USER MOD reduce.3.24.130724 H: found=0, std=0, add=850, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 853 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 13 LYS NZ :NH3+ 155:sc= 2.13 (180deg=-0.321!) USER MOD Set 1.2: A 98 SER OG : rot 57:sc= 2.1 USER MOD Set 2.1: A 75 ASN : amide:sc= 1.58 K(o=6.4,f=0.54!) USER MOD Set 2.2: A 79 THR OG1 : rot 158:sc= 2.1 USER MOD Set 2.3: A 83 LYS NZ :NH3+ -121:sc= 2.74 (180deg=-1.06) USER MOD Set 3.1: A 6 SER OG : rot -34:sc= 2.22 USER MOD Set 3.2: A 68 TYR OH : rot 149:sc= 1.29 USER MOD Set 4.1: A 39 SER OG : rot 56:sc= 2.29 USER MOD Set 4.2: A 64 LYS NZ :NH3+ 153:sc= 3.64 (180deg=1.29) USER MOD Set 4.3: A 65 THR OG1 : rot -20:sc= 2.29 USER MOD Set 5.1: A 53 LYS NZ :NH3+ 156:sc= 1.23 (180deg=-0.543!) USER MOD Set 5.2: A 54 SER OG : rot -79:sc= 0.975 USER MOD Set 6.1: A 32 LYS NZ :NH3+ 164:sc= 1.17 (180deg=0) USER MOD Set 6.2: A 36 GLN : amide:sc= 1.11 K(o=2.3,f=-9.3!) USER MOD Set 7.1: A 30 THR OG1 : rot 132:sc= 1.21 USER MOD Set 7.2: A 91 SER OG : rot -26:sc= 1.9 USER MOD Set 8.1: A 28 LYS NZ :NH3+ 138:sc= 1.04 (180deg=0) USER MOD Set 8.2: A 29 SER OG : rot 163:sc= 2.09 USER MOD Set 9.1: A 24 THR OG1 : rot 169:sc= 0.929 USER MOD Set 9.2: A 33 SER OG : rot 67:sc= 1.8 USER MOD Single : A 5 LYS NZ :NH3+ -168:sc= 2.25 (180deg=1.79) USER MOD Single : A 7 GLN : amide:sc= -0.207 K(o=-0.21,f=-0.92) USER MOD Single : A 9 SER OG : rot 94:sc= 0.975 USER MOD Single : A 11 ASN : amide:sc= 0.776 K(o=0.78,f=-3!) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 LYS NZ :NH3+ -164:sc= 0.0999 (180deg=-1.45!) USER MOD Single : A 20 SER OG : rot -42:sc= 0.976 USER MOD Single : A 22 LYS NZ :NH3+ -162:sc= 1.25 (180deg=1.14) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 39:sc= 1.17 USER MOD Single : A 38 LYS NZ :NH3+ 179:sc= 3.36 (180deg=3.34) USER MOD Single : A 40 LYS NZ :NH3+ -165:sc= 3.53 (180deg=3.31) USER MOD Single : A 47 ASN : amide:sc= 0.89 K(o=0.89,f=-0.048) USER MOD Single : A 48 THR OG1 : rot 110:sc= -0.0679 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 174:sc= 1.65 USER MOD Single : A 61 MET CE :methyl -162:sc= -0.17 (180deg=-0.585) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -178:sc= 1.92 (180deg=1.79) USER MOD Single : A 69 TYR OH : rot -173:sc= 1.02 USER MOD Single : A 71 GLN : amide:sc= 0.325 K(o=0.33,f=-5.4!) USER MOD Single : A 74 ASN : amide:sc= 0.706 K(o=0.71,f=-2.5) USER MOD Single : A 102 THR OG1 : rot -97:sc= 1.12 USER MOD Single : A 103 THR OG1 : rot -38:sc= 0.934 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 13.088 1.271 -17.097 1.00 0.00 N ATOM 2 CA ALA A 2 13.114 0.476 -18.341 1.00 0.00 C ATOM 3 C ALA A 2 14.255 0.948 -19.248 1.00 0.00 C ATOM 4 O ALA A 2 14.778 2.034 -19.001 1.00 0.00 O ATOM 5 CB ALA A 2 11.758 0.600 -19.044 1.00 0.00 C ATOM 0 HA ALA A 2 13.292 -0.573 -18.105 1.00 0.00 H new ATOM 0 HB1 ALA A 2 11.770 0.015 -19.964 1.00 0.00 H new ATOM 0 HB2 ALA A 2 10.972 0.227 -18.387 1.00 0.00 H new ATOM 0 HB3 ALA A 2 11.566 1.646 -19.282 1.00 0.00 H new ATOM 13 N PRO A 3 14.657 0.170 -20.277 1.00 0.00 N ATOM 14 CA PRO A 3 15.618 0.596 -21.299 1.00 0.00 C ATOM 15 C PRO A 3 15.320 2.009 -21.821 1.00 0.00 C ATOM 16 O PRO A 3 14.222 2.265 -22.326 1.00 0.00 O ATOM 17 CB PRO A 3 15.553 -0.467 -22.399 1.00 0.00 C ATOM 18 CG PRO A 3 15.182 -1.727 -21.619 1.00 0.00 C ATOM 19 CD PRO A 3 14.217 -1.191 -20.561 1.00 0.00 C ATOM 0 HA PRO A 3 16.626 0.669 -20.891 1.00 0.00 H new ATOM 0 HB2 PRO A 3 14.807 -0.223 -23.155 1.00 0.00 H new ATOM 0 HB3 PRO A 3 16.507 -0.575 -22.916 1.00 0.00 H new ATOM 0 HG2 PRO A 3 14.710 -2.475 -22.257 1.00 0.00 H new ATOM 0 HG3 PRO A 3 16.056 -2.198 -21.169 1.00 0.00 H new ATOM 0 HD2 PRO A 3 13.190 -1.202 -20.927 1.00 0.00 H new ATOM 0 HD3 PRO A 3 14.242 -1.806 -19.661 1.00 0.00 H new ATOM 27 N VAL A 4 16.278 2.926 -21.628 1.00 0.00 N ATOM 28 CA VAL A 4 16.072 4.384 -21.580 1.00 0.00 C ATOM 29 C VAL A 4 15.241 4.910 -22.750 1.00 0.00 C ATOM 30 O VAL A 4 14.201 5.520 -22.517 1.00 0.00 O ATOM 31 CB VAL A 4 17.416 5.137 -21.456 1.00 0.00 C ATOM 32 CG1 VAL A 4 17.203 6.651 -21.323 1.00 0.00 C ATOM 33 CG2 VAL A 4 18.214 4.665 -20.230 1.00 0.00 C ATOM 0 H VAL A 4 17.255 2.665 -21.496 1.00 0.00 H new ATOM 0 HA VAL A 4 15.489 4.582 -20.681 1.00 0.00 H new ATOM 0 HB VAL A 4 17.971 4.919 -22.368 1.00 0.00 H new ATOM 0 HG11 VAL A 4 18.169 7.148 -21.238 1.00 0.00 H new ATOM 0 HG12 VAL A 4 16.679 7.023 -22.203 1.00 0.00 H new ATOM 0 HG13 VAL A 4 16.609 6.858 -20.433 1.00 0.00 H new ATOM 0 HG21 VAL A 4 19.153 5.215 -20.173 1.00 0.00 H new ATOM 0 HG22 VAL A 4 17.633 4.846 -19.326 1.00 0.00 H new ATOM 0 HG23 VAL A 4 18.423 3.599 -20.320 1.00 0.00 H new ATOM 43 N LYS A 5 15.652 4.632 -23.995 1.00 0.00 N ATOM 44 CA LYS A 5 14.969 5.047 -25.232 1.00 0.00 C ATOM 45 C LYS A 5 13.598 4.396 -25.483 1.00 0.00 C ATOM 46 O LYS A 5 13.018 4.640 -26.538 1.00 0.00 O ATOM 47 CB LYS A 5 15.926 4.866 -26.434 1.00 0.00 C ATOM 48 CG LYS A 5 16.730 6.143 -26.734 1.00 0.00 C ATOM 49 CD LYS A 5 16.101 7.087 -27.779 1.00 0.00 C ATOM 50 CE LYS A 5 14.728 7.681 -27.417 1.00 0.00 C ATOM 51 NZ LYS A 5 13.596 6.874 -27.930 1.00 0.00 N ATOM 0 H LYS A 5 16.499 4.093 -24.177 1.00 0.00 H new ATOM 0 HA LYS A 5 14.724 6.101 -25.104 1.00 0.00 H new ATOM 0 HB2 LYS A 5 16.614 4.046 -26.228 1.00 0.00 H new ATOM 0 HB3 LYS A 5 15.350 4.586 -27.316 1.00 0.00 H new ATOM 0 HG2 LYS A 5 16.864 6.695 -25.804 1.00 0.00 H new ATOM 0 HG3 LYS A 5 17.723 5.855 -27.080 1.00 0.00 H new ATOM 0 HD2 LYS A 5 16.794 7.909 -27.959 1.00 0.00 H new ATOM 0 HD3 LYS A 5 16.002 6.542 -28.718 1.00 0.00 H new ATOM 0 HE2 LYS A 5 14.648 7.762 -26.333 1.00 0.00 H new ATOM 0 HE3 LYS A 5 14.658 8.692 -27.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 12.713 7.416 -27.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 13.759 6.645 -28.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 13.521 5.994 -27.382 1.00 0.00 H new ATOM 65 N SER A 6 13.063 3.605 -24.550 1.00 0.00 N ATOM 66 CA SER A 6 11.633 3.278 -24.515 1.00 0.00 C ATOM 67 C SER A 6 10.810 4.271 -23.678 1.00 0.00 C ATOM 68 O SER A 6 9.609 4.396 -23.913 1.00 0.00 O ATOM 69 CB SER A 6 11.421 1.840 -24.016 1.00 0.00 C ATOM 70 OG SER A 6 11.786 1.664 -22.656 1.00 0.00 O ATOM 0 H SER A 6 13.604 3.174 -23.800 1.00 0.00 H new ATOM 0 HA SER A 6 11.268 3.359 -25.539 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.373 1.568 -24.143 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.004 1.157 -24.634 1.00 0.00 H new ATOM 0 HG SER A 6 12.549 2.242 -22.445 1.00 0.00 H new ATOM 76 N GLN A 7 11.422 4.980 -22.718 1.00 0.00 N ATOM 77 CA GLN A 7 10.711 5.615 -21.607 1.00 0.00 C ATOM 78 C GLN A 7 9.981 6.916 -21.966 1.00 0.00 C ATOM 79 O GLN A 7 8.981 7.226 -21.323 1.00 0.00 O ATOM 80 CB GLN A 7 11.667 5.844 -20.425 1.00 0.00 C ATOM 81 CG GLN A 7 12.129 4.513 -19.811 1.00 0.00 C ATOM 82 CD GLN A 7 12.898 4.680 -18.503 1.00 0.00 C ATOM 83 OE1 GLN A 7 12.627 4.011 -17.511 1.00 0.00 O ATOM 84 NE2 GLN A 7 13.884 5.555 -18.454 1.00 0.00 N ATOM 0 H GLN A 7 12.431 5.128 -22.694 1.00 0.00 H new ATOM 0 HA GLN A 7 9.924 4.914 -21.328 1.00 0.00 H new ATOM 0 HB2 GLN A 7 12.535 6.412 -20.762 1.00 0.00 H new ATOM 0 HB3 GLN A 7 11.169 6.444 -19.663 1.00 0.00 H new ATOM 0 HG2 GLN A 7 11.258 3.882 -19.633 1.00 0.00 H new ATOM 0 HG3 GLN A 7 12.760 3.990 -20.530 1.00 0.00 H new ATOM 0 HE21 GLN A 7 14.112 6.113 -19.277 1.00 0.00 H new ATOM 0 HE22 GLN A 7 14.418 5.674 -17.593 1.00 0.00 H new ATOM 93 N GLU A 8 10.409 7.666 -22.987 1.00 0.00 N ATOM 94 CA GLU A 8 9.614 8.796 -23.494 1.00 0.00 C ATOM 95 C GLU A 8 8.500 8.322 -24.447 1.00 0.00 C ATOM 96 O GLU A 8 7.366 8.800 -24.374 1.00 0.00 O ATOM 97 CB GLU A 8 10.544 9.868 -24.100 1.00 0.00 C ATOM 98 CG GLU A 8 11.094 9.618 -25.514 1.00 0.00 C ATOM 99 CD GLU A 8 11.692 8.224 -25.728 1.00 0.00 C ATOM 100 OE1 GLU A 8 12.487 7.745 -24.891 1.00 0.00 O ATOM 101 OE2 GLU A 8 11.317 7.585 -26.741 1.00 0.00 O ATOM 0 H GLU A 8 11.291 7.516 -23.476 1.00 0.00 H new ATOM 0 HA GLU A 8 9.091 9.270 -22.664 1.00 0.00 H new ATOM 0 HB2 GLU A 8 10.002 10.814 -24.113 1.00 0.00 H new ATOM 0 HB3 GLU A 8 11.392 9.996 -23.428 1.00 0.00 H new ATOM 0 HG2 GLU A 8 10.290 9.769 -26.234 1.00 0.00 H new ATOM 0 HG3 GLU A 8 11.859 10.364 -25.729 1.00 0.00 H new ATOM 108 N SER A 9 8.810 7.333 -25.294 1.00 0.00 N ATOM 109 CA SER A 9 7.928 6.759 -26.309 1.00 0.00 C ATOM 110 C SER A 9 6.745 6.032 -25.676 1.00 0.00 C ATOM 111 O SER A 9 5.604 6.303 -26.051 1.00 0.00 O ATOM 112 CB SER A 9 8.719 5.803 -27.212 1.00 0.00 C ATOM 113 OG SER A 9 9.625 6.513 -28.033 1.00 0.00 O ATOM 0 H SER A 9 9.730 6.892 -25.287 1.00 0.00 H new ATOM 0 HA SER A 9 7.531 7.576 -26.911 1.00 0.00 H new ATOM 0 HB2 SER A 9 9.264 5.086 -26.599 1.00 0.00 H new ATOM 0 HB3 SER A 9 8.030 5.232 -27.834 1.00 0.00 H new ATOM 0 HG SER A 9 10.504 6.544 -27.600 1.00 0.00 H new ATOM 119 N ILE A 10 7.002 5.158 -24.686 1.00 0.00 N ATOM 120 CA ILE A 10 5.966 4.491 -23.886 1.00 0.00 C ATOM 121 C ILE A 10 5.031 5.554 -23.295 1.00 0.00 C ATOM 122 O ILE A 10 3.824 5.459 -23.467 1.00 0.00 O ATOM 123 CB ILE A 10 6.611 3.557 -22.819 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.746 2.372 -22.332 1.00 0.00 C ATOM 125 CG2 ILE A 10 7.164 4.336 -21.616 1.00 0.00 C ATOM 126 CD1 ILE A 10 4.386 2.707 -21.720 1.00 0.00 C ATOM 0 H ILE A 10 7.950 4.893 -24.418 1.00 0.00 H new ATOM 0 HA ILE A 10 5.358 3.838 -24.513 1.00 0.00 H new ATOM 0 HB ILE A 10 7.432 3.102 -23.372 1.00 0.00 H new ATOM 0 HG12 ILE A 10 5.581 1.704 -23.177 1.00 0.00 H new ATOM 0 HG13 ILE A 10 6.321 1.815 -21.593 1.00 0.00 H new ATOM 0 HG21 ILE A 10 7.603 3.639 -20.902 1.00 0.00 H new ATOM 0 HG22 ILE A 10 7.927 5.036 -21.956 1.00 0.00 H new ATOM 0 HG23 ILE A 10 6.355 4.886 -21.136 1.00 0.00 H new ATOM 0 HD11 ILE A 10 3.885 1.786 -21.421 1.00 0.00 H new ATOM 0 HD12 ILE A 10 4.527 3.343 -20.846 1.00 0.00 H new ATOM 0 HD13 ILE A 10 3.775 3.231 -22.455 1.00 0.00 H new ATOM 138 N ASN A 11 5.575 6.604 -22.671 1.00 0.00 N ATOM 139 CA ASN A 11 4.827 7.618 -21.942 1.00 0.00 C ATOM 140 C ASN A 11 3.906 8.425 -22.868 1.00 0.00 C ATOM 141 O ASN A 11 2.705 8.523 -22.613 1.00 0.00 O ATOM 142 CB ASN A 11 5.850 8.492 -21.205 1.00 0.00 C ATOM 143 CG ASN A 11 5.217 9.306 -20.098 1.00 0.00 C ATOM 144 OD1 ASN A 11 4.496 8.779 -19.269 1.00 0.00 O ATOM 145 ND2 ASN A 11 5.512 10.584 -20.013 1.00 0.00 N ATOM 0 H ASN A 11 6.581 6.771 -22.663 1.00 0.00 H new ATOM 0 HA ASN A 11 4.154 7.156 -21.220 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.631 7.858 -20.786 1.00 0.00 H new ATOM 0 HB3 ASN A 11 6.331 9.163 -21.917 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.136 11.144 -19.248 1.00 0.00 H new ATOM 0 HD22 ASN A 11 6.117 11.015 -20.712 1.00 0.00 H new ATOM 152 N GLN A 12 4.460 8.944 -23.972 1.00 0.00 N ATOM 153 CA GLN A 12 3.707 9.639 -25.013 1.00 0.00 C ATOM 154 C GLN A 12 2.596 8.746 -25.589 1.00 0.00 C ATOM 155 O GLN A 12 1.431 9.148 -25.625 1.00 0.00 O ATOM 156 CB GLN A 12 4.689 10.106 -26.101 1.00 0.00 C ATOM 157 CG GLN A 12 4.011 10.963 -27.179 1.00 0.00 C ATOM 158 CD GLN A 12 4.992 11.357 -28.277 1.00 0.00 C ATOM 159 OE1 GLN A 12 5.024 10.770 -29.347 1.00 0.00 O ATOM 160 NE2 GLN A 12 5.828 12.354 -28.056 1.00 0.00 N ATOM 0 H GLN A 12 5.460 8.889 -24.166 1.00 0.00 H new ATOM 0 HA GLN A 12 3.209 10.509 -24.586 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.492 10.679 -25.638 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.148 9.235 -26.569 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.178 10.410 -27.614 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.594 11.861 -26.723 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.807 12.849 -27.164 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.495 12.630 -28.777 1.00 0.00 H new ATOM 169 N LYS A 13 2.946 7.529 -26.026 1.00 0.00 N ATOM 170 CA LYS A 13 2.011 6.574 -26.632 1.00 0.00 C ATOM 171 C LYS A 13 0.948 6.088 -25.634 1.00 0.00 C ATOM 172 O LYS A 13 -0.203 5.890 -26.019 1.00 0.00 O ATOM 173 CB LYS A 13 2.844 5.442 -27.252 1.00 0.00 C ATOM 174 CG LYS A 13 2.081 4.530 -28.226 1.00 0.00 C ATOM 175 CD LYS A 13 3.097 3.603 -28.914 1.00 0.00 C ATOM 176 CE LYS A 13 2.452 2.458 -29.700 1.00 0.00 C ATOM 177 NZ LYS A 13 1.781 2.896 -30.941 1.00 0.00 N ATOM 0 H LYS A 13 3.901 7.176 -25.967 1.00 0.00 H new ATOM 0 HA LYS A 13 1.429 7.054 -27.418 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.691 5.882 -27.778 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.251 4.829 -26.448 1.00 0.00 H new ATOM 0 HG2 LYS A 13 1.333 3.944 -27.691 1.00 0.00 H new ATOM 0 HG3 LYS A 13 1.548 5.126 -28.967 1.00 0.00 H new ATOM 0 HD2 LYS A 13 3.714 4.194 -29.591 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.762 3.184 -28.159 1.00 0.00 H new ATOM 0 HE2 LYS A 13 3.218 1.724 -29.951 1.00 0.00 H new ATOM 0 HE3 LYS A 13 1.725 1.955 -29.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 1.744 2.104 -31.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 0.814 3.208 -30.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 2.312 3.684 -31.363 1.00 0.00 H new ATOM 191 N LEU A 14 1.290 5.953 -24.348 1.00 0.00 N ATOM 192 CA LEU A 14 0.364 5.610 -23.269 1.00 0.00 C ATOM 193 C LEU A 14 -0.606 6.756 -22.982 1.00 0.00 C ATOM 194 O LEU A 14 -1.798 6.495 -22.862 1.00 0.00 O ATOM 195 CB LEU A 14 1.142 5.173 -22.021 1.00 0.00 C ATOM 196 CG LEU A 14 0.241 4.528 -20.950 1.00 0.00 C ATOM 197 CD1 LEU A 14 1.001 3.401 -20.255 1.00 0.00 C ATOM 198 CD2 LEU A 14 -0.215 5.527 -19.888 1.00 0.00 C ATOM 0 H LEU A 14 2.248 6.084 -24.022 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.247 4.765 -23.587 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.917 4.464 -22.312 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.646 6.039 -21.591 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.643 4.151 -21.464 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.363 2.945 -19.498 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.287 2.648 -20.989 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.896 3.804 -19.781 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.847 5.020 -19.159 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.656 5.946 -19.384 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.780 6.329 -20.362 1.00 0.00 H new ATOM 210 N ALA A 15 -0.147 8.013 -22.919 1.00 0.00 N ATOM 211 CA ALA A 15 -1.054 9.158 -22.819 1.00 0.00 C ATOM 212 C ALA A 15 -1.980 9.256 -24.045 1.00 0.00 C ATOM 213 O ALA A 15 -3.192 9.431 -23.893 1.00 0.00 O ATOM 214 CB ALA A 15 -0.251 10.442 -22.616 1.00 0.00 C ATOM 0 H ALA A 15 0.843 8.259 -22.936 1.00 0.00 H new ATOM 0 HA ALA A 15 -1.698 9.013 -21.952 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -0.932 11.290 -22.543 1.00 0.00 H new ATOM 0 HB2 ALA A 15 0.333 10.365 -21.699 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.421 10.589 -23.462 1.00 0.00 H new ATOM 220 N LEU A 16 -1.425 9.066 -25.253 1.00 0.00 N ATOM 221 CA LEU A 16 -2.185 8.944 -26.500 1.00 0.00 C ATOM 222 C LEU A 16 -3.261 7.855 -26.399 1.00 0.00 C ATOM 223 O LEU A 16 -4.379 8.109 -26.833 1.00 0.00 O ATOM 224 CB LEU A 16 -1.206 8.737 -27.672 1.00 0.00 C ATOM 225 CG LEU A 16 -1.834 8.621 -29.079 1.00 0.00 C ATOM 226 CD1 LEU A 16 -0.760 8.927 -30.127 1.00 0.00 C ATOM 227 CD2 LEU A 16 -2.350 7.215 -29.410 1.00 0.00 C ATOM 0 H LEU A 16 -0.417 8.992 -25.389 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.734 9.867 -26.689 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.502 9.569 -27.680 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.629 7.832 -27.480 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.672 9.318 -29.090 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.192 8.848 -31.125 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.381 9.937 -29.975 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.058 8.214 -30.029 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.777 7.211 -30.413 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.525 6.504 -29.364 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -3.116 6.929 -28.689 1.00 0.00 H new ATOM 239 N VAL A 17 -2.954 6.688 -25.816 1.00 0.00 N ATOM 240 CA VAL A 17 -3.917 5.621 -25.491 1.00 0.00 C ATOM 241 C VAL A 17 -4.962 6.058 -24.457 1.00 0.00 C ATOM 242 O VAL A 17 -6.156 5.926 -24.715 1.00 0.00 O ATOM 243 CB VAL A 17 -3.162 4.343 -25.060 1.00 0.00 C ATOM 244 CG1 VAL A 17 -3.968 3.356 -24.203 1.00 0.00 C ATOM 245 CG2 VAL A 17 -2.680 3.618 -26.319 1.00 0.00 C ATOM 0 H VAL A 17 -1.999 6.451 -25.548 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.485 5.396 -26.394 1.00 0.00 H new ATOM 0 HB VAL A 17 -2.344 4.682 -24.424 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.346 2.496 -23.956 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.287 3.848 -23.284 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.844 3.022 -24.759 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.144 2.712 -26.035 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.538 3.353 -26.937 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.014 4.271 -26.883 1.00 0.00 H new ATOM 255 N ILE A 18 -4.533 6.579 -23.301 1.00 0.00 N ATOM 256 CA ILE A 18 -5.371 7.031 -22.174 1.00 0.00 C ATOM 257 C ILE A 18 -6.437 8.071 -22.575 1.00 0.00 C ATOM 258 O ILE A 18 -7.473 8.164 -21.916 1.00 0.00 O ATOM 259 CB ILE A 18 -4.445 7.437 -20.996 1.00 0.00 C ATOM 260 CG1 ILE A 18 -3.973 6.140 -20.283 1.00 0.00 C ATOM 261 CG2 ILE A 18 -5.149 8.389 -20.029 1.00 0.00 C ATOM 262 CD1 ILE A 18 -3.424 6.304 -18.859 1.00 0.00 C ATOM 0 H ILE A 18 -3.539 6.705 -23.112 1.00 0.00 H new ATOM 0 HA ILE A 18 -5.992 6.205 -21.826 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.581 7.981 -21.378 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -4.812 5.445 -20.248 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.200 5.676 -20.896 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.470 8.651 -19.218 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.446 9.293 -20.560 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.034 7.902 -19.619 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.128 5.330 -18.469 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -2.558 6.966 -18.877 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.195 6.732 -18.219 1.00 0.00 H new ATOM 274 N LYS A 19 -6.262 8.748 -23.714 1.00 0.00 N ATOM 275 CA LYS A 19 -7.287 9.539 -24.411 1.00 0.00 C ATOM 276 C LYS A 19 -8.627 8.803 -24.584 1.00 0.00 C ATOM 277 O LYS A 19 -9.667 9.451 -24.489 1.00 0.00 O ATOM 278 CB LYS A 19 -6.701 9.894 -25.778 1.00 0.00 C ATOM 279 CG LYS A 19 -7.562 10.792 -26.682 1.00 0.00 C ATOM 280 CD LYS A 19 -6.828 11.184 -27.981 1.00 0.00 C ATOM 281 CE LYS A 19 -6.822 10.136 -29.112 1.00 0.00 C ATOM 282 NZ LYS A 19 -6.193 8.855 -28.723 1.00 0.00 N ATOM 0 H LYS A 19 -5.364 8.762 -24.198 1.00 0.00 H new ATOM 0 HA LYS A 19 -7.522 10.420 -23.813 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.742 10.388 -25.620 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.497 8.966 -26.313 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -8.487 10.273 -26.932 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -7.840 11.694 -26.137 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -7.280 12.098 -28.366 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.794 11.421 -27.730 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -7.848 9.947 -29.428 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -6.294 10.545 -29.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -5.975 8.302 -29.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -5.315 9.044 -28.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -6.847 8.317 -28.119 1.00 0.00 H new ATOM 296 N SER A 20 -8.623 7.486 -24.850 1.00 0.00 N ATOM 297 CA SER A 20 -9.866 6.698 -24.966 1.00 0.00 C ATOM 298 C SER A 20 -9.786 5.208 -24.586 1.00 0.00 C ATOM 299 O SER A 20 -10.832 4.585 -24.404 1.00 0.00 O ATOM 300 CB SER A 20 -10.459 6.857 -26.373 1.00 0.00 C ATOM 301 OG SER A 20 -9.761 6.111 -27.347 1.00 0.00 O ATOM 0 H SER A 20 -7.772 6.942 -24.989 1.00 0.00 H new ATOM 0 HA SER A 20 -10.520 7.123 -24.205 1.00 0.00 H new ATOM 0 HB2 SER A 20 -11.503 6.543 -26.360 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.446 7.911 -26.651 1.00 0.00 H new ATOM 0 HG SER A 20 -8.797 6.196 -27.195 1.00 0.00 H new ATOM 307 N GLY A 21 -8.591 4.628 -24.408 1.00 0.00 N ATOM 308 CA GLY A 21 -8.417 3.237 -23.983 1.00 0.00 C ATOM 309 C GLY A 21 -8.605 3.050 -22.472 1.00 0.00 C ATOM 310 O GLY A 21 -8.500 3.993 -21.690 1.00 0.00 O ATOM 0 H GLY A 21 -7.710 5.119 -24.557 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -9.131 2.607 -24.514 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -7.421 2.897 -24.265 1.00 0.00 H new ATOM 314 N LYS A 22 -8.866 1.809 -22.046 1.00 0.00 N ATOM 315 CA LYS A 22 -9.175 1.452 -20.654 1.00 0.00 C ATOM 316 C LYS A 22 -7.910 1.287 -19.811 1.00 0.00 C ATOM 317 O LYS A 22 -7.174 0.307 -19.964 1.00 0.00 O ATOM 318 CB LYS A 22 -9.999 0.160 -20.618 1.00 0.00 C ATOM 319 CG LYS A 22 -11.460 0.371 -21.050 1.00 0.00 C ATOM 320 CD LYS A 22 -12.407 0.735 -19.894 1.00 0.00 C ATOM 321 CE LYS A 22 -12.502 -0.327 -18.782 1.00 0.00 C ATOM 322 NZ LYS A 22 -12.858 -1.670 -19.300 1.00 0.00 N ATOM 0 H LYS A 22 -8.869 1.005 -22.673 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.753 2.270 -20.224 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -9.535 -0.579 -21.271 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -9.979 -0.250 -19.608 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.496 1.162 -21.799 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.821 -0.539 -21.530 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -12.075 1.675 -19.453 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -13.404 0.907 -20.299 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -11.547 -0.385 -18.259 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -13.248 -0.015 -18.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.204 -2.263 -18.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -13.602 -1.578 -20.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.018 -2.112 -19.725 1.00 0.00 H new ATOM 336 N TYR A 23 -7.711 2.229 -18.887 1.00 0.00 N ATOM 337 CA TYR A 23 -6.648 2.223 -17.881 1.00 0.00 C ATOM 338 C TYR A 23 -7.182 2.221 -16.433 1.00 0.00 C ATOM 339 O TYR A 23 -8.386 2.324 -16.197 1.00 0.00 O ATOM 340 CB TYR A 23 -5.757 3.447 -18.137 1.00 0.00 C ATOM 341 CG TYR A 23 -6.471 4.760 -17.877 1.00 0.00 C ATOM 342 CD1 TYR A 23 -7.209 5.381 -18.901 1.00 0.00 C ATOM 343 CD2 TYR A 23 -6.447 5.327 -16.590 1.00 0.00 C ATOM 344 CE1 TYR A 23 -7.933 6.555 -18.638 1.00 0.00 C ATOM 345 CE2 TYR A 23 -7.176 6.500 -16.319 1.00 0.00 C ATOM 346 CZ TYR A 23 -7.920 7.120 -17.347 1.00 0.00 C ATOM 347 OH TYR A 23 -8.616 8.263 -17.101 1.00 0.00 O ATOM 0 H TYR A 23 -8.311 3.051 -18.817 1.00 0.00 H new ATOM 0 HA TYR A 23 -6.079 1.298 -17.978 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -4.874 3.387 -17.501 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -5.408 3.427 -19.169 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -7.219 4.953 -19.893 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -5.867 4.861 -15.807 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.501 7.026 -19.427 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -7.166 6.925 -15.326 1.00 0.00 H new ATOM 0 HH TYR A 23 -8.503 8.519 -16.162 1.00 0.00 H new ATOM 357 N THR A 24 -6.267 2.128 -15.460 1.00 0.00 N ATOM 358 CA THR A 24 -6.519 2.211 -14.010 1.00 0.00 C ATOM 359 C THR A 24 -5.308 2.839 -13.286 1.00 0.00 C ATOM 360 O THR A 24 -4.179 2.657 -13.745 1.00 0.00 O ATOM 361 CB THR A 24 -6.858 0.797 -13.506 1.00 0.00 C ATOM 362 OG1 THR A 24 -7.294 0.794 -12.172 1.00 0.00 O ATOM 363 CG2 THR A 24 -5.696 -0.186 -13.625 1.00 0.00 C ATOM 0 H THR A 24 -5.279 1.985 -15.670 1.00 0.00 H new ATOM 0 HA THR A 24 -7.364 2.865 -13.795 1.00 0.00 H new ATOM 0 HB THR A 24 -7.665 0.469 -14.162 1.00 0.00 H new ATOM 0 HG1 THR A 24 -7.662 -0.087 -11.950 1.00 0.00 H new ATOM 0 HG21 THR A 24 -6.006 -1.162 -13.252 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.400 -0.274 -14.670 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.852 0.176 -13.038 1.00 0.00 H new ATOM 371 N LEU A 25 -5.522 3.591 -12.188 1.00 0.00 N ATOM 372 CA LEU A 25 -4.521 4.488 -11.562 1.00 0.00 C ATOM 373 C LEU A 25 -4.411 4.322 -10.033 1.00 0.00 C ATOM 374 O LEU A 25 -5.408 4.475 -9.318 1.00 0.00 O ATOM 375 CB LEU A 25 -4.866 5.970 -11.839 1.00 0.00 C ATOM 376 CG LEU A 25 -5.026 6.415 -13.301 1.00 0.00 C ATOM 377 CD1 LEU A 25 -5.382 7.898 -13.372 1.00 0.00 C ATOM 378 CD2 LEU A 25 -3.746 6.250 -14.106 1.00 0.00 C ATOM 0 H LEU A 25 -6.416 3.594 -11.697 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.569 4.205 -12.011 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.795 6.199 -11.317 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.087 6.584 -11.387 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.812 5.783 -13.715 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.492 8.196 -14.415 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.319 8.073 -12.844 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.589 8.485 -12.908 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.916 6.579 -15.131 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.955 6.851 -13.658 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.449 5.201 -14.106 1.00 0.00 H new ATOM 390 N GLY A 26 -3.195 4.087 -9.520 1.00 0.00 N ATOM 391 CA GLY A 26 -2.891 3.995 -8.084 1.00 0.00 C ATOM 392 C GLY A 26 -3.079 2.581 -7.520 1.00 0.00 C ATOM 393 O GLY A 26 -3.940 1.840 -7.995 1.00 0.00 O ATOM 0 H GLY A 26 -2.373 3.952 -10.108 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -1.862 4.314 -7.915 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.533 4.686 -7.538 1.00 0.00 H new ATOM 397 N TYR A 27 -2.290 2.215 -6.491 1.00 0.00 N ATOM 398 CA TYR A 27 -2.083 0.831 -6.021 1.00 0.00 C ATOM 399 C TYR A 27 -3.402 0.067 -5.825 1.00 0.00 C ATOM 400 O TYR A 27 -3.619 -0.951 -6.473 1.00 0.00 O ATOM 401 CB TYR A 27 -1.206 0.810 -4.754 1.00 0.00 C ATOM 402 CG TYR A 27 -0.686 -0.575 -4.394 1.00 0.00 C ATOM 403 CD1 TYR A 27 -1.440 -1.435 -3.563 1.00 0.00 C ATOM 404 CD2 TYR A 27 0.547 -1.021 -4.914 1.00 0.00 C ATOM 405 CE1 TYR A 27 -0.989 -2.742 -3.286 1.00 0.00 C ATOM 406 CE2 TYR A 27 0.997 -2.323 -4.635 1.00 0.00 C ATOM 407 CZ TYR A 27 0.221 -3.202 -3.852 1.00 0.00 C ATOM 408 OH TYR A 27 0.666 -4.476 -3.674 1.00 0.00 O ATOM 0 H TYR A 27 -1.762 2.897 -5.946 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.548 0.299 -6.808 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -0.359 1.481 -4.898 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -1.783 1.201 -3.916 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -2.370 -1.088 -3.137 1.00 0.00 H new ATOM 0 HD2 TYR A 27 1.145 -0.362 -5.526 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -1.567 -3.389 -2.643 1.00 0.00 H new ATOM 0 HE2 TYR A 27 1.948 -2.654 -5.025 1.00 0.00 H new ATOM 0 HH TYR A 27 -0.093 -5.095 -3.705 1.00 0.00 H new ATOM 418 N LYS A 28 -4.315 0.614 -5.010 1.00 0.00 N ATOM 419 CA LYS A 28 -5.707 0.169 -4.824 1.00 0.00 C ATOM 420 C LYS A 28 -6.365 -0.255 -6.143 1.00 0.00 C ATOM 421 O LYS A 28 -6.862 -1.374 -6.281 1.00 0.00 O ATOM 422 CB LYS A 28 -6.471 1.344 -4.173 1.00 0.00 C ATOM 423 CG LYS A 28 -8.008 1.212 -4.170 1.00 0.00 C ATOM 424 CD LYS A 28 -8.718 2.502 -3.723 1.00 0.00 C ATOM 425 CE LYS A 28 -8.470 3.741 -4.608 1.00 0.00 C ATOM 426 NZ LYS A 28 -8.890 3.564 -6.023 1.00 0.00 N ATOM 0 H LYS A 28 -4.092 1.423 -4.430 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.731 -0.716 -4.188 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.130 1.451 -3.143 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.203 2.263 -4.694 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.347 0.945 -5.171 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.296 0.396 -3.507 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -9.791 2.312 -3.688 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.403 2.735 -2.706 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.005 4.591 -4.184 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -7.408 3.987 -4.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -9.366 4.427 -6.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -8.053 3.382 -6.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -9.545 2.759 -6.093 1.00 0.00 H new ATOM 440 N SER A 29 -6.403 0.689 -7.083 1.00 0.00 N ATOM 441 CA SER A 29 -7.125 0.624 -8.345 1.00 0.00 C ATOM 442 C SER A 29 -6.542 -0.454 -9.245 1.00 0.00 C ATOM 443 O SER A 29 -7.289 -1.326 -9.695 1.00 0.00 O ATOM 444 CB SER A 29 -7.017 1.965 -9.068 1.00 0.00 C ATOM 445 OG SER A 29 -7.158 3.064 -8.181 1.00 0.00 O ATOM 0 H SER A 29 -5.900 1.569 -6.974 1.00 0.00 H new ATOM 0 HA SER A 29 -8.167 0.390 -8.128 1.00 0.00 H new ATOM 0 HB2 SER A 29 -6.052 2.028 -9.572 1.00 0.00 H new ATOM 0 HB3 SER A 29 -7.784 2.023 -9.840 1.00 0.00 H new ATOM 0 HG SER A 29 -6.813 3.876 -8.608 1.00 0.00 H new ATOM 451 N THR A 30 -5.221 -0.405 -9.487 1.00 0.00 N ATOM 452 CA THR A 30 -4.523 -1.464 -10.218 1.00 0.00 C ATOM 453 C THR A 30 -4.754 -2.800 -9.523 1.00 0.00 C ATOM 454 O THR A 30 -5.404 -3.632 -10.132 1.00 0.00 O ATOM 455 CB THR A 30 -3.062 -1.129 -10.556 1.00 0.00 C ATOM 456 OG1 THR A 30 -2.497 -2.205 -11.258 1.00 0.00 O ATOM 457 CG2 THR A 30 -2.181 -0.837 -9.353 1.00 0.00 C ATOM 0 H THR A 30 -4.618 0.360 -9.184 1.00 0.00 H new ATOM 0 HA THR A 30 -4.959 -1.551 -11.213 1.00 0.00 H new ATOM 0 HB THR A 30 -3.098 -0.214 -11.147 1.00 0.00 H new ATOM 0 HG1 THR A 30 -2.027 -1.869 -12.050 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.169 -0.612 -9.689 1.00 0.00 H new ATOM 0 HG22 THR A 30 -2.581 0.018 -8.808 1.00 0.00 H new ATOM 0 HG23 THR A 30 -2.160 -1.708 -8.698 1.00 0.00 H new ATOM 465 N VAL A 31 -4.400 -3.004 -8.246 1.00 0.00 N ATOM 466 CA VAL A 31 -4.578 -4.298 -7.561 1.00 0.00 C ATOM 467 C VAL A 31 -5.993 -4.873 -7.718 1.00 0.00 C ATOM 468 O VAL A 31 -6.123 -6.029 -8.126 1.00 0.00 O ATOM 469 CB VAL A 31 -4.143 -4.213 -6.087 1.00 0.00 C ATOM 470 CG1 VAL A 31 -4.476 -5.499 -5.322 1.00 0.00 C ATOM 471 CG2 VAL A 31 -2.624 -4.016 -6.031 1.00 0.00 C ATOM 0 H VAL A 31 -3.984 -2.282 -7.659 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.918 -5.009 -8.059 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.677 -3.381 -5.628 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.153 -5.400 -4.286 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.552 -5.672 -5.352 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.960 -6.341 -5.783 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.303 -3.954 -4.991 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.130 -4.859 -6.514 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.357 -3.094 -6.548 1.00 0.00 H new ATOM 481 N LYS A 32 -7.047 -4.076 -7.483 1.00 0.00 N ATOM 482 CA LYS A 32 -8.431 -4.484 -7.766 1.00 0.00 C ATOM 483 C LYS A 32 -8.612 -4.924 -9.228 1.00 0.00 C ATOM 484 O LYS A 32 -9.104 -6.019 -9.491 1.00 0.00 O ATOM 485 CB LYS A 32 -9.386 -3.341 -7.382 1.00 0.00 C ATOM 486 CG LYS A 32 -10.857 -3.770 -7.503 1.00 0.00 C ATOM 487 CD LYS A 32 -11.804 -2.657 -7.028 1.00 0.00 C ATOM 488 CE LYS A 32 -13.279 -2.993 -7.286 1.00 0.00 C ATOM 489 NZ LYS A 32 -13.735 -4.181 -6.527 1.00 0.00 N ATOM 0 H LYS A 32 -6.965 -3.137 -7.094 1.00 0.00 H new ATOM 0 HA LYS A 32 -8.672 -5.358 -7.161 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.182 -3.023 -6.360 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.203 -2.481 -8.026 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.080 -4.023 -8.540 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.025 -4.670 -6.912 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -11.654 -2.487 -5.962 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -11.552 -1.727 -7.538 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.895 -2.136 -7.016 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -13.427 -3.169 -8.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -14.775 -4.208 -6.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -13.371 -5.043 -6.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -13.380 -4.127 -5.551 1.00 0.00 H new ATOM 503 N SER A 33 -8.180 -4.083 -10.170 1.00 0.00 N ATOM 504 CA SER A 33 -8.252 -4.305 -11.620 1.00 0.00 C ATOM 505 C SER A 33 -7.476 -5.551 -12.077 1.00 0.00 C ATOM 506 O SER A 33 -7.971 -6.304 -12.908 1.00 0.00 O ATOM 507 CB SER A 33 -7.714 -3.084 -12.383 1.00 0.00 C ATOM 508 OG SER A 33 -8.258 -1.854 -11.931 1.00 0.00 O ATOM 0 H SER A 33 -7.751 -3.188 -9.935 1.00 0.00 H new ATOM 0 HA SER A 33 -9.307 -4.463 -11.846 1.00 0.00 H new ATOM 0 HB2 SER A 33 -6.629 -3.052 -12.284 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.933 -3.202 -13.444 1.00 0.00 H new ATOM 0 HG SER A 33 -7.948 -1.675 -11.019 1.00 0.00 H new ATOM 514 N LEU A 34 -6.268 -5.787 -11.546 1.00 0.00 N ATOM 515 CA LEU A 34 -5.426 -6.939 -11.874 1.00 0.00 C ATOM 516 C LEU A 34 -6.000 -8.238 -11.295 1.00 0.00 C ATOM 517 O LEU A 34 -5.957 -9.270 -11.964 1.00 0.00 O ATOM 518 CB LEU A 34 -3.986 -6.751 -11.355 1.00 0.00 C ATOM 519 CG LEU A 34 -3.249 -5.461 -11.748 1.00 0.00 C ATOM 520 CD1 LEU A 34 -1.836 -5.444 -11.177 1.00 0.00 C ATOM 521 CD2 LEU A 34 -3.217 -5.216 -13.245 1.00 0.00 C ATOM 0 H LEU A 34 -5.842 -5.165 -10.860 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.408 -7.011 -12.961 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.012 -6.804 -10.267 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -3.391 -7.596 -11.702 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.823 -4.644 -11.311 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.336 -4.521 -11.470 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.882 -5.502 -10.090 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.277 -6.297 -11.563 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.682 -4.289 -13.451 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.710 -6.045 -13.739 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -4.236 -5.138 -13.623 1.00 0.00 H new ATOM 533 N ARG A 35 -6.541 -8.197 -10.070 1.00 0.00 N ATOM 534 CA ARG A 35 -7.160 -9.362 -9.426 1.00 0.00 C ATOM 535 C ARG A 35 -8.525 -9.709 -10.033 1.00 0.00 C ATOM 536 O ARG A 35 -8.827 -10.892 -10.150 1.00 0.00 O ATOM 537 CB ARG A 35 -7.250 -9.139 -7.904 1.00 0.00 C ATOM 538 CG ARG A 35 -5.851 -9.124 -7.254 1.00 0.00 C ATOM 539 CD ARG A 35 -5.879 -8.704 -5.778 1.00 0.00 C ATOM 540 NE ARG A 35 -6.335 -9.789 -4.889 1.00 0.00 N ATOM 541 CZ ARG A 35 -5.794 -10.186 -3.740 1.00 0.00 C ATOM 542 NH1 ARG A 35 -4.692 -9.674 -3.232 1.00 0.00 N ATOM 543 NH2 ARG A 35 -6.370 -11.146 -3.056 1.00 0.00 N ATOM 0 H ARG A 35 -6.561 -7.353 -9.497 1.00 0.00 H new ATOM 0 HA ARG A 35 -6.521 -10.225 -9.612 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -7.757 -8.195 -7.702 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -7.854 -9.927 -7.454 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -5.408 -10.117 -7.335 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -5.207 -8.441 -7.808 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -4.881 -8.386 -5.475 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -6.537 -7.843 -5.661 1.00 0.00 H new ATOM 0 HE ARG A 35 -7.166 -10.297 -5.192 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -4.202 -8.928 -3.725 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -4.329 -10.024 -2.345 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -7.224 -11.580 -3.406 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -5.964 -11.458 -2.174 1.00 0.00 H new ATOM 557 N GLN A 36 -9.342 -8.716 -10.413 1.00 0.00 N ATOM 558 CA GLN A 36 -10.718 -8.931 -10.889 1.00 0.00 C ATOM 559 C GLN A 36 -10.958 -8.762 -12.403 1.00 0.00 C ATOM 560 O GLN A 36 -12.021 -9.164 -12.870 1.00 0.00 O ATOM 561 CB GLN A 36 -11.695 -8.052 -10.085 1.00 0.00 C ATOM 562 CG GLN A 36 -11.627 -8.313 -8.571 1.00 0.00 C ATOM 563 CD GLN A 36 -12.833 -7.726 -7.845 1.00 0.00 C ATOM 564 OE1 GLN A 36 -12.841 -6.580 -7.410 1.00 0.00 O ATOM 565 NE2 GLN A 36 -13.897 -8.493 -7.686 1.00 0.00 N ATOM 0 H GLN A 36 -9.066 -7.734 -10.399 1.00 0.00 H new ATOM 0 HA GLN A 36 -10.904 -9.991 -10.714 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.474 -7.002 -10.278 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -12.711 -8.234 -10.435 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -11.579 -9.386 -8.388 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -10.712 -7.879 -8.167 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -13.896 -9.447 -8.046 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -14.719 -8.131 -7.203 1.00 0.00 H new ATOM 574 N GLY A 37 -10.029 -8.181 -13.179 1.00 0.00 N ATOM 575 CA GLY A 37 -10.271 -7.768 -14.569 1.00 0.00 C ATOM 576 C GLY A 37 -9.199 -8.193 -15.581 1.00 0.00 C ATOM 577 O GLY A 37 -8.158 -8.761 -15.240 1.00 0.00 O ATOM 0 H GLY A 37 -9.082 -7.984 -12.856 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -11.230 -8.176 -14.889 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -10.361 -6.682 -14.596 1.00 0.00 H new ATOM 581 N LYS A 38 -9.464 -7.909 -16.865 1.00 0.00 N ATOM 582 CA LYS A 38 -8.666 -8.319 -18.033 1.00 0.00 C ATOM 583 C LYS A 38 -7.409 -7.448 -18.248 1.00 0.00 C ATOM 584 O LYS A 38 -7.186 -6.903 -19.329 1.00 0.00 O ATOM 585 CB LYS A 38 -9.588 -8.343 -19.268 1.00 0.00 C ATOM 586 CG LYS A 38 -9.029 -9.215 -20.412 1.00 0.00 C ATOM 587 CD LYS A 38 -9.565 -8.801 -21.796 1.00 0.00 C ATOM 588 CE LYS A 38 -8.623 -7.854 -22.557 1.00 0.00 C ATOM 589 NZ LYS A 38 -8.306 -6.635 -21.784 1.00 0.00 N ATOM 0 H LYS A 38 -10.281 -7.360 -17.131 1.00 0.00 H new ATOM 0 HA LYS A 38 -8.272 -9.319 -17.855 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -10.569 -8.718 -18.977 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.731 -7.325 -19.629 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.941 -9.149 -20.414 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -9.285 -10.258 -20.226 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -9.731 -9.696 -22.396 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -10.533 -8.316 -21.672 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.699 -8.380 -22.796 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -9.083 -7.571 -23.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.655 -6.036 -22.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -9.182 -6.108 -21.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.858 -6.901 -20.884 1.00 0.00 H new ATOM 603 N SER A 39 -6.577 -7.305 -17.218 1.00 0.00 N ATOM 604 CA SER A 39 -5.313 -6.560 -17.261 1.00 0.00 C ATOM 605 C SER A 39 -4.354 -7.055 -18.355 1.00 0.00 C ATOM 606 O SER A 39 -4.072 -8.253 -18.421 1.00 0.00 O ATOM 607 CB SER A 39 -4.652 -6.637 -15.881 1.00 0.00 C ATOM 608 OG SER A 39 -4.434 -7.971 -15.439 1.00 0.00 O ATOM 0 H SER A 39 -6.766 -7.715 -16.303 1.00 0.00 H new ATOM 0 HA SER A 39 -5.542 -5.526 -17.517 1.00 0.00 H new ATOM 0 HB2 SER A 39 -3.698 -6.111 -15.912 1.00 0.00 H new ATOM 0 HB3 SER A 39 -5.279 -6.118 -15.155 1.00 0.00 H new ATOM 0 HG SER A 39 -3.909 -8.456 -16.109 1.00 0.00 H new ATOM 614 N LYS A 40 -3.790 -6.153 -19.176 1.00 0.00 N ATOM 615 CA LYS A 40 -2.854 -6.538 -20.248 1.00 0.00 C ATOM 616 C LYS A 40 -1.424 -6.029 -20.033 1.00 0.00 C ATOM 617 O LYS A 40 -0.489 -6.762 -20.361 1.00 0.00 O ATOM 618 CB LYS A 40 -3.423 -6.111 -21.618 1.00 0.00 C ATOM 619 CG LYS A 40 -2.724 -6.787 -22.807 1.00 0.00 C ATOM 620 CD LYS A 40 -2.934 -8.308 -22.915 1.00 0.00 C ATOM 621 CE LYS A 40 -1.603 -9.028 -23.155 1.00 0.00 C ATOM 622 NZ LYS A 40 -0.777 -9.080 -21.929 1.00 0.00 N ATOM 0 H LYS A 40 -3.966 -5.150 -19.118 1.00 0.00 H new ATOM 0 HA LYS A 40 -2.766 -7.624 -20.223 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -4.487 -6.346 -21.650 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.332 -5.030 -21.720 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -3.077 -6.322 -23.727 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -1.654 -6.588 -22.739 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -3.394 -8.681 -22.000 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -3.623 -8.527 -23.731 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -1.796 -10.042 -23.506 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -1.051 -8.517 -23.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 0.199 -9.337 -22.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -0.782 -8.148 -21.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -1.167 -9.791 -21.278 1.00 0.00 H new ATOM 636 N LEU A 41 -1.249 -4.844 -19.441 1.00 0.00 N ATOM 637 CA LEU A 41 0.050 -4.224 -19.155 1.00 0.00 C ATOM 638 C LEU A 41 -0.026 -3.455 -17.830 1.00 0.00 C ATOM 639 O LEU A 41 -0.980 -2.705 -17.626 1.00 0.00 O ATOM 640 CB LEU A 41 0.382 -3.310 -20.352 1.00 0.00 C ATOM 641 CG LEU A 41 1.651 -2.434 -20.351 1.00 0.00 C ATOM 642 CD1 LEU A 41 1.500 -1.155 -19.527 1.00 0.00 C ATOM 643 CD2 LEU A 41 2.930 -3.171 -19.952 1.00 0.00 C ATOM 0 H LEU A 41 -2.035 -4.269 -19.137 1.00 0.00 H new ATOM 0 HA LEU A 41 0.842 -4.963 -19.037 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.433 -3.946 -21.236 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.468 -2.642 -20.489 1.00 0.00 H new ATOM 0 HG LEU A 41 1.763 -2.154 -21.399 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.428 -0.584 -19.568 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.686 -0.554 -19.933 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.278 -1.413 -18.492 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.772 -2.479 -19.979 1.00 0.00 H new ATOM 0 HD22 LEU A 41 2.820 -3.571 -18.944 1.00 0.00 H new ATOM 0 HD23 LEU A 41 3.111 -3.989 -20.649 1.00 0.00 H new ATOM 655 N ILE A 42 0.979 -3.598 -16.958 1.00 0.00 N ATOM 656 CA ILE A 42 1.135 -2.774 -15.751 1.00 0.00 C ATOM 657 C ILE A 42 2.384 -1.890 -15.839 1.00 0.00 C ATOM 658 O ILE A 42 3.474 -2.358 -16.170 1.00 0.00 O ATOM 659 CB ILE A 42 1.048 -3.591 -14.441 1.00 0.00 C ATOM 660 CG1 ILE A 42 2.280 -4.453 -14.093 1.00 0.00 C ATOM 661 CG2 ILE A 42 -0.166 -4.521 -14.480 1.00 0.00 C ATOM 662 CD1 ILE A 42 2.237 -4.978 -12.656 1.00 0.00 C ATOM 0 H ILE A 42 1.715 -4.296 -17.071 1.00 0.00 H new ATOM 0 HA ILE A 42 0.278 -2.101 -15.710 1.00 0.00 H new ATOM 0 HB ILE A 42 0.975 -2.827 -13.667 1.00 0.00 H new ATOM 0 HG12 ILE A 42 2.338 -5.295 -14.783 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.185 -3.862 -14.234 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.217 -5.091 -13.553 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.074 -3.929 -14.593 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.073 -5.206 -15.323 1.00 0.00 H new ATOM 0 HD11 ILE A 42 3.126 -5.578 -12.461 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.207 -4.138 -11.962 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.347 -5.592 -12.520 1.00 0.00 H new ATOM 674 N ILE A 43 2.207 -0.601 -15.540 1.00 0.00 N ATOM 675 CA ILE A 43 3.267 0.387 -15.364 1.00 0.00 C ATOM 676 C ILE A 43 3.559 0.494 -13.873 1.00 0.00 C ATOM 677 O ILE A 43 2.655 0.771 -13.080 1.00 0.00 O ATOM 678 CB ILE A 43 2.824 1.777 -15.864 1.00 0.00 C ATOM 679 CG1 ILE A 43 2.407 1.823 -17.344 1.00 0.00 C ATOM 680 CG2 ILE A 43 3.912 2.830 -15.590 1.00 0.00 C ATOM 681 CD1 ILE A 43 3.544 1.570 -18.335 1.00 0.00 C ATOM 0 H ILE A 43 1.277 -0.202 -15.409 1.00 0.00 H new ATOM 0 HA ILE A 43 4.142 0.073 -15.933 1.00 0.00 H new ATOM 0 HB ILE A 43 1.925 2.009 -15.293 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.626 1.081 -17.511 1.00 0.00 H new ATOM 0 HG13 ILE A 43 1.970 2.799 -17.554 1.00 0.00 H new ATOM 0 HG21 ILE A 43 3.577 3.802 -15.951 1.00 0.00 H new ATOM 0 HG22 ILE A 43 4.101 2.887 -14.518 1.00 0.00 H new ATOM 0 HG23 ILE A 43 4.830 2.548 -16.106 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.158 1.622 -19.353 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.318 2.326 -18.202 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.968 0.582 -18.158 1.00 0.00 H new ATOM 693 N ILE A 44 4.831 0.347 -13.502 1.00 0.00 N ATOM 694 CA ILE A 44 5.282 0.627 -12.141 1.00 0.00 C ATOM 695 C ILE A 44 6.407 1.663 -12.230 1.00 0.00 C ATOM 696 O ILE A 44 7.584 1.329 -12.382 1.00 0.00 O ATOM 697 CB ILE A 44 5.632 -0.667 -11.367 1.00 0.00 C ATOM 698 CG1 ILE A 44 4.521 -1.746 -11.449 1.00 0.00 C ATOM 699 CG2 ILE A 44 5.890 -0.283 -9.898 1.00 0.00 C ATOM 700 CD1 ILE A 44 4.958 -3.123 -10.945 1.00 0.00 C ATOM 0 H ILE A 44 5.571 0.033 -14.130 1.00 0.00 H new ATOM 0 HA ILE A 44 4.482 1.058 -11.540 1.00 0.00 H new ATOM 0 HB ILE A 44 6.516 -1.111 -11.824 1.00 0.00 H new ATOM 0 HG12 ILE A 44 3.661 -1.413 -10.868 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.191 -1.836 -12.484 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.140 -1.177 -9.327 1.00 0.00 H new ATOM 0 HG22 ILE A 44 6.718 0.423 -9.847 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.995 0.177 -9.479 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.128 -3.823 -11.034 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.798 -3.479 -11.541 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.260 -3.049 -9.900 1.00 0.00 H new ATOM 712 N ALA A 45 6.020 2.942 -12.177 1.00 0.00 N ATOM 713 CA ALA A 45 6.900 4.101 -12.252 1.00 0.00 C ATOM 714 C ALA A 45 7.046 4.768 -10.875 1.00 0.00 C ATOM 715 O ALA A 45 6.650 5.915 -10.666 1.00 0.00 O ATOM 716 CB ALA A 45 6.364 5.061 -13.316 1.00 0.00 C ATOM 0 H ALA A 45 5.039 3.203 -12.076 1.00 0.00 H new ATOM 0 HA ALA A 45 7.903 3.791 -12.546 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.015 5.933 -13.381 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.337 4.556 -14.281 1.00 0.00 H new ATOM 0 HB3 ALA A 45 5.357 5.379 -13.045 1.00 0.00 H new ATOM 722 N ALA A 46 7.591 4.017 -9.915 1.00 0.00 N ATOM 723 CA ALA A 46 7.739 4.439 -8.529 1.00 0.00 C ATOM 724 C ALA A 46 9.057 3.917 -7.932 1.00 0.00 C ATOM 725 O ALA A 46 9.681 3.006 -8.479 1.00 0.00 O ATOM 726 CB ALA A 46 6.517 3.939 -7.752 1.00 0.00 C ATOM 0 H ALA A 46 7.948 3.078 -10.089 1.00 0.00 H new ATOM 0 HA ALA A 46 7.787 5.526 -8.465 1.00 0.00 H new ATOM 0 HB1 ALA A 46 6.601 4.241 -6.708 1.00 0.00 H new ATOM 0 HB2 ALA A 46 5.612 4.368 -8.182 1.00 0.00 H new ATOM 0 HB3 ALA A 46 6.468 2.852 -7.812 1.00 0.00 H new ATOM 732 N ASN A 47 9.477 4.460 -6.783 1.00 0.00 N ATOM 733 CA ASN A 47 10.592 3.946 -5.975 1.00 0.00 C ATOM 734 C ASN A 47 10.162 2.679 -5.187 1.00 0.00 C ATOM 735 O ASN A 47 10.250 2.622 -3.959 1.00 0.00 O ATOM 736 CB ASN A 47 11.111 5.103 -5.096 1.00 0.00 C ATOM 737 CG ASN A 47 12.498 4.849 -4.520 1.00 0.00 C ATOM 738 OD1 ASN A 47 13.469 5.488 -4.890 1.00 0.00 O ATOM 739 ND2 ASN A 47 12.630 3.910 -3.609 1.00 0.00 N ATOM 0 H ASN A 47 9.041 5.289 -6.379 1.00 0.00 H new ATOM 0 HA ASN A 47 11.420 3.610 -6.600 1.00 0.00 H new ATOM 0 HB2 ASN A 47 11.133 6.018 -5.688 1.00 0.00 H new ATOM 0 HB3 ASN A 47 10.411 5.270 -4.278 1.00 0.00 H new ATOM 0 HD21 ASN A 47 13.547 3.713 -3.209 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.815 3.378 -3.303 1.00 0.00 H new ATOM 746 N THR A 48 9.631 1.684 -5.899 1.00 0.00 N ATOM 747 CA THR A 48 8.828 0.571 -5.373 1.00 0.00 C ATOM 748 C THR A 48 9.644 -0.432 -4.534 1.00 0.00 C ATOM 749 O THR A 48 10.532 -1.082 -5.085 1.00 0.00 O ATOM 750 CB THR A 48 8.162 -0.176 -6.539 1.00 0.00 C ATOM 751 OG1 THR A 48 7.709 0.725 -7.514 1.00 0.00 O ATOM 752 CG2 THR A 48 6.926 -0.943 -6.084 1.00 0.00 C ATOM 0 H THR A 48 9.754 1.627 -6.910 1.00 0.00 H new ATOM 0 HA THR A 48 8.083 1.011 -4.710 1.00 0.00 H new ATOM 0 HB THR A 48 8.921 -0.853 -6.931 1.00 0.00 H new ATOM 0 HG1 THR A 48 8.263 0.643 -8.318 1.00 0.00 H new ATOM 0 HG21 THR A 48 6.483 -1.458 -6.936 1.00 0.00 H new ATOM 0 HG22 THR A 48 7.210 -1.673 -5.326 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.200 -0.247 -5.664 1.00 0.00 H new ATOM 760 N PRO A 49 9.345 -0.620 -3.230 1.00 0.00 N ATOM 761 CA PRO A 49 9.947 -1.679 -2.411 1.00 0.00 C ATOM 762 C PRO A 49 9.754 -3.084 -3.004 1.00 0.00 C ATOM 763 O PRO A 49 8.721 -3.368 -3.612 1.00 0.00 O ATOM 764 CB PRO A 49 9.269 -1.579 -1.040 1.00 0.00 C ATOM 765 CG PRO A 49 8.787 -0.132 -0.976 1.00 0.00 C ATOM 766 CD PRO A 49 8.422 0.169 -2.427 1.00 0.00 C ATOM 0 HA PRO A 49 11.027 -1.538 -2.357 1.00 0.00 H new ATOM 0 HB2 PRO A 49 8.440 -2.281 -0.952 1.00 0.00 H new ATOM 0 HB3 PRO A 49 9.965 -1.805 -0.232 1.00 0.00 H new ATOM 0 HG2 PRO A 49 7.930 -0.021 -0.312 1.00 0.00 H new ATOM 0 HG3 PRO A 49 9.565 0.537 -0.608 1.00 0.00 H new ATOM 0 HD2 PRO A 49 7.388 -0.103 -2.636 1.00 0.00 H new ATOM 0 HD3 PRO A 49 8.522 1.232 -2.645 1.00 0.00 H new ATOM 774 N VAL A 50 10.710 -3.993 -2.762 1.00 0.00 N ATOM 775 CA VAL A 50 10.779 -5.335 -3.374 1.00 0.00 C ATOM 776 C VAL A 50 9.482 -6.139 -3.191 1.00 0.00 C ATOM 777 O VAL A 50 8.915 -6.628 -4.166 1.00 0.00 O ATOM 778 CB VAL A 50 11.999 -6.128 -2.855 1.00 0.00 C ATOM 779 CG1 VAL A 50 12.115 -7.496 -3.545 1.00 0.00 C ATOM 780 CG2 VAL A 50 13.311 -5.368 -3.105 1.00 0.00 C ATOM 0 H VAL A 50 11.480 -3.813 -2.117 1.00 0.00 H new ATOM 0 HA VAL A 50 10.903 -5.178 -4.445 1.00 0.00 H new ATOM 0 HB VAL A 50 11.841 -6.261 -1.785 1.00 0.00 H new ATOM 0 HG11 VAL A 50 12.984 -8.027 -3.156 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.215 -8.080 -3.349 1.00 0.00 H new ATOM 0 HG13 VAL A 50 12.228 -7.353 -4.620 1.00 0.00 H new ATOM 0 HG21 VAL A 50 14.149 -5.954 -2.728 1.00 0.00 H new ATOM 0 HG22 VAL A 50 13.437 -5.202 -4.175 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.279 -4.408 -2.590 1.00 0.00 H new ATOM 790 N LEU A 51 8.972 -6.243 -1.960 1.00 0.00 N ATOM 791 CA LEU A 51 7.719 -6.953 -1.670 1.00 0.00 C ATOM 792 C LEU A 51 6.485 -6.294 -2.311 1.00 0.00 C ATOM 793 O LEU A 51 5.446 -6.937 -2.478 1.00 0.00 O ATOM 794 CB LEU A 51 7.529 -7.036 -0.145 1.00 0.00 C ATOM 795 CG LEU A 51 8.608 -7.842 0.607 1.00 0.00 C ATOM 796 CD1 LEU A 51 8.333 -7.775 2.111 1.00 0.00 C ATOM 797 CD2 LEU A 51 8.645 -9.314 0.184 1.00 0.00 C ATOM 0 H LEU A 51 9.415 -5.838 -1.135 1.00 0.00 H new ATOM 0 HA LEU A 51 7.803 -7.948 -2.107 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.507 -6.024 0.258 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.556 -7.482 0.060 1.00 0.00 H new ATOM 0 HG LEU A 51 9.572 -7.397 0.360 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.094 -8.344 2.646 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.359 -6.736 2.440 1.00 0.00 H new ATOM 0 HD13 LEU A 51 7.350 -8.197 2.320 1.00 0.00 H new ATOM 0 HD21 LEU A 51 9.422 -9.834 0.744 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.679 -9.776 0.389 1.00 0.00 H new ATOM 0 HD23 LEU A 51 8.860 -9.381 -0.882 1.00 0.00 H new ATOM 809 N ARG A 52 6.566 -5.004 -2.658 1.00 0.00 N ATOM 810 CA ARG A 52 5.463 -4.254 -3.258 1.00 0.00 C ATOM 811 C ARG A 52 5.522 -4.364 -4.778 1.00 0.00 C ATOM 812 O ARG A 52 4.499 -4.679 -5.388 1.00 0.00 O ATOM 813 CB ARG A 52 5.476 -2.807 -2.719 1.00 0.00 C ATOM 814 CG ARG A 52 4.054 -2.220 -2.661 1.00 0.00 C ATOM 815 CD ARG A 52 3.309 -2.574 -1.352 1.00 0.00 C ATOM 816 NE ARG A 52 3.550 -3.972 -0.931 1.00 0.00 N ATOM 817 CZ ARG A 52 2.693 -4.979 -0.876 1.00 0.00 C ATOM 818 NH1 ARG A 52 1.401 -4.822 -0.753 1.00 0.00 N ATOM 819 NH2 ARG A 52 3.115 -6.213 -0.990 1.00 0.00 N ATOM 0 H ARG A 52 7.411 -4.448 -2.527 1.00 0.00 H new ATOM 0 HA ARG A 52 4.500 -4.677 -2.973 1.00 0.00 H new ATOM 0 HB2 ARG A 52 5.919 -2.791 -1.723 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.103 -2.184 -3.357 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.110 -1.136 -2.760 1.00 0.00 H new ATOM 0 HG3 ARG A 52 3.479 -2.588 -3.511 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.629 -1.898 -0.560 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.239 -2.418 -1.491 1.00 0.00 H new ATOM 0 HE ARG A 52 4.505 -4.189 -0.645 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.005 -3.884 -0.694 1.00 0.00 H new ATOM 0 HH12 ARG A 52 0.789 -5.637 -0.716 1.00 0.00 H new ATOM 0 HH21 ARG A 52 4.109 -6.402 -1.122 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.450 -6.985 -0.947 1.00 0.00 H new ATOM 833 N LYS A 53 6.717 -4.228 -5.374 1.00 0.00 N ATOM 834 CA LYS A 53 6.930 -4.523 -6.793 1.00 0.00 C ATOM 835 C LYS A 53 6.540 -5.972 -7.075 1.00 0.00 C ATOM 836 O LYS A 53 5.705 -6.199 -7.946 1.00 0.00 O ATOM 837 CB LYS A 53 8.328 -4.080 -7.296 1.00 0.00 C ATOM 838 CG LYS A 53 9.562 -4.987 -7.147 1.00 0.00 C ATOM 839 CD LYS A 53 9.715 -6.057 -8.228 1.00 0.00 C ATOM 840 CE LYS A 53 10.928 -6.955 -7.979 1.00 0.00 C ATOM 841 NZ LYS A 53 10.975 -8.032 -8.991 1.00 0.00 N ATOM 0 H LYS A 53 7.556 -3.912 -4.887 1.00 0.00 H new ATOM 0 HA LYS A 53 6.266 -3.910 -7.402 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.226 -3.856 -8.358 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.562 -3.142 -6.794 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.455 -4.362 -7.147 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.517 -5.478 -6.175 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.813 -6.668 -8.263 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.813 -5.577 -9.202 1.00 0.00 H new ATOM 0 HE2 LYS A 53 11.843 -6.364 -8.022 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.873 -7.386 -6.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.952 -8.375 -9.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.361 -8.816 -8.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 10.645 -7.663 -9.906 1.00 0.00 H new ATOM 855 N SER A 54 7.043 -6.935 -6.289 1.00 0.00 N ATOM 856 CA SER A 54 6.744 -8.344 -6.534 1.00 0.00 C ATOM 857 C SER A 54 5.315 -8.784 -6.182 1.00 0.00 C ATOM 858 O SER A 54 4.848 -9.743 -6.789 1.00 0.00 O ATOM 859 CB SER A 54 7.811 -9.283 -5.970 1.00 0.00 C ATOM 860 OG SER A 54 8.988 -9.173 -6.757 1.00 0.00 O ATOM 0 H SER A 54 7.651 -6.762 -5.489 1.00 0.00 H new ATOM 0 HA SER A 54 6.784 -8.435 -7.620 1.00 0.00 H new ATOM 0 HB2 SER A 54 8.027 -9.027 -4.933 1.00 0.00 H new ATOM 0 HB3 SER A 54 7.449 -10.311 -5.976 1.00 0.00 H new ATOM 0 HG SER A 54 8.880 -9.692 -7.581 1.00 0.00 H new ATOM 866 N GLU A 55 4.556 -8.086 -5.318 1.00 0.00 N ATOM 867 CA GLU A 55 3.098 -8.313 -5.276 1.00 0.00 C ATOM 868 C GLU A 55 2.396 -7.871 -6.584 1.00 0.00 C ATOM 869 O GLU A 55 1.554 -8.600 -7.105 1.00 0.00 O ATOM 870 CB GLU A 55 2.482 -7.627 -4.048 1.00 0.00 C ATOM 871 CG GLU A 55 1.091 -8.189 -3.715 1.00 0.00 C ATOM 872 CD GLU A 55 0.346 -7.313 -2.705 1.00 0.00 C ATOM 873 OE1 GLU A 55 0.755 -7.287 -1.519 1.00 0.00 O ATOM 874 OE2 GLU A 55 -0.601 -6.591 -3.118 1.00 0.00 O ATOM 0 H GLU A 55 4.908 -7.387 -4.664 1.00 0.00 H new ATOM 0 HA GLU A 55 2.936 -9.387 -5.187 1.00 0.00 H new ATOM 0 HB2 GLU A 55 3.141 -7.758 -3.190 1.00 0.00 H new ATOM 0 HB3 GLU A 55 2.406 -6.555 -4.231 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.503 -8.268 -4.630 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.194 -9.197 -3.314 1.00 0.00 H new ATOM 881 N LEU A 56 2.759 -6.718 -7.164 1.00 0.00 N ATOM 882 CA LEU A 56 2.224 -6.296 -8.477 1.00 0.00 C ATOM 883 C LEU A 56 2.604 -7.240 -9.614 1.00 0.00 C ATOM 884 O LEU A 56 1.788 -7.601 -10.460 1.00 0.00 O ATOM 885 CB LEU A 56 2.648 -4.862 -8.774 1.00 0.00 C ATOM 886 CG LEU A 56 2.050 -3.863 -7.774 1.00 0.00 C ATOM 887 CD1 LEU A 56 2.040 -2.506 -8.436 1.00 0.00 C ATOM 888 CD2 LEU A 56 0.606 -4.183 -7.394 1.00 0.00 C ATOM 0 H LEU A 56 3.419 -6.059 -6.750 1.00 0.00 H new ATOM 0 HA LEU A 56 1.137 -6.341 -8.413 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.736 -4.793 -8.748 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.336 -4.594 -9.783 1.00 0.00 H new ATOM 0 HG LEU A 56 2.656 -3.904 -6.869 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.620 -1.770 -7.751 1.00 0.00 H new ATOM 0 HD12 LEU A 56 3.059 -2.220 -8.695 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.434 -2.547 -9.341 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.243 -3.439 -6.685 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.018 -4.167 -8.288 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.560 -5.172 -6.938 1.00 0.00 H new ATOM 900 N GLU A 57 3.855 -7.664 -9.570 1.00 0.00 N ATOM 901 CA GLU A 57 4.467 -8.696 -10.411 1.00 0.00 C ATOM 902 C GLU A 57 3.706 -10.026 -10.304 1.00 0.00 C ATOM 903 O GLU A 57 3.430 -10.643 -11.330 1.00 0.00 O ATOM 904 CB GLU A 57 5.913 -8.841 -9.942 1.00 0.00 C ATOM 905 CG GLU A 57 6.991 -9.354 -10.884 1.00 0.00 C ATOM 906 CD GLU A 57 8.329 -8.932 -10.257 1.00 0.00 C ATOM 907 OE1 GLU A 57 8.697 -9.437 -9.161 1.00 0.00 O ATOM 908 OE2 GLU A 57 8.942 -7.960 -10.770 1.00 0.00 O ATOM 0 H GLU A 57 4.521 -7.274 -8.903 1.00 0.00 H new ATOM 0 HA GLU A 57 4.430 -8.412 -11.463 1.00 0.00 H new ATOM 0 HB2 GLU A 57 6.235 -7.861 -9.591 1.00 0.00 H new ATOM 0 HB3 GLU A 57 5.904 -9.503 -9.076 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.934 -10.437 -10.991 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.874 -8.928 -11.881 1.00 0.00 H new ATOM 915 N TYR A 58 3.308 -10.441 -9.090 1.00 0.00 N ATOM 916 CA TYR A 58 2.410 -11.574 -8.855 1.00 0.00 C ATOM 917 C TYR A 58 1.066 -11.381 -9.571 1.00 0.00 C ATOM 918 O TYR A 58 0.631 -12.264 -10.307 1.00 0.00 O ATOM 919 CB TYR A 58 2.223 -11.809 -7.348 1.00 0.00 C ATOM 920 CG TYR A 58 1.475 -13.083 -7.015 1.00 0.00 C ATOM 921 CD1 TYR A 58 0.067 -13.114 -7.053 1.00 0.00 C ATOM 922 CD2 TYR A 58 2.197 -14.240 -6.675 1.00 0.00 C ATOM 923 CE1 TYR A 58 -0.619 -14.311 -6.775 1.00 0.00 C ATOM 924 CE2 TYR A 58 1.516 -15.442 -6.398 1.00 0.00 C ATOM 925 CZ TYR A 58 0.104 -15.478 -6.451 1.00 0.00 C ATOM 926 OH TYR A 58 -0.565 -16.635 -6.196 1.00 0.00 O ATOM 0 H TYR A 58 3.610 -9.986 -8.229 1.00 0.00 H new ATOM 0 HA TYR A 58 2.870 -12.467 -9.278 1.00 0.00 H new ATOM 0 HB2 TYR A 58 3.202 -11.839 -6.870 1.00 0.00 H new ATOM 0 HB3 TYR A 58 1.686 -10.962 -6.922 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -0.486 -12.219 -7.296 1.00 0.00 H new ATOM 0 HD2 TYR A 58 3.275 -14.208 -6.626 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -1.698 -14.336 -6.810 1.00 0.00 H new ATOM 0 HE2 TYR A 58 2.071 -16.333 -6.146 1.00 0.00 H new ATOM 0 HH TYR A 58 0.077 -17.346 -5.990 1.00 0.00 H new ATOM 936 N TYR A 59 0.400 -10.230 -9.392 1.00 0.00 N ATOM 937 CA TYR A 59 -0.871 -9.984 -10.081 1.00 0.00 C ATOM 938 C TYR A 59 -0.730 -9.937 -11.611 1.00 0.00 C ATOM 939 O TYR A 59 -1.622 -10.423 -12.302 1.00 0.00 O ATOM 940 CB TYR A 59 -1.553 -8.714 -9.572 1.00 0.00 C ATOM 941 CG TYR A 59 -1.746 -8.603 -8.074 1.00 0.00 C ATOM 942 CD1 TYR A 59 -2.328 -9.653 -7.334 1.00 0.00 C ATOM 943 CD2 TYR A 59 -1.365 -7.417 -7.426 1.00 0.00 C ATOM 944 CE1 TYR A 59 -2.521 -9.511 -5.945 1.00 0.00 C ATOM 945 CE2 TYR A 59 -1.537 -7.279 -6.041 1.00 0.00 C ATOM 946 CZ TYR A 59 -2.134 -8.316 -5.297 1.00 0.00 C ATOM 947 OH TYR A 59 -2.367 -8.131 -3.969 1.00 0.00 O ATOM 0 H TYR A 59 0.714 -9.470 -8.788 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.503 -10.840 -9.843 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -0.968 -7.856 -9.905 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -2.530 -8.638 -10.048 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -2.625 -10.565 -7.831 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -0.937 -6.607 -7.997 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -2.964 -10.315 -5.376 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -1.212 -6.377 -5.544 1.00 0.00 H new ATOM 0 HH TYR A 59 -1.948 -7.295 -3.677 1.00 0.00 H new ATOM 957 N ALA A 60 0.380 -9.419 -12.156 1.00 0.00 N ATOM 958 CA ALA A 60 0.722 -9.580 -13.570 1.00 0.00 C ATOM 959 C ALA A 60 0.957 -11.056 -13.977 1.00 0.00 C ATOM 960 O ALA A 60 0.482 -11.491 -15.026 1.00 0.00 O ATOM 961 CB ALA A 60 1.942 -8.723 -13.893 1.00 0.00 C ATOM 0 H ALA A 60 1.063 -8.878 -11.626 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.134 -9.245 -14.156 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.200 -8.840 -14.945 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.716 -7.676 -13.689 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.783 -9.040 -13.276 1.00 0.00 H new ATOM 967 N MET A 61 1.679 -11.826 -13.147 1.00 0.00 N ATOM 968 CA MET A 61 1.971 -13.259 -13.318 1.00 0.00 C ATOM 969 C MET A 61 0.708 -14.133 -13.363 1.00 0.00 C ATOM 970 O MET A 61 0.738 -15.188 -13.996 1.00 0.00 O ATOM 971 CB MET A 61 2.973 -13.695 -12.229 1.00 0.00 C ATOM 972 CG MET A 61 3.352 -15.184 -12.169 1.00 0.00 C ATOM 973 SD MET A 61 2.159 -16.360 -11.447 1.00 0.00 S ATOM 974 CE MET A 61 1.745 -15.590 -9.860 1.00 0.00 C ATOM 0 H MET A 61 2.096 -11.448 -12.296 1.00 0.00 H new ATOM 0 HA MET A 61 2.428 -13.409 -14.296 1.00 0.00 H new ATOM 0 HB2 MET A 61 3.889 -13.120 -12.365 1.00 0.00 H new ATOM 0 HB3 MET A 61 2.561 -13.413 -11.260 1.00 0.00 H new ATOM 0 HG2 MET A 61 3.566 -15.512 -13.186 1.00 0.00 H new ATOM 0 HG3 MET A 61 4.281 -15.267 -11.605 1.00 0.00 H new ATOM 0 HE1 MET A 61 1.296 -16.333 -9.201 1.00 0.00 H new ATOM 0 HE2 MET A 61 2.651 -15.197 -9.399 1.00 0.00 H new ATOM 0 HE3 MET A 61 1.038 -14.776 -10.024 1.00 0.00 H new ATOM 984 N LEU A 62 -0.426 -13.675 -12.810 1.00 0.00 N ATOM 985 CA LEU A 62 -1.761 -14.175 -13.175 1.00 0.00 C ATOM 986 C LEU A 62 -2.042 -13.852 -14.661 1.00 0.00 C ATOM 987 O LEU A 62 -2.670 -12.854 -15.015 1.00 0.00 O ATOM 988 CB LEU A 62 -2.848 -13.598 -12.261 1.00 0.00 C ATOM 989 CG LEU A 62 -2.600 -13.712 -10.745 1.00 0.00 C ATOM 990 CD1 LEU A 62 -3.717 -13.002 -9.976 1.00 0.00 C ATOM 991 CD2 LEU A 62 -2.524 -15.170 -10.280 1.00 0.00 C ATOM 0 H LEU A 62 -0.443 -12.947 -12.096 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.780 -15.256 -13.039 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -2.978 -12.544 -12.508 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.789 -14.098 -12.492 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.639 -13.239 -10.541 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.533 -13.088 -8.905 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.740 -11.949 -10.257 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.675 -13.463 -10.218 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -2.348 -15.200 -9.205 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.463 -15.674 -10.508 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.707 -15.674 -10.796 1.00 0.00 H new ATOM 1003 N SER A 63 -1.511 -14.736 -15.503 1.00 0.00 N ATOM 1004 CA SER A 63 -0.779 -14.542 -16.773 1.00 0.00 C ATOM 1005 C SER A 63 -1.479 -13.850 -17.956 1.00 0.00 C ATOM 1006 O SER A 63 -1.080 -14.041 -19.105 1.00 0.00 O ATOM 1007 CB SER A 63 -0.198 -15.897 -17.214 1.00 0.00 C ATOM 1008 OG SER A 63 -1.191 -16.703 -17.816 1.00 0.00 O ATOM 0 H SER A 63 -1.588 -15.731 -15.293 1.00 0.00 H new ATOM 0 HA SER A 63 -0.024 -13.800 -16.514 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.619 -15.735 -17.917 1.00 0.00 H new ATOM 0 HB3 SER A 63 0.222 -16.415 -16.351 1.00 0.00 H new ATOM 0 HG SER A 63 -0.797 -17.558 -18.089 1.00 0.00 H new ATOM 1014 N LYS A 64 -2.501 -13.031 -17.708 1.00 0.00 N ATOM 1015 CA LYS A 64 -3.129 -12.125 -18.675 1.00 0.00 C ATOM 1016 C LYS A 64 -2.178 -11.010 -19.146 1.00 0.00 C ATOM 1017 O LYS A 64 -2.432 -10.358 -20.158 1.00 0.00 O ATOM 1018 CB LYS A 64 -4.337 -11.456 -17.994 1.00 0.00 C ATOM 1019 CG LYS A 64 -5.424 -12.397 -17.448 1.00 0.00 C ATOM 1020 CD LYS A 64 -6.328 -11.628 -16.471 1.00 0.00 C ATOM 1021 CE LYS A 64 -5.656 -11.459 -15.096 1.00 0.00 C ATOM 1022 NZ LYS A 64 -5.950 -10.137 -14.503 1.00 0.00 N ATOM 0 H LYS A 64 -2.935 -12.977 -16.786 1.00 0.00 H new ATOM 0 HA LYS A 64 -3.415 -12.716 -19.545 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -3.969 -10.845 -17.170 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -4.801 -10.778 -18.711 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -6.018 -12.799 -18.269 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -4.964 -13.246 -16.942 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -6.563 -10.648 -16.886 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -7.273 -12.159 -16.353 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -6.001 -12.244 -14.423 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.578 -11.579 -15.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -5.901 -10.203 -13.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.252 -9.443 -14.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -6.904 -9.834 -14.786 1.00 0.00 H new ATOM 1036 N THR A 65 -1.112 -10.728 -18.390 1.00 0.00 N ATOM 1037 CA THR A 65 -0.537 -9.383 -18.252 1.00 0.00 C ATOM 1038 C THR A 65 0.996 -9.370 -18.390 1.00 0.00 C ATOM 1039 O THR A 65 1.648 -10.390 -18.179 1.00 0.00 O ATOM 1040 CB THR A 65 -0.957 -8.860 -16.867 1.00 0.00 C ATOM 1041 OG1 THR A 65 -2.357 -8.916 -16.666 1.00 0.00 O ATOM 1042 CG2 THR A 65 -0.572 -7.417 -16.583 1.00 0.00 C ATOM 0 H THR A 65 -0.616 -11.436 -17.849 1.00 0.00 H new ATOM 0 HA THR A 65 -0.909 -8.747 -19.055 1.00 0.00 H new ATOM 0 HB THR A 65 -0.415 -9.528 -16.198 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.810 -8.977 -17.533 1.00 0.00 H new ATOM 0 HG21 THR A 65 -0.910 -7.140 -15.584 1.00 0.00 H new ATOM 0 HG22 THR A 65 0.511 -7.311 -16.642 1.00 0.00 H new ATOM 0 HG23 THR A 65 -1.041 -6.764 -17.319 1.00 0.00 H new ATOM 1050 N LYS A 66 1.582 -8.197 -18.688 1.00 0.00 N ATOM 1051 CA LYS A 66 3.034 -7.949 -18.636 1.00 0.00 C ATOM 1052 C LYS A 66 3.366 -6.720 -17.768 1.00 0.00 C ATOM 1053 O LYS A 66 2.487 -5.907 -17.481 1.00 0.00 O ATOM 1054 CB LYS A 66 3.567 -7.804 -20.077 1.00 0.00 C ATOM 1055 CG LYS A 66 5.051 -8.189 -20.240 1.00 0.00 C ATOM 1056 CD LYS A 66 5.330 -9.699 -20.086 1.00 0.00 C ATOM 1057 CE LYS A 66 4.519 -10.588 -21.041 1.00 0.00 C ATOM 1058 NZ LYS A 66 4.840 -10.315 -22.458 1.00 0.00 N ATOM 0 H LYS A 66 1.048 -7.378 -18.978 1.00 0.00 H new ATOM 0 HA LYS A 66 3.530 -8.795 -18.161 1.00 0.00 H new ATOM 0 HB2 LYS A 66 2.966 -8.427 -20.740 1.00 0.00 H new ATOM 0 HB3 LYS A 66 3.433 -6.772 -20.401 1.00 0.00 H new ATOM 0 HG2 LYS A 66 5.393 -7.865 -21.223 1.00 0.00 H new ATOM 0 HG3 LYS A 66 5.640 -7.644 -19.502 1.00 0.00 H new ATOM 0 HD2 LYS A 66 6.392 -9.880 -20.252 1.00 0.00 H new ATOM 0 HD3 LYS A 66 5.113 -9.995 -19.060 1.00 0.00 H new ATOM 0 HE2 LYS A 66 4.720 -11.636 -20.819 1.00 0.00 H new ATOM 0 HE3 LYS A 66 3.455 -10.425 -20.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 4.247 -10.912 -23.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 4.657 -9.313 -22.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 5.843 -10.528 -22.634 1.00 0.00 H new ATOM 1072 N VAL A 67 4.633 -6.578 -17.363 1.00 0.00 N ATOM 1073 CA VAL A 67 5.126 -5.566 -16.413 1.00 0.00 C ATOM 1074 C VAL A 67 6.139 -4.635 -17.080 1.00 0.00 C ATOM 1075 O VAL A 67 7.030 -5.096 -17.791 1.00 0.00 O ATOM 1076 CB VAL A 67 5.794 -6.248 -15.198 1.00 0.00 C ATOM 1077 CG1 VAL A 67 6.163 -5.237 -14.104 1.00 0.00 C ATOM 1078 CG2 VAL A 67 4.896 -7.318 -14.570 1.00 0.00 C ATOM 0 H VAL A 67 5.377 -7.189 -17.701 1.00 0.00 H new ATOM 0 HA VAL A 67 4.269 -4.980 -16.081 1.00 0.00 H new ATOM 0 HB VAL A 67 6.698 -6.715 -15.589 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.630 -5.759 -13.269 1.00 0.00 H new ATOM 0 HG12 VAL A 67 6.860 -4.502 -14.508 1.00 0.00 H new ATOM 0 HG13 VAL A 67 5.262 -4.731 -13.758 1.00 0.00 H new ATOM 0 HG21 VAL A 67 5.408 -7.769 -13.720 1.00 0.00 H new ATOM 0 HG22 VAL A 67 3.966 -6.860 -14.232 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.674 -8.087 -15.310 1.00 0.00 H new ATOM 1088 N TYR A 68 6.037 -3.331 -16.799 1.00 0.00 N ATOM 1089 CA TYR A 68 6.960 -2.302 -17.265 1.00 0.00 C ATOM 1090 C TYR A 68 7.388 -1.377 -16.107 1.00 0.00 C ATOM 1091 O TYR A 68 6.650 -0.483 -15.680 1.00 0.00 O ATOM 1092 CB TYR A 68 6.304 -1.574 -18.444 1.00 0.00 C ATOM 1093 CG TYR A 68 7.214 -0.604 -19.170 1.00 0.00 C ATOM 1094 CD1 TYR A 68 7.272 0.735 -18.750 1.00 0.00 C ATOM 1095 CD2 TYR A 68 7.996 -1.035 -20.262 1.00 0.00 C ATOM 1096 CE1 TYR A 68 8.136 1.634 -19.398 1.00 0.00 C ATOM 1097 CE2 TYR A 68 8.842 -0.129 -20.933 1.00 0.00 C ATOM 1098 CZ TYR A 68 8.922 1.212 -20.492 1.00 0.00 C ATOM 1099 OH TYR A 68 9.744 2.118 -21.091 1.00 0.00 O ATOM 0 H TYR A 68 5.284 -2.956 -16.222 1.00 0.00 H new ATOM 0 HA TYR A 68 7.891 -2.741 -17.623 1.00 0.00 H new ATOM 0 HB2 TYR A 68 5.942 -2.316 -19.156 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.432 -1.031 -18.079 1.00 0.00 H new ATOM 0 HD1 TYR A 68 6.654 1.073 -17.931 1.00 0.00 H new ATOM 0 HD2 TYR A 68 7.946 -2.064 -20.586 1.00 0.00 H new ATOM 0 HE1 TYR A 68 8.199 2.657 -19.056 1.00 0.00 H new ATOM 0 HE2 TYR A 68 9.426 -0.458 -21.780 1.00 0.00 H new ATOM 0 HH TYR A 68 10.534 1.659 -21.445 1.00 0.00 H new ATOM 1109 N TYR A 69 8.593 -1.625 -15.579 1.00 0.00 N ATOM 1110 CA TYR A 69 9.239 -0.837 -14.526 1.00 0.00 C ATOM 1111 C TYR A 69 9.863 0.440 -15.105 1.00 0.00 C ATOM 1112 O TYR A 69 10.777 0.365 -15.924 1.00 0.00 O ATOM 1113 CB TYR A 69 10.310 -1.692 -13.824 1.00 0.00 C ATOM 1114 CG TYR A 69 9.729 -2.796 -12.960 1.00 0.00 C ATOM 1115 CD1 TYR A 69 8.945 -2.439 -11.849 1.00 0.00 C ATOM 1116 CD2 TYR A 69 9.938 -4.158 -13.265 1.00 0.00 C ATOM 1117 CE1 TYR A 69 8.312 -3.431 -11.087 1.00 0.00 C ATOM 1118 CE2 TYR A 69 9.329 -5.155 -12.474 1.00 0.00 C ATOM 1119 CZ TYR A 69 8.486 -4.795 -11.407 1.00 0.00 C ATOM 1120 OH TYR A 69 7.851 -5.760 -10.694 1.00 0.00 O ATOM 0 H TYR A 69 9.166 -2.411 -15.887 1.00 0.00 H new ATOM 0 HA TYR A 69 8.485 -0.540 -13.797 1.00 0.00 H new ATOM 0 HB2 TYR A 69 10.962 -2.135 -14.577 1.00 0.00 H new ATOM 0 HB3 TYR A 69 10.932 -1.046 -13.205 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.830 -1.399 -11.582 1.00 0.00 H new ATOM 0 HD2 TYR A 69 10.562 -4.436 -14.101 1.00 0.00 H new ATOM 0 HE1 TYR A 69 7.688 -3.150 -10.251 1.00 0.00 H new ATOM 0 HE2 TYR A 69 9.511 -6.198 -12.688 1.00 0.00 H new ATOM 0 HH TYR A 69 8.169 -6.641 -10.981 1.00 0.00 H new ATOM 1130 N PHE A 70 9.368 1.611 -14.693 1.00 0.00 N ATOM 1131 CA PHE A 70 9.606 2.902 -15.352 1.00 0.00 C ATOM 1132 C PHE A 70 10.087 3.961 -14.347 1.00 0.00 C ATOM 1133 O PHE A 70 9.387 4.927 -14.058 1.00 0.00 O ATOM 1134 CB PHE A 70 8.301 3.266 -16.093 1.00 0.00 C ATOM 1135 CG PHE A 70 8.186 4.606 -16.817 1.00 0.00 C ATOM 1136 CD1 PHE A 70 9.308 5.419 -17.084 1.00 0.00 C ATOM 1137 CD2 PHE A 70 6.910 5.045 -17.228 1.00 0.00 C ATOM 1138 CE1 PHE A 70 9.148 6.666 -17.714 1.00 0.00 C ATOM 1139 CE2 PHE A 70 6.755 6.278 -17.888 1.00 0.00 C ATOM 1140 CZ PHE A 70 7.873 7.095 -18.118 1.00 0.00 C ATOM 0 H PHE A 70 8.773 1.691 -13.868 1.00 0.00 H new ATOM 0 HA PHE A 70 10.416 2.849 -16.079 1.00 0.00 H new ATOM 0 HB2 PHE A 70 8.115 2.483 -16.828 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.491 3.219 -15.366 1.00 0.00 H new ATOM 0 HD1 PHE A 70 10.295 5.082 -16.803 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.044 4.429 -17.034 1.00 0.00 H new ATOM 0 HE1 PHE A 70 10.008 7.296 -17.888 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.777 6.595 -18.217 1.00 0.00 H new ATOM 0 HZ PHE A 70 7.753 8.052 -18.605 1.00 0.00 H new ATOM 1150 N GLN A 71 11.307 3.821 -13.810 1.00 0.00 N ATOM 1151 CA GLN A 71 11.800 4.696 -12.735 1.00 0.00 C ATOM 1152 C GLN A 71 11.820 6.201 -13.080 1.00 0.00 C ATOM 1153 O GLN A 71 11.610 7.017 -12.183 1.00 0.00 O ATOM 1154 CB GLN A 71 13.159 4.223 -12.189 1.00 0.00 C ATOM 1155 CG GLN A 71 14.278 4.025 -13.227 1.00 0.00 C ATOM 1156 CD GLN A 71 14.326 2.589 -13.748 1.00 0.00 C ATOM 1157 OE1 GLN A 71 13.484 2.159 -14.526 1.00 0.00 O ATOM 1158 NE2 GLN A 71 15.297 1.799 -13.335 1.00 0.00 N ATOM 0 H GLN A 71 11.974 3.107 -14.104 1.00 0.00 H new ATOM 0 HA GLN A 71 11.058 4.600 -11.942 1.00 0.00 H new ATOM 0 HB2 GLN A 71 13.502 4.947 -11.450 1.00 0.00 H new ATOM 0 HB3 GLN A 71 13.008 3.280 -11.665 1.00 0.00 H new ATOM 0 HG2 GLN A 71 14.124 4.709 -14.062 1.00 0.00 H new ATOM 0 HG3 GLN A 71 15.238 4.281 -12.779 1.00 0.00 H new ATOM 0 HE21 GLN A 71 16.001 2.152 -12.687 1.00 0.00 H new ATOM 0 HE22 GLN A 71 15.344 0.835 -13.664 1.00 0.00 H new ATOM 1167 N GLY A 72 11.971 6.592 -14.353 1.00 0.00 N ATOM 1168 CA GLY A 72 11.857 8.002 -14.764 1.00 0.00 C ATOM 1169 C GLY A 72 10.434 8.575 -14.659 1.00 0.00 C ATOM 1170 O GLY A 72 10.248 9.790 -14.587 1.00 0.00 O ATOM 0 H GLY A 72 12.173 5.950 -15.120 1.00 0.00 H new ATOM 0 HA2 GLY A 72 12.525 8.604 -14.148 1.00 0.00 H new ATOM 0 HA3 GLY A 72 12.200 8.098 -15.794 1.00 0.00 H new ATOM 1174 N GLY A 73 9.415 7.712 -14.592 1.00 0.00 N ATOM 1175 CA GLY A 73 8.021 8.128 -14.528 1.00 0.00 C ATOM 1176 C GLY A 73 7.569 8.588 -13.135 1.00 0.00 C ATOM 1177 O GLY A 73 6.458 9.102 -13.035 1.00 0.00 O ATOM 0 H GLY A 73 9.541 6.700 -14.581 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.862 8.941 -15.237 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.390 7.299 -14.848 1.00 0.00 H new ATOM 1181 N ASN A 74 8.444 8.520 -12.112 1.00 0.00 N ATOM 1182 CA ASN A 74 8.271 9.144 -10.783 1.00 0.00 C ATOM 1183 C ASN A 74 7.944 10.655 -10.859 1.00 0.00 C ATOM 1184 O ASN A 74 7.439 11.239 -9.897 1.00 0.00 O ATOM 1185 CB ASN A 74 9.546 8.936 -9.935 1.00 0.00 C ATOM 1186 CG ASN A 74 9.634 7.588 -9.230 1.00 0.00 C ATOM 1187 OD1 ASN A 74 9.157 7.404 -8.121 1.00 0.00 O ATOM 1188 ND2 ASN A 74 10.316 6.623 -9.813 1.00 0.00 N ATOM 0 H ASN A 74 9.324 8.010 -12.191 1.00 0.00 H new ATOM 0 HA ASN A 74 7.417 8.654 -10.316 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.417 9.050 -10.581 1.00 0.00 H new ATOM 0 HB3 ASN A 74 9.599 9.726 -9.186 1.00 0.00 H new ATOM 0 HD21 ASN A 74 10.443 5.729 -9.338 1.00 0.00 H new ATOM 0 HD22 ASN A 74 10.717 6.770 -10.739 1.00 0.00 H new ATOM 1195 N ASN A 75 8.200 11.292 -12.007 1.00 0.00 N ATOM 1196 CA ASN A 75 7.619 12.585 -12.360 1.00 0.00 C ATOM 1197 C ASN A 75 6.940 12.594 -13.736 1.00 0.00 C ATOM 1198 O ASN A 75 5.961 13.325 -13.918 1.00 0.00 O ATOM 1199 CB ASN A 75 8.707 13.662 -12.274 1.00 0.00 C ATOM 1200 CG ASN A 75 8.086 15.045 -12.240 1.00 0.00 C ATOM 1201 OD1 ASN A 75 7.411 15.399 -11.282 1.00 0.00 O ATOM 1202 ND2 ASN A 75 8.251 15.846 -13.272 1.00 0.00 N ATOM 0 H ASN A 75 8.823 10.917 -12.722 1.00 0.00 H new ATOM 0 HA ASN A 75 6.825 12.796 -11.644 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.311 13.506 -11.380 1.00 0.00 H new ATOM 0 HB3 ASN A 75 9.377 13.579 -13.130 1.00 0.00 H new ATOM 0 HD21 ASN A 75 7.815 16.768 -13.277 1.00 0.00 H new ATOM 0 HD22 ASN A 75 8.815 15.544 -14.067 1.00 0.00 H new ATOM 1209 N GLU A 76 7.439 11.811 -14.703 1.00 0.00 N ATOM 1210 CA GLU A 76 6.980 11.906 -16.088 1.00 0.00 C ATOM 1211 C GLU A 76 5.827 10.982 -16.469 1.00 0.00 C ATOM 1212 O GLU A 76 5.122 11.323 -17.415 1.00 0.00 O ATOM 1213 CB GLU A 76 8.162 11.815 -17.069 1.00 0.00 C ATOM 1214 CG GLU A 76 9.120 13.018 -16.940 1.00 0.00 C ATOM 1215 CD GLU A 76 8.357 14.351 -16.868 1.00 0.00 C ATOM 1216 OE1 GLU A 76 7.472 14.586 -17.727 1.00 0.00 O ATOM 1217 OE2 GLU A 76 8.496 15.058 -15.838 1.00 0.00 O ATOM 0 H GLU A 76 8.160 11.106 -14.547 1.00 0.00 H new ATOM 0 HA GLU A 76 6.536 12.898 -16.170 1.00 0.00 H new ATOM 0 HB2 GLU A 76 8.713 10.892 -16.887 1.00 0.00 H new ATOM 0 HB3 GLU A 76 7.782 11.763 -18.089 1.00 0.00 H new ATOM 0 HG2 GLU A 76 9.732 12.901 -16.046 1.00 0.00 H new ATOM 0 HG3 GLU A 76 9.800 13.034 -17.792 1.00 0.00 H new ATOM 1224 N LEU A 77 5.489 9.944 -15.693 1.00 0.00 N ATOM 1225 CA LEU A 77 4.164 9.334 -15.854 1.00 0.00 C ATOM 1226 C LEU A 77 3.070 10.318 -15.411 1.00 0.00 C ATOM 1227 O LEU A 77 1.969 10.308 -15.955 1.00 0.00 O ATOM 1228 CB LEU A 77 4.091 7.987 -15.130 1.00 0.00 C ATOM 1229 CG LEU A 77 2.878 7.137 -15.559 1.00 0.00 C ATOM 1230 CD1 LEU A 77 2.969 6.602 -16.991 1.00 0.00 C ATOM 1231 CD2 LEU A 77 2.799 5.937 -14.630 1.00 0.00 C ATOM 0 H LEU A 77 6.084 9.524 -14.979 1.00 0.00 H new ATOM 0 HA LEU A 77 3.990 9.121 -16.909 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.006 7.427 -15.323 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.044 8.161 -14.055 1.00 0.00 H new ATOM 0 HG LEU A 77 2.003 7.785 -15.509 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.079 6.015 -17.217 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.039 7.437 -17.688 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.854 5.973 -17.089 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.948 5.316 -14.910 1.00 0.00 H new ATOM 0 HD22 LEU A 77 3.716 5.354 -14.710 1.00 0.00 H new ATOM 0 HD23 LEU A 77 2.676 6.280 -13.603 1.00 0.00 H new ATOM 1243 N GLY A 78 3.408 11.277 -14.541 1.00 0.00 N ATOM 1244 CA GLY A 78 2.598 12.459 -14.276 1.00 0.00 C ATOM 1245 C GLY A 78 2.386 13.372 -15.496 1.00 0.00 C ATOM 1246 O GLY A 78 1.458 14.175 -15.485 1.00 0.00 O ATOM 0 H GLY A 78 4.269 11.247 -13.995 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.625 12.141 -13.902 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.071 13.038 -13.482 1.00 0.00 H new ATOM 1250 N THR A 79 3.185 13.245 -16.566 1.00 0.00 N ATOM 1251 CA THR A 79 2.919 13.896 -17.862 1.00 0.00 C ATOM 1252 C THR A 79 1.875 13.114 -18.681 1.00 0.00 C ATOM 1253 O THR A 79 1.247 13.695 -19.562 1.00 0.00 O ATOM 1254 CB THR A 79 4.242 14.130 -18.633 1.00 0.00 C ATOM 1255 OG1 THR A 79 5.068 14.919 -17.802 1.00 0.00 O ATOM 1256 CG2 THR A 79 4.087 14.905 -19.942 1.00 0.00 C ATOM 0 H THR A 79 4.038 12.686 -16.559 1.00 0.00 H new ATOM 0 HA THR A 79 2.481 14.877 -17.677 1.00 0.00 H new ATOM 0 HB THR A 79 4.641 13.146 -18.880 1.00 0.00 H new ATOM 0 HG1 THR A 79 6.005 14.799 -18.063 1.00 0.00 H new ATOM 0 HG21 THR A 79 5.063 15.022 -20.413 1.00 0.00 H new ATOM 0 HG22 THR A 79 3.423 14.358 -20.612 1.00 0.00 H new ATOM 0 HG23 THR A 79 3.664 15.888 -19.735 1.00 0.00 H new ATOM 1264 N ALA A 80 1.621 11.835 -18.358 1.00 0.00 N ATOM 1265 CA ALA A 80 0.513 11.043 -18.895 1.00 0.00 C ATOM 1266 C ALA A 80 -0.767 11.124 -18.038 1.00 0.00 C ATOM 1267 O ALA A 80 -1.848 11.289 -18.597 1.00 0.00 O ATOM 1268 CB ALA A 80 0.976 9.590 -19.080 1.00 0.00 C ATOM 0 H ALA A 80 2.199 11.314 -17.698 1.00 0.00 H new ATOM 0 HA ALA A 80 0.238 11.467 -19.861 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.155 8.995 -19.480 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.816 9.561 -19.774 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.286 9.181 -18.118 1.00 0.00 H new ATOM 1274 N VAL A 81 -0.663 10.993 -16.701 1.00 0.00 N ATOM 1275 CA VAL A 81 -1.813 10.830 -15.787 1.00 0.00 C ATOM 1276 C VAL A 81 -1.934 11.914 -14.699 1.00 0.00 C ATOM 1277 O VAL A 81 -2.805 11.813 -13.838 1.00 0.00 O ATOM 1278 CB VAL A 81 -1.859 9.403 -15.191 1.00 0.00 C ATOM 1279 CG1 VAL A 81 -1.786 8.340 -16.298 1.00 0.00 C ATOM 1280 CG2 VAL A 81 -0.755 9.117 -14.165 1.00 0.00 C ATOM 0 H VAL A 81 0.235 10.997 -16.218 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.696 10.973 -16.410 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.814 9.350 -14.668 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.820 7.346 -15.851 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.631 8.462 -16.976 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -0.855 8.456 -16.853 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.857 8.097 -13.795 1.00 0.00 H new ATOM 0 HG22 VAL A 81 0.220 9.236 -14.637 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -0.842 9.815 -13.332 1.00 0.00 H new ATOM 1290 N GLY A 82 -1.095 12.959 -14.736 1.00 0.00 N ATOM 1291 CA GLY A 82 -1.158 14.122 -13.842 1.00 0.00 C ATOM 1292 C GLY A 82 -0.073 14.105 -12.760 1.00 0.00 C ATOM 1293 O GLY A 82 -0.059 13.213 -11.914 1.00 0.00 O ATOM 0 H GLY A 82 -0.331 13.019 -15.409 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -1.060 15.033 -14.433 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.138 14.155 -13.366 1.00 0.00 H new ATOM 1297 N LYS A 83 0.815 15.115 -12.746 1.00 0.00 N ATOM 1298 CA LYS A 83 1.971 15.261 -11.830 1.00 0.00 C ATOM 1299 C LYS A 83 1.654 15.319 -10.327 1.00 0.00 C ATOM 1300 O LYS A 83 2.589 15.346 -9.522 1.00 0.00 O ATOM 1301 CB LYS A 83 2.836 16.467 -12.244 1.00 0.00 C ATOM 1302 CG LYS A 83 3.555 16.246 -13.583 1.00 0.00 C ATOM 1303 CD LYS A 83 4.753 17.200 -13.710 1.00 0.00 C ATOM 1304 CE LYS A 83 5.467 17.089 -15.062 1.00 0.00 C ATOM 1305 NZ LYS A 83 5.938 15.717 -15.345 1.00 0.00 N ATOM 0 H LYS A 83 0.747 15.892 -13.403 1.00 0.00 H new ATOM 0 HA LYS A 83 2.521 14.327 -11.948 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.206 17.354 -12.316 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.575 16.663 -11.467 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.895 15.213 -13.654 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.861 16.411 -14.407 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.410 18.225 -13.569 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.464 16.989 -12.911 1.00 0.00 H new ATOM 0 HE2 LYS A 83 4.789 17.407 -15.854 1.00 0.00 H new ATOM 0 HE3 LYS A 83 6.317 17.771 -15.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 6.969 15.725 -15.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 5.699 15.096 -14.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.478 15.363 -16.208 1.00 0.00 H new ATOM 1319 N LEU A 84 0.375 15.258 -9.945 1.00 0.00 N ATOM 1320 CA LEU A 84 -0.077 14.799 -8.630 1.00 0.00 C ATOM 1321 C LEU A 84 0.560 13.446 -8.283 1.00 0.00 C ATOM 1322 O LEU A 84 1.083 13.275 -7.183 1.00 0.00 O ATOM 1323 CB LEU A 84 -1.618 14.758 -8.644 1.00 0.00 C ATOM 1324 CG LEU A 84 -2.285 14.384 -7.300 1.00 0.00 C ATOM 1325 CD1 LEU A 84 -3.698 14.974 -7.249 1.00 0.00 C ATOM 1326 CD2 LEU A 84 -2.420 12.869 -7.095 1.00 0.00 C ATOM 0 H LEU A 84 -0.393 15.533 -10.557 1.00 0.00 H new ATOM 0 HA LEU A 84 0.241 15.485 -7.845 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.988 15.736 -8.954 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.938 14.042 -9.401 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.640 14.785 -6.518 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -4.168 14.710 -6.302 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.643 16.059 -7.337 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.290 14.573 -8.072 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.895 12.673 -6.134 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.029 12.447 -7.894 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.431 12.410 -7.111 1.00 0.00 H new ATOM 1338 N PHE A 85 0.565 12.506 -9.235 1.00 0.00 N ATOM 1339 CA PHE A 85 1.214 11.212 -9.079 1.00 0.00 C ATOM 1340 C PHE A 85 2.724 11.337 -8.933 1.00 0.00 C ATOM 1341 O PHE A 85 3.383 12.082 -9.656 1.00 0.00 O ATOM 1342 CB PHE A 85 0.897 10.301 -10.262 1.00 0.00 C ATOM 1343 CG PHE A 85 -0.459 9.653 -10.130 1.00 0.00 C ATOM 1344 CD1 PHE A 85 -1.623 10.338 -10.522 1.00 0.00 C ATOM 1345 CD2 PHE A 85 -0.548 8.387 -9.526 1.00 0.00 C ATOM 1346 CE1 PHE A 85 -2.881 9.743 -10.324 1.00 0.00 C ATOM 1347 CE2 PHE A 85 -1.806 7.792 -9.328 1.00 0.00 C ATOM 1348 CZ PHE A 85 -2.972 8.474 -9.721 1.00 0.00 C ATOM 0 H PHE A 85 0.113 12.629 -10.141 1.00 0.00 H new ATOM 0 HA PHE A 85 0.819 10.776 -8.162 1.00 0.00 H new ATOM 0 HB2 PHE A 85 0.934 10.880 -11.185 1.00 0.00 H new ATOM 0 HB3 PHE A 85 1.662 9.528 -10.340 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -1.551 11.317 -10.973 1.00 0.00 H new ATOM 0 HD2 PHE A 85 0.349 7.872 -9.214 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -3.778 10.259 -10.634 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -1.877 6.814 -8.875 1.00 0.00 H new ATOM 0 HZ PHE A 85 -3.940 8.023 -9.560 1.00 0.00 H new ATOM 1358 N ARG A 86 3.248 10.507 -8.028 1.00 0.00 N ATOM 1359 CA ARG A 86 4.676 10.300 -7.778 1.00 0.00 C ATOM 1360 C ARG A 86 4.999 8.811 -7.702 1.00 0.00 C ATOM 1361 O ARG A 86 5.858 8.327 -8.429 1.00 0.00 O ATOM 1362 CB ARG A 86 5.106 11.048 -6.502 1.00 0.00 C ATOM 1363 CG ARG A 86 6.599 11.423 -6.509 1.00 0.00 C ATOM 1364 CD ARG A 86 6.854 12.908 -6.823 1.00 0.00 C ATOM 1365 NE ARG A 86 6.444 13.307 -8.183 1.00 0.00 N ATOM 1366 CZ ARG A 86 5.393 14.042 -8.531 1.00 0.00 C ATOM 1367 NH1 ARG A 86 4.385 14.279 -7.726 1.00 0.00 N ATOM 1368 NH2 ARG A 86 5.301 14.593 -9.714 1.00 0.00 N ATOM 0 H ARG A 86 2.661 9.934 -7.422 1.00 0.00 H new ATOM 0 HA ARG A 86 5.246 10.711 -8.611 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.508 11.954 -6.398 1.00 0.00 H new ATOM 0 HB3 ARG A 86 4.896 10.425 -5.632 1.00 0.00 H new ATOM 0 HG2 ARG A 86 7.030 11.185 -5.537 1.00 0.00 H new ATOM 0 HG3 ARG A 86 7.117 10.809 -7.246 1.00 0.00 H new ATOM 0 HD2 ARG A 86 6.318 13.520 -6.098 1.00 0.00 H new ATOM 0 HD3 ARG A 86 7.916 13.120 -6.697 1.00 0.00 H new ATOM 0 HE ARG A 86 7.037 12.980 -8.946 1.00 0.00 H new ATOM 0 HH11 ARG A 86 4.384 13.892 -6.782 1.00 0.00 H new ATOM 0 HH12 ARG A 86 3.602 14.851 -8.044 1.00 0.00 H new ATOM 0 HH21 ARG A 86 6.048 14.463 -10.396 1.00 0.00 H new ATOM 0 HH22 ARG A 86 4.482 15.152 -9.954 1.00 0.00 H new ATOM 1382 N VAL A 87 4.231 8.070 -6.893 1.00 0.00 N ATOM 1383 CA VAL A 87 4.078 6.617 -7.023 1.00 0.00 C ATOM 1384 C VAL A 87 3.290 6.343 -8.316 1.00 0.00 C ATOM 1385 O VAL A 87 2.072 6.165 -8.293 1.00 0.00 O ATOM 1386 CB VAL A 87 3.407 6.002 -5.772 1.00 0.00 C ATOM 1387 CG1 VAL A 87 3.273 4.473 -5.870 1.00 0.00 C ATOM 1388 CG2 VAL A 87 4.221 6.308 -4.506 1.00 0.00 C ATOM 0 H VAL A 87 3.693 8.467 -6.122 1.00 0.00 H new ATOM 0 HA VAL A 87 5.054 6.136 -7.089 1.00 0.00 H new ATOM 0 HB VAL A 87 2.415 6.452 -5.718 1.00 0.00 H new ATOM 0 HG11 VAL A 87 2.796 4.091 -4.967 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.666 4.216 -6.738 1.00 0.00 H new ATOM 0 HG13 VAL A 87 4.262 4.027 -5.974 1.00 0.00 H new ATOM 0 HG21 VAL A 87 3.728 5.865 -3.641 1.00 0.00 H new ATOM 0 HG22 VAL A 87 5.222 5.889 -4.607 1.00 0.00 H new ATOM 0 HG23 VAL A 87 4.291 7.387 -4.370 1.00 0.00 H new ATOM 1398 N GLY A 88 3.981 6.374 -9.460 1.00 0.00 N ATOM 1399 CA GLY A 88 3.390 6.260 -10.792 1.00 0.00 C ATOM 1400 C GLY A 88 2.995 4.825 -11.131 1.00 0.00 C ATOM 1401 O GLY A 88 3.535 4.230 -12.059 1.00 0.00 O ATOM 0 H GLY A 88 4.995 6.482 -9.483 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.510 6.900 -10.852 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.100 6.624 -11.534 1.00 0.00 H new ATOM 1405 N VAL A 89 2.053 4.257 -10.378 1.00 0.00 N ATOM 1406 CA VAL A 89 1.519 2.921 -10.644 1.00 0.00 C ATOM 1407 C VAL A 89 0.206 3.016 -11.426 1.00 0.00 C ATOM 1408 O VAL A 89 -0.783 3.595 -10.967 1.00 0.00 O ATOM 1409 CB VAL A 89 1.459 2.073 -9.366 1.00 0.00 C ATOM 1410 CG1 VAL A 89 0.330 2.430 -8.400 1.00 0.00 C ATOM 1411 CG2 VAL A 89 1.348 0.603 -9.762 1.00 0.00 C ATOM 0 H VAL A 89 1.638 4.711 -9.565 1.00 0.00 H new ATOM 0 HA VAL A 89 2.204 2.376 -11.293 1.00 0.00 H new ATOM 0 HB VAL A 89 2.378 2.283 -8.819 1.00 0.00 H new ATOM 0 HG11 VAL A 89 0.374 1.774 -7.530 1.00 0.00 H new ATOM 0 HG12 VAL A 89 0.439 3.466 -8.079 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.630 2.305 -8.900 1.00 0.00 H new ATOM 0 HG21 VAL A 89 1.304 -0.013 -8.864 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.443 0.452 -10.350 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.218 0.319 -10.355 1.00 0.00 H new ATOM 1421 N VAL A 90 0.234 2.488 -12.652 1.00 0.00 N ATOM 1422 CA VAL A 90 -0.851 2.559 -13.637 1.00 0.00 C ATOM 1423 C VAL A 90 -0.980 1.185 -14.297 1.00 0.00 C ATOM 1424 O VAL A 90 -0.071 0.353 -14.233 1.00 0.00 O ATOM 1425 CB VAL A 90 -0.578 3.695 -14.661 1.00 0.00 C ATOM 1426 CG1 VAL A 90 -1.627 3.824 -15.781 1.00 0.00 C ATOM 1427 CG2 VAL A 90 -0.445 5.043 -13.937 1.00 0.00 C ATOM 0 H VAL A 90 1.046 1.978 -13.001 1.00 0.00 H new ATOM 0 HA VAL A 90 -1.799 2.805 -13.159 1.00 0.00 H new ATOM 0 HB VAL A 90 0.356 3.416 -15.150 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.351 4.643 -16.445 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -1.669 2.894 -16.349 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.604 4.026 -15.343 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.254 5.830 -14.666 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.369 5.261 -13.401 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.382 4.996 -13.229 1.00 0.00 H new ATOM 1437 N SER A 91 -2.114 0.865 -14.911 1.00 0.00 N ATOM 1438 CA SER A 91 -2.228 -0.350 -15.722 1.00 0.00 C ATOM 1439 C SER A 91 -3.236 -0.148 -16.850 1.00 0.00 C ATOM 1440 O SER A 91 -4.121 0.701 -16.738 1.00 0.00 O ATOM 1441 CB SER A 91 -2.599 -1.542 -14.833 1.00 0.00 C ATOM 1442 OG SER A 91 -1.723 -1.627 -13.718 1.00 0.00 O ATOM 0 H SER A 91 -2.966 1.425 -14.865 1.00 0.00 H new ATOM 0 HA SER A 91 -1.264 -0.565 -16.183 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.627 -1.438 -14.487 1.00 0.00 H new ATOM 0 HB3 SER A 91 -2.549 -2.464 -15.412 1.00 0.00 H new ATOM 0 HG SER A 91 -0.865 -1.212 -13.944 1.00 0.00 H new ATOM 1448 N ILE A 92 -3.099 -0.930 -17.925 1.00 0.00 N ATOM 1449 CA ILE A 92 -3.892 -0.853 -19.154 1.00 0.00 C ATOM 1450 C ILE A 92 -4.543 -2.222 -19.417 1.00 0.00 C ATOM 1451 O ILE A 92 -3.921 -3.278 -19.239 1.00 0.00 O ATOM 1452 CB ILE A 92 -3.023 -0.399 -20.355 1.00 0.00 C ATOM 1453 CG1 ILE A 92 -2.109 0.821 -20.079 1.00 0.00 C ATOM 1454 CG2 ILE A 92 -3.910 -0.110 -21.582 1.00 0.00 C ATOM 1455 CD1 ILE A 92 -2.843 2.131 -19.781 1.00 0.00 C ATOM 0 H ILE A 92 -2.398 -1.670 -17.963 1.00 0.00 H new ATOM 0 HA ILE A 92 -4.675 -0.104 -19.031 1.00 0.00 H new ATOM 0 HB ILE A 92 -2.353 -1.237 -20.547 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.461 0.586 -19.234 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -1.463 0.974 -20.943 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.285 0.208 -22.416 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -4.453 -1.013 -21.859 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -4.620 0.681 -21.339 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.116 2.923 -19.602 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -3.469 2.399 -20.632 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -3.467 2.005 -18.897 1.00 0.00 H new ATOM 1467 N LEU A 93 -5.812 -2.187 -19.835 1.00 0.00 N ATOM 1468 CA LEU A 93 -6.690 -3.346 -19.971 1.00 0.00 C ATOM 1469 C LEU A 93 -7.122 -3.517 -21.434 1.00 0.00 C ATOM 1470 O LEU A 93 -6.712 -4.473 -22.096 1.00 0.00 O ATOM 1471 CB LEU A 93 -7.895 -3.212 -19.012 1.00 0.00 C ATOM 1472 CG LEU A 93 -7.549 -3.048 -17.515 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -7.367 -1.589 -17.074 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -8.683 -3.627 -16.667 1.00 0.00 C ATOM 0 H LEU A 93 -6.271 -1.315 -20.097 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.150 -4.250 -19.689 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.490 -2.353 -19.324 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.525 -4.094 -19.125 1.00 0.00 H new ATOM 0 HG LEU A 93 -6.602 -3.569 -17.373 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.126 -1.557 -16.011 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.556 -1.135 -17.643 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -8.289 -1.037 -17.254 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -8.442 -3.513 -15.610 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.609 -3.096 -16.887 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -8.807 -4.685 -16.899 1.00 0.00 H new ATOM 1486 N GLU A 94 -7.921 -2.582 -21.955 1.00 0.00 N ATOM 1487 CA GLU A 94 -8.373 -2.530 -23.346 1.00 0.00 C ATOM 1488 C GLU A 94 -7.788 -1.282 -24.016 1.00 0.00 C ATOM 1489 O GLU A 94 -8.365 -0.195 -23.950 1.00 0.00 O ATOM 1490 CB GLU A 94 -9.910 -2.562 -23.475 1.00 0.00 C ATOM 1491 CG GLU A 94 -10.598 -3.827 -22.942 1.00 0.00 C ATOM 1492 CD GLU A 94 -10.615 -3.930 -21.413 1.00 0.00 C ATOM 1493 OE1 GLU A 94 -11.054 -2.966 -20.744 1.00 0.00 O ATOM 1494 OE2 GLU A 94 -10.180 -4.994 -20.916 1.00 0.00 O ATOM 0 H GLU A 94 -8.285 -1.810 -21.396 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.012 -3.425 -23.853 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -10.318 -1.700 -22.948 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.170 -2.445 -24.527 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -11.624 -3.852 -23.309 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -10.092 -4.702 -23.349 1.00 0.00 H new ATOM 1501 N ALA A 95 -6.627 -1.434 -24.663 1.00 0.00 N ATOM 1502 CA ALA A 95 -5.963 -0.389 -25.446 1.00 0.00 C ATOM 1503 C ALA A 95 -6.705 -0.083 -26.770 1.00 0.00 C ATOM 1504 O ALA A 95 -6.114 -0.102 -27.847 1.00 0.00 O ATOM 1505 CB ALA A 95 -4.513 -0.809 -25.671 1.00 0.00 C ATOM 0 H ALA A 95 -6.110 -2.313 -24.655 1.00 0.00 H new ATOM 0 HA ALA A 95 -5.984 0.549 -24.891 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -3.999 -0.044 -26.253 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.015 -0.928 -24.709 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.488 -1.755 -26.212 1.00 0.00 H new ATOM 1511 N GLY A 96 -8.012 0.199 -26.698 1.00 0.00 N ATOM 1512 CA GLY A 96 -8.908 0.454 -27.831 1.00 0.00 C ATOM 1513 C GLY A 96 -8.696 1.815 -28.503 1.00 0.00 C ATOM 1514 O GLY A 96 -9.668 2.491 -28.826 1.00 0.00 O ATOM 0 H GLY A 96 -8.497 0.258 -25.802 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -8.769 -0.331 -28.574 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -9.940 0.388 -27.486 1.00 0.00 H new ATOM 1518 N ASP A 97 -7.435 2.220 -28.675 1.00 0.00 N ATOM 1519 CA ASP A 97 -7.018 3.532 -29.160 1.00 0.00 C ATOM 1520 C ASP A 97 -5.783 3.372 -30.068 1.00 0.00 C ATOM 1521 O ASP A 97 -5.933 3.251 -31.281 1.00 0.00 O ATOM 1522 CB ASP A 97 -6.809 4.444 -27.936 1.00 0.00 C ATOM 1523 CG ASP A 97 -6.715 5.921 -28.310 1.00 0.00 C ATOM 1524 OD1 ASP A 97 -5.906 6.270 -29.196 1.00 0.00 O ATOM 1525 OD2 ASP A 97 -7.464 6.739 -27.712 1.00 0.00 O ATOM 0 H ASP A 97 -6.643 1.612 -28.469 1.00 0.00 H new ATOM 0 HA ASP A 97 -7.774 4.009 -29.784 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -7.634 4.302 -27.238 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -5.898 4.146 -27.418 1.00 0.00 H new ATOM 1530 N SER A 98 -4.575 3.294 -29.488 1.00 0.00 N ATOM 1531 CA SER A 98 -3.373 2.761 -30.137 1.00 0.00 C ATOM 1532 C SER A 98 -2.957 1.402 -29.554 1.00 0.00 C ATOM 1533 O SER A 98 -3.097 1.103 -28.372 1.00 0.00 O ATOM 1534 CB SER A 98 -2.247 3.814 -30.144 1.00 0.00 C ATOM 1535 OG SER A 98 -0.944 3.327 -30.454 1.00 0.00 O ATOM 0 H SER A 98 -4.406 3.608 -28.532 1.00 0.00 H new ATOM 0 HA SER A 98 -3.605 2.554 -31.182 1.00 0.00 H new ATOM 0 HB2 SER A 98 -2.505 4.590 -30.865 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.213 4.289 -29.163 1.00 0.00 H new ATOM 0 HG SER A 98 -0.961 2.881 -31.326 1.00 0.00 H new ATOM 1541 N ASP A 99 -2.304 0.647 -30.425 1.00 0.00 N ATOM 1542 CA ASP A 99 -1.671 -0.669 -30.417 1.00 0.00 C ATOM 1543 C ASP A 99 -0.647 -0.968 -29.297 1.00 0.00 C ATOM 1544 O ASP A 99 -0.049 -2.048 -29.317 1.00 0.00 O ATOM 1545 CB ASP A 99 -0.947 -0.714 -31.786 1.00 0.00 C ATOM 1546 CG ASP A 99 -0.044 0.523 -31.992 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -0.583 1.648 -32.184 1.00 0.00 O ATOM 1548 OD2 ASP A 99 1.186 0.423 -31.809 1.00 0.00 O ATOM 0 H ASP A 99 -2.183 1.037 -31.360 1.00 0.00 H new ATOM 0 HA ASP A 99 -2.440 -1.419 -30.235 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -0.344 -1.620 -31.850 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -1.685 -0.764 -32.587 1.00 0.00 H new ATOM 1553 N ILE A 100 -0.430 -0.059 -28.336 1.00 0.00 N ATOM 1554 CA ILE A 100 0.778 0.014 -27.490 1.00 0.00 C ATOM 1555 C ILE A 100 1.244 -1.311 -26.883 1.00 0.00 C ATOM 1556 O ILE A 100 2.440 -1.595 -26.891 1.00 0.00 O ATOM 1557 CB ILE A 100 0.632 1.106 -26.403 1.00 0.00 C ATOM 1558 CG1 ILE A 100 2.018 1.424 -25.800 1.00 0.00 C ATOM 1559 CG2 ILE A 100 -0.369 0.727 -25.291 1.00 0.00 C ATOM 1560 CD1 ILE A 100 2.007 2.619 -24.847 1.00 0.00 C ATOM 0 H ILE A 100 -1.109 0.670 -28.116 1.00 0.00 H new ATOM 0 HA ILE A 100 1.575 0.289 -28.180 1.00 0.00 H new ATOM 0 HB ILE A 100 0.224 1.992 -26.889 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.383 0.547 -25.266 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.721 1.621 -26.609 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -0.425 1.535 -24.561 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -1.354 0.564 -25.728 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -0.036 -0.186 -24.797 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.013 2.786 -24.461 1.00 0.00 H new ATOM 0 HD12 ILE A 100 1.672 3.508 -25.382 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.329 2.417 -24.018 1.00 0.00 H new ATOM 1572 N LEU A 101 0.314 -2.112 -26.360 1.00 0.00 N ATOM 1573 CA LEU A 101 0.623 -3.303 -25.576 1.00 0.00 C ATOM 1574 C LEU A 101 0.565 -4.616 -26.366 1.00 0.00 C ATOM 1575 O LEU A 101 0.791 -5.677 -25.795 1.00 0.00 O ATOM 1576 CB LEU A 101 -0.104 -3.259 -24.222 1.00 0.00 C ATOM 1577 CG LEU A 101 -1.585 -3.664 -24.175 1.00 0.00 C ATOM 1578 CD1 LEU A 101 -2.307 -2.919 -23.051 1.00 0.00 C ATOM 1579 CD2 LEU A 101 -2.383 -3.421 -25.443 1.00 0.00 C ATOM 0 H LEU A 101 -0.686 -1.947 -26.472 1.00 0.00 H new ATOM 0 HA LEU A 101 1.683 -3.286 -25.324 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.439 -3.905 -23.532 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -0.025 -2.243 -23.836 1.00 0.00 H new ATOM 0 HG LEU A 101 -1.545 -4.742 -24.020 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -3.355 -3.217 -23.031 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -1.842 -3.163 -22.096 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -2.239 -1.845 -23.224 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.413 -3.745 -25.292 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -2.368 -2.358 -25.684 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.942 -3.985 -26.264 1.00 0.00 H new ATOM 1591 N THR A 102 0.335 -4.535 -27.685 1.00 0.00 N ATOM 1592 CA THR A 102 0.472 -5.652 -28.630 1.00 0.00 C ATOM 1593 C THR A 102 1.902 -6.201 -28.605 1.00 0.00 C ATOM 1594 O THR A 102 2.127 -7.332 -28.184 1.00 0.00 O ATOM 1595 CB THR A 102 0.077 -5.237 -30.062 1.00 0.00 C ATOM 1596 OG1 THR A 102 0.821 -4.113 -30.491 1.00 0.00 O ATOM 1597 CG2 THR A 102 -1.414 -4.916 -30.184 1.00 0.00 C ATOM 0 H THR A 102 0.041 -3.668 -28.135 1.00 0.00 H new ATOM 0 HA THR A 102 -0.213 -6.439 -28.314 1.00 0.00 H new ATOM 0 HB THR A 102 0.301 -6.094 -30.697 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.293 -3.299 -30.353 1.00 0.00 H new ATOM 0 HG21 THR A 102 -1.642 -4.629 -31.211 1.00 0.00 H new ATOM 0 HG22 THR A 102 -1.999 -5.796 -29.915 1.00 0.00 H new ATOM 0 HG23 THR A 102 -1.665 -4.094 -29.514 1.00 0.00 H new ATOM 1605 N THR A 103 2.884 -5.369 -28.968 1.00 0.00 N ATOM 1606 CA THR A 103 4.323 -5.675 -28.928 1.00 0.00 C ATOM 1607 C THR A 103 4.887 -5.955 -27.524 1.00 0.00 C ATOM 1608 O THR A 103 6.069 -6.286 -27.419 1.00 0.00 O ATOM 1609 CB THR A 103 5.129 -4.551 -29.606 1.00 0.00 C ATOM 1610 OG1 THR A 103 6.479 -4.942 -29.691 1.00 0.00 O ATOM 1611 CG2 THR A 103 5.067 -3.212 -28.864 1.00 0.00 C ATOM 0 H THR A 103 2.694 -4.427 -29.311 1.00 0.00 H new ATOM 0 HA THR A 103 4.432 -6.609 -29.478 1.00 0.00 H new ATOM 0 HB THR A 103 4.680 -4.399 -30.588 1.00 0.00 H new ATOM 0 HG1 THR A 103 6.729 -5.432 -28.880 1.00 0.00 H new ATOM 0 HG21 THR A 103 5.658 -2.471 -29.401 1.00 0.00 H new ATOM 0 HG22 THR A 103 4.032 -2.877 -28.804 1.00 0.00 H new ATOM 0 HG23 THR A 103 5.467 -3.335 -27.858 1.00 0.00 H new ATOM 1619 N LEU A 104 4.089 -5.799 -26.460 1.00 0.00 N ATOM 1620 CA LEU A 104 4.456 -6.114 -25.078 1.00 0.00 C ATOM 1621 C LEU A 104 3.821 -7.413 -24.558 1.00 0.00 C ATOM 1622 O LEU A 104 4.196 -7.858 -23.471 1.00 0.00 O ATOM 1623 CB LEU A 104 4.011 -4.965 -24.154 1.00 0.00 C ATOM 1624 CG LEU A 104 4.461 -3.550 -24.556 1.00 0.00 C ATOM 1625 CD1 LEU A 104 3.862 -2.569 -23.548 1.00 0.00 C ATOM 1626 CD2 LEU A 104 5.984 -3.394 -24.569 1.00 0.00 C ATOM 0 H LEU A 104 3.139 -5.438 -26.543 1.00 0.00 H new ATOM 0 HA LEU A 104 5.538 -6.245 -25.072 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.922 -4.974 -24.098 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.384 -5.170 -23.150 1.00 0.00 H new ATOM 0 HG LEU A 104 4.116 -3.354 -25.571 1.00 0.00 H new ATOM 0 HD11 LEU A 104 4.163 -1.554 -23.806 1.00 0.00 H new ATOM 0 HD12 LEU A 104 2.775 -2.642 -23.571 1.00 0.00 H new ATOM 0 HD13 LEU A 104 4.221 -2.811 -22.548 1.00 0.00 H new ATOM 0 HD21 LEU A 104 6.243 -2.376 -24.860 1.00 0.00 H new ATOM 0 HD22 LEU A 104 6.379 -3.599 -23.574 1.00 0.00 H new ATOM 0 HD23 LEU A 104 6.416 -4.096 -25.283 1.00 0.00 H new ATOM 1638 N ALA A 105 2.831 -7.966 -25.274 1.00 0.00 N ATOM 1639 CA ALA A 105 1.715 -8.722 -24.701 1.00 0.00 C ATOM 1640 C ALA A 105 2.120 -9.882 -23.777 1.00 0.00 C ATOM 1641 O ALA A 105 2.911 -10.758 -24.195 1.00 0.00 O ATOM 1642 CB ALA A 105 0.808 -9.198 -25.844 1.00 0.00 C ATOM 1643 OXT ALA A 105 1.660 -9.864 -22.613 1.00 0.00 O ATOM 0 H ALA A 105 2.786 -7.897 -26.291 1.00 0.00 H new ATOM 0 HA ALA A 105 1.177 -8.043 -24.039 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.029 -9.763 -25.433 1.00 0.00 H new ATOM 0 HB2 ALA A 105 0.429 -8.335 -26.391 1.00 0.00 H new ATOM 0 HB3 ALA A 105 1.379 -9.834 -26.520 1.00 0.00 H new TER 1649 ALA A 105