102 19.033 -1.799 -18.042 1.00 0.00 H new ATOM 0 HG1 THR A 102 19.101 -1.178 -15.516 1.00 0.00 H new ATOM 0 HG21 THR A 102 17.006 -0.425 -18.297 1.00 0.00 H new ATOM 0 HG22 THR A 102 16.744 -2.145 -18.672 1.00 0.00 H new ATOM 0 HG23 THR A 102 16.172 -1.474 -17.126 1.00 0.00 H new ATOM 1597 N ASN A 103 17.539 -2.914 -14.252 1.00 0.00 N ATOM 1598 CA ASN A 103 16.441 -2.824 -13.246 1.00 0.00 C ATOM 1599 C ASN A 103 16.296 -1.405 -12.605 1.00 0.00 C ATOM 1600 O ASN A 103 17.279 -0.707 -12.331 1.00 0.00 O ATOM 1601 CB ASN A 103 16.454 -4.018 -12.256 1.00 0.00 C ATOM 1602 CG ASN A 103 17.594 -4.101 -11.240 1.00 0.00 C ATOM 1603 OD1 ASN A 103 17.568 -3.469 -10.191 1.00 0.00 O ATOM 1604 ND2 ASN A 103 18.597 -4.907 -11.492 1.00 0.00 N ATOM 0 H ASN A 103 18.435 -2.548 -13.929 1.00 0.00 H new ATOM 0 HA ASN A 103 15.501 -2.936 -13.786 1.00 0.00 H new ATOM 0 HB2 ASN A 103 15.515 -4.002 -11.703 1.00 0.00 H new ATOM 0 HB3 ASN A 103 16.463 -4.937 -12.842 1.00 0.00 H new ATOM 0 HD21 ASN A 103 19.354 -5.007 -10.815 1.00 0.00 H new ATOM 0 HD22 ASN A 103 18.621 -5.434 -12.365 1.00 0.00 H new ATOM 1611 N PHE A 104 15.036 -0.982 -12.384 1.00 0.00 N ATOM 1612 CA PHE A 104 14.711 0.360 -11.829 1.00 0.00 C ATOM 1613 C PHE A 104 14.141 0.126 -10.397 1.00 0.00 C ATOM 1614 O PHE A 104 12.988 -0.295 -10.249 1.00 0.00 O ATOM 1615 CB PHE A 104 13.690 1.122 -12.733 1.00 0.00 C ATOM 1616 CG PHE A 104 14.065 1.475 -14.191 1.00 0.00 C ATOM 1617 CD1 PHE A 104 14.183 0.473 -15.162 1.00 0.00 C ATOM 1618 CD2 PHE A 104 14.170 2.815 -14.585 1.00 0.00 C ATOM 1619 CE1 PHE A 104 14.444 0.803 -16.489 1.00 0.00 C ATOM 1620 CE2 PHE A 104 14.404 3.141 -15.922 1.00 0.00 C ATOM 1621 CZ PHE A 104 14.551 2.135 -16.872 1.00 0.00 C ATOM 0 H PHE A 104 14.214 -1.553 -12.582 1.00 0.00 H new ATOM 0 HA PHE A 104 15.602 0.987 -11.792 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.779 0.525 -12.768 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.441 2.055 -12.227 1.00 0.00 H new ATOM 0 HD1 PHE A 104 14.071 -0.563 -14.879 1.00 0.00 H new ATOM 0 HD2 PHE A 104 14.069 3.600 -13.850 1.00 0.00 H new ATOM 0 HE1 PHE A 104 14.564 0.021 -17.224 1.00 0.00 H new ATOM 0 HE2 PHE A 104 14.471 4.177 -16.220 1.00 0.00 H new ATOM 0 HZ PHE A 104 14.748 2.388 -17.903 1.00 0.00 H new ATOM 1631 N VAL A 105 14.946 0.383 -9.351 1.00 0.00 N ATOM 1632 CA VAL A 105 14.550 0.128 -7.931 1.00 0.00 C ATOM 1633 C VAL A 105 13.770 1.381 -7.417 1.00 0.00 C ATOM 1634 O VAL A 105 14.357 2.427 -7.125 1.00 0.00 O ATOM 1635 CB VAL A 105 15.787 -0.242 -7.039 1.00 0.00 C ATOM 1636 CG1 VAL A 105 15.416 -0.538 -5.565 1.00 0.00 C ATOM 1637 CG2 VAL A 105 16.617 -1.443 -7.553 1.00 0.00 C ATOM 0 H VAL A 105 15.884 0.770 -9.451 1.00 0.00 H new ATOM 0 HA VAL A 105 13.896 -0.742 -7.870 1.00 0.00 H new ATOM 0 HB VAL A 105 16.394 0.661 -7.102 1.00 0.00 H new ATOM 0 HG11 VAL A 105 16.318 -0.787 -5.006 1.00 0.00 H new ATOM 0 HG12 VAL A 105 14.946 0.341 -5.124 1.00 0.00 H new ATOM 0 HG13 VAL A 105 14.722 -1.378 -5.526 1.00 0.00 H new ATOM 0 HG21 VAL A 105 17.450 -1.626 -6.875 1.00 0.00 H new ATOM 0 HG22 VAL A 105 15.985 -2.330 -7.598 1.00 0.00 H new ATOM 0 HG23 VAL A 105 17.001 -1.220 -8.548 1.00 0.00 H new ATOM 1647 N ARG A 106 12.439 1.264 -7.357 1.00 0.00 N ATOM 1648 CA ARG A 106 11.517 2.406 -7.117 1.00 0.00 C ATOM 1649 C ARG A 106 10.992 2.329 -5.658 1.00 0.00 C ATOM 1650 O ARG A 106 10.209 1.429 -5.345 1.00 0.00 O ATOM 1651 CB ARG A 106 10.376 2.271 -8.170 1.00 0.00 C ATOM 1652 CG ARG A 106 10.789 2.612 -9.622 1.00 0.00 C ATOM 1653 CD ARG A 106 9.780 2.120 -10.673 1.00 0.00 C ATOM 1654 NE ARG A 106 10.234 2.587 -12.013 1.00 0.00 N ATOM 1655 CZ ARG A 106 9.472 2.677 -13.100 1.00 0.00 C ATOM 1656 NH1 ARG A 106 8.262 2.188 -13.175 1.00 0.00 N ATOM 1657 NH2 ARG A 106 9.961 3.269 -14.151 1.00 0.00 N ATOM 0 H ARG A 106 11.957 0.373 -7.473 1.00 0.00 H new ATOM 0 HA ARG A 106 12.000 3.377 -7.227 1.00 0.00 H new ATOM 0 HB2 ARG A 106 9.997 1.249 -8.145 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.553 2.923 -7.879 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.903 3.692 -9.716 1.00 0.00 H new ATOM 0 HG3 ARG A 106 11.763 2.169 -9.829 1.00 0.00 H new ATOM 0 HD2 ARG A 106 9.711 1.032 -10.653 1.00 0.00 H new ATOM 0 HD3 ARG A 106 8.785 2.506 -10.454 1.00 0.00 H new ATOM 0 HE ARG A 106 11.212 2.861 -12.105 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.856 1.707 -12.373 1.00 0.00 H new ATOM 0 HH12 ARG A 106 7.724 2.287 -14.036 1.00 0.00 H new ATOM 0 HH21 ARG A 106 10.907 3.650 -14.128 1.00 0.00 H new ATOM 0 HH22 ARG A 106 9.398 3.352 -14.998 1.00 0.00 H new ATOM 1671 N GLU A 107 11.424 3.229 -4.755 1.00 0.00 N ATOM 1672 CA GLU A 107 11.137 3.079 -3.295 1.00 0.00 C ATOM 1673 C GLU A 107 10.679 4.384 -2.582 1.00 0.00 C ATOM 1674 O GLU A 107 11.275 5.447 -2.775 1.00 0.00 O ATOM 1675 CB GLU A 107 12.332 2.370 -2.599 1.00 0.00 C ATOM 1676 CG GLU A 107 13.671 3.144 -2.495 1.00 0.00 C ATOM 1677 CD GLU A 107 14.819 2.276 -1.997 1.00 0.00 C ATOM 1678 OE1 GLU A 107 15.693 1.821 -2.729 1.00 0.00 O ATOM 1679 OE2 GLU A 107 14.738 2.034 -0.655 1.00 0.00 O ATOM 0 H GLU A 107 11.966 4.059 -4.994 1.00 0.00 H new ATOM 0 HA GLU A 107 10.257 2.442 -3.202 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.021 2.102 -1.589 1.00 0.00 H new ATOM 0 HB3 GLU A 107 12.524 1.438 -3.131 1.00 0.00 H new ATOM 0 HG2 GLU A 107 13.927 3.550 -3.473 1.00 0.00 H new ATOM 0 HG3 GLU A 107 13.544 3.991 -1.821 1.00 0.00 H new ATOM 1687 N ILE A 108 9.643 4.297 -1.719 1.00 0.00 N ATOM 1688 CA ILE A 108 9.128 5.478 -0.961 1.00 0.00 C ATOM 1689 C ILE A 108 10.009 5.707 0.312 1.00 0.00 C ATOM 1690 O ILE A 108 10.025 4.887 1.238 1.00 0.00 O ATOM 1691 CB ILE A 108 7.585 5.400 -0.656 1.00 0.00 C ATOM 1692 CG1 ILE A 108 6.671 5.145 -1.891 1.00 0.00 C ATOM 1693 CG2 ILE A 108 7.053 6.660 0.083 1.00 0.00 C ATOM 1694 CD1 ILE A 108 6.910 6.060 -3.109 1.00 0.00 C ATOM 0 H ILE A 108 9.143 3.429 -1.525 1.00 0.00 H new ATOM 0 HA ILE A 108 9.220 6.359 -1.596 1.00 0.00 H new ATOM 0 HB ILE A 108 7.521 4.523 -0.012 1.00 0.00 H new ATOM 0 HG12 ILE A 108 6.802 4.110 -2.208 1.00 0.00 H new ATOM 0 HG13 ILE A 108 5.633 5.254 -1.578 1.00 0.00 H new ATOM 0 HG21 ILE A 108 5.984 6.550 0.267 1.00 0.00 H new ATOM 0 HG22 ILE A 108 7.575 6.772 1.033 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.226 7.543 -0.532 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.218 5.791 -3.907 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.747 7.099 -2.821 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.934 5.938 -3.461 1.00 0.00 H new ATOM 1706 N LYS A 109 10.724 6.843 0.321 1.00 0.00 N ATOM 1707 CA LYS A 109 11.548 7.307 1.464 1.00 0.00 C ATOM 1708 C LYS A 109 11.004 8.707 1.904 1.00 0.00 C ATOM 1709 O LYS A 109 11.150 9.696 1.181 1.00 0.00 O ATOM 1710 CB LYS A 109 13.020 7.353 0.971 1.00 0.00 C ATOM 1711 CG LYS A 109 14.067 7.638 2.076 1.00 0.00 C ATOM 1712 CD LYS A 109 15.443 8.079 1.535 1.00 0.00 C ATOM 1713 CE LYS A 109 15.448 9.541 1.050 1.00 0.00 C ATOM 1714 NZ LYS A 109 16.781 9.923 0.547 1.00 0.00 N ATOM 0 H LYS A 109 10.751 7.480 -0.475 1.00 0.00 H new ATOM 0 HA LYS A 109 11.500 6.649 2.332 1.00 0.00 H new ATOM 0 HB2 LYS A 109 13.260 6.400 0.500 1.00 0.00 H new ATOM 0 HB3 LYS A 109 13.107 8.120 0.201 1.00 0.00 H new ATOM 0 HG2 LYS A 109 13.681 8.415 2.737 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.196 6.740 2.681 1.00 0.00 H new ATOM 0 HD2 LYS A 109 16.193 7.957 2.317 1.00 0.00 H new ATOM 0 HD3 LYS A 109 15.732 7.426 0.711 1.00 0.00 H new ATOM 0 HE2 LYS A 109 14.707 9.670 0.261 1.00 0.00 H new ATOM 0 HE3 LYS A 109 15.161 10.201 1.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 16.761 10.912 0.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 17.482 9.821 1.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 17.042 9.306 -0.248 1.00 0.00 H new ATOM 1727 N ASP A 110 10.340 8.782 3.076 1.00 0.00 N ATOM 1728 CA ASP A 110 9.694 10.035 3.602 1.00 0.00 C ATOM 1729 C ASP A 110 8.741 10.808 2.610 1.00 0.00 C ATOM 1730 O ASP A 110 8.929 11.997 2.329 1.00 0.00 O ATOM 1731 CB ASP A 110 10.802 10.900 4.275 1.00 0.00 C ATOM 1732 CG ASP A 110 10.286 11.997 5.206 1.00 0.00 C ATOM 1733 OD1 ASP A 110 9.527 11.791 6.148 1.00 0.00 O ATOM 1734 OD2 ASP A 110 10.766 13.228 4.879 1.00 0.00 O ATOM 0 H ASP A 110 10.228 7.981 3.697 1.00 0.00 H new ATOM 0 HA ASP A 110 8.958 9.744 4.352 1.00 0.00 H new ATOM 0 HB2 ASP A 110 11.461 10.243 4.842 1.00 0.00 H new ATOM 0 HB3 ASP A 110 11.407 11.361 3.494 1.00 0.00 H new ATOM 1740 N GLY A 111 7.735 10.113 2.045 1.00 0.00 N ATOM 1741 CA GLY A 111 6.916 10.661 0.920 1.00 0.00 C ATOM 1742 C GLY A 111 7.592 10.964 -0.448 1.00 0.00 C ATOM 1743 O GLY A 111 7.027 11.733 -1.227 1.00 0.00 O ATOM 0 H GLY A 111 7.462 9.175 2.339 1.00 0.00 H new ATOM 0 HA2 GLY A 111 6.105 9.957 0.734 1.00 0.00 H new ATOM 0 HA3 GLY A 111 6.460 11.587 1.270 1.00 0.00 H new ATOM 1747 N LYS A 112 8.767 10.382 -0.743 1.00 0.00 N ATOM 1748 CA LYS A 112 9.543 10.668 -1.983 1.00 0.00 C ATOM 1749 C LYS A 112 9.909 9.325 -2.668 1.00 0.00 C ATOM 1750 O LYS A 112 10.472 8.420 -2.043 1.00 0.00 O ATOM 1751 CB LYS A 112 10.842 11.480 -1.703 1.00 0.00 C ATOM 1752 CG LYS A 112 10.703 12.787 -0.894 1.00 0.00 C ATOM 1753 CD LYS A 112 9.872 13.897 -1.571 1.00 0.00 C ATOM 1754 CE LYS A 112 9.468 15.042 -0.626 1.00 0.00 C ATOM 1755 NZ LYS A 112 8.437 14.606 0.343 1.00 0.00 N ATOM 0 H LYS A 112 9.214 9.697 -0.133 1.00 0.00 H new ATOM 0 HA LYS A 112 8.917 11.279 -2.633 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.538 10.829 -1.174 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.299 11.724 -2.662 1.00 0.00 H new ATOM 0 HG2 LYS A 112 10.249 12.552 0.069 1.00 0.00 H new ATOM 0 HG3 LYS A 112 11.700 13.176 -0.690 1.00 0.00 H new ATOM 0 HD2 LYS A 112 10.445 14.310 -2.401 1.00 0.00 H new ATOM 0 HD3 LYS A 112 8.971 13.454 -1.995 1.00 0.00 H new ATOM 0 HE2 LYS A 112 10.347 15.399 -0.089 1.00 0.00 H new ATOM 0 HE3 LYS A 112 9.089 15.881 -1.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 8.113 15.424 0.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.631 14.194 -0.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 8.841 13.893 0.983 1.00 0.00 H new ATOM 1768 N MET A 113 9.630 9.213 -3.972 1.00 0.00 N ATOM 1769 CA MET A 113 10.004 8.019 -4.769 1.00 0.00 C ATOM 1770 C MET A 113 11.493 8.131 -5.229 1.00 0.00 C ATOM 1771 O MET A 113 11.841 8.880 -6.147 1.00 0.00 O ATOM 1772 CB MET A 113 8.965 7.903 -5.910 1.00 0.00 C ATOM 1773 CG MET A 113 9.146 6.714 -6.866 1.00 0.00 C ATOM 1774 SD MET A 113 7.960 6.892 -8.209 1.00 0.00 S ATOM 1775 CE MET A 113 8.510 5.530 -9.241 1.00 0.00 C ATOM 0 H MET A 113 9.145 9.933 -4.507 1.00 0.00 H new ATOM 0 HA MET A 113 9.970 7.092 -4.197 1.00 0.00 H new ATOM 0 HB2 MET A 113 7.972 7.838 -5.465 1.00 0.00 H new ATOM 0 HB3 MET A 113 8.993 8.822 -6.495 1.00 0.00 H new ATOM 0 HG2 MET A 113 10.163 6.691 -7.257 1.00 0.00 H new ATOM 0 HG3 MET A 113 8.986 5.774 -6.339 1.00 0.00 H new ATOM 0 HE1 MET A 113 8.053 5.613 -10.227 1.00 0.00 H new ATOM 0 HE2 MET A 113 9.595 5.564 -9.340 1.00 0.00 H new ATOM 0 HE3 MET A 113 8.217 4.585 -8.783 1.00 0.00 H new ATOM 1785 N VAL A 114 12.376 7.363 -4.577 1.00 0.00 N ATOM 1786 CA VAL A 114 13.809 7.265 -4.970 1.00 0.00 C ATOM 1787 C VAL A 114 13.898 6.143 -6.055 1.00 0.00 C ATOM 1788 O VAL A 114 13.802 4.951 -5.744 1.00 0.00 O ATOM 1789 CB VAL A 114 14.714 7.035 -3.710 1.00 0.00 C ATOM 1790 CG1 VAL A 114 16.209 6.847 -4.059 1.00 0.00 C ATOM 1791 CG2 VAL A 114 14.641 8.182 -2.670 1.00 0.00 C ATOM 0 H VAL A 114 12.131 6.792 -3.768 1.00 0.00 H new ATOM 0 HA VAL A 114 14.189 8.190 -5.403 1.00 0.00 H new ATOM 0 HB VAL A 114 14.305 6.120 -3.282 1.00 0.00 H new ATOM 0 HG11 VAL A 114 16.780 6.692 -3.143 1.00 0.00 H new ATOM 0 HG12 VAL A 114 16.325 5.980 -4.709 1.00 0.00 H new ATOM 0 HG13 VAL A 114 16.578 7.736 -4.571 1.00 0.00 H new ATOM 0 HG21 VAL A 114 15.293 7.951 -1.828 1.00 0.00 H new ATOM 0 HG22 VAL A 114 14.963 9.114 -3.134 1.00 0.00 H new ATOM 0 HG23 VAL A 114 13.615 8.288 -2.316 1.00 0.00 H new ATOM 1801 N MET A 115 14.053 6.541 -7.330 1.00 0.00 N ATOM 1802 CA MET A 115 14.225 5.592 -8.459 1.00 0.00 C ATOM 1803 C MET A 115 15.747 5.374 -8.714 1.00 0.00 C ATOM 1804 O MET A 115 16.401 6.245 -9.291 1.00 0.00 O ATOM 1805 CB MET A 115 13.462 6.180 -9.680 1.00 0.00 C ATOM 1806 CG MET A 115 13.460 5.290 -10.942 1.00 0.00 C ATOM 1807 SD MET A 115 12.749 6.168 -12.351 1.00 0.00 S ATOM 1808 CE MET A 115 10.987 6.179 -11.978 1.00 0.00 C ATOM 0 H MET A 115 14.063 7.521 -7.612 1.00 0.00 H new ATOM 0 HA MET A 115 13.809 4.607 -8.247 1.00 0.00 H new ATOM 0 HB2 MET A 115 12.430 6.370 -9.387 1.00 0.00 H new ATOM 0 HB3 MET A 115 13.903 7.144 -9.935 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.479 4.983 -11.177 1.00 0.00 H new ATOM 0 HG3 MET A 115 12.890 4.381 -10.750 1.00 0.00 H new ATOM 0 HE1 MET A 115 10.422 6.357 -12.893 1.00 0.00 H new ATOM 0 HE2 MET A 115 10.699 5.217 -11.555 1.00 0.00 H new ATOM 0 HE3 MET A 115 10.772 6.970 -11.260 1.00 0.00 H new ATOM 1818 N THR A 116 16.300 4.221 -8.296 1.00 0.00 N ATOM 1819 CA THR A 116 17.723 3.857 -8.583 1.00 0.00 C ATOM 1820 C THR A 116 17.784 2.994 -9.887 1.00 0.00 C ATOM 1821 O THR A 116 17.322 1.849 -9.926 1.00 0.00 O ATOM 1822 CB THR A 116 18.367 3.184 -7.336 1.00 0.00 C ATOM 1823 OG1 THR A 116 18.265 4.049 -6.208 1.00 0.00 O ATOM 1824 CG2 THR A 116 19.860 2.858 -7.484 1.00 0.00 C ATOM 0 H THR A 116 15.794 3.518 -7.758 1.00 0.00 H new ATOM 0 HA THR A 116 18.322 4.747 -8.775 1.00 0.00 H new ATOM 0 HB THR A 116 17.817 2.250 -7.216 1.00 0.00 H new ATOM 0 HG1 THR A 116 18.671 3.618 -5.427 1.00 0.00 H new ATOM 0 HG21 THR A 116 20.223 2.392 -6.568 1.00 0.00 H new ATOM 0 HG22 THR A 116 20.002 2.173 -8.320 1.00 0.00 H new ATOM 0 HG23 THR A 116 20.416 3.777 -7.669 1.00 0.00 H new ATOM 1832 N LEU A 117 18.334 3.574 -10.963 1.00 0.00 N ATOM 1833 CA LEU A 117 18.362 2.965 -12.315 1.00 0.00 C ATOM 1834 C LEU A 117 19.732 2.239 -12.515 1.00 0.00 C ATOM 1835 O LEU A 117 20.752 2.909 -12.704 1.00 0.00 O ATOM 1836 CB LEU A 117 18.182 4.062 -13.412 1.00 0.00 C ATOM 1837 CG LEU A 117 16.997 5.069 -13.398 1.00 0.00 C ATOM 1838 CD1 LEU A 117 17.220 6.280 -12.474 1.00 0.00 C ATOM 1839 CD2 LEU A 117 16.803 5.636 -14.815 1.00 0.00 C ATOM 0 H LEU A 117 18.779 4.491 -10.926 1.00 0.00 H new ATOM 0 HA LEU A 117 17.544 2.250 -12.405 1.00 0.00 H new ATOM 0 HB2 LEU A 117 19.096 4.656 -13.413 1.00 0.00 H new ATOM 0 HB3 LEU A 117 18.139 3.542 -14.369 1.00 0.00 H new ATOM 0 HG LEU A 117 16.136 4.509 -13.034 1.00 0.00 H new ATOM 0 HD11 LEU A 117 16.351 6.936 -12.518 1.00 0.00 H new ATOM 0 HD12 LEU A 117 17.362 5.935 -11.450 1.00 0.00 H new ATOM 0 HD13 LEU A 117 18.105 6.827 -12.799 1.00 0.00 H new ATOM 0 HD21 LEU A 117 15.974 6.343 -14.814 1.00 0.00 H new ATOM 0 HD22 LEU A 117 17.713 6.145 -15.131 1.00 0.00 H new ATOM 0 HD23 LEU A 117 16.584 4.822 -15.506 1.00 0.00 H new ATOM 1851 N THR A 118 19.776 0.897 -12.470 1.00 0.00 N ATOM 1852 CA THR A 118 21.054 0.125 -12.569 1.00 0.00 C ATOM 1853 C THR A 118 21.107 -0.753 -13.859 1.00 0.00 C ATOM 1854 O THR A 118 20.364 -1.730 -14.002 1.00 0.00 O ATOM 1855 CB THR A 118 21.353 -0.655 -11.249 1.00 0.00 C ATOM 1856 OG1 THR A 118 22.582 -1.373 -11.365 1.00 0.00 O ATOM 1857 CG2 THR A 118 20.305 -1.680 -10.788 1.00 0.00 C ATOM 0 H THR A 118 18.947 0.312 -12.366 1.00 0.00 H new ATOM 0 HA THR A 118 21.873 0.836 -12.680 1.00 0.00 H new ATOM 0 HB THR A 118 21.368 0.141 -10.505 1.00 0.00 H new ATOM 0 HG1 THR A 118 22.759 -1.856 -10.531 1.00 0.00 H new ATOM 0 HG21 THR A 118 20.637 -2.148 -9.861 1.00 0.00 H new ATOM 0 HG22 THR A 118 19.353 -1.176 -10.620 1.00 0.00 H new ATOM 0 HG23 THR A 118 20.181 -2.444 -11.556 1.00 0.00 H new ATOM 1865 N PHE A 119 22.046 -0.434 -14.774 1.00 0.00 N ATOM 1866 CA PHE A 119 22.446 -1.357 -15.874 1.00 0.00 C ATOM 1867 C PHE A 119 23.759 -2.105 -15.468 1.00 0.00 C ATOM 1868 O PHE A 119 24.858 -1.780 -15.934 1.00 0.00 O ATOM 1869 CB PHE A 119 22.521 -0.527 -17.191 1.00 0.00 C ATOM 1870 CG PHE A 119 22.835 -1.332 -18.467 1.00 0.00 C ATOM 1871 CD1 PHE A 119 21.936 -2.296 -18.933 1.00 0.00 C ATOM 1872 CD2 PHE A 119 24.028 -1.119 -19.166 1.00 0.00 C ATOM 1873 CE1 PHE A 119 22.220 -3.035 -20.076 1.00 0.00 C ATOM 1874 CE2 PHE A 119 24.315 -1.863 -20.310 1.00 0.00 C ATOM 1875 CZ PHE A 119 23.406 -2.814 -20.768 1.00 0.00 C ATOM 0 H PHE A 119 22.546 0.455 -14.779 1.00 0.00 H new ATOM 0 HA PHE A 119 21.719 -2.149 -16.053 1.00 0.00 H new ATOM 0 HB2 PHE A 119 21.569 -0.014 -17.331 1.00 0.00 H new ATOM 0 HB3 PHE A 119 23.283 0.243 -17.072 1.00 0.00 H new ATOM 0 HD1 PHE A 119 21.012 -2.468 -18.400 1.00 0.00 H new ATOM 0 HD2 PHE A 119 24.730 -0.375 -18.818 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.521 -3.780 -20.426 1.00 0.00 H new ATOM 0 HE2 PHE A 119 25.242 -1.702 -20.841 1.00 0.00 H new ATOM 0 HZ PHE A 119 23.623 -3.380 -21.662 1.00 0.00 H new ATOM 1885 N GLY A 120 23.634 -3.089 -14.552 1.00 0.00 N ATOM 1886 CA GLY A 120 24.796 -3.828 -13.987 1.00 0.00 C ATOM 1887 C GLY A 120 25.753 -2.990 -13.111 1.00 0.00 C ATOM 1888 O GLY A 120 25.548 -2.844 -11.905 1.00 0.00 O ATOM 0 H GLY A 120 22.734 -3.396 -14.182 1.00 0.00 H new ATOM 0 HA2 GLY A 120 24.421 -4.660 -13.391 1.00 0.00 H new ATOM 0 HA3 GLY A 120 25.367 -4.257 -14.810 1.00 0.00 H new ATOM 1892 N ASP A 121 26.786 -2.432 -13.754 1.00 0.00 N ATOM 1893 CA ASP A 121 27.720 -1.466 -13.111 1.00 0.00 C ATOM 1894 C ASP A 121 27.266 0.038 -13.136 1.00 0.00 C ATOM 1895 O ASP A 121 27.580 0.769 -12.193 1.00 0.00 O ATOM 1896 CB ASP A 121 29.105 -1.705 -13.774 1.00 0.00 C ATOM 1897 CG ASP A 121 30.277 -1.028 -13.067 1.00 0.00 C ATOM 1898 OD1 ASP A 121 30.859 -1.507 -12.100 1.00 0.00 O ATOM 1899 OD2 ASP A 121 30.599 0.170 -13.627 1.00 0.00 O ATOM 0 H ASP A 121 27.007 -2.628 -14.730 1.00 0.00 H new ATOM 0 HA ASP A 121 27.750 -1.656 -12.038 1.00 0.00 H new ATOM 0 HB2 ASP A 121 29.293 -2.778 -13.814 1.00 0.00 H new ATOM 0 HB3 ASP A 121 29.066 -1.350 -14.804 1.00 0.00 H new ATOM 1905 N VAL A 122 26.587 0.522 -14.196 1.00 0.00 N ATOM 1906 CA VAL A 122 26.289 1.979 -14.376 1.00 0.00 C ATOM 1907 C VAL A 122 24.952 2.340 -13.643 1.00 0.00 C ATOM 1908 O VAL A 122 23.880 1.819 -13.978 1.00 0.00 O ATOM 1909 CB VAL A 122 26.308 2.390 -15.892 1.00 0.00 C ATOM 1910 CG1 VAL A 122 26.039 3.899 -16.119 1.00 0.00 C ATOM 1911 CG2 VAL A 122 27.651 2.078 -16.601 1.00 0.00 C ATOM 0 H VAL A 122 26.229 -0.067 -14.948 1.00 0.00 H new ATOM 0 HA VAL A 122 27.079 2.570 -13.912 1.00 0.00 H new ATOM 0 HB VAL A 122 25.506 1.788 -16.318 1.00 0.00 H new ATOM 0 HG11 VAL A 122 26.066 4.117 -17.187 1.00 0.00 H new ATOM 0 HG12 VAL A 122 25.058 4.158 -15.720 1.00 0.00 H new ATOM 0 HG13 VAL A 122 26.804 4.486 -15.610 1.00 0.00 H new ATOM 0 HG21 VAL A 122 27.592 2.388 -17.644 1.00 0.00 H new ATOM 0 HG22 VAL A 122 28.458 2.619 -16.107 1.00 0.00 H new ATOM 0 HG23 VAL A 122 27.849 1.007 -16.551 1.00 0.00 H new ATOM 1921 N VAL A 123 25.041 3.237 -12.642 1.00 0.00 N ATOM 1922 CA VAL A 123 23.900 3.584 -11.742 1.00 0.00 C ATOM 1923 C VAL A 123 23.514 5.093 -11.932 1.00 0.00 C ATOM 1924 O VAL A 123 24.347 5.990 -11.765 1.00 0.00 O ATOM 1925 CB VAL A 123 24.232 3.236 -10.244 1.00 0.00 C ATOM 1926 CG1 VAL A 123 23.062 3.541 -9.275 1.00 0.00 C ATOM 1927 CG2 VAL A 123 24.619 1.756 -10.002 1.00 0.00 C ATOM 0 H VAL A 123 25.899 3.746 -12.427 1.00 0.00 H new ATOM 0 HA VAL A 123 23.034 2.980 -12.014 1.00 0.00 H new ATOM 0 HB VAL A 123 25.088 3.879 -10.040 1.00 0.00 H new ATOM 0 HG11 VAL A 123 23.354 3.279 -8.258 1.00 0.00 H new ATOM 0 HG12 VAL A 123 22.819 4.603 -9.321 1.00 0.00 H new ATOM 0 HG13 VAL A 123 22.189 2.956 -9.564 1.00 0.00 H new ATOM 0 HG21 VAL A 123 24.832 1.604 -8.944 1.00 0.00 H new ATOM 0 HG22 VAL A 123 23.794 1.110 -10.303 1.00 0.00 H new ATOM 0 HG23 VAL A 123 25.504 1.511 -10.589 1.00 0.00 H new ATOM 1937 N ALA A 124 22.225 5.365 -12.200 1.00 0.00 N ATOM 1938 CA ALA A 124 21.620 6.712 -12.017 1.00 0.00 C ATOM 1939 C ALA A 124 20.559 6.743 -10.869 1.00 0.00 C ATOM 1940 O ALA A 124 20.015 5.710 -10.469 1.00 0.00 O ATOM 1941 CB ALA A 124 21.027 7.121 -13.378 1.00 0.00 C ATOM 0 H ALA A 124 21.569 4.666 -12.548 1.00 0.00 H new ATOM 0 HA ALA A 124 22.379 7.428 -11.702 1.00 0.00 H new ATOM 0 HB1 ALA A 124 20.570 8.107 -13.294 1.00 0.00 H new ATOM 0 HB2 ALA A 124 21.819 7.151 -14.126 1.00 0.00 H new ATOM 0 HB3 ALA A 124 20.272 6.395 -13.679 1.00 0.00 H new ATOM 1947 N VAL A 125 20.247 7.940 -10.339 1.00 0.00 N ATOM 1948 CA VAL A 125 19.189 8.114 -9.290 1.00 0.00 C ATOM 1949 C VAL A 125 18.245 9.288 -9.717 1.00 0.00 C ATOM 1950 O VAL A 125 18.641 10.458 -9.671 1.00 0.00 O ATOM 1951 CB VAL A 125 19.748 8.296 -7.832 1.00 0.00 C ATOM 1952 CG1 VAL A 125 18.621 8.299 -6.771 1.00 0.00 C ATOM 1953 CG2 VAL A 125 20.770 7.226 -7.381 1.00 0.00 C ATOM 0 H VAL A 125 20.705 8.810 -10.611 1.00 0.00 H new ATOM 0 HA VAL A 125 18.621 7.185 -9.235 1.00 0.00 H new ATOM 0 HB VAL A 125 20.254 9.260 -7.891 1.00 0.00 H new ATOM 0 HG11 VAL A 125 19.055 8.427 -5.779 1.00 0.00 H new ATOM 0 HG12 VAL A 125 17.932 9.119 -6.974 1.00 0.00 H new ATOM 0 HG13 VAL A 125 18.081 7.353 -6.811 1.00 0.00 H new ATOM 0 HG21 VAL A 125 21.095 7.440 -6.363 1.00 0.00 H new ATOM 0 HG22 VAL A 125 20.304 6.241 -7.414 1.00 0.00 H new ATOM 0 HG23 VAL A 125 21.632 7.242 -8.048 1.00 0.00 H new ATOM 1963 N ARG A 126 16.981 8.994 -10.081 1.00 0.00 N ATOM 1964 CA ARG A 126 15.944 10.050 -10.273 1.00 0.00 C ATOM 1965 C ARG A 126 15.107 10.242 -8.969 1.00 0.00 C ATOM 1966 O ARG A 126 14.423 9.328 -8.494 1.00 0.00 O ATOM 1967 CB ARG A 126 15.037 9.759 -11.495 1.00 0.00 C ATOM 1968 CG ARG A 126 15.679 10.045 -12.877 1.00 0.00 C ATOM 1969 CD ARG A 126 14.698 9.954 -14.062 1.00 0.00 C ATOM 1970 NE ARG A 126 14.318 8.548 -14.365 1.00 0.00 N ATOM 1971 CZ ARG A 126 13.396 8.179 -15.257 1.00 0.00 C ATOM 1972 NH1 ARG A 126 12.632 9.023 -15.898 1.00 0.00 N ATOM 1973 NH2 ARG A 126 13.240 6.912 -15.504 1.00 0.00 N ATOM 0 H ARG A 126 16.647 8.045 -10.249 1.00 0.00 H new ATOM 0 HA ARG A 126 16.461 10.986 -10.485 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.735 8.712 -11.462 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.129 10.355 -11.404 1.00 0.00 H new ATOM 0 HG2 ARG A 126 16.120 11.042 -12.861 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.493 9.339 -13.039 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.801 10.531 -13.835 1.00 0.00 H new ATOM 0 HD3 ARG A 126 15.153 10.405 -14.944 1.00 0.00 H new ATOM 0 HE ARG A 126 14.799 7.809 -13.852 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.723 10.025 -15.727 1.00 0.00 H new ATOM 0 HH12 ARG A 126 11.944 8.680 -16.569 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.816 6.223 -15.020 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.542 6.607 -16.182 1.00 0.00 H new ATOM 1987 N HIS A 127 15.159 11.462 -8.417 1.00 0.00 N ATOM 1988 CA HIS A 127 14.473 11.815 -7.144 1.00 0.00 C ATOM 1989 C HIS A 127 13.060 12.391 -7.456 1.00 0.00 C ATOM 1990 O HIS A 127 12.922 13.530 -7.917 1.00 0.00 O ATOM 1991 CB HIS A 127 15.339 12.836 -6.353 1.00 0.00 C ATOM 1992 CG HIS A 127 16.685 12.320 -5.846 1.00 0.00 C ATOM 1993 ND1 HIS A 127 17.840 12.309 -6.605 1.00 0.00 N ATOM 1994 CD2 HIS A 127 16.936 11.765 -4.581 1.00 0.00 C ATOM 1995 CE1 HIS A 127 18.699 11.713 -5.722 1.00 0.00 C ATOM 1996 NE2 HIS A 127 18.258 11.352 -4.473 1.00 0.00 N ATOM 0 H HIS A 127 15.674 12.238 -8.832 1.00 0.00 H new ATOM 0 HA HIS A 127 14.348 10.925 -6.527 1.00 0.00 H new ATOM 0 HB2 HIS A 127 15.521 13.700 -6.992 1.00 0.00 H new ATOM 0 HB3 HIS A 127 14.761 13.187 -5.498 1.00 0.00 H new ATOM 0 HD1 HIS A 127 18.005 12.648 -7.553 1.00 0.00 H new ATOM 0 HD2 HIS A 127 16.200 11.672 -3.797 1.00 0.00 H new ATOM 0 HE1 HIS A 127 19.724 11.527 -6.008 1.00 0.00 H new ATOM 2004 N TYR A 128 12.010 11.600 -7.219 1.00 0.00 N ATOM 2005 CA TYR A 128 10.620 11.948 -7.606 1.00 0.00 C ATOM 2006 C TYR A 128 9.773 12.349 -6.356 1.00 0.00 C ATOM 2007 O TYR A 128 9.624 11.565 -5.417 1.00 0.00 O ATOM 2008 CB TYR A 128 10.049 10.702 -8.343 1.00 0.00 C ATOM 2009 CG TYR A 128 10.261 10.651 -9.860 1.00 0.00 C ATOM 2010 CD1 TYR A 128 9.386 11.377 -10.665 1.00 0.00 C ATOM 2011 CD2 TYR A 128 11.257 9.873 -10.457 1.00 0.00 C ATOM 2012 CE1 TYR A 128 9.502 11.341 -12.046 1.00 0.00 C ATOM 2013 CE2 TYR A 128 11.373 9.834 -11.850 1.00 0.00 C ATOM 2014 CZ TYR A 128 10.499 10.579 -12.642 1.00 0.00 C ATOM 2015 OH TYR A 128 10.622 10.593 -14.007 1.00 0.00 O ATOM 0 H TYR A 128 12.089 10.696 -6.753 1.00 0.00 H new ATOM 0 HA TYR A 128 10.589 12.818 -8.262 1.00 0.00 H new ATOM 0 HB2 TYR A 128 10.498 9.811 -7.905 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.978 10.649 -8.146 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.610 11.974 -10.209 1.00 0.00 H new ATOM 0 HD2 TYR A 128 11.937 9.302 -9.842 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.816 11.906 -12.660 1.00 0.00 H new ATOM 0 HE2 TYR A 128 12.138 9.228 -12.312 1.00 0.00 H new ATOM 0 HH TYR A 128 9.804 10.958 -14.405 1.00 0.00 H new ATOM 2025 N GLU A 129 9.187 13.559 -6.347 1.00 0.00 N ATOM 2026 CA GLU A 129 8.321 14.031 -5.221 1.00 0.00 C ATOM 2027 C GLU A 129 6.797 13.802 -5.466 1.00 0.00 C ATOM 2028 O GLU A 129 6.339 13.700 -6.609 1.00 0.00 O ATOM 2029 CB GLU A 129 8.703 15.495 -4.864 1.00 0.00 C ATOM 2030 CG GLU A 129 8.161 16.649 -5.752 1.00 0.00 C ATOM 2031 CD GLU A 129 6.676 17.029 -5.619 1.00 0.00 C ATOM 2032 OE1 GLU A 129 5.992 17.403 -6.564 1.00 0.00 O ATOM 2033 OE2 GLU A 129 6.189 16.865 -4.355 1.00 0.00 O ATOM 0 H GLU A 129 9.290 14.238 -7.101 1.00 0.00 H new ATOM 0 HA GLU A 129 8.517 13.413 -4.345 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.373 15.682 -3.842 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.791 15.561 -4.865 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.753 17.539 -5.540 1.00 0.00 H new ATOM 0 HG3 GLU A 129 8.345 16.384 -6.793 1.00 0.00 H new ATOM 2041 N LYS A 130 6.007 13.747 -4.380 1.00 0.00 N ATOM 2042 CA LYS A 130 4.570 13.392 -4.451 1.00 0.00 C ATOM 2043 C LYS A 130 3.627 14.570 -4.871 1.00 0.00 C ATOM 2044 O LYS A 130 3.799 15.728 -4.465 1.00 0.00 O ATOM 2045 CB LYS A 130 4.217 12.796 -3.062 1.00 0.00 C ATOM 2046 CG LYS A 130 3.010 11.841 -3.069 1.00 0.00 C ATOM 2047 CD LYS A 130 2.883 11.043 -1.754 1.00 0.00 C ATOM 2048 CE LYS A 130 1.941 9.841 -1.901 1.00 0.00 C ATOM 2049 NZ LYS A 130 1.883 9.062 -0.650 1.00 0.00 N ATOM 0 H LYS A 130 6.337 13.944 -3.435 1.00 0.00 H new ATOM 0 HA LYS A 130 4.404 12.671 -5.251 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.086 12.261 -2.678 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.014 13.613 -2.370 1.00 0.00 H new ATOM 0 HG2 LYS A 130 2.098 12.414 -3.232 1.00 0.00 H new ATOM 0 HG3 LYS A 130 3.104 11.147 -3.904 1.00 0.00 H new ATOM 0 HD2 LYS A 130 3.869 10.696 -1.444 1.00 0.00 H new ATOM 0 HD3 LYS A 130 2.514 11.699 -0.966 1.00 0.00 H new ATOM 0 HE2 LYS A 130 0.942 10.187 -2.165 1.00 0.00 H new ATOM 0 HE3 LYS A 130 2.283 9.203 -2.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 2.172 8.081 -0.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 2.525 9.484 0.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 0.911 9.071 -0.280 1.00 0.00 H new ATOM 2062 N ALA A 131 2.624 14.226 -5.688 1.00 0.00 N ATOM 2063 CA ALA A 131 1.617 15.163 -6.236 1.00 0.00 C ATOM 2064 C ALA A 131 0.230 14.479 -6.433 1.00 0.00 C ATOM 2065 O ALA A 131 -0.780 15.219 -6.446 1.00 0.00 O ATOM 2066 CB ALA A 131 2.160 15.724 -7.559 1.00 0.00 C ATOM 2067 OXT ALA A 131 0.124 13.234 -6.592 1.00 0.00 O ATOM 0 H ALA A 131 2.481 13.265 -5.998 1.00 0.00 H new ATOM 0 HA ALA A 131 1.452 15.974 -5.527 1.00 0.00 H new ATOM 0 HB1 ALA A 131 1.436 16.419 -7.984 1.00 0.00 H new ATOM 0 HB2 ALA A 131 3.099 16.247 -7.375 1.00 0.00 H new ATOM 0 HB3 ALA A 131 2.332 14.906 -8.258 1.00 0.00 H new