USER MOD reduce.3.24.130724 H: found=0, std=0, add=1402, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1400 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 Single : A 1 MET CE :methyl -136:sc= -0.158 (180deg=-1.05) USER MOD Single : A 1 MET N :NH3+ -164:sc= -0.0141 (180deg=-0.252) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.0081 X(o=-0.0081,f=0) USER MOD Single : A 15 MET CE :methyl -165:sc= -4.31! (180deg=-6.17!) USER MOD Single : A 18 LYS NZ :NH3+ -166:sc= 0.00462 (180deg=0) USER MOD Single : A 22 SER OG : rot -140:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -154:sc= -0.173 (180deg=-0.98) USER MOD Single : A 41 LYS NZ :NH3+ -168:sc=-0.00434 (180deg=-0.161) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN :FLIP amide:sc= -0.246 F(o=-2.9!,f=-0.25) USER MOD Single : A 53 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0358) USER MOD Single : A 54 LYS NZ :NH3+ 161:sc= -0.0388 (180deg=-0.432) USER MOD Single : A 64 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.0753) USER MOD Single : A 66 THR OG1 : rot 60:sc= 0.881 USER MOD Single : A 67 CYS SG : rot -44:sc= 1.01 USER MOD Single : A 70 ASN :FLIP amide:sc=-0.00566 F(o=-0.66,f=-0.0057) USER MOD Single : A 72 LYS NZ :NH3+ 162:sc= -0.0396 (180deg=-0.36) USER MOD Single : A 73 GLN : amide:sc= 0.113 K(o=0.11,f=-7!) USER MOD Single : A 74 SER OG : rot -59:sc= 0.0285 USER MOD Single : A 77 CYS SG : rot -24:sc= 0.603 USER MOD Single : A 80 CYS SG : rot -140:sc= -1.02 USER MOD Single : A 85 CYS SG : rot 180:sc= -0.0806 USER MOD Single : B 1 MET CE :methyl -152:sc= -0.226 (180deg=-1.08) USER MOD Single : B 1 MET N :NH3+ -164:sc= 0 (180deg=-0.243) USER MOD Single : B 2 THR OG1 : rot 180:sc= 0 USER MOD Single : B 3 THR OG1 : rot 180:sc= 0 USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 HIS : no HD1:sc= -0.0353 X(o=-0.035,f=0) USER MOD Single : B 15 MET CE :methyl -162:sc= -4.3! (180deg=-5.97!) USER MOD Single : B 18 LYS NZ :NH3+ -167:sc= 0.00661 (180deg=0) USER MOD Single : B 22 SER OG : rot -140:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 LYS NZ :NH3+ -161:sc= -0.173 (180deg=-1.01) USER MOD Single : B 41 LYS NZ :NH3+ -169:sc=-0.00657 (180deg=-0.176) USER MOD Single : B 43 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN :FLIP amide:sc= -0.283 F(o=-2.8!,f=-0.28) USER MOD Single : B 53 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0354) USER MOD Single : B 54 LYS NZ :NH3+ 160:sc= -0.0183 (180deg=-0.404) USER MOD Single : B 64 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0724) USER MOD Single : B 66 THR OG1 : rot 68:sc= 0.993 USER MOD Single : B 67 CYS SG : rot -43:sc= 0.933 USER MOD Single : B 70 ASN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD Single : B 72 LYS NZ :NH3+ 161:sc= -0.0196 (180deg=-0.367) USER MOD Single : B 73 GLN : amide:sc= 0.0226 K(o=0.023,f=-6.9!) USER MOD Single : B 74 SER OG : rot -57:sc= 0.114 USER MOD Single : B 77 CYS SG : rot -23:sc= 0.601 USER MOD Single : B 80 CYS SG : rot -23:sc= -1.02 USER MOD Single : B 85 CYS SG : rot 180:sc= -0.0843 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 114.091 -8.244 11.998 1.00 0.00 N ATOM 2 CA MET A 1 115.163 -8.038 13.012 1.00 0.00 C ATOM 3 C MET A 1 116.441 -8.741 12.548 1.00 0.00 C ATOM 4 O MET A 1 117.474 -8.125 12.376 1.00 0.00 O ATOM 5 CB MET A 1 114.719 -8.627 14.353 1.00 0.00 C ATOM 6 CG MET A 1 113.593 -7.773 14.939 1.00 0.00 C ATOM 7 SD MET A 1 113.066 -8.466 16.527 1.00 0.00 S ATOM 8 CE MET A 1 112.326 -9.996 15.898 1.00 0.00 C ATOM 0 H1 MET A 1 113.323 -7.562 12.162 1.00 0.00 H new ATOM 0 H2 MET A 1 114.483 -8.102 11.045 1.00 0.00 H new ATOM 0 H3 MET A 1 113.718 -9.212 12.079 1.00 0.00 H new ATOM 0 HA MET A 1 115.353 -6.971 13.129 1.00 0.00 H new ATOM 0 HB2 MET A 1 114.378 -9.653 14.216 1.00 0.00 H new ATOM 0 HB3 MET A 1 115.561 -8.661 15.044 1.00 0.00 H new ATOM 0 HG2 MET A 1 113.934 -6.747 15.074 1.00 0.00 H new ATOM 0 HG3 MET A 1 112.751 -7.740 14.248 1.00 0.00 H new ATOM 0 HE1 MET A 1 111.373 -10.171 16.397 1.00 0.00 H new ATOM 0 HE2 MET A 1 112.162 -9.906 14.824 1.00 0.00 H new ATOM 0 HE3 MET A 1 112.997 -10.832 16.094 1.00 0.00 H new ATOM 20 N THR A 2 116.378 -10.029 12.347 1.00 0.00 N ATOM 21 CA THR A 2 117.587 -10.775 11.896 1.00 0.00 C ATOM 22 C THR A 2 117.996 -10.291 10.503 1.00 0.00 C ATOM 23 O THR A 2 117.167 -10.071 9.642 1.00 0.00 O ATOM 24 CB THR A 2 117.270 -12.273 11.850 1.00 0.00 C ATOM 25 OG1 THR A 2 116.747 -12.681 13.107 1.00 0.00 O ATOM 26 CG2 THR A 2 118.547 -13.060 11.550 1.00 0.00 C ATOM 0 H THR A 2 115.541 -10.597 12.476 1.00 0.00 H new ATOM 0 HA THR A 2 118.407 -10.599 12.592 1.00 0.00 H new ATOM 0 HB THR A 2 116.536 -12.465 11.067 1.00 0.00 H new ATOM 0 HG1 THR A 2 116.541 -13.639 13.080 1.00 0.00 H new ATOM 0 HG21 THR A 2 118.319 -14.125 11.518 1.00 0.00 H new ATOM 0 HG22 THR A 2 118.950 -12.746 10.587 1.00 0.00 H new ATOM 0 HG23 THR A 2 119.283 -12.870 12.331 1.00 0.00 H new ATOM 34 N THR A 3 119.269 -10.122 10.276 1.00 0.00 N ATOM 35 CA THR A 3 119.736 -9.648 8.941 1.00 0.00 C ATOM 36 C THR A 3 119.709 -10.805 7.940 1.00 0.00 C ATOM 37 O THR A 3 119.530 -11.951 8.303 1.00 0.00 O ATOM 38 CB THR A 3 121.166 -9.114 9.064 1.00 0.00 C ATOM 39 OG1 THR A 3 122.019 -10.151 9.529 1.00 0.00 O ATOM 40 CG2 THR A 3 121.197 -7.943 10.047 1.00 0.00 C ATOM 0 H THR A 3 120.008 -10.292 10.958 1.00 0.00 H new ATOM 0 HA THR A 3 119.076 -8.855 8.590 1.00 0.00 H new ATOM 0 HB THR A 3 121.510 -8.771 8.088 1.00 0.00 H new ATOM 0 HG1 THR A 3 122.935 -9.811 9.607 1.00 0.00 H new ATOM 0 HG21 THR A 3 122.216 -7.566 10.132 1.00 0.00 H new ATOM 0 HG22 THR A 3 120.545 -7.148 9.686 1.00 0.00 H new ATOM 0 HG23 THR A 3 120.852 -8.280 11.025 1.00 0.00 H new ATOM 48 N SER A 4 119.881 -10.510 6.680 1.00 0.00 N ATOM 49 CA SER A 4 119.864 -11.584 5.645 1.00 0.00 C ATOM 50 C SER A 4 121.118 -12.452 5.782 1.00 0.00 C ATOM 51 O SER A 4 122.081 -12.087 6.427 1.00 0.00 O ATOM 52 CB SER A 4 119.831 -10.952 4.254 1.00 0.00 C ATOM 53 OG SER A 4 121.068 -10.296 4.006 1.00 0.00 O ATOM 0 H SER A 4 120.033 -9.567 6.321 1.00 0.00 H new ATOM 0 HA SER A 4 118.979 -12.204 5.784 1.00 0.00 H new ATOM 0 HB2 SER A 4 119.654 -11.717 3.498 1.00 0.00 H new ATOM 0 HB3 SER A 4 119.008 -10.240 4.185 1.00 0.00 H new ATOM 0 HG SER A 4 121.050 -9.891 3.114 1.00 0.00 H new ATOM 59 N GLN A 5 121.091 -13.612 5.186 1.00 0.00 N ATOM 60 CA GLN A 5 122.248 -14.545 5.271 1.00 0.00 C ATOM 61 C GLN A 5 123.460 -13.944 4.557 1.00 0.00 C ATOM 62 O GLN A 5 124.587 -14.331 4.797 1.00 0.00 O ATOM 63 CB GLN A 5 121.869 -15.868 4.602 1.00 0.00 C ATOM 64 CG GLN A 5 120.819 -16.584 5.452 1.00 0.00 C ATOM 65 CD GLN A 5 120.436 -17.908 4.788 1.00 0.00 C ATOM 66 OE1 GLN A 5 120.717 -18.099 3.528 1.00 0.00 O flip ATOM 67 NE2 GLN A 5 119.872 -18.778 5.422 1.00 0.00 N flip ATOM 0 H GLN A 5 120.304 -13.957 4.636 1.00 0.00 H new ATOM 0 HA GLN A 5 122.501 -14.714 6.318 1.00 0.00 H new ATOM 0 HB2 GLN A 5 121.479 -15.683 3.601 1.00 0.00 H new ATOM 0 HB3 GLN A 5 122.752 -16.497 4.489 1.00 0.00 H new ATOM 0 HG2 GLN A 5 121.210 -16.767 6.453 1.00 0.00 H new ATOM 0 HG3 GLN A 5 119.937 -15.954 5.565 1.00 0.00 H new ATOM 0 HE21 GLN A 5 119.652 -18.630 6.407 1.00 0.00 H new ATOM 0 HE22 GLN A 5 119.619 -19.656 4.969 1.00 0.00 H new ATOM 76 N LYS A 6 123.242 -12.998 3.678 1.00 0.00 N ATOM 77 CA LYS A 6 124.380 -12.373 2.948 1.00 0.00 C ATOM 78 C LYS A 6 125.273 -11.632 3.948 1.00 0.00 C ATOM 79 O LYS A 6 126.480 -11.602 3.810 1.00 0.00 O ATOM 80 CB LYS A 6 123.839 -11.365 1.929 1.00 0.00 C ATOM 81 CG LYS A 6 122.950 -12.068 0.892 1.00 0.00 C ATOM 82 CD LYS A 6 123.804 -12.819 -0.137 1.00 0.00 C ATOM 83 CE LYS A 6 122.912 -13.263 -1.300 1.00 0.00 C ATOM 84 NZ LYS A 6 123.747 -13.901 -2.355 1.00 0.00 N ATOM 0 H LYS A 6 122.321 -12.633 3.436 1.00 0.00 H new ATOM 0 HA LYS A 6 124.952 -13.147 2.436 1.00 0.00 H new ATOM 0 HB2 LYS A 6 123.267 -10.592 2.442 1.00 0.00 H new ATOM 0 HB3 LYS A 6 124.668 -10.867 1.427 1.00 0.00 H new ATOM 0 HG2 LYS A 6 122.280 -12.766 1.394 1.00 0.00 H new ATOM 0 HG3 LYS A 6 122.324 -11.334 0.385 1.00 0.00 H new ATOM 0 HD2 LYS A 6 124.605 -12.176 -0.502 1.00 0.00 H new ATOM 0 HD3 LYS A 6 124.276 -13.685 0.327 1.00 0.00 H new ATOM 0 HE2 LYS A 6 122.157 -13.965 -0.945 1.00 0.00 H new ATOM 0 HE3 LYS A 6 122.381 -12.405 -1.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 123.140 -14.202 -3.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 124.451 -13.218 -2.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 124.235 -14.729 -1.958 1.00 0.00 H new ATOM 98 N HIS A 7 124.690 -11.013 4.937 1.00 0.00 N ATOM 99 CA HIS A 7 125.510 -10.250 5.922 1.00 0.00 C ATOM 100 C HIS A 7 126.508 -11.171 6.625 1.00 0.00 C ATOM 101 O HIS A 7 127.688 -10.887 6.688 1.00 0.00 O ATOM 102 CB HIS A 7 124.581 -9.626 6.969 1.00 0.00 C ATOM 103 CG HIS A 7 125.399 -8.946 8.036 1.00 0.00 C ATOM 104 ND1 HIS A 7 125.910 -7.667 7.878 1.00 0.00 N ATOM 105 CD2 HIS A 7 125.808 -9.362 9.282 1.00 0.00 C ATOM 106 CE1 HIS A 7 126.590 -7.360 9.000 1.00 0.00 C ATOM 107 NE2 HIS A 7 126.558 -8.359 9.883 1.00 0.00 N ATOM 0 H HIS A 7 123.684 -11.002 5.106 1.00 0.00 H new ATOM 0 HA HIS A 7 126.063 -9.474 5.392 1.00 0.00 H new ATOM 0 HB2 HIS A 7 123.915 -8.906 6.494 1.00 0.00 H new ATOM 0 HB3 HIS A 7 123.952 -10.396 7.416 1.00 0.00 H new ATOM 0 HD2 HIS A 7 125.581 -10.321 9.725 1.00 0.00 H new ATOM 0 HE1 HIS A 7 127.098 -6.421 9.164 1.00 0.00 H new ATOM 0 HE2 HIS A 7 126.993 -8.382 10.805 1.00 0.00 H new ATOM 115 N ARG A 8 126.048 -12.268 7.161 1.00 0.00 N ATOM 116 CA ARG A 8 126.963 -13.206 7.864 1.00 0.00 C ATOM 117 C ARG A 8 127.879 -13.892 6.852 1.00 0.00 C ATOM 118 O ARG A 8 129.013 -14.217 7.141 1.00 0.00 O ATOM 119 CB ARG A 8 126.125 -14.253 8.603 1.00 0.00 C ATOM 120 CG ARG A 8 125.406 -13.591 9.782 1.00 0.00 C ATOM 121 CD ARG A 8 124.566 -14.635 10.523 1.00 0.00 C ATOM 122 NE ARG A 8 123.552 -15.199 9.588 1.00 0.00 N ATOM 123 CZ ARG A 8 122.901 -16.286 9.903 1.00 0.00 C ATOM 124 NH1 ARG A 8 123.127 -16.874 11.046 1.00 0.00 N ATOM 125 NH2 ARG A 8 122.021 -16.783 9.076 1.00 0.00 N ATOM 0 H ARG A 8 125.070 -12.555 7.141 1.00 0.00 H new ATOM 0 HA ARG A 8 127.578 -12.657 8.577 1.00 0.00 H new ATOM 0 HB2 ARG A 8 125.398 -14.698 7.924 1.00 0.00 H new ATOM 0 HB3 ARG A 8 126.764 -15.060 8.960 1.00 0.00 H new ATOM 0 HG2 ARG A 8 126.133 -13.146 10.461 1.00 0.00 H new ATOM 0 HG3 ARG A 8 124.768 -12.783 9.425 1.00 0.00 H new ATOM 0 HD2 ARG A 8 125.206 -15.429 10.907 1.00 0.00 H new ATOM 0 HD3 ARG A 8 124.073 -14.180 11.382 1.00 0.00 H new ATOM 0 HE ARG A 8 123.366 -14.734 8.699 1.00 0.00 H new ATOM 0 HH11 ARG A 8 123.812 -16.484 11.693 1.00 0.00 H new ATOM 0 HH12 ARG A 8 122.618 -17.723 11.292 1.00 0.00 H new ATOM 0 HH21 ARG A 8 121.842 -16.322 8.184 1.00 0.00 H new ATOM 0 HH22 ARG A 8 121.512 -17.632 9.322 1.00 0.00 H new ATOM 139 N ASP A 9 127.392 -14.109 5.665 1.00 0.00 N ATOM 140 CA ASP A 9 128.223 -14.769 4.623 1.00 0.00 C ATOM 141 C ASP A 9 129.304 -13.812 4.116 1.00 0.00 C ATOM 142 O ASP A 9 130.418 -14.209 3.852 1.00 0.00 O ATOM 143 CB ASP A 9 127.341 -15.200 3.453 1.00 0.00 C ATOM 144 CG ASP A 9 126.443 -16.359 3.889 1.00 0.00 C ATOM 145 OD1 ASP A 9 126.786 -17.016 4.858 1.00 0.00 O ATOM 146 OD2 ASP A 9 125.427 -16.569 3.247 1.00 0.00 O ATOM 0 H ASP A 9 126.449 -13.856 5.370 1.00 0.00 H new ATOM 0 HA ASP A 9 128.701 -15.644 5.064 1.00 0.00 H new ATOM 0 HB2 ASP A 9 126.732 -14.362 3.115 1.00 0.00 H new ATOM 0 HB3 ASP A 9 127.961 -15.504 2.610 1.00 0.00 H new ATOM 151 N PHE A 10 128.975 -12.559 3.948 1.00 0.00 N ATOM 152 CA PHE A 10 129.983 -11.590 3.421 1.00 0.00 C ATOM 153 C PHE A 10 131.100 -11.376 4.446 1.00 0.00 C ATOM 154 O PHE A 10 132.261 -11.280 4.094 1.00 0.00 O ATOM 155 CB PHE A 10 129.289 -10.256 3.125 1.00 0.00 C ATOM 156 CG PHE A 10 130.228 -9.347 2.365 1.00 0.00 C ATOM 157 CD1 PHE A 10 130.259 -9.390 0.965 1.00 0.00 C ATOM 158 CD2 PHE A 10 131.062 -8.459 3.057 1.00 0.00 C ATOM 159 CE1 PHE A 10 131.123 -8.545 0.256 1.00 0.00 C ATOM 160 CE2 PHE A 10 131.927 -7.615 2.348 1.00 0.00 C ATOM 161 CZ PHE A 10 131.958 -7.658 0.948 1.00 0.00 C ATOM 0 H PHE A 10 128.057 -12.165 4.151 1.00 0.00 H new ATOM 0 HA PHE A 10 130.422 -11.989 2.507 1.00 0.00 H new ATOM 0 HB2 PHE A 10 128.384 -10.428 2.542 1.00 0.00 H new ATOM 0 HB3 PHE A 10 128.983 -9.780 4.057 1.00 0.00 H new ATOM 0 HD1 PHE A 10 129.616 -10.075 0.432 1.00 0.00 H new ATOM 0 HD2 PHE A 10 131.038 -8.425 4.136 1.00 0.00 H new ATOM 0 HE1 PHE A 10 131.145 -8.577 -0.823 1.00 0.00 H new ATOM 0 HE2 PHE A 10 132.570 -6.931 2.881 1.00 0.00 H new ATOM 0 HZ PHE A 10 132.625 -7.008 0.402 1.00 0.00 H new ATOM 171 N VAL A 11 130.771 -11.295 5.705 1.00 0.00 N ATOM 172 CA VAL A 11 131.825 -11.080 6.739 1.00 0.00 C ATOM 173 C VAL A 11 132.477 -12.416 7.109 1.00 0.00 C ATOM 174 O VAL A 11 133.105 -12.539 8.142 1.00 0.00 O ATOM 175 CB VAL A 11 131.193 -10.460 7.983 1.00 0.00 C ATOM 176 CG1 VAL A 11 130.504 -9.147 7.603 1.00 0.00 C ATOM 177 CG2 VAL A 11 130.161 -11.430 8.561 1.00 0.00 C ATOM 0 H VAL A 11 129.819 -11.368 6.064 1.00 0.00 H new ATOM 0 HA VAL A 11 132.587 -10.411 6.340 1.00 0.00 H new ATOM 0 HB VAL A 11 131.965 -10.262 8.727 1.00 0.00 H new ATOM 0 HG11 VAL A 11 130.052 -8.703 8.490 1.00 0.00 H new ATOM 0 HG12 VAL A 11 131.239 -8.458 7.186 1.00 0.00 H new ATOM 0 HG13 VAL A 11 129.730 -9.344 6.861 1.00 0.00 H new ATOM 0 HG21 VAL A 11 129.707 -10.991 9.450 1.00 0.00 H new ATOM 0 HG22 VAL A 11 129.388 -11.625 7.817 1.00 0.00 H new ATOM 0 HG23 VAL A 11 130.651 -12.366 8.828 1.00 0.00 H new ATOM 187 N ALA A 12 132.315 -13.425 6.281 1.00 0.00 N ATOM 188 CA ALA A 12 132.907 -14.771 6.584 1.00 0.00 C ATOM 189 C ALA A 12 133.881 -15.193 5.478 1.00 0.00 C ATOM 190 O ALA A 12 134.550 -16.201 5.590 1.00 0.00 O ATOM 191 CB ALA A 12 131.781 -15.803 6.680 1.00 0.00 C ATOM 0 H ALA A 12 131.796 -13.373 5.405 1.00 0.00 H new ATOM 0 HA ALA A 12 133.449 -14.713 7.528 1.00 0.00 H new ATOM 0 HB1 ALA A 12 132.204 -16.783 6.900 1.00 0.00 H new ATOM 0 HB2 ALA A 12 131.093 -15.518 7.476 1.00 0.00 H new ATOM 0 HB3 ALA A 12 131.243 -15.844 5.733 1.00 0.00 H new ATOM 197 N GLU A 13 133.988 -14.434 4.418 1.00 0.00 N ATOM 198 CA GLU A 13 134.946 -14.813 3.332 1.00 0.00 C ATOM 199 C GLU A 13 135.391 -13.554 2.567 1.00 0.00 C ATOM 200 O GLU A 13 134.637 -12.607 2.449 1.00 0.00 O ATOM 201 CB GLU A 13 134.267 -15.782 2.360 1.00 0.00 C ATOM 202 CG GLU A 13 132.905 -15.225 1.951 1.00 0.00 C ATOM 203 CD GLU A 13 132.242 -16.173 0.950 1.00 0.00 C ATOM 204 OE1 GLU A 13 132.469 -16.004 -0.236 1.00 0.00 O ATOM 205 OE2 GLU A 13 131.515 -17.050 1.388 1.00 0.00 O ATOM 0 H GLU A 13 133.460 -13.576 4.256 1.00 0.00 H new ATOM 0 HA GLU A 13 135.817 -15.294 3.778 1.00 0.00 H new ATOM 0 HB2 GLU A 13 134.892 -15.927 1.479 1.00 0.00 H new ATOM 0 HB3 GLU A 13 134.146 -16.759 2.829 1.00 0.00 H new ATOM 0 HG2 GLU A 13 132.271 -15.106 2.830 1.00 0.00 H new ATOM 0 HG3 GLU A 13 133.024 -14.236 1.507 1.00 0.00 H new ATOM 212 N PRO A 14 136.593 -13.538 2.027 1.00 0.00 N ATOM 213 CA PRO A 14 137.098 -12.372 1.247 1.00 0.00 C ATOM 214 C PRO A 14 136.022 -11.799 0.314 1.00 0.00 C ATOM 215 O PRO A 14 135.049 -12.457 0.002 1.00 0.00 O ATOM 216 CB PRO A 14 138.260 -12.959 0.435 1.00 0.00 C ATOM 217 CG PRO A 14 138.780 -14.101 1.255 1.00 0.00 C ATOM 218 CD PRO A 14 137.602 -14.617 2.103 1.00 0.00 C ATOM 0 HA PRO A 14 137.394 -11.543 1.890 1.00 0.00 H new ATOM 0 HB2 PRO A 14 137.923 -13.300 -0.544 1.00 0.00 H new ATOM 0 HB3 PRO A 14 139.036 -12.213 0.263 1.00 0.00 H new ATOM 0 HG2 PRO A 14 139.169 -14.891 0.613 1.00 0.00 H new ATOM 0 HG3 PRO A 14 139.602 -13.775 1.893 1.00 0.00 H new ATOM 0 HD2 PRO A 14 137.211 -15.555 1.710 1.00 0.00 H new ATOM 0 HD3 PRO A 14 137.906 -14.805 3.133 1.00 0.00 H new ATOM 226 N MET A 15 136.184 -10.581 -0.132 1.00 0.00 N ATOM 227 CA MET A 15 135.165 -9.975 -1.043 1.00 0.00 C ATOM 228 C MET A 15 135.556 -10.223 -2.504 1.00 0.00 C ATOM 229 O MET A 15 134.731 -10.173 -3.395 1.00 0.00 O ATOM 230 CB MET A 15 135.076 -8.470 -0.783 1.00 0.00 C ATOM 231 CG MET A 15 136.482 -7.874 -0.681 1.00 0.00 C ATOM 232 SD MET A 15 136.390 -6.069 -0.829 1.00 0.00 S ATOM 233 CE MET A 15 135.851 -5.697 0.862 1.00 0.00 C ATOM 0 H MET A 15 136.976 -9.979 0.094 1.00 0.00 H new ATOM 0 HA MET A 15 134.196 -10.435 -0.851 1.00 0.00 H new ATOM 0 HB2 MET A 15 134.524 -7.985 -1.588 1.00 0.00 H new ATOM 0 HB3 MET A 15 134.525 -8.284 0.139 1.00 0.00 H new ATOM 0 HG2 MET A 15 136.936 -8.148 0.271 1.00 0.00 H new ATOM 0 HG3 MET A 15 137.118 -8.281 -1.467 1.00 0.00 H new ATOM 0 HE1 MET A 15 135.481 -4.673 0.909 1.00 0.00 H new ATOM 0 HE2 MET A 15 135.055 -6.384 1.150 1.00 0.00 H new ATOM 0 HE3 MET A 15 136.693 -5.810 1.545 1.00 0.00 H new ATOM 243 N GLY A 16 136.809 -10.492 -2.756 1.00 0.00 N ATOM 244 CA GLY A 16 137.255 -10.746 -4.158 1.00 0.00 C ATOM 245 C GLY A 16 136.811 -9.591 -5.060 1.00 0.00 C ATOM 246 O GLY A 16 136.882 -8.437 -4.687 1.00 0.00 O ATOM 0 H GLY A 16 137.544 -10.547 -2.051 1.00 0.00 H new ATOM 0 HA2 GLY A 16 138.340 -10.850 -4.191 1.00 0.00 H new ATOM 0 HA3 GLY A 16 136.834 -11.684 -4.519 1.00 0.00 H new ATOM 250 N GLU A 17 136.369 -9.898 -6.255 1.00 0.00 N ATOM 251 CA GLU A 17 135.933 -8.831 -7.213 1.00 0.00 C ATOM 252 C GLU A 17 134.407 -8.798 -7.296 1.00 0.00 C ATOM 253 O GLU A 17 133.843 -8.504 -8.332 1.00 0.00 O ATOM 254 CB GLU A 17 136.503 -9.140 -8.600 1.00 0.00 C ATOM 255 CG GLU A 17 138.019 -8.930 -8.590 1.00 0.00 C ATOM 256 CD GLU A 17 138.587 -9.252 -9.975 1.00 0.00 C ATOM 257 OE1 GLU A 17 138.873 -10.413 -10.220 1.00 0.00 O ATOM 258 OE2 GLU A 17 138.726 -8.333 -10.765 1.00 0.00 O ATOM 0 H GLU A 17 136.291 -10.850 -6.612 1.00 0.00 H new ATOM 0 HA GLU A 17 136.296 -7.864 -6.865 1.00 0.00 H new ATOM 0 HB2 GLU A 17 136.270 -10.167 -8.880 1.00 0.00 H new ATOM 0 HB3 GLU A 17 136.041 -8.494 -9.346 1.00 0.00 H new ATOM 0 HG2 GLU A 17 138.253 -7.900 -8.320 1.00 0.00 H new ATOM 0 HG3 GLU A 17 138.481 -9.570 -7.838 1.00 0.00 H new ATOM 265 N LYS A 18 133.727 -9.108 -6.225 1.00 0.00 N ATOM 266 CA LYS A 18 132.237 -9.103 -6.261 1.00 0.00 C ATOM 267 C LYS A 18 131.742 -7.692 -6.622 1.00 0.00 C ATOM 268 O LYS A 18 132.391 -6.711 -6.318 1.00 0.00 O ATOM 269 CB LYS A 18 131.705 -9.499 -4.881 1.00 0.00 C ATOM 270 CG LYS A 18 131.929 -10.997 -4.666 1.00 0.00 C ATOM 271 CD LYS A 18 131.297 -11.430 -3.341 1.00 0.00 C ATOM 272 CE LYS A 18 131.815 -12.818 -2.963 1.00 0.00 C ATOM 273 NZ LYS A 18 131.058 -13.329 -1.785 1.00 0.00 N ATOM 0 H LYS A 18 134.139 -9.364 -5.328 1.00 0.00 H new ATOM 0 HA LYS A 18 131.880 -9.812 -7.008 1.00 0.00 H new ATOM 0 HB2 LYS A 18 132.214 -8.928 -4.104 1.00 0.00 H new ATOM 0 HB3 LYS A 18 130.643 -9.263 -4.806 1.00 0.00 H new ATOM 0 HG2 LYS A 18 131.492 -11.561 -5.490 1.00 0.00 H new ATOM 0 HG3 LYS A 18 132.996 -11.217 -4.660 1.00 0.00 H new ATOM 0 HD2 LYS A 18 131.541 -10.713 -2.557 1.00 0.00 H new ATOM 0 HD3 LYS A 18 130.211 -11.447 -3.431 1.00 0.00 H new ATOM 0 HE2 LYS A 18 131.703 -13.501 -3.805 1.00 0.00 H new ATOM 0 HE3 LYS A 18 132.879 -12.770 -2.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 131.554 -14.150 -1.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 130.987 -12.581 -1.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 130.103 -13.614 -2.083 1.00 0.00 H new ATOM 287 N PRO A 19 130.607 -7.587 -7.280 1.00 0.00 N ATOM 288 CA PRO A 19 130.040 -6.268 -7.699 1.00 0.00 C ATOM 289 C PRO A 19 129.595 -5.413 -6.507 1.00 0.00 C ATOM 290 O PRO A 19 129.325 -5.911 -5.432 1.00 0.00 O ATOM 291 CB PRO A 19 128.840 -6.644 -8.588 1.00 0.00 C ATOM 292 CG PRO A 19 128.449 -8.021 -8.151 1.00 0.00 C ATOM 293 CD PRO A 19 129.739 -8.706 -7.694 1.00 0.00 C ATOM 0 HA PRO A 19 130.781 -5.658 -8.215 1.00 0.00 H new ATOM 0 HB2 PRO A 19 128.017 -5.941 -8.458 1.00 0.00 H new ATOM 0 HB3 PRO A 19 129.111 -6.627 -9.644 1.00 0.00 H new ATOM 0 HG2 PRO A 19 127.722 -7.980 -7.340 1.00 0.00 H new ATOM 0 HG3 PRO A 19 127.984 -8.572 -8.969 1.00 0.00 H new ATOM 0 HD2 PRO A 19 129.555 -9.395 -6.870 1.00 0.00 H new ATOM 0 HD3 PRO A 19 130.191 -9.285 -8.499 1.00 0.00 H new ATOM 301 N VAL A 20 129.529 -4.123 -6.698 1.00 0.00 N ATOM 302 CA VAL A 20 129.115 -3.215 -5.592 1.00 0.00 C ATOM 303 C VAL A 20 127.756 -3.644 -5.030 1.00 0.00 C ATOM 304 O VAL A 20 127.531 -3.624 -3.837 1.00 0.00 O ATOM 305 CB VAL A 20 129.018 -1.780 -6.121 1.00 0.00 C ATOM 306 CG1 VAL A 20 128.072 -1.734 -7.325 1.00 0.00 C ATOM 307 CG2 VAL A 20 128.486 -0.859 -5.017 1.00 0.00 C ATOM 0 H VAL A 20 129.746 -3.657 -7.579 1.00 0.00 H new ATOM 0 HA VAL A 20 129.858 -3.267 -4.796 1.00 0.00 H new ATOM 0 HB VAL A 20 130.008 -1.444 -6.428 1.00 0.00 H new ATOM 0 HG11 VAL A 20 128.006 -0.712 -7.697 1.00 0.00 H new ATOM 0 HG12 VAL A 20 128.454 -2.383 -8.113 1.00 0.00 H new ATOM 0 HG13 VAL A 20 127.082 -2.074 -7.023 1.00 0.00 H new ATOM 0 HG21 VAL A 20 128.418 0.161 -5.395 1.00 0.00 H new ATOM 0 HG22 VAL A 20 127.498 -1.197 -4.706 1.00 0.00 H new ATOM 0 HG23 VAL A 20 129.164 -0.885 -4.164 1.00 0.00 H new ATOM 317 N GLY A 21 126.837 -4.009 -5.890 1.00 0.00 N ATOM 318 CA GLY A 21 125.478 -4.413 -5.428 1.00 0.00 C ATOM 319 C GLY A 21 125.554 -5.669 -4.559 1.00 0.00 C ATOM 320 O GLY A 21 124.560 -6.112 -4.020 1.00 0.00 O ATOM 0 H GLY A 21 126.974 -4.044 -6.900 1.00 0.00 H new ATOM 0 HA2 GLY A 21 125.024 -3.600 -4.862 1.00 0.00 H new ATOM 0 HA3 GLY A 21 124.836 -4.599 -6.289 1.00 0.00 H new ATOM 324 N SER A 22 126.711 -6.255 -4.409 1.00 0.00 N ATOM 325 CA SER A 22 126.811 -7.480 -3.565 1.00 0.00 C ATOM 326 C SER A 22 126.899 -7.071 -2.093 1.00 0.00 C ATOM 327 O SER A 22 126.607 -7.847 -1.205 1.00 0.00 O ATOM 328 CB SER A 22 128.060 -8.272 -3.954 1.00 0.00 C ATOM 329 OG SER A 22 128.081 -9.497 -3.231 1.00 0.00 O ATOM 0 H SER A 22 127.585 -5.942 -4.831 1.00 0.00 H new ATOM 0 HA SER A 22 125.930 -8.103 -3.719 1.00 0.00 H new ATOM 0 HB2 SER A 22 128.061 -8.469 -5.026 1.00 0.00 H new ATOM 0 HB3 SER A 22 128.956 -7.691 -3.735 1.00 0.00 H new ATOM 0 HG SER A 22 128.998 -9.692 -2.944 1.00 0.00 H new ATOM 335 N LEU A 23 127.300 -5.857 -1.826 1.00 0.00 N ATOM 336 CA LEU A 23 127.405 -5.404 -0.411 1.00 0.00 C ATOM 337 C LEU A 23 126.011 -5.344 0.216 1.00 0.00 C ATOM 338 O LEU A 23 125.046 -4.947 -0.405 1.00 0.00 O ATOM 339 CB LEU A 23 128.050 -4.019 -0.358 1.00 0.00 C ATOM 340 CG LEU A 23 129.482 -4.094 -0.905 1.00 0.00 C ATOM 341 CD1 LEU A 23 130.043 -2.675 -1.037 1.00 0.00 C ATOM 342 CD2 LEU A 23 130.376 -4.925 0.041 1.00 0.00 C ATOM 0 H LEU A 23 127.559 -5.161 -2.526 1.00 0.00 H new ATOM 0 HA LEU A 23 128.021 -6.110 0.146 1.00 0.00 H new ATOM 0 HB2 LEU A 23 127.463 -3.311 -0.944 1.00 0.00 H new ATOM 0 HB3 LEU A 23 128.061 -3.651 0.668 1.00 0.00 H new ATOM 0 HG LEU A 23 129.469 -4.578 -1.882 1.00 0.00 H new ATOM 0 HD11 LEU A 23 131.061 -2.721 -1.425 1.00 0.00 H new ATOM 0 HD12 LEU A 23 129.419 -2.099 -1.721 1.00 0.00 H new ATOM 0 HD13 LEU A 23 130.049 -2.194 -0.059 1.00 0.00 H new ATOM 0 HD21 LEU A 23 131.388 -4.969 -0.361 1.00 0.00 H new ATOM 0 HD22 LEU A 23 130.396 -4.458 1.026 1.00 0.00 H new ATOM 0 HD23 LEU A 23 129.975 -5.935 0.126 1.00 0.00 H new ATOM 354 N ALA A 24 125.915 -5.736 1.448 1.00 0.00 N ATOM 355 CA ALA A 24 124.595 -5.706 2.135 1.00 0.00 C ATOM 356 C ALA A 24 124.100 -4.256 2.243 1.00 0.00 C ATOM 357 O ALA A 24 124.839 -3.357 2.590 1.00 0.00 O ATOM 358 CB ALA A 24 124.732 -6.318 3.534 1.00 0.00 C ATOM 0 H ALA A 24 126.692 -6.077 2.014 1.00 0.00 H new ATOM 0 HA ALA A 24 123.873 -6.285 1.560 1.00 0.00 H new ATOM 0 HB1 ALA A 24 123.765 -6.296 4.037 1.00 0.00 H new ATOM 0 HB2 ALA A 24 125.073 -7.350 3.448 1.00 0.00 H new ATOM 0 HB3 ALA A 24 125.455 -5.744 4.113 1.00 0.00 H new ATOM 364 N GLY A 25 122.844 -4.036 1.943 1.00 0.00 N ATOM 365 CA GLY A 25 122.268 -2.653 2.017 1.00 0.00 C ATOM 366 C GLY A 25 122.127 -2.065 0.608 1.00 0.00 C ATOM 367 O GLY A 25 121.330 -1.177 0.380 1.00 0.00 O ATOM 0 H GLY A 25 122.187 -4.758 1.648 1.00 0.00 H new ATOM 0 HA2 GLY A 25 121.295 -2.682 2.507 1.00 0.00 H new ATOM 0 HA3 GLY A 25 122.911 -2.015 2.623 1.00 0.00 H new ATOM 371 N ILE A 26 122.884 -2.554 -0.344 1.00 0.00 N ATOM 372 CA ILE A 26 122.777 -2.018 -1.740 1.00 0.00 C ATOM 373 C ILE A 26 121.895 -2.958 -2.559 1.00 0.00 C ATOM 374 O ILE A 26 122.206 -4.122 -2.717 1.00 0.00 O ATOM 375 CB ILE A 26 124.165 -1.958 -2.381 1.00 0.00 C ATOM 376 CG1 ILE A 26 125.148 -1.251 -1.439 1.00 0.00 C ATOM 377 CG2 ILE A 26 124.077 -1.189 -3.701 1.00 0.00 C ATOM 378 CD1 ILE A 26 124.578 0.100 -0.992 1.00 0.00 C ATOM 0 H ILE A 26 123.570 -3.299 -0.217 1.00 0.00 H new ATOM 0 HA ILE A 26 122.347 -1.017 -1.714 1.00 0.00 H new ATOM 0 HB ILE A 26 124.520 -2.971 -2.568 1.00 0.00 H new ATOM 0 HG12 ILE A 26 125.342 -1.877 -0.568 1.00 0.00 H new ATOM 0 HG13 ILE A 26 126.102 -1.102 -1.944 1.00 0.00 H new ATOM 0 HG21 ILE A 26 125.064 -1.143 -4.162 1.00 0.00 H new ATOM 0 HG22 ILE A 26 123.386 -1.698 -4.373 1.00 0.00 H new ATOM 0 HG23 ILE A 26 123.719 -0.177 -3.510 1.00 0.00 H new ATOM 0 HD11 ILE A 26 125.286 0.591 -0.324 1.00 0.00 H new ATOM 0 HD12 ILE A 26 124.407 0.730 -1.865 1.00 0.00 H new ATOM 0 HD13 ILE A 26 123.635 -0.058 -0.468 1.00 0.00 H new ATOM 390 N GLY A 27 120.799 -2.480 -3.092 1.00 0.00 N ATOM 391 CA GLY A 27 119.917 -3.368 -3.907 1.00 0.00 C ATOM 392 C GLY A 27 120.295 -3.246 -5.384 1.00 0.00 C ATOM 393 O GLY A 27 121.184 -2.501 -5.749 1.00 0.00 O ATOM 0 H GLY A 27 120.478 -1.516 -2.998 1.00 0.00 H new ATOM 0 HA2 GLY A 27 120.021 -4.402 -3.578 1.00 0.00 H new ATOM 0 HA3 GLY A 27 118.872 -3.091 -3.764 1.00 0.00 H new ATOM 397 N GLU A 28 119.641 -3.988 -6.235 1.00 0.00 N ATOM 398 CA GLU A 28 119.980 -3.927 -7.687 1.00 0.00 C ATOM 399 C GLU A 28 119.811 -2.496 -8.204 1.00 0.00 C ATOM 400 O GLU A 28 120.601 -2.018 -8.995 1.00 0.00 O ATOM 401 CB GLU A 28 119.052 -4.856 -8.473 1.00 0.00 C ATOM 402 CG GLU A 28 119.394 -6.312 -8.155 1.00 0.00 C ATOM 403 CD GLU A 28 118.478 -7.238 -8.959 1.00 0.00 C ATOM 404 OE1 GLU A 28 117.376 -7.493 -8.501 1.00 0.00 O ATOM 405 OE2 GLU A 28 118.894 -7.674 -10.019 1.00 0.00 O ATOM 0 H GLU A 28 118.889 -4.632 -5.990 1.00 0.00 H new ATOM 0 HA GLU A 28 121.015 -4.242 -7.820 1.00 0.00 H new ATOM 0 HB2 GLU A 28 118.013 -4.651 -8.215 1.00 0.00 H new ATOM 0 HB3 GLU A 28 119.157 -4.672 -9.542 1.00 0.00 H new ATOM 0 HG2 GLU A 28 120.437 -6.513 -8.399 1.00 0.00 H new ATOM 0 HG3 GLU A 28 119.274 -6.500 -7.088 1.00 0.00 H new ATOM 412 N VAL A 29 118.788 -1.809 -7.776 1.00 0.00 N ATOM 413 CA VAL A 29 118.578 -0.414 -8.258 1.00 0.00 C ATOM 414 C VAL A 29 119.706 0.479 -7.738 1.00 0.00 C ATOM 415 O VAL A 29 120.270 1.277 -8.460 1.00 0.00 O ATOM 416 CB VAL A 29 117.230 0.102 -7.742 1.00 0.00 C ATOM 417 CG1 VAL A 29 117.086 1.594 -8.061 1.00 0.00 C ATOM 418 CG2 VAL A 29 116.096 -0.680 -8.410 1.00 0.00 C ATOM 0 H VAL A 29 118.090 -2.151 -7.116 1.00 0.00 H new ATOM 0 HA VAL A 29 118.579 -0.397 -9.348 1.00 0.00 H new ATOM 0 HB VAL A 29 117.181 -0.037 -6.662 1.00 0.00 H new ATOM 0 HG11 VAL A 29 116.126 1.954 -7.692 1.00 0.00 H new ATOM 0 HG12 VAL A 29 117.891 2.148 -7.579 1.00 0.00 H new ATOM 0 HG13 VAL A 29 117.138 1.742 -9.140 1.00 0.00 H new ATOM 0 HG21 VAL A 29 115.137 -0.314 -8.044 1.00 0.00 H new ATOM 0 HG22 VAL A 29 116.148 -0.544 -9.490 1.00 0.00 H new ATOM 0 HG23 VAL A 29 116.195 -1.739 -8.172 1.00 0.00 H new ATOM 428 N LEU A 30 120.028 0.357 -6.481 1.00 0.00 N ATOM 429 CA LEU A 30 121.105 1.198 -5.891 1.00 0.00 C ATOM 430 C LEU A 30 122.446 0.831 -6.527 1.00 0.00 C ATOM 431 O LEU A 30 123.287 1.674 -6.759 1.00 0.00 O ATOM 432 CB LEU A 30 121.175 0.950 -4.382 1.00 0.00 C ATOM 433 CG LEU A 30 119.837 1.311 -3.725 1.00 0.00 C ATOM 434 CD1 LEU A 30 119.915 0.997 -2.229 1.00 0.00 C ATOM 435 CD2 LEU A 30 119.528 2.806 -3.924 1.00 0.00 C ATOM 0 H LEU A 30 119.587 -0.295 -5.832 1.00 0.00 H new ATOM 0 HA LEU A 30 120.888 2.249 -6.079 1.00 0.00 H new ATOM 0 HB2 LEU A 30 121.413 -0.096 -4.188 1.00 0.00 H new ATOM 0 HB3 LEU A 30 121.976 1.546 -3.945 1.00 0.00 H new ATOM 0 HG LEU A 30 119.041 0.727 -4.187 1.00 0.00 H new ATOM 0 HD11 LEU A 30 118.967 1.251 -1.754 1.00 0.00 H new ATOM 0 HD12 LEU A 30 120.117 -0.065 -2.090 1.00 0.00 H new ATOM 0 HD13 LEU A 30 120.716 1.581 -1.776 1.00 0.00 H new ATOM 0 HD21 LEU A 30 118.575 3.047 -3.452 1.00 0.00 H new ATOM 0 HD22 LEU A 30 120.319 3.404 -3.471 1.00 0.00 H new ATOM 0 HD23 LEU A 30 119.471 3.027 -4.990 1.00 0.00 H new ATOM 447 N GLY A 31 122.646 -0.423 -6.807 1.00 0.00 N ATOM 448 CA GLY A 31 123.929 -0.850 -7.429 1.00 0.00 C ATOM 449 C GLY A 31 124.105 -0.137 -8.771 1.00 0.00 C ATOM 450 O GLY A 31 125.193 0.264 -9.135 1.00 0.00 O ATOM 0 H GLY A 31 121.977 -1.173 -6.632 1.00 0.00 H new ATOM 0 HA2 GLY A 31 124.763 -0.615 -6.767 1.00 0.00 H new ATOM 0 HA3 GLY A 31 123.933 -1.930 -7.575 1.00 0.00 H new ATOM 454 N LYS A 32 123.043 0.009 -9.517 1.00 0.00 N ATOM 455 CA LYS A 32 123.145 0.679 -10.846 1.00 0.00 C ATOM 456 C LYS A 32 123.572 2.146 -10.684 1.00 0.00 C ATOM 457 O LYS A 32 124.357 2.651 -11.462 1.00 0.00 O ATOM 458 CB LYS A 32 121.783 0.614 -11.540 1.00 0.00 C ATOM 459 CG LYS A 32 121.903 1.157 -12.966 1.00 0.00 C ATOM 460 CD LYS A 32 120.538 1.086 -13.651 1.00 0.00 C ATOM 461 CE LYS A 32 120.644 1.646 -15.070 1.00 0.00 C ATOM 462 NZ LYS A 32 119.318 1.548 -15.743 1.00 0.00 N ATOM 0 H LYS A 32 122.107 -0.307 -9.263 1.00 0.00 H new ATOM 0 HA LYS A 32 123.897 0.167 -11.446 1.00 0.00 H new ATOM 0 HB2 LYS A 32 121.424 -0.415 -11.562 1.00 0.00 H new ATOM 0 HB3 LYS A 32 121.051 1.195 -10.980 1.00 0.00 H new ATOM 0 HG2 LYS A 32 122.260 2.187 -12.946 1.00 0.00 H new ATOM 0 HG3 LYS A 32 122.635 0.577 -13.528 1.00 0.00 H new ATOM 0 HD2 LYS A 32 120.189 0.054 -13.682 1.00 0.00 H new ATOM 0 HD3 LYS A 32 119.804 1.654 -13.080 1.00 0.00 H new ATOM 0 HE2 LYS A 32 120.972 2.685 -15.039 1.00 0.00 H new ATOM 0 HE3 LYS A 32 121.393 1.092 -15.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 119.390 1.929 -16.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 119.023 0.552 -15.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 118.615 2.095 -15.206 1.00 0.00 H new ATOM 476 N LYS A 33 123.069 2.843 -9.698 1.00 0.00 N ATOM 477 CA LYS A 33 123.472 4.275 -9.539 1.00 0.00 C ATOM 478 C LYS A 33 124.951 4.368 -9.160 1.00 0.00 C ATOM 479 O LYS A 33 125.706 5.104 -9.763 1.00 0.00 O ATOM 480 CB LYS A 33 122.624 4.932 -8.448 1.00 0.00 C ATOM 481 CG LYS A 33 121.188 5.089 -8.946 1.00 0.00 C ATOM 482 CD LYS A 33 120.338 5.748 -7.857 1.00 0.00 C ATOM 483 CE LYS A 33 118.901 5.906 -8.357 1.00 0.00 C ATOM 484 NZ LYS A 33 118.916 6.483 -9.732 1.00 0.00 N ATOM 0 H LYS A 33 122.407 2.491 -9.006 1.00 0.00 H new ATOM 0 HA LYS A 33 123.313 4.792 -10.485 1.00 0.00 H new ATOM 0 HB2 LYS A 33 122.642 4.325 -7.543 1.00 0.00 H new ATOM 0 HB3 LYS A 33 123.038 5.906 -8.187 1.00 0.00 H new ATOM 0 HG2 LYS A 33 121.170 5.695 -9.852 1.00 0.00 H new ATOM 0 HG3 LYS A 33 120.774 4.115 -9.206 1.00 0.00 H new ATOM 0 HD2 LYS A 33 120.355 5.142 -6.951 1.00 0.00 H new ATOM 0 HD3 LYS A 33 120.753 6.722 -7.596 1.00 0.00 H new ATOM 0 HE2 LYS A 33 118.398 4.939 -8.362 1.00 0.00 H new ATOM 0 HE3 LYS A 33 118.339 6.555 -7.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 118.025 6.990 -9.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 119.714 7.144 -9.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 119.020 5.718 -10.429 1.00 0.00 H new ATOM 498 N LEU A 34 125.379 3.619 -8.187 1.00 0.00 N ATOM 499 CA LEU A 34 126.816 3.658 -7.798 1.00 0.00 C ATOM 500 C LEU A 34 127.668 3.232 -9.000 1.00 0.00 C ATOM 501 O LEU A 34 128.724 3.775 -9.258 1.00 0.00 O ATOM 502 CB LEU A 34 127.050 2.719 -6.606 1.00 0.00 C ATOM 503 CG LEU A 34 126.390 3.299 -5.339 1.00 0.00 C ATOM 504 CD1 LEU A 34 126.169 2.178 -4.320 1.00 0.00 C ATOM 505 CD2 LEU A 34 127.302 4.364 -4.700 1.00 0.00 C ATOM 0 H LEU A 34 124.798 2.981 -7.643 1.00 0.00 H new ATOM 0 HA LEU A 34 127.099 4.668 -7.502 1.00 0.00 H new ATOM 0 HB2 LEU A 34 126.637 1.734 -6.822 1.00 0.00 H new ATOM 0 HB3 LEU A 34 128.119 2.587 -6.441 1.00 0.00 H new ATOM 0 HG LEU A 34 125.439 3.752 -5.620 1.00 0.00 H new ATOM 0 HD11 LEU A 34 125.702 2.588 -3.424 1.00 0.00 H new ATOM 0 HD12 LEU A 34 125.519 1.417 -4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 34 127.128 1.731 -4.058 1.00 0.00 H new ATOM 0 HD21 LEU A 34 126.823 4.765 -3.807 1.00 0.00 H new ATOM 0 HD22 LEU A 34 128.255 3.911 -4.428 1.00 0.00 H new ATOM 0 HD23 LEU A 34 127.474 5.171 -5.412 1.00 0.00 H new ATOM 517 N GLU A 35 127.210 2.252 -9.724 1.00 0.00 N ATOM 518 CA GLU A 35 127.991 1.772 -10.904 1.00 0.00 C ATOM 519 C GLU A 35 128.175 2.914 -11.909 1.00 0.00 C ATOM 520 O GLU A 35 129.256 3.136 -12.417 1.00 0.00 O ATOM 521 CB GLU A 35 127.241 0.611 -11.568 1.00 0.00 C ATOM 522 CG GLU A 35 128.030 0.108 -12.781 1.00 0.00 C ATOM 523 CD GLU A 35 127.309 -1.094 -13.393 1.00 0.00 C ATOM 524 OE1 GLU A 35 126.381 -1.584 -12.771 1.00 0.00 O ATOM 525 OE2 GLU A 35 127.698 -1.505 -14.474 1.00 0.00 O ATOM 0 H GLU A 35 126.332 1.761 -9.554 1.00 0.00 H new ATOM 0 HA GLU A 35 128.973 1.431 -10.575 1.00 0.00 H new ATOM 0 HB2 GLU A 35 127.101 -0.199 -10.853 1.00 0.00 H new ATOM 0 HB3 GLU A 35 126.249 0.938 -11.878 1.00 0.00 H new ATOM 0 HG2 GLU A 35 128.127 0.903 -13.520 1.00 0.00 H new ATOM 0 HG3 GLU A 35 129.039 -0.173 -12.481 1.00 0.00 H new ATOM 532 N GLU A 36 127.132 3.641 -12.199 1.00 0.00 N ATOM 533 CA GLU A 36 127.251 4.768 -13.167 1.00 0.00 C ATOM 534 C GLU A 36 128.184 5.830 -12.580 1.00 0.00 C ATOM 535 O GLU A 36 128.703 6.678 -13.279 1.00 0.00 O ATOM 536 CB GLU A 36 125.864 5.370 -13.424 1.00 0.00 C ATOM 537 CG GLU A 36 125.966 6.503 -14.451 1.00 0.00 C ATOM 538 CD GLU A 36 124.577 7.082 -14.715 1.00 0.00 C ATOM 539 OE1 GLU A 36 123.615 6.511 -14.228 1.00 0.00 O ATOM 540 OE2 GLU A 36 124.497 8.087 -15.404 1.00 0.00 O ATOM 0 H GLU A 36 126.201 3.503 -11.807 1.00 0.00 H new ATOM 0 HA GLU A 36 127.660 4.408 -14.111 1.00 0.00 H new ATOM 0 HB2 GLU A 36 125.185 4.598 -13.788 1.00 0.00 H new ATOM 0 HB3 GLU A 36 125.445 5.750 -12.492 1.00 0.00 H new ATOM 0 HG2 GLU A 36 126.632 7.283 -14.082 1.00 0.00 H new ATOM 0 HG3 GLU A 36 126.397 6.128 -15.379 1.00 0.00 H new ATOM 547 N ARG A 37 128.386 5.798 -11.293 1.00 0.00 N ATOM 548 CA ARG A 37 129.264 6.823 -10.651 1.00 0.00 C ATOM 549 C ARG A 37 130.721 6.346 -10.627 1.00 0.00 C ATOM 550 O ARG A 37 131.597 7.052 -10.168 1.00 0.00 O ATOM 551 CB ARG A 37 128.773 7.092 -9.227 1.00 0.00 C ATOM 552 CG ARG A 37 127.440 7.839 -9.299 1.00 0.00 C ATOM 553 CD ARG A 37 126.931 8.138 -7.886 1.00 0.00 C ATOM 554 NE ARG A 37 125.456 8.405 -7.929 1.00 0.00 N ATOM 555 CZ ARG A 37 124.947 9.293 -8.741 1.00 0.00 C ATOM 556 NH1 ARG A 37 125.718 10.135 -9.371 1.00 0.00 N ATOM 557 NH2 ARG A 37 123.652 9.381 -8.874 1.00 0.00 N ATOM 0 H ARG A 37 127.984 5.110 -10.657 1.00 0.00 H new ATOM 0 HA ARG A 37 129.217 7.745 -11.231 1.00 0.00 H new ATOM 0 HB2 ARG A 37 128.651 6.154 -8.686 1.00 0.00 H new ATOM 0 HB3 ARG A 37 129.508 7.682 -8.680 1.00 0.00 H new ATOM 0 HG2 ARG A 37 127.564 8.769 -9.854 1.00 0.00 H new ATOM 0 HG3 ARG A 37 126.707 7.240 -9.840 1.00 0.00 H new ATOM 0 HD2 ARG A 37 127.139 7.295 -7.228 1.00 0.00 H new ATOM 0 HD3 ARG A 37 127.455 9.001 -7.475 1.00 0.00 H new ATOM 0 HE ARG A 37 124.836 7.882 -7.311 1.00 0.00 H new ATOM 0 HH11 ARG A 37 126.728 10.104 -9.232 1.00 0.00 H new ATOM 0 HH12 ARG A 37 125.311 10.825 -10.003 1.00 0.00 H new ATOM 0 HH21 ARG A 37 123.042 8.758 -8.345 1.00 0.00 H new ATOM 0 HH22 ARG A 37 123.250 10.073 -9.507 1.00 0.00 H new ATOM 571 N GLY A 38 131.000 5.179 -11.158 1.00 0.00 N ATOM 572 CA GLY A 38 132.419 4.691 -11.212 1.00 0.00 C ATOM 573 C GLY A 38 132.688 3.607 -10.167 1.00 0.00 C ATOM 574 O GLY A 38 133.800 3.130 -10.047 1.00 0.00 O ATOM 0 H GLY A 38 130.309 4.543 -11.556 1.00 0.00 H new ATOM 0 HA2 GLY A 38 132.630 4.298 -12.206 1.00 0.00 H new ATOM 0 HA3 GLY A 38 133.098 5.528 -11.050 1.00 0.00 H new ATOM 578 N PHE A 39 131.697 3.190 -9.423 1.00 0.00 N ATOM 579 CA PHE A 39 131.919 2.110 -8.408 1.00 0.00 C ATOM 580 C PHE A 39 131.325 0.812 -8.956 1.00 0.00 C ATOM 581 O PHE A 39 130.271 0.371 -8.542 1.00 0.00 O ATOM 582 CB PHE A 39 131.209 2.477 -7.106 1.00 0.00 C ATOM 583 CG PHE A 39 131.757 3.775 -6.566 1.00 0.00 C ATOM 584 CD1 PHE A 39 132.868 3.768 -5.718 1.00 0.00 C ATOM 585 CD2 PHE A 39 131.152 4.985 -6.917 1.00 0.00 C ATOM 586 CE1 PHE A 39 133.375 4.974 -5.220 1.00 0.00 C ATOM 587 CE2 PHE A 39 131.657 6.191 -6.420 1.00 0.00 C ATOM 588 CZ PHE A 39 132.771 6.187 -5.571 1.00 0.00 C ATOM 0 H PHE A 39 130.743 3.548 -9.472 1.00 0.00 H new ATOM 0 HA PHE A 39 132.985 1.991 -8.213 1.00 0.00 H new ATOM 0 HB2 PHE A 39 130.137 2.570 -7.281 1.00 0.00 H new ATOM 0 HB3 PHE A 39 131.344 1.683 -6.372 1.00 0.00 H new ATOM 0 HD1 PHE A 39 133.335 2.833 -5.447 1.00 0.00 H new ATOM 0 HD2 PHE A 39 130.294 4.989 -7.573 1.00 0.00 H new ATOM 0 HE1 PHE A 39 134.233 4.969 -4.564 1.00 0.00 H new ATOM 0 HE2 PHE A 39 131.188 7.125 -6.691 1.00 0.00 H new ATOM 0 HZ PHE A 39 133.163 7.118 -5.188 1.00 0.00 H new ATOM 598 N ASP A 40 131.990 0.209 -9.904 1.00 0.00 N ATOM 599 CA ASP A 40 131.454 -1.047 -10.503 1.00 0.00 C ATOM 600 C ASP A 40 131.804 -2.252 -9.627 1.00 0.00 C ATOM 601 O ASP A 40 131.317 -3.343 -9.853 1.00 0.00 O ATOM 602 CB ASP A 40 132.053 -1.241 -11.899 1.00 0.00 C ATOM 603 CG ASP A 40 133.557 -1.498 -11.783 1.00 0.00 C ATOM 604 OD1 ASP A 40 134.133 -1.088 -10.789 1.00 0.00 O ATOM 605 OD2 ASP A 40 134.106 -2.104 -12.689 1.00 0.00 O ATOM 0 H ASP A 40 132.878 0.530 -10.289 1.00 0.00 H new ATOM 0 HA ASP A 40 130.369 -0.967 -10.572 1.00 0.00 H new ATOM 0 HB2 ASP A 40 131.569 -2.079 -12.400 1.00 0.00 H new ATOM 0 HB3 ASP A 40 131.871 -0.356 -12.509 1.00 0.00 H new ATOM 610 N LYS A 41 132.652 -2.077 -8.640 1.00 0.00 N ATOM 611 CA LYS A 41 133.039 -3.230 -7.763 1.00 0.00 C ATOM 612 C LYS A 41 133.032 -2.799 -6.293 1.00 0.00 C ATOM 613 O LYS A 41 133.115 -1.631 -5.970 1.00 0.00 O ATOM 614 CB LYS A 41 134.427 -3.716 -8.172 1.00 0.00 C ATOM 615 CG LYS A 41 134.333 -4.345 -9.566 1.00 0.00 C ATOM 616 CD LYS A 41 135.710 -4.833 -10.005 1.00 0.00 C ATOM 617 CE LYS A 41 135.664 -5.235 -11.481 1.00 0.00 C ATOM 618 NZ LYS A 41 134.748 -6.398 -11.657 1.00 0.00 N ATOM 0 H LYS A 41 133.092 -1.188 -8.404 1.00 0.00 H new ATOM 0 HA LYS A 41 132.322 -4.042 -7.881 1.00 0.00 H new ATOM 0 HB2 LYS A 41 135.132 -2.885 -8.179 1.00 0.00 H new ATOM 0 HB3 LYS A 41 134.800 -4.445 -7.452 1.00 0.00 H new ATOM 0 HG2 LYS A 41 133.629 -5.177 -9.553 1.00 0.00 H new ATOM 0 HG3 LYS A 41 133.951 -3.615 -10.280 1.00 0.00 H new ATOM 0 HD2 LYS A 41 136.451 -4.048 -9.854 1.00 0.00 H new ATOM 0 HD3 LYS A 41 136.018 -5.683 -9.395 1.00 0.00 H new ATOM 0 HE2 LYS A 41 135.322 -4.395 -12.086 1.00 0.00 H new ATOM 0 HE3 LYS A 41 136.664 -5.492 -11.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 134.871 -6.796 -12.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 134.969 -7.125 -10.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 133.763 -6.086 -11.537 1.00 0.00 H new ATOM 632 N ALA A 42 132.885 -3.745 -5.407 1.00 0.00 N ATOM 633 CA ALA A 42 132.818 -3.428 -3.948 1.00 0.00 C ATOM 634 C ALA A 42 134.140 -2.867 -3.394 1.00 0.00 C ATOM 635 O ALA A 42 134.129 -1.988 -2.557 1.00 0.00 O ATOM 636 CB ALA A 42 132.470 -4.707 -3.187 1.00 0.00 C ATOM 0 H ALA A 42 132.807 -4.737 -5.632 1.00 0.00 H new ATOM 0 HA ALA A 42 132.058 -2.658 -3.815 1.00 0.00 H new ATOM 0 HB1 ALA A 42 132.417 -4.492 -2.120 1.00 0.00 H new ATOM 0 HB2 ALA A 42 131.506 -5.083 -3.530 1.00 0.00 H new ATOM 0 HB3 ALA A 42 133.238 -5.459 -3.368 1.00 0.00 H new ATOM 642 N TYR A 43 135.272 -3.385 -3.794 1.00 0.00 N ATOM 643 CA TYR A 43 136.550 -2.880 -3.199 1.00 0.00 C ATOM 644 C TYR A 43 136.751 -1.384 -3.476 1.00 0.00 C ATOM 645 O TYR A 43 137.498 -0.727 -2.779 1.00 0.00 O ATOM 646 CB TYR A 43 137.762 -3.691 -3.692 1.00 0.00 C ATOM 647 CG TYR A 43 138.065 -3.427 -5.150 1.00 0.00 C ATOM 648 CD1 TYR A 43 138.693 -2.235 -5.534 1.00 0.00 C ATOM 649 CD2 TYR A 43 137.751 -4.391 -6.116 1.00 0.00 C ATOM 650 CE1 TYR A 43 139.001 -2.006 -6.879 1.00 0.00 C ATOM 651 CE2 TYR A 43 138.059 -4.161 -7.461 1.00 0.00 C ATOM 652 CZ TYR A 43 138.684 -2.969 -7.842 1.00 0.00 C ATOM 653 OH TYR A 43 138.990 -2.745 -9.169 1.00 0.00 O ATOM 0 H TYR A 43 135.370 -4.121 -4.493 1.00 0.00 H new ATOM 0 HA TYR A 43 136.472 -3.013 -2.120 1.00 0.00 H new ATOM 0 HB2 TYR A 43 138.635 -3.441 -3.089 1.00 0.00 H new ATOM 0 HB3 TYR A 43 137.569 -4.754 -3.548 1.00 0.00 H new ATOM 0 HD1 TYR A 43 138.940 -1.492 -4.790 1.00 0.00 H new ATOM 0 HD2 TYR A 43 137.271 -5.313 -5.822 1.00 0.00 H new ATOM 0 HE1 TYR A 43 139.483 -1.086 -7.174 1.00 0.00 H new ATOM 0 HE2 TYR A 43 137.814 -4.904 -8.206 1.00 0.00 H new ATOM 0 HH TYR A 43 138.703 -3.514 -9.705 1.00 0.00 H new ATOM 663 N VAL A 44 136.086 -0.818 -4.447 1.00 0.00 N ATOM 664 CA VAL A 44 136.260 0.649 -4.685 1.00 0.00 C ATOM 665 C VAL A 44 135.430 1.385 -3.630 1.00 0.00 C ATOM 666 O VAL A 44 135.776 2.451 -3.160 1.00 0.00 O ATOM 667 CB VAL A 44 135.772 1.027 -6.092 1.00 0.00 C ATOM 668 CG1 VAL A 44 136.010 2.521 -6.348 1.00 0.00 C ATOM 669 CG2 VAL A 44 136.543 0.218 -7.136 1.00 0.00 C ATOM 0 H VAL A 44 135.441 -1.295 -5.077 1.00 0.00 H new ATOM 0 HA VAL A 44 137.313 0.922 -4.612 1.00 0.00 H new ATOM 0 HB VAL A 44 134.706 0.810 -6.164 1.00 0.00 H new ATOM 0 HG11 VAL A 44 135.661 2.779 -7.348 1.00 0.00 H new ATOM 0 HG12 VAL A 44 135.463 3.108 -5.610 1.00 0.00 H new ATOM 0 HG13 VAL A 44 137.075 2.739 -6.268 1.00 0.00 H new ATOM 0 HG21 VAL A 44 136.196 0.487 -8.134 1.00 0.00 H new ATOM 0 HG22 VAL A 44 137.608 0.436 -7.051 1.00 0.00 H new ATOM 0 HG23 VAL A 44 136.376 -0.846 -6.968 1.00 0.00 H new ATOM 679 N VAL A 45 134.334 0.783 -3.254 1.00 0.00 N ATOM 680 CA VAL A 45 133.445 1.386 -2.224 1.00 0.00 C ATOM 681 C VAL A 45 134.095 1.184 -0.856 1.00 0.00 C ATOM 682 O VAL A 45 134.066 2.055 -0.008 1.00 0.00 O ATOM 683 CB VAL A 45 132.080 0.694 -2.249 1.00 0.00 C ATOM 684 CG1 VAL A 45 131.231 1.192 -1.078 1.00 0.00 C ATOM 685 CG2 VAL A 45 131.370 1.017 -3.566 1.00 0.00 C ATOM 0 H VAL A 45 134.014 -0.113 -3.623 1.00 0.00 H new ATOM 0 HA VAL A 45 133.304 2.448 -2.425 1.00 0.00 H new ATOM 0 HB VAL A 45 132.218 -0.384 -2.163 1.00 0.00 H new ATOM 0 HG11 VAL A 45 130.259 0.698 -1.097 1.00 0.00 H new ATOM 0 HG12 VAL A 45 131.736 0.963 -0.139 1.00 0.00 H new ATOM 0 HG13 VAL A 45 131.092 2.270 -1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 45 130.398 0.525 -3.585 1.00 0.00 H new ATOM 0 HG22 VAL A 45 131.233 2.095 -3.651 1.00 0.00 H new ATOM 0 HG23 VAL A 45 131.973 0.661 -4.401 1.00 0.00 H new ATOM 695 N LEU A 46 134.708 0.052 -0.644 1.00 0.00 N ATOM 696 CA LEU A 46 135.386 -0.191 0.657 1.00 0.00 C ATOM 697 C LEU A 46 136.461 0.885 0.827 1.00 0.00 C ATOM 698 O LEU A 46 136.683 1.397 1.903 1.00 0.00 O ATOM 699 CB LEU A 46 136.038 -1.586 0.655 1.00 0.00 C ATOM 700 CG LEU A 46 136.748 -1.856 2.004 1.00 0.00 C ATOM 701 CD1 LEU A 46 135.701 -2.002 3.126 1.00 0.00 C ATOM 702 CD2 LEU A 46 137.620 -3.139 1.917 1.00 0.00 C ATOM 0 H LEU A 46 134.768 -0.713 -1.316 1.00 0.00 H new ATOM 0 HA LEU A 46 134.669 -0.149 1.476 1.00 0.00 H new ATOM 0 HB2 LEU A 46 135.279 -2.348 0.478 1.00 0.00 H new ATOM 0 HB3 LEU A 46 136.757 -1.657 -0.161 1.00 0.00 H new ATOM 0 HG LEU A 46 137.400 -1.012 2.230 1.00 0.00 H new ATOM 0 HD11 LEU A 46 136.206 -2.192 4.073 1.00 0.00 H new ATOM 0 HD12 LEU A 46 135.120 -1.083 3.203 1.00 0.00 H new ATOM 0 HD13 LEU A 46 135.036 -2.834 2.897 1.00 0.00 H new ATOM 0 HD21 LEU A 46 138.110 -3.311 2.875 1.00 0.00 H new ATOM 0 HD22 LEU A 46 136.988 -3.993 1.674 1.00 0.00 H new ATOM 0 HD23 LEU A 46 138.375 -3.014 1.140 1.00 0.00 H new ATOM 714 N GLY A 47 137.131 1.222 -0.240 1.00 0.00 N ATOM 715 CA GLY A 47 138.200 2.256 -0.162 1.00 0.00 C ATOM 716 C GLY A 47 137.605 3.579 0.325 1.00 0.00 C ATOM 717 O GLY A 47 138.199 4.277 1.121 1.00 0.00 O ATOM 0 H GLY A 47 136.983 0.823 -1.167 1.00 0.00 H new ATOM 0 HA2 GLY A 47 138.987 1.928 0.517 1.00 0.00 H new ATOM 0 HA3 GLY A 47 138.660 2.392 -1.141 1.00 0.00 H new ATOM 721 N GLN A 48 136.433 3.931 -0.137 1.00 0.00 N ATOM 722 CA GLN A 48 135.809 5.204 0.319 1.00 0.00 C ATOM 723 C GLN A 48 135.615 5.140 1.839 1.00 0.00 C ATOM 724 O GLN A 48 135.856 6.094 2.551 1.00 0.00 O ATOM 725 CB GLN A 48 134.451 5.375 -0.371 1.00 0.00 C ATOM 726 CG GLN A 48 133.917 6.790 -0.123 1.00 0.00 C ATOM 727 CD GLN A 48 134.629 7.777 -1.053 1.00 0.00 C ATOM 728 OE1 GLN A 48 135.620 7.358 -1.793 1.00 0.00 O flip ATOM 729 NE2 GLN A 48 134.278 8.938 -1.109 1.00 0.00 N flip ATOM 0 H GLN A 48 135.885 3.393 -0.808 1.00 0.00 H new ATOM 0 HA GLN A 48 136.448 6.050 0.066 1.00 0.00 H new ATOM 0 HB2 GLN A 48 134.552 5.197 -1.442 1.00 0.00 H new ATOM 0 HB3 GLN A 48 133.744 4.638 0.010 1.00 0.00 H new ATOM 0 HG2 GLN A 48 132.842 6.820 -0.299 1.00 0.00 H new ATOM 0 HG3 GLN A 48 134.078 7.074 0.917 1.00 0.00 H new ATOM 0 HE21 GLN A 48 133.504 9.265 -0.531 1.00 0.00 H new ATOM 0 HE22 GLN A 48 134.757 9.586 -1.734 1.00 0.00 H new ATOM 738 N PHE A 49 135.195 4.006 2.336 1.00 0.00 N ATOM 739 CA PHE A 49 134.996 3.842 3.806 1.00 0.00 C ATOM 740 C PHE A 49 136.340 4.087 4.502 1.00 0.00 C ATOM 741 O PHE A 49 136.419 4.708 5.543 1.00 0.00 O ATOM 742 CB PHE A 49 134.506 2.413 4.070 1.00 0.00 C ATOM 743 CG PHE A 49 134.267 2.190 5.545 1.00 0.00 C ATOM 744 CD1 PHE A 49 133.228 2.868 6.192 1.00 0.00 C ATOM 745 CD2 PHE A 49 135.066 1.287 6.262 1.00 0.00 C ATOM 746 CE1 PHE A 49 132.987 2.647 7.552 1.00 0.00 C ATOM 747 CE2 PHE A 49 134.826 1.069 7.623 1.00 0.00 C ATOM 748 CZ PHE A 49 133.786 1.750 8.268 1.00 0.00 C ATOM 0 H PHE A 49 134.979 3.178 1.780 1.00 0.00 H new ATOM 0 HA PHE A 49 134.259 4.548 4.189 1.00 0.00 H new ATOM 0 HB2 PHE A 49 133.585 2.232 3.517 1.00 0.00 H new ATOM 0 HB3 PHE A 49 135.243 1.698 3.705 1.00 0.00 H new ATOM 0 HD1 PHE A 49 132.612 3.563 5.641 1.00 0.00 H new ATOM 0 HD2 PHE A 49 135.866 0.760 5.764 1.00 0.00 H new ATOM 0 HE1 PHE A 49 132.183 3.169 8.049 1.00 0.00 H new ATOM 0 HE2 PHE A 49 135.443 0.376 8.176 1.00 0.00 H new ATOM 0 HZ PHE A 49 133.601 1.582 9.319 1.00 0.00 H new ATOM 758 N LEU A 50 137.388 3.602 3.915 1.00 0.00 N ATOM 759 CA LEU A 50 138.738 3.804 4.520 1.00 0.00 C ATOM 760 C LEU A 50 139.096 5.290 4.426 1.00 0.00 C ATOM 761 O LEU A 50 139.684 5.858 5.324 1.00 0.00 O ATOM 762 CB LEU A 50 139.779 2.970 3.766 1.00 0.00 C ATOM 763 CG LEU A 50 139.428 1.479 3.854 1.00 0.00 C ATOM 764 CD1 LEU A 50 140.452 0.671 3.049 1.00 0.00 C ATOM 765 CD2 LEU A 50 139.444 1.014 5.324 1.00 0.00 C ATOM 0 H LEU A 50 137.376 3.074 3.043 1.00 0.00 H new ATOM 0 HA LEU A 50 138.728 3.488 5.563 1.00 0.00 H new ATOM 0 HB2 LEU A 50 139.818 3.281 2.722 1.00 0.00 H new ATOM 0 HB3 LEU A 50 140.769 3.143 4.187 1.00 0.00 H new ATOM 0 HG LEU A 50 138.430 1.322 3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 50 140.207 -0.389 3.109 1.00 0.00 H new ATOM 0 HD12 LEU A 50 140.430 0.991 2.007 1.00 0.00 H new ATOM 0 HD13 LEU A 50 141.449 0.836 3.458 1.00 0.00 H new ATOM 0 HD21 LEU A 50 139.193 -0.046 5.373 1.00 0.00 H new ATOM 0 HD22 LEU A 50 140.437 1.172 5.745 1.00 0.00 H new ATOM 0 HD23 LEU A 50 138.713 1.587 5.895 1.00 0.00 H new ATOM 777 N VAL A 51 138.751 5.917 3.338 1.00 0.00 N ATOM 778 CA VAL A 51 139.067 7.365 3.166 1.00 0.00 C ATOM 779 C VAL A 51 138.318 8.198 4.216 1.00 0.00 C ATOM 780 O VAL A 51 138.777 9.243 4.633 1.00 0.00 O ATOM 781 CB VAL A 51 138.655 7.808 1.758 1.00 0.00 C ATOM 782 CG1 VAL A 51 138.737 9.333 1.644 1.00 0.00 C ATOM 783 CG2 VAL A 51 139.601 7.172 0.737 1.00 0.00 C ATOM 0 H VAL A 51 138.260 5.487 2.554 1.00 0.00 H new ATOM 0 HA VAL A 51 140.138 7.519 3.298 1.00 0.00 H new ATOM 0 HB VAL A 51 137.630 7.491 1.565 1.00 0.00 H new ATOM 0 HG11 VAL A 51 138.443 9.639 0.640 1.00 0.00 H new ATOM 0 HG12 VAL A 51 138.068 9.789 2.373 1.00 0.00 H new ATOM 0 HG13 VAL A 51 139.759 9.658 1.837 1.00 0.00 H new ATOM 0 HG21 VAL A 51 139.314 7.483 -0.268 1.00 0.00 H new ATOM 0 HG22 VAL A 51 140.623 7.493 0.938 1.00 0.00 H new ATOM 0 HG23 VAL A 51 139.541 6.086 0.812 1.00 0.00 H new ATOM 793 N LEU A 52 137.164 7.754 4.634 1.00 0.00 N ATOM 794 CA LEU A 52 136.381 8.531 5.646 1.00 0.00 C ATOM 795 C LEU A 52 136.792 8.116 7.062 1.00 0.00 C ATOM 796 O LEU A 52 136.110 8.414 8.021 1.00 0.00 O ATOM 797 CB LEU A 52 134.884 8.266 5.450 1.00 0.00 C ATOM 798 CG LEU A 52 134.456 8.696 4.038 1.00 0.00 C ATOM 799 CD1 LEU A 52 132.985 8.319 3.818 1.00 0.00 C ATOM 800 CD2 LEU A 52 134.626 10.220 3.874 1.00 0.00 C ATOM 0 H LEU A 52 136.727 6.887 4.321 1.00 0.00 H new ATOM 0 HA LEU A 52 136.585 9.593 5.513 1.00 0.00 H new ATOM 0 HB2 LEU A 52 134.671 7.207 5.597 1.00 0.00 H new ATOM 0 HB3 LEU A 52 134.308 8.814 6.196 1.00 0.00 H new ATOM 0 HG LEU A 52 135.081 8.188 3.304 1.00 0.00 H new ATOM 0 HD11 LEU A 52 132.677 8.622 2.817 1.00 0.00 H new ATOM 0 HD12 LEU A 52 132.866 7.241 3.923 1.00 0.00 H new ATOM 0 HD13 LEU A 52 132.365 8.826 4.557 1.00 0.00 H new ATOM 0 HD21 LEU A 52 134.320 10.514 2.870 1.00 0.00 H new ATOM 0 HD22 LEU A 52 134.007 10.736 4.608 1.00 0.00 H new ATOM 0 HD23 LEU A 52 135.671 10.488 4.028 1.00 0.00 H new ATOM 812 N LYS A 53 137.901 7.444 7.211 1.00 0.00 N ATOM 813 CA LYS A 53 138.343 7.035 8.574 1.00 0.00 C ATOM 814 C LYS A 53 137.196 6.345 9.315 1.00 0.00 C ATOM 815 O LYS A 53 137.078 6.439 10.519 1.00 0.00 O ATOM 816 CB LYS A 53 138.781 8.277 9.349 1.00 0.00 C ATOM 817 CG LYS A 53 139.947 8.937 8.613 1.00 0.00 C ATOM 818 CD LYS A 53 140.398 10.183 9.375 1.00 0.00 C ATOM 819 CE LYS A 53 141.564 10.842 8.635 1.00 0.00 C ATOM 820 NZ LYS A 53 141.044 11.586 7.453 1.00 0.00 N ATOM 0 H LYS A 53 138.518 7.161 6.450 1.00 0.00 H new ATOM 0 HA LYS A 53 139.176 6.337 8.490 1.00 0.00 H new ATOM 0 HB2 LYS A 53 137.950 8.976 9.441 1.00 0.00 H new ATOM 0 HB3 LYS A 53 139.081 8.003 10.361 1.00 0.00 H new ATOM 0 HG2 LYS A 53 140.776 8.235 8.521 1.00 0.00 H new ATOM 0 HG3 LYS A 53 139.645 9.207 7.601 1.00 0.00 H new ATOM 0 HD2 LYS A 53 139.569 10.885 9.468 1.00 0.00 H new ATOM 0 HD3 LYS A 53 140.702 9.913 10.386 1.00 0.00 H new ATOM 0 HE2 LYS A 53 142.094 11.522 9.302 1.00 0.00 H new ATOM 0 HE3 LYS A 53 142.281 10.085 8.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 141.812 12.144 7.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 140.677 10.911 6.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 140.279 12.223 7.753 1.00 0.00 H new ATOM 834 N LYS A 54 136.363 5.638 8.597 1.00 0.00 N ATOM 835 CA LYS A 54 135.220 4.907 9.220 1.00 0.00 C ATOM 836 C LYS A 54 134.272 5.880 9.930 1.00 0.00 C ATOM 837 O LYS A 54 133.485 5.479 10.765 1.00 0.00 O ATOM 838 CB LYS A 54 135.756 3.887 10.230 1.00 0.00 C ATOM 839 CG LYS A 54 136.871 3.066 9.577 1.00 0.00 C ATOM 840 CD LYS A 54 137.228 1.879 10.470 1.00 0.00 C ATOM 841 CE LYS A 54 138.390 1.102 9.847 1.00 0.00 C ATOM 842 NZ LYS A 54 139.626 1.933 9.888 1.00 0.00 N ATOM 0 H LYS A 54 136.429 5.535 7.584 1.00 0.00 H new ATOM 0 HA LYS A 54 134.666 4.395 8.433 1.00 0.00 H new ATOM 0 HB2 LYS A 54 136.136 4.399 11.114 1.00 0.00 H new ATOM 0 HB3 LYS A 54 134.952 3.230 10.562 1.00 0.00 H new ATOM 0 HG2 LYS A 54 136.549 2.712 8.597 1.00 0.00 H new ATOM 0 HG3 LYS A 54 137.750 3.691 9.418 1.00 0.00 H new ATOM 0 HD2 LYS A 54 137.503 2.229 11.465 1.00 0.00 H new ATOM 0 HD3 LYS A 54 136.363 1.227 10.589 1.00 0.00 H new ATOM 0 HE2 LYS A 54 138.549 0.169 10.388 1.00 0.00 H new ATOM 0 HE3 LYS A 54 138.152 0.836 8.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 140.459 1.321 9.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 139.601 2.631 9.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 139.682 2.427 10.801 1.00 0.00 H new ATOM 856 N ASP A 55 134.303 7.140 9.600 1.00 0.00 N ATOM 857 CA ASP A 55 133.357 8.089 10.262 1.00 0.00 C ATOM 858 C ASP A 55 131.930 7.718 9.827 1.00 0.00 C ATOM 859 O ASP A 55 131.592 7.777 8.661 1.00 0.00 O ATOM 860 CB ASP A 55 133.686 9.515 9.820 1.00 0.00 C ATOM 861 CG ASP A 55 134.916 10.019 10.578 1.00 0.00 C ATOM 862 OD1 ASP A 55 135.022 9.728 11.757 1.00 0.00 O ATOM 863 OD2 ASP A 55 135.729 10.691 9.965 1.00 0.00 O ATOM 0 H ASP A 55 134.932 7.553 8.911 1.00 0.00 H new ATOM 0 HA ASP A 55 133.443 8.029 11.347 1.00 0.00 H new ATOM 0 HB2 ASP A 55 133.873 9.539 8.746 1.00 0.00 H new ATOM 0 HB3 ASP A 55 132.836 10.170 10.010 1.00 0.00 H new ATOM 868 N GLU A 56 131.102 7.299 10.752 1.00 0.00 N ATOM 869 CA GLU A 56 129.707 6.877 10.401 1.00 0.00 C ATOM 870 C GLU A 56 128.834 8.042 9.905 1.00 0.00 C ATOM 871 O GLU A 56 128.057 7.889 8.985 1.00 0.00 O ATOM 872 CB GLU A 56 129.050 6.259 11.636 1.00 0.00 C ATOM 873 CG GLU A 56 127.684 5.688 11.253 1.00 0.00 C ATOM 874 CD GLU A 56 127.092 4.935 12.446 1.00 0.00 C ATOM 875 OE1 GLU A 56 127.713 4.946 13.496 1.00 0.00 O ATOM 876 OE2 GLU A 56 126.033 4.354 12.287 1.00 0.00 O ATOM 0 H GLU A 56 131.333 7.230 11.743 1.00 0.00 H new ATOM 0 HA GLU A 56 129.783 6.157 9.586 1.00 0.00 H new ATOM 0 HB2 GLU A 56 129.684 5.472 12.043 1.00 0.00 H new ATOM 0 HB3 GLU A 56 128.936 7.012 12.416 1.00 0.00 H new ATOM 0 HG2 GLU A 56 127.014 6.492 10.949 1.00 0.00 H new ATOM 0 HG3 GLU A 56 127.785 5.017 10.400 1.00 0.00 H new ATOM 883 N ASP A 57 128.929 9.193 10.512 1.00 0.00 N ATOM 884 CA ASP A 57 128.073 10.343 10.076 1.00 0.00 C ATOM 885 C ASP A 57 128.517 10.818 8.695 1.00 0.00 C ATOM 886 O ASP A 57 127.710 11.141 7.844 1.00 0.00 O ATOM 887 CB ASP A 57 128.216 11.492 11.075 1.00 0.00 C ATOM 888 CG ASP A 57 127.545 11.111 12.395 1.00 0.00 C ATOM 889 OD1 ASP A 57 126.847 10.111 12.416 1.00 0.00 O ATOM 890 OD2 ASP A 57 127.740 11.827 13.364 1.00 0.00 O ATOM 0 H ASP A 57 129.559 9.391 11.289 1.00 0.00 H new ATOM 0 HA ASP A 57 127.032 10.022 10.033 1.00 0.00 H new ATOM 0 HB2 ASP A 57 129.270 11.713 11.242 1.00 0.00 H new ATOM 0 HB3 ASP A 57 127.761 12.397 10.672 1.00 0.00 H new ATOM 895 N LEU A 58 129.787 10.852 8.470 1.00 0.00 N ATOM 896 CA LEU A 58 130.281 11.295 7.139 1.00 0.00 C ATOM 897 C LEU A 58 129.934 10.228 6.103 1.00 0.00 C ATOM 898 O LEU A 58 129.559 10.528 4.987 1.00 0.00 O ATOM 899 CB LEU A 58 131.797 11.492 7.173 1.00 0.00 C ATOM 900 CG LEU A 58 132.164 12.663 8.095 1.00 0.00 C ATOM 901 CD1 LEU A 58 133.690 12.754 8.197 1.00 0.00 C ATOM 902 CD2 LEU A 58 131.600 13.984 7.534 1.00 0.00 C ATOM 0 H LEU A 58 130.509 10.595 9.143 1.00 0.00 H new ATOM 0 HA LEU A 58 129.809 12.242 6.878 1.00 0.00 H new ATOM 0 HB2 LEU A 58 132.281 10.580 7.523 1.00 0.00 H new ATOM 0 HB3 LEU A 58 132.168 11.684 6.166 1.00 0.00 H new ATOM 0 HG LEU A 58 131.734 12.495 9.082 1.00 0.00 H new ATOM 0 HD11 LEU A 58 133.962 13.583 8.850 1.00 0.00 H new ATOM 0 HD12 LEU A 58 134.083 11.824 8.608 1.00 0.00 H new ATOM 0 HD13 LEU A 58 134.112 12.919 7.206 1.00 0.00 H new ATOM 0 HD21 LEU A 58 131.868 14.805 8.198 1.00 0.00 H new ATOM 0 HD22 LEU A 58 132.018 14.167 6.544 1.00 0.00 H new ATOM 0 HD23 LEU A 58 130.515 13.915 7.462 1.00 0.00 H new ATOM 914 N PHE A 59 130.039 8.983 6.474 1.00 0.00 N ATOM 915 CA PHE A 59 129.699 7.888 5.525 1.00 0.00 C ATOM 916 C PHE A 59 128.215 7.963 5.156 1.00 0.00 C ATOM 917 O PHE A 59 127.845 7.859 4.004 1.00 0.00 O ATOM 918 CB PHE A 59 130.005 6.536 6.175 1.00 0.00 C ATOM 919 CG PHE A 59 129.579 5.416 5.250 1.00 0.00 C ATOM 920 CD1 PHE A 59 130.217 5.248 4.014 1.00 0.00 C ATOM 921 CD2 PHE A 59 128.551 4.541 5.630 1.00 0.00 C ATOM 922 CE1 PHE A 59 129.828 4.209 3.159 1.00 0.00 C ATOM 923 CE2 PHE A 59 128.162 3.502 4.774 1.00 0.00 C ATOM 924 CZ PHE A 59 128.800 3.335 3.540 1.00 0.00 C ATOM 0 H PHE A 59 130.347 8.676 7.397 1.00 0.00 H new ATOM 0 HA PHE A 59 130.296 7.997 4.619 1.00 0.00 H new ATOM 0 HB2 PHE A 59 131.071 6.458 6.389 1.00 0.00 H new ATOM 0 HB3 PHE A 59 129.481 6.453 7.127 1.00 0.00 H new ATOM 0 HD1 PHE A 59 131.010 5.920 3.720 1.00 0.00 H new ATOM 0 HD2 PHE A 59 128.059 4.668 6.583 1.00 0.00 H new ATOM 0 HE1 PHE A 59 130.320 4.081 2.206 1.00 0.00 H new ATOM 0 HE2 PHE A 59 127.369 2.830 5.067 1.00 0.00 H new ATOM 0 HZ PHE A 59 128.501 2.533 2.881 1.00 0.00 H new ATOM 934 N ARG A 60 127.360 8.114 6.135 1.00 0.00 N ATOM 935 CA ARG A 60 125.898 8.163 5.847 1.00 0.00 C ATOM 936 C ARG A 60 125.554 9.325 4.913 1.00 0.00 C ATOM 937 O ARG A 60 124.816 9.158 3.962 1.00 0.00 O ATOM 938 CB ARG A 60 125.114 8.325 7.154 1.00 0.00 C ATOM 939 CG ARG A 60 125.134 7.012 7.942 1.00 0.00 C ATOM 940 CD ARG A 60 124.307 7.185 9.218 1.00 0.00 C ATOM 941 NE ARG A 60 124.238 5.890 9.954 1.00 0.00 N ATOM 942 CZ ARG A 60 123.790 5.859 11.180 1.00 0.00 C ATOM 943 NH1 ARG A 60 123.426 6.965 11.770 1.00 0.00 N ATOM 944 NH2 ARG A 60 123.706 4.724 11.817 1.00 0.00 N ATOM 0 H ARG A 60 127.612 8.205 7.119 1.00 0.00 H new ATOM 0 HA ARG A 60 125.624 7.228 5.358 1.00 0.00 H new ATOM 0 HB2 ARG A 60 125.550 9.125 7.753 1.00 0.00 H new ATOM 0 HB3 ARG A 60 124.085 8.613 6.938 1.00 0.00 H new ATOM 0 HG2 ARG A 60 124.727 6.203 7.336 1.00 0.00 H new ATOM 0 HG3 ARG A 60 126.159 6.738 8.192 1.00 0.00 H new ATOM 0 HD2 ARG A 60 124.755 7.951 9.852 1.00 0.00 H new ATOM 0 HD3 ARG A 60 123.302 7.526 8.968 1.00 0.00 H new ATOM 0 HE ARG A 60 124.541 5.028 9.500 1.00 0.00 H new ATOM 0 HH11 ARG A 60 123.492 7.853 11.273 1.00 0.00 H new ATOM 0 HH12 ARG A 60 123.076 6.941 12.728 1.00 0.00 H new ATOM 0 HH21 ARG A 60 123.991 3.859 11.357 1.00 0.00 H new ATOM 0 HH22 ARG A 60 123.356 4.701 12.775 1.00 0.00 H new ATOM 958 N GLU A 61 126.066 10.502 5.159 1.00 0.00 N ATOM 959 CA GLU A 61 125.737 11.642 4.260 1.00 0.00 C ATOM 960 C GLU A 61 126.275 11.342 2.862 1.00 0.00 C ATOM 961 O GLU A 61 125.663 11.673 1.866 1.00 0.00 O ATOM 962 CB GLU A 61 126.383 12.924 4.792 1.00 0.00 C ATOM 963 CG GLU A 61 125.679 13.356 6.081 1.00 0.00 C ATOM 964 CD GLU A 61 124.266 13.842 5.757 1.00 0.00 C ATOM 965 OE1 GLU A 61 124.023 14.181 4.611 1.00 0.00 O ATOM 966 OE2 GLU A 61 123.448 13.867 6.663 1.00 0.00 O ATOM 0 H GLU A 61 126.691 10.720 5.935 1.00 0.00 H new ATOM 0 HA GLU A 61 124.656 11.778 4.221 1.00 0.00 H new ATOM 0 HB2 GLU A 61 127.443 12.757 4.983 1.00 0.00 H new ATOM 0 HB3 GLU A 61 126.314 13.715 4.045 1.00 0.00 H new ATOM 0 HG2 GLU A 61 125.636 12.521 6.781 1.00 0.00 H new ATOM 0 HG3 GLU A 61 126.245 14.151 6.567 1.00 0.00 H new ATOM 973 N TRP A 62 127.410 10.711 2.779 1.00 0.00 N ATOM 974 CA TRP A 62 127.982 10.384 1.443 1.00 0.00 C ATOM 975 C TRP A 62 127.067 9.418 0.684 1.00 0.00 C ATOM 976 O TRP A 62 126.789 9.600 -0.481 1.00 0.00 O ATOM 977 CB TRP A 62 129.358 9.727 1.629 1.00 0.00 C ATOM 978 CG TRP A 62 129.830 9.148 0.327 1.00 0.00 C ATOM 979 CD1 TRP A 62 130.472 9.830 -0.649 1.00 0.00 C ATOM 980 CD2 TRP A 62 129.683 7.779 -0.159 1.00 0.00 C ATOM 981 NE1 TRP A 62 130.739 8.965 -1.698 1.00 0.00 N ATOM 982 CE2 TRP A 62 130.271 7.689 -1.443 1.00 0.00 C ATOM 983 CE3 TRP A 62 129.105 6.617 0.388 1.00 0.00 C ATOM 984 CZ2 TRP A 62 130.286 6.489 -2.159 1.00 0.00 C ATOM 985 CZ3 TRP A 62 129.119 5.409 -0.329 1.00 0.00 C ATOM 986 CH2 TRP A 62 129.710 5.346 -1.599 1.00 0.00 C ATOM 0 H TRP A 62 127.968 10.407 3.577 1.00 0.00 H new ATOM 0 HA TRP A 62 128.076 11.306 0.869 1.00 0.00 H new ATOM 0 HB2 TRP A 62 130.076 10.463 1.991 1.00 0.00 H new ATOM 0 HB3 TRP A 62 129.297 8.943 2.384 1.00 0.00 H new ATOM 0 HD1 TRP A 62 130.734 10.877 -0.616 1.00 0.00 H new ATOM 0 HE1 TRP A 62 131.222 9.236 -2.554 1.00 0.00 H new ATOM 0 HE3 TRP A 62 128.648 6.655 1.366 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 130.740 6.446 -3.138 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 128.672 4.524 0.100 1.00 0.00 H new ATOM 0 HH2 TRP A 62 129.720 4.414 -2.144 1.00 0.00 H new ATOM 997 N LEU A 63 126.614 8.386 1.331 1.00 0.00 N ATOM 998 CA LEU A 63 125.740 7.400 0.639 1.00 0.00 C ATOM 999 C LEU A 63 124.391 8.041 0.294 1.00 0.00 C ATOM 1000 O LEU A 63 123.905 7.930 -0.813 1.00 0.00 O ATOM 1001 CB LEU A 63 125.526 6.197 1.564 1.00 0.00 C ATOM 1002 CG LEU A 63 124.630 5.151 0.889 1.00 0.00 C ATOM 1003 CD1 LEU A 63 125.290 4.640 -0.403 1.00 0.00 C ATOM 1004 CD2 LEU A 63 124.417 3.983 1.858 1.00 0.00 C ATOM 0 H LEU A 63 126.810 8.180 2.311 1.00 0.00 H new ATOM 0 HA LEU A 63 126.215 7.075 -0.287 1.00 0.00 H new ATOM 0 HB2 LEU A 63 126.488 5.751 1.818 1.00 0.00 H new ATOM 0 HB3 LEU A 63 125.071 6.526 2.498 1.00 0.00 H new ATOM 0 HG LEU A 63 123.671 5.603 0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 63 124.644 3.898 -0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 63 125.443 5.474 -1.088 1.00 0.00 H new ATOM 0 HD13 LEU A 63 126.252 4.185 -0.165 1.00 0.00 H new ATOM 0 HD21 LEU A 63 123.781 3.232 1.389 1.00 0.00 H new ATOM 0 HD22 LEU A 63 125.380 3.538 2.108 1.00 0.00 H new ATOM 0 HD23 LEU A 63 123.938 4.347 2.767 1.00 0.00 H new ATOM 1016 N LYS A 64 123.784 8.710 1.234 1.00 0.00 N ATOM 1017 CA LYS A 64 122.469 9.362 0.969 1.00 0.00 C ATOM 1018 C LYS A 64 122.629 10.380 -0.161 1.00 0.00 C ATOM 1019 O LYS A 64 121.860 10.415 -1.100 1.00 0.00 O ATOM 1020 CB LYS A 64 121.994 10.065 2.254 1.00 0.00 C ATOM 1021 CG LYS A 64 120.634 10.764 2.054 1.00 0.00 C ATOM 1022 CD LYS A 64 119.501 9.732 1.996 1.00 0.00 C ATOM 1023 CE LYS A 64 118.149 10.451 2.057 1.00 0.00 C ATOM 1024 NZ LYS A 64 117.860 10.850 3.464 1.00 0.00 N ATOM 0 H LYS A 64 124.144 8.834 2.180 1.00 0.00 H new ATOM 0 HA LYS A 64 121.731 8.617 0.672 1.00 0.00 H new ATOM 0 HB2 LYS A 64 121.913 9.335 3.059 1.00 0.00 H new ATOM 0 HB3 LYS A 64 122.738 10.799 2.563 1.00 0.00 H new ATOM 0 HG2 LYS A 64 120.455 11.463 2.871 1.00 0.00 H new ATOM 0 HG3 LYS A 64 120.650 11.347 1.133 1.00 0.00 H new ATOM 0 HD2 LYS A 64 119.573 9.149 1.078 1.00 0.00 H new ATOM 0 HD3 LYS A 64 119.590 9.032 2.827 1.00 0.00 H new ATOM 0 HE2 LYS A 64 118.164 11.331 1.414 1.00 0.00 H new ATOM 0 HE3 LYS A 64 117.361 9.797 1.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 116.841 10.758 3.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 118.387 10.233 4.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 118.151 11.838 3.611 1.00 0.00 H new ATOM 1038 N ASP A 65 123.626 11.210 -0.065 1.00 0.00 N ATOM 1039 CA ASP A 65 123.858 12.237 -1.115 1.00 0.00 C ATOM 1040 C ASP A 65 124.294 11.559 -2.411 1.00 0.00 C ATOM 1041 O ASP A 65 124.040 12.043 -3.496 1.00 0.00 O ATOM 1042 CB ASP A 65 124.949 13.203 -0.650 1.00 0.00 C ATOM 1043 CG ASP A 65 125.062 14.362 -1.641 1.00 0.00 C ATOM 1044 OD1 ASP A 65 124.993 14.105 -2.831 1.00 0.00 O ATOM 1045 OD2 ASP A 65 125.211 15.487 -1.193 1.00 0.00 O ATOM 0 H ASP A 65 124.297 11.221 0.703 1.00 0.00 H new ATOM 0 HA ASP A 65 122.935 12.788 -1.291 1.00 0.00 H new ATOM 0 HB2 ASP A 65 124.713 13.583 0.344 1.00 0.00 H new ATOM 0 HB3 ASP A 65 125.903 12.681 -0.574 1.00 0.00 H new ATOM 1050 N THR A 66 124.987 10.458 -2.307 1.00 0.00 N ATOM 1051 CA THR A 66 125.483 9.770 -3.528 1.00 0.00 C ATOM 1052 C THR A 66 124.362 9.022 -4.255 1.00 0.00 C ATOM 1053 O THR A 66 124.353 8.990 -5.470 1.00 0.00 O ATOM 1054 CB THR A 66 126.591 8.782 -3.141 1.00 0.00 C ATOM 1055 OG1 THR A 66 127.702 9.501 -2.626 1.00 0.00 O ATOM 1056 CG2 THR A 66 127.029 7.983 -4.369 1.00 0.00 C ATOM 0 H THR A 66 125.231 10.006 -1.426 1.00 0.00 H new ATOM 0 HA THR A 66 125.872 10.529 -4.207 1.00 0.00 H new ATOM 0 HB THR A 66 126.212 8.096 -2.384 1.00 0.00 H new ATOM 0 HG1 THR A 66 127.425 10.007 -1.834 1.00 0.00 H new ATOM 0 HG21 THR A 66 127.816 7.284 -4.086 1.00 0.00 H new ATOM 0 HG22 THR A 66 126.178 7.430 -4.766 1.00 0.00 H new ATOM 0 HG23 THR A 66 127.406 8.665 -5.131 1.00 0.00 H new ATOM 1064 N CYS A 67 123.437 8.379 -3.565 1.00 0.00 N ATOM 1065 CA CYS A 67 122.370 7.608 -4.292 1.00 0.00 C ATOM 1066 C CYS A 67 120.970 7.885 -3.738 1.00 0.00 C ATOM 1067 O CYS A 67 119.995 7.826 -4.460 1.00 0.00 O ATOM 1068 CB CYS A 67 122.667 6.114 -4.158 1.00 0.00 C ATOM 1069 SG CYS A 67 122.478 5.614 -2.429 1.00 0.00 S ATOM 0 H CYS A 67 123.377 8.356 -2.547 1.00 0.00 H new ATOM 0 HA CYS A 67 122.382 7.925 -5.335 1.00 0.00 H new ATOM 0 HB2 CYS A 67 121.990 5.540 -4.790 1.00 0.00 H new ATOM 0 HB3 CYS A 67 123.680 5.901 -4.501 1.00 0.00 H new ATOM 0 HG CYS A 67 123.035 6.500 -1.658 1.00 0.00 H new ATOM 1075 N GLY A 68 120.856 8.173 -2.464 1.00 0.00 N ATOM 1076 CA GLY A 68 119.509 8.441 -1.860 1.00 0.00 C ATOM 1077 C GLY A 68 119.120 7.277 -0.943 1.00 0.00 C ATOM 1078 O GLY A 68 117.974 7.138 -0.562 1.00 0.00 O ATOM 0 H GLY A 68 121.639 8.235 -1.813 1.00 0.00 H new ATOM 0 HA2 GLY A 68 119.531 9.372 -1.294 1.00 0.00 H new ATOM 0 HA3 GLY A 68 118.764 8.563 -2.646 1.00 0.00 H new ATOM 1082 N ALA A 69 120.055 6.441 -0.576 1.00 0.00 N ATOM 1083 CA ALA A 69 119.717 5.299 0.326 1.00 0.00 C ATOM 1084 C ALA A 69 118.925 5.825 1.523 1.00 0.00 C ATOM 1085 O ALA A 69 119.045 6.973 1.897 1.00 0.00 O ATOM 1086 CB ALA A 69 121.006 4.638 0.819 1.00 0.00 C ATOM 0 H ALA A 69 121.033 6.498 -0.859 1.00 0.00 H new ATOM 0 HA ALA A 69 119.121 4.566 -0.217 1.00 0.00 H new ATOM 0 HB1 ALA A 69 120.759 3.805 1.477 1.00 0.00 H new ATOM 0 HB2 ALA A 69 121.576 4.270 -0.034 1.00 0.00 H new ATOM 0 HB3 ALA A 69 121.603 5.368 1.366 1.00 0.00 H new ATOM 1092 N ASN A 70 118.101 5.006 2.124 1.00 0.00 N ATOM 1093 CA ASN A 70 117.291 5.482 3.286 1.00 0.00 C ATOM 1094 C ASN A 70 118.065 5.248 4.586 1.00 0.00 C ATOM 1095 O ASN A 70 119.111 4.631 4.600 1.00 0.00 O ATOM 1096 CB ASN A 70 115.974 4.704 3.338 1.00 0.00 C ATOM 1097 CG ASN A 70 115.284 4.759 1.974 1.00 0.00 C ATOM 1098 OD1 ASN A 70 115.446 5.807 1.214 1.00 0.00 O flip ATOM 1099 ND2 ASN A 70 114.590 3.837 1.593 1.00 0.00 N flip ATOM 0 H ASN A 70 117.954 4.031 1.862 1.00 0.00 H new ATOM 0 HA ASN A 70 117.088 6.547 3.171 1.00 0.00 H new ATOM 0 HB2 ASN A 70 116.164 3.668 3.618 1.00 0.00 H new ATOM 0 HB3 ASN A 70 115.322 5.126 4.103 1.00 0.00 H new ATOM 0 HD21 ASN A 70 114.462 3.017 2.185 1.00 0.00 H new ATOM 0 HD22 ASN A 70 114.136 3.884 0.681 1.00 0.00 H new ATOM 1106 N ALA A 71 117.557 5.752 5.677 1.00 0.00 N ATOM 1107 CA ALA A 71 118.255 5.584 6.983 1.00 0.00 C ATOM 1108 C ALA A 71 118.404 4.098 7.325 1.00 0.00 C ATOM 1109 O ALA A 71 119.382 3.689 7.915 1.00 0.00 O ATOM 1110 CB ALA A 71 117.444 6.275 8.082 1.00 0.00 C ATOM 0 H ALA A 71 116.683 6.276 5.720 1.00 0.00 H new ATOM 0 HA ALA A 71 119.247 6.031 6.912 1.00 0.00 H new ATOM 0 HB1 ALA A 71 117.951 6.154 9.039 1.00 0.00 H new ATOM 0 HB2 ALA A 71 117.350 7.336 7.852 1.00 0.00 H new ATOM 0 HB3 ALA A 71 116.452 5.827 8.138 1.00 0.00 H new ATOM 1116 N LYS A 72 117.449 3.285 6.966 1.00 0.00 N ATOM 1117 CA LYS A 72 117.568 1.834 7.288 1.00 0.00 C ATOM 1118 C LYS A 72 118.642 1.199 6.406 1.00 0.00 C ATOM 1119 O LYS A 72 119.408 0.360 6.840 1.00 0.00 O ATOM 1120 CB LYS A 72 116.230 1.126 7.061 1.00 0.00 C ATOM 1121 CG LYS A 72 116.310 -0.297 7.623 1.00 0.00 C ATOM 1122 CD LYS A 72 114.977 -1.017 7.403 1.00 0.00 C ATOM 1123 CE LYS A 72 115.066 -2.439 7.966 1.00 0.00 C ATOM 1124 NZ LYS A 72 115.186 -2.381 9.452 1.00 0.00 N ATOM 0 H LYS A 72 116.601 3.557 6.469 1.00 0.00 H new ATOM 0 HA LYS A 72 117.847 1.728 8.336 1.00 0.00 H new ATOM 0 HB2 LYS A 72 115.426 1.677 7.549 1.00 0.00 H new ATOM 0 HB3 LYS A 72 115.997 1.097 5.997 1.00 0.00 H new ATOM 0 HG2 LYS A 72 117.115 -0.846 7.135 1.00 0.00 H new ATOM 0 HG3 LYS A 72 116.545 -0.265 8.687 1.00 0.00 H new ATOM 0 HD2 LYS A 72 114.171 -0.470 7.893 1.00 0.00 H new ATOM 0 HD3 LYS A 72 114.740 -1.050 6.340 1.00 0.00 H new ATOM 0 HE2 LYS A 72 114.181 -3.009 7.684 1.00 0.00 H new ATOM 0 HE3 LYS A 72 115.926 -2.956 7.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 114.943 -3.308 9.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 116.162 -2.135 9.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 114.536 -1.660 9.825 1.00 0.00 H new ATOM 1138 N GLN A 73 118.689 1.585 5.161 1.00 0.00 N ATOM 1139 CA GLN A 73 119.688 1.010 4.219 1.00 0.00 C ATOM 1140 C GLN A 73 121.104 1.420 4.614 1.00 0.00 C ATOM 1141 O GLN A 73 122.033 0.642 4.517 1.00 0.00 O ATOM 1142 CB GLN A 73 119.390 1.517 2.808 1.00 0.00 C ATOM 1143 CG GLN A 73 118.096 0.881 2.297 1.00 0.00 C ATOM 1144 CD GLN A 73 117.729 1.495 0.947 1.00 0.00 C ATOM 1145 OE1 GLN A 73 117.770 2.699 0.782 1.00 0.00 O ATOM 1146 NE2 GLN A 73 117.374 0.715 -0.037 1.00 0.00 N ATOM 0 H GLN A 73 118.069 2.284 4.752 1.00 0.00 H new ATOM 0 HA GLN A 73 119.620 -0.077 4.254 1.00 0.00 H new ATOM 0 HB2 GLN A 73 119.296 2.603 2.813 1.00 0.00 H new ATOM 0 HB3 GLN A 73 120.216 1.272 2.140 1.00 0.00 H new ATOM 0 HG2 GLN A 73 118.222 -0.197 2.197 1.00 0.00 H new ATOM 0 HG3 GLN A 73 117.291 1.042 3.014 1.00 0.00 H new ATOM 0 HE21 GLN A 73 117.339 -0.295 0.100 1.00 0.00 H new ATOM 0 HE22 GLN A 73 117.131 1.115 -0.943 1.00 0.00 H new ATOM 1155 N SER A 74 121.289 2.641 5.040 1.00 0.00 N ATOM 1156 CA SER A 74 122.653 3.093 5.415 1.00 0.00 C ATOM 1157 C SER A 74 123.130 2.339 6.657 1.00 0.00 C ATOM 1158 O SER A 74 124.288 1.983 6.764 1.00 0.00 O ATOM 1159 CB SER A 74 122.622 4.592 5.711 1.00 0.00 C ATOM 1160 OG SER A 74 122.188 4.797 7.048 1.00 0.00 O ATOM 0 H SER A 74 120.554 3.341 5.143 1.00 0.00 H new ATOM 0 HA SER A 74 123.338 2.892 4.591 1.00 0.00 H new ATOM 0 HB2 SER A 74 123.613 5.023 5.568 1.00 0.00 H new ATOM 0 HB3 SER A 74 121.951 5.098 5.017 1.00 0.00 H new ATOM 0 HG SER A 74 121.293 4.414 7.164 1.00 0.00 H new ATOM 1166 N ARG A 75 122.260 2.090 7.604 1.00 0.00 N ATOM 1167 CA ARG A 75 122.691 1.361 8.830 1.00 0.00 C ATOM 1168 C ARG A 75 123.225 -0.017 8.448 1.00 0.00 C ATOM 1169 O ARG A 75 124.171 -0.500 9.038 1.00 0.00 O ATOM 1170 CB ARG A 75 121.516 1.219 9.801 1.00 0.00 C ATOM 1171 CG ARG A 75 121.197 2.584 10.416 1.00 0.00 C ATOM 1172 CD ARG A 75 120.023 2.450 11.388 1.00 0.00 C ATOM 1173 NE ARG A 75 120.425 1.583 12.533 1.00 0.00 N ATOM 1174 CZ ARG A 75 119.713 1.573 13.628 1.00 0.00 C ATOM 1175 NH1 ARG A 75 118.647 2.321 13.722 1.00 0.00 N ATOM 1176 NH2 ARG A 75 120.066 0.814 14.630 1.00 0.00 N ATOM 0 H ARG A 75 121.276 2.359 7.579 1.00 0.00 H new ATOM 0 HA ARG A 75 123.482 1.928 9.321 1.00 0.00 H new ATOM 0 HB2 ARG A 75 120.642 0.830 9.278 1.00 0.00 H new ATOM 0 HB3 ARG A 75 121.762 0.503 10.585 1.00 0.00 H new ATOM 0 HG2 ARG A 75 122.072 2.972 10.938 1.00 0.00 H new ATOM 0 HG3 ARG A 75 120.952 3.299 9.631 1.00 0.00 H new ATOM 0 HD2 ARG A 75 119.722 3.433 11.750 1.00 0.00 H new ATOM 0 HD3 ARG A 75 119.161 2.021 10.877 1.00 0.00 H new ATOM 0 HE ARG A 75 121.257 0.997 12.461 1.00 0.00 H new ATOM 0 HH11 ARG A 75 118.369 2.914 12.940 1.00 0.00 H new ATOM 0 HH12 ARG A 75 118.092 2.312 14.578 1.00 0.00 H new ATOM 0 HH21 ARG A 75 120.898 0.229 14.558 1.00 0.00 H new ATOM 0 HH22 ARG A 75 119.510 0.807 15.485 1.00 0.00 H new ATOM 1190 N ASP A 76 122.633 -0.675 7.488 1.00 0.00 N ATOM 1191 CA ASP A 76 123.110 -2.031 7.101 1.00 0.00 C ATOM 1192 C ASP A 76 124.494 -1.951 6.457 1.00 0.00 C ATOM 1193 O ASP A 76 125.336 -2.795 6.686 1.00 0.00 O ATOM 1194 CB ASP A 76 122.126 -2.651 6.108 1.00 0.00 C ATOM 1195 CG ASP A 76 120.819 -2.992 6.828 1.00 0.00 C ATOM 1196 OD1 ASP A 76 120.859 -3.163 8.036 1.00 0.00 O ATOM 1197 OD2 ASP A 76 119.801 -3.075 6.161 1.00 0.00 O ATOM 0 H ASP A 76 121.836 -0.329 6.954 1.00 0.00 H new ATOM 0 HA ASP A 76 123.175 -2.648 7.997 1.00 0.00 H new ATOM 0 HB2 ASP A 76 121.932 -1.957 5.290 1.00 0.00 H new ATOM 0 HB3 ASP A 76 122.556 -3.550 5.667 1.00 0.00 H new ATOM 1202 N CYS A 77 124.748 -0.954 5.656 1.00 0.00 N ATOM 1203 CA CYS A 77 126.087 -0.849 5.015 1.00 0.00 C ATOM 1204 C CYS A 77 127.162 -0.564 6.068 1.00 0.00 C ATOM 1205 O CYS A 77 128.258 -1.084 5.993 1.00 0.00 O ATOM 1206 CB CYS A 77 126.071 0.289 3.992 1.00 0.00 C ATOM 1207 SG CYS A 77 125.041 -0.179 2.580 1.00 0.00 S ATOM 0 H CYS A 77 124.090 -0.212 5.419 1.00 0.00 H new ATOM 0 HA CYS A 77 126.316 -1.793 4.521 1.00 0.00 H new ATOM 0 HB2 CYS A 77 125.685 1.199 4.451 1.00 0.00 H new ATOM 0 HB3 CYS A 77 127.086 0.506 3.659 1.00 0.00 H new ATOM 0 HG CYS A 77 124.979 -1.475 2.499 1.00 0.00 H new ATOM 1213 N PHE A 78 126.886 0.272 7.035 1.00 0.00 N ATOM 1214 CA PHE A 78 127.938 0.578 8.045 1.00 0.00 C ATOM 1215 C PHE A 78 128.362 -0.700 8.766 1.00 0.00 C ATOM 1216 O PHE A 78 129.513 -1.087 8.738 1.00 0.00 O ATOM 1217 CB PHE A 78 127.404 1.582 9.069 1.00 0.00 C ATOM 1218 CG PHE A 78 128.492 1.888 10.071 1.00 0.00 C ATOM 1219 CD1 PHE A 78 128.618 1.112 11.229 1.00 0.00 C ATOM 1220 CD2 PHE A 78 129.380 2.946 9.837 1.00 0.00 C ATOM 1221 CE1 PHE A 78 129.632 1.395 12.154 1.00 0.00 C ATOM 1222 CE2 PHE A 78 130.393 3.227 10.760 1.00 0.00 C ATOM 1223 CZ PHE A 78 130.520 2.453 11.920 1.00 0.00 C ATOM 0 H PHE A 78 125.994 0.748 7.167 1.00 0.00 H new ATOM 0 HA PHE A 78 128.799 1.006 7.532 1.00 0.00 H new ATOM 0 HB2 PHE A 78 127.085 2.496 8.569 1.00 0.00 H new ATOM 0 HB3 PHE A 78 126.529 1.174 9.576 1.00 0.00 H new ATOM 0 HD1 PHE A 78 127.934 0.296 11.410 1.00 0.00 H new ATOM 0 HD2 PHE A 78 129.282 3.545 8.944 1.00 0.00 H new ATOM 0 HE1 PHE A 78 129.729 0.797 13.048 1.00 0.00 H new ATOM 0 HE2 PHE A 78 131.078 4.042 10.578 1.00 0.00 H new ATOM 0 HZ PHE A 78 131.301 2.671 12.633 1.00 0.00 H new ATOM 1233 N GLY A 79 127.443 -1.357 9.419 1.00 0.00 N ATOM 1234 CA GLY A 79 127.798 -2.606 10.150 1.00 0.00 C ATOM 1235 C GLY A 79 128.357 -3.638 9.171 1.00 0.00 C ATOM 1236 O GLY A 79 129.208 -4.437 9.509 1.00 0.00 O ATOM 0 H GLY A 79 126.462 -1.083 9.478 1.00 0.00 H new ATOM 0 HA2 GLY A 79 128.535 -2.389 10.923 1.00 0.00 H new ATOM 0 HA3 GLY A 79 126.918 -3.007 10.652 1.00 0.00 H new ATOM 1240 N CYS A 80 127.887 -3.627 7.959 1.00 0.00 N ATOM 1241 CA CYS A 80 128.396 -4.608 6.964 1.00 0.00 C ATOM 1242 C CYS A 80 129.852 -4.279 6.612 1.00 0.00 C ATOM 1243 O CYS A 80 130.718 -5.128 6.674 1.00 0.00 O ATOM 1244 CB CYS A 80 127.535 -4.552 5.701 1.00 0.00 C ATOM 1245 SG CYS A 80 128.065 -5.845 4.550 1.00 0.00 S ATOM 0 H CYS A 80 127.175 -2.984 7.614 1.00 0.00 H new ATOM 0 HA CYS A 80 128.347 -5.611 7.389 1.00 0.00 H new ATOM 0 HB2 CYS A 80 126.484 -4.688 5.958 1.00 0.00 H new ATOM 0 HB3 CYS A 80 127.624 -3.573 5.231 1.00 0.00 H new ATOM 0 HG CYS A 80 128.044 -5.380 3.336 1.00 0.00 H new ATOM 1251 N LEU A 81 130.140 -3.052 6.263 1.00 0.00 N ATOM 1252 CA LEU A 81 131.556 -2.711 5.941 1.00 0.00 C ATOM 1253 C LEU A 81 132.393 -2.720 7.228 1.00 0.00 C ATOM 1254 O LEU A 81 133.522 -3.169 7.238 1.00 0.00 O ATOM 1255 CB LEU A 81 131.628 -1.319 5.299 1.00 0.00 C ATOM 1256 CG LEU A 81 130.826 -1.294 3.989 1.00 0.00 C ATOM 1257 CD1 LEU A 81 130.872 0.122 3.403 1.00 0.00 C ATOM 1258 CD2 LEU A 81 131.426 -2.290 2.978 1.00 0.00 C ATOM 0 H LEU A 81 129.471 -2.286 6.188 1.00 0.00 H new ATOM 0 HA LEU A 81 131.948 -3.450 5.242 1.00 0.00 H new ATOM 0 HB2 LEU A 81 131.234 -0.572 5.989 1.00 0.00 H new ATOM 0 HB3 LEU A 81 132.667 -1.055 5.102 1.00 0.00 H new ATOM 0 HG LEU A 81 129.794 -1.580 4.192 1.00 0.00 H new ATOM 0 HD11 LEU A 81 130.305 0.149 2.472 1.00 0.00 H new ATOM 0 HD12 LEU A 81 130.437 0.824 4.114 1.00 0.00 H new ATOM 0 HD13 LEU A 81 131.907 0.401 3.205 1.00 0.00 H new ATOM 0 HD21 LEU A 81 130.849 -2.263 2.054 1.00 0.00 H new ATOM 0 HD22 LEU A 81 132.460 -2.017 2.768 1.00 0.00 H new ATOM 0 HD23 LEU A 81 131.394 -3.296 3.396 1.00 0.00 H new ATOM 1270 N ARG A 82 131.856 -2.219 8.312 1.00 0.00 N ATOM 1271 CA ARG A 82 132.635 -2.194 9.589 1.00 0.00 C ATOM 1272 C ARG A 82 132.999 -3.616 10.019 1.00 0.00 C ATOM 1273 O ARG A 82 134.091 -3.873 10.485 1.00 0.00 O ATOM 1274 CB ARG A 82 131.799 -1.513 10.686 1.00 0.00 C ATOM 1275 CG ARG A 82 132.521 -1.549 12.050 1.00 0.00 C ATOM 1276 CD ARG A 82 133.871 -0.824 11.978 1.00 0.00 C ATOM 1277 NE ARG A 82 134.411 -0.644 13.356 1.00 0.00 N ATOM 1278 CZ ARG A 82 135.667 -0.332 13.529 1.00 0.00 C ATOM 1279 NH1 ARG A 82 136.456 -0.198 12.499 1.00 0.00 N ATOM 1280 NH2 ARG A 82 136.135 -0.159 14.734 1.00 0.00 N ATOM 0 H ARG A 82 130.916 -1.828 8.369 1.00 0.00 H new ATOM 0 HA ARG A 82 133.556 -1.633 9.432 1.00 0.00 H new ATOM 0 HB2 ARG A 82 131.601 -0.479 10.405 1.00 0.00 H new ATOM 0 HB3 ARG A 82 130.833 -2.011 10.771 1.00 0.00 H new ATOM 0 HG2 ARG A 82 131.894 -1.082 12.810 1.00 0.00 H new ATOM 0 HG3 ARG A 82 132.676 -2.584 12.356 1.00 0.00 H new ATOM 0 HD2 ARG A 82 134.573 -1.398 11.373 1.00 0.00 H new ATOM 0 HD3 ARG A 82 133.750 0.145 11.493 1.00 0.00 H new ATOM 0 HE ARG A 82 133.799 -0.765 14.163 1.00 0.00 H new ATOM 0 HH11 ARG A 82 136.092 -0.337 11.556 1.00 0.00 H new ATOM 0 HH12 ARG A 82 137.437 0.046 12.636 1.00 0.00 H new ATOM 0 HH21 ARG A 82 135.520 -0.267 15.540 1.00 0.00 H new ATOM 0 HH22 ARG A 82 137.116 0.085 14.870 1.00 0.00 H new ATOM 1294 N GLU A 83 132.092 -4.542 9.878 1.00 0.00 N ATOM 1295 CA GLU A 83 132.385 -5.945 10.292 1.00 0.00 C ATOM 1296 C GLU A 83 133.406 -6.587 9.348 1.00 0.00 C ATOM 1297 O GLU A 83 134.280 -7.308 9.787 1.00 0.00 O ATOM 1298 CB GLU A 83 131.085 -6.767 10.301 1.00 0.00 C ATOM 1299 CG GLU A 83 130.306 -6.518 11.602 1.00 0.00 C ATOM 1300 CD GLU A 83 130.186 -5.016 11.876 1.00 0.00 C ATOM 1301 OE1 GLU A 83 131.210 -4.394 12.108 1.00 0.00 O ATOM 1302 OE2 GLU A 83 129.074 -4.517 11.859 1.00 0.00 O ATOM 0 H GLU A 83 131.160 -4.389 9.494 1.00 0.00 H new ATOM 0 HA GLU A 83 132.809 -5.930 11.296 1.00 0.00 H new ATOM 0 HB2 GLU A 83 130.470 -6.496 9.443 1.00 0.00 H new ATOM 0 HB3 GLU A 83 131.317 -7.828 10.205 1.00 0.00 H new ATOM 0 HG2 GLU A 83 129.313 -6.961 11.528 1.00 0.00 H new ATOM 0 HG3 GLU A 83 130.812 -7.006 12.435 1.00 0.00 H new ATOM 1309 N TRP A 84 133.340 -6.333 8.066 1.00 0.00 N ATOM 1310 CA TRP A 84 134.346 -6.937 7.149 1.00 0.00 C ATOM 1311 C TRP A 84 135.736 -6.457 7.573 1.00 0.00 C ATOM 1312 O TRP A 84 136.672 -7.226 7.677 1.00 0.00 O ATOM 1313 CB TRP A 84 134.067 -6.515 5.706 1.00 0.00 C ATOM 1314 CG TRP A 84 134.960 -7.295 4.797 1.00 0.00 C ATOM 1315 CD1 TRP A 84 134.657 -8.499 4.259 1.00 0.00 C ATOM 1316 CD2 TRP A 84 136.294 -6.958 4.324 1.00 0.00 C ATOM 1317 NE1 TRP A 84 135.722 -8.922 3.485 1.00 0.00 N ATOM 1318 CE2 TRP A 84 136.755 -8.007 3.494 1.00 0.00 C ATOM 1319 CE3 TRP A 84 137.141 -5.855 4.534 1.00 0.00 C ATOM 1320 CZ2 TRP A 84 138.013 -7.963 2.894 1.00 0.00 C ATOM 1321 CZ3 TRP A 84 138.407 -5.808 3.931 1.00 0.00 C ATOM 1322 CH2 TRP A 84 138.842 -6.860 3.114 1.00 0.00 C ATOM 0 H TRP A 84 132.640 -5.740 7.620 1.00 0.00 H new ATOM 0 HA TRP A 84 134.291 -8.024 7.205 1.00 0.00 H new ATOM 0 HB2 TRP A 84 133.022 -6.696 5.455 1.00 0.00 H new ATOM 0 HB3 TRP A 84 134.244 -5.446 5.584 1.00 0.00 H new ATOM 0 HD1 TRP A 84 133.735 -9.041 4.409 1.00 0.00 H new ATOM 0 HE1 TRP A 84 135.742 -9.802 2.970 1.00 0.00 H new ATOM 0 HE3 TRP A 84 136.815 -5.040 5.163 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 138.344 -8.775 2.264 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 139.050 -4.956 4.097 1.00 0.00 H new ATOM 0 HH2 TRP A 84 139.818 -6.818 2.654 1.00 0.00 H new ATOM 1333 N CYS A 85 135.875 -5.183 7.819 1.00 0.00 N ATOM 1334 CA CYS A 85 137.198 -4.642 8.237 1.00 0.00 C ATOM 1335 C CYS A 85 137.629 -5.322 9.538 1.00 0.00 C ATOM 1336 O CYS A 85 138.782 -5.656 9.728 1.00 0.00 O ATOM 1337 CB CYS A 85 137.078 -3.131 8.457 1.00 0.00 C ATOM 1338 SG CYS A 85 136.933 -2.296 6.857 1.00 0.00 S ATOM 0 H CYS A 85 135.128 -4.493 7.748 1.00 0.00 H new ATOM 0 HA CYS A 85 137.941 -4.836 7.463 1.00 0.00 H new ATOM 0 HB2 CYS A 85 136.207 -2.911 9.074 1.00 0.00 H new ATOM 0 HB3 CYS A 85 137.951 -2.761 8.994 1.00 0.00 H new ATOM 0 HG CYS A 85 136.829 -1.014 7.045 1.00 0.00 H new ATOM 1344 N ASP A 86 136.706 -5.530 10.433 1.00 0.00 N ATOM 1345 CA ASP A 86 137.040 -6.192 11.727 1.00 0.00 C ATOM 1346 C ASP A 86 137.606 -7.594 11.479 1.00 0.00 C ATOM 1347 O ASP A 86 138.465 -8.060 12.203 1.00 0.00 O ATOM 1348 CB ASP A 86 135.779 -6.297 12.588 1.00 0.00 C ATOM 1349 CG ASP A 86 135.384 -4.906 13.086 1.00 0.00 C ATOM 1350 OD1 ASP A 86 136.190 -3.999 12.951 1.00 0.00 O ATOM 1351 OD2 ASP A 86 134.285 -4.771 13.598 1.00 0.00 O ATOM 0 H ASP A 86 135.726 -5.268 10.324 1.00 0.00 H new ATOM 0 HA ASP A 86 137.791 -5.595 12.244 1.00 0.00 H new ATOM 0 HB2 ASP A 86 134.965 -6.732 12.008 1.00 0.00 H new ATOM 0 HB3 ASP A 86 135.958 -6.961 13.434 1.00 0.00 H new ATOM 1356 N ALA A 87 137.122 -8.284 10.478 1.00 0.00 N ATOM 1357 CA ALA A 87 137.627 -9.667 10.212 1.00 0.00 C ATOM 1358 C ALA A 87 138.864 -9.617 9.316 1.00 0.00 C ATOM 1359 O ALA A 87 139.756 -10.433 9.441 1.00 0.00 O ATOM 1360 CB ALA A 87 136.537 -10.485 9.514 1.00 0.00 C ATOM 0 H ALA A 87 136.402 -7.953 9.836 1.00 0.00 H new ATOM 0 HA ALA A 87 137.891 -10.132 11.162 1.00 0.00 H new ATOM 0 HB1 ALA A 87 136.906 -11.492 9.321 1.00 0.00 H new ATOM 0 HB2 ALA A 87 135.656 -10.538 10.154 1.00 0.00 H new ATOM 0 HB3 ALA A 87 136.272 -10.008 8.570 1.00 0.00 H new ATOM 1366 N PHE A 88 138.916 -8.688 8.393 1.00 0.00 N ATOM 1367 CA PHE A 88 140.089 -8.610 7.466 1.00 0.00 C ATOM 1368 C PHE A 88 140.994 -7.441 7.857 1.00 0.00 C ATOM 1369 O PHE A 88 141.947 -7.609 8.592 1.00 0.00 O ATOM 1370 CB PHE A 88 139.583 -8.412 6.035 1.00 0.00 C ATOM 1371 CG PHE A 88 138.856 -9.660 5.592 1.00 0.00 C ATOM 1372 CD1 PHE A 88 139.581 -10.757 5.112 1.00 0.00 C ATOM 1373 CD2 PHE A 88 137.460 -9.727 5.675 1.00 0.00 C ATOM 1374 CE1 PHE A 88 138.910 -11.918 4.710 1.00 0.00 C ATOM 1375 CE2 PHE A 88 136.788 -10.888 5.275 1.00 0.00 C ATOM 1376 CZ PHE A 88 137.514 -11.983 4.793 1.00 0.00 C ATOM 0 H PHE A 88 138.197 -7.980 8.241 1.00 0.00 H new ATOM 0 HA PHE A 88 140.663 -9.534 7.532 1.00 0.00 H new ATOM 0 HB2 PHE A 88 138.916 -7.551 5.987 1.00 0.00 H new ATOM 0 HB3 PHE A 88 140.418 -8.205 5.366 1.00 0.00 H new ATOM 0 HD1 PHE A 88 140.658 -10.708 5.052 1.00 0.00 H new ATOM 0 HD2 PHE A 88 136.901 -8.882 6.048 1.00 0.00 H new ATOM 0 HE1 PHE A 88 139.469 -12.763 4.336 1.00 0.00 H new ATOM 0 HE2 PHE A 88 135.711 -10.939 5.338 1.00 0.00 H new ATOM 0 HZ PHE A 88 136.997 -12.879 4.485 1.00 0.00 H new ATOM 1386 N LEU A 89 140.712 -6.256 7.380 1.00 0.00 N ATOM 1387 CA LEU A 89 141.562 -5.080 7.732 1.00 0.00 C ATOM 1388 C LEU A 89 141.045 -4.458 9.031 1.00 0.00 C ATOM 1389 O LEU A 89 141.583 -4.783 10.076 1.00 0.00 O ATOM 1390 CB LEU A 89 141.489 -4.045 6.599 1.00 0.00 C ATOM 1391 CG LEU A 89 142.209 -2.748 7.003 1.00 0.00 C ATOM 1392 CD1 LEU A 89 143.645 -3.056 7.451 1.00 0.00 C ATOM 1393 CD2 LEU A 89 142.241 -1.796 5.800 1.00 0.00 C ATOM 1394 OXT LEU A 89 140.121 -3.667 8.958 1.00 0.00 O ATOM 0 H LEU A 89 139.928 -6.052 6.760 1.00 0.00 H new ATOM 0 HA LEU A 89 142.596 -5.397 7.867 1.00 0.00 H new ATOM 0 HB2 LEU A 89 141.943 -4.453 5.696 1.00 0.00 H new ATOM 0 HB3 LEU A 89 140.447 -3.830 6.362 1.00 0.00 H new ATOM 0 HG LEU A 89 141.674 -2.283 7.831 1.00 0.00 H new ATOM 0 HD11 LEU A 89 144.144 -2.129 7.734 1.00 0.00 H new ATOM 0 HD12 LEU A 89 143.622 -3.732 8.306 1.00 0.00 H new ATOM 0 HD13 LEU A 89 144.189 -3.525 6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 89 142.750 -0.874 6.079 1.00 0.00 H new ATOM 0 HD22 LEU A 89 142.774 -2.269 4.975 1.00 0.00 H new ATOM 0 HD23 LEU A 89 141.221 -1.568 5.489 1.00 0.00 H new TER 1406 LEU A 89 ATOM 1407 N MET B 1 169.880 -4.475 -4.203 1.00 0.00 N ATOM 1408 CA MET B 1 168.935 -5.371 -4.926 1.00 0.00 C ATOM 1409 C MET B 1 167.893 -5.910 -3.944 1.00 0.00 C ATOM 1410 O MET B 1 166.707 -5.710 -4.111 1.00 0.00 O ATOM 1411 CB MET B 1 169.709 -6.541 -5.539 1.00 0.00 C ATOM 1412 CG MET B 1 170.575 -6.032 -6.694 1.00 0.00 C ATOM 1413 SD MET B 1 171.493 -7.415 -7.422 1.00 0.00 S ATOM 1414 CE MET B 1 172.584 -7.755 -6.016 1.00 0.00 C ATOM 0 H1 MET B 1 170.410 -3.903 -4.890 1.00 0.00 H new ATOM 0 H2 MET B 1 169.346 -3.847 -3.568 1.00 0.00 H new ATOM 0 H3 MET B 1 170.544 -5.049 -3.645 1.00 0.00 H new ATOM 0 HA MET B 1 168.436 -4.811 -5.717 1.00 0.00 H new ATOM 0 HB2 MET B 1 170.335 -7.013 -4.782 1.00 0.00 H new ATOM 0 HB3 MET B 1 169.015 -7.301 -5.898 1.00 0.00 H new ATOM 0 HG2 MET B 1 169.949 -5.560 -7.451 1.00 0.00 H new ATOM 0 HG3 MET B 1 171.268 -5.272 -6.334 1.00 0.00 H new ATOM 0 HE1 MET B 1 173.517 -8.189 -6.376 1.00 0.00 H new ATOM 0 HE2 MET B 1 172.797 -6.826 -5.487 1.00 0.00 H new ATOM 0 HE3 MET B 1 172.096 -8.455 -5.338 1.00 0.00 H new ATOM 1426 N THR B 2 168.329 -6.594 -2.922 1.00 0.00 N ATOM 1427 CA THR B 2 167.368 -7.149 -1.927 1.00 0.00 C ATOM 1428 C THR B 2 166.653 -6.000 -1.210 1.00 0.00 C ATOM 1429 O THR B 2 167.255 -5.006 -0.855 1.00 0.00 O ATOM 1430 CB THR B 2 168.129 -7.999 -0.907 1.00 0.00 C ATOM 1431 OG1 THR B 2 168.910 -8.968 -1.592 1.00 0.00 O ATOM 1432 CG2 THR B 2 167.134 -8.705 0.017 1.00 0.00 C ATOM 0 H THR B 2 169.311 -6.793 -2.733 1.00 0.00 H new ATOM 0 HA THR B 2 166.630 -7.769 -2.437 1.00 0.00 H new ATOM 0 HB THR B 2 168.780 -7.358 -0.313 1.00 0.00 H new ATOM 0 HG1 THR B 2 169.400 -9.513 -0.941 1.00 0.00 H new ATOM 0 HG21 THR B 2 167.678 -9.310 0.743 1.00 0.00 H new ATOM 0 HG22 THR B 2 166.534 -7.961 0.541 1.00 0.00 H new ATOM 0 HG23 THR B 2 166.481 -9.347 -0.574 1.00 0.00 H new ATOM 1440 N THR B 3 165.370 -6.128 -0.999 1.00 0.00 N ATOM 1441 CA THR B 3 164.612 -5.045 -0.311 1.00 0.00 C ATOM 1442 C THR B 3 164.872 -5.105 1.196 1.00 0.00 C ATOM 1443 O THR B 3 165.441 -6.052 1.703 1.00 0.00 O ATOM 1444 CB THR B 3 163.115 -5.224 -0.578 1.00 0.00 C ATOM 1445 OG1 THR B 3 162.696 -6.490 -0.085 1.00 0.00 O ATOM 1446 CG2 THR B 3 162.848 -5.145 -2.083 1.00 0.00 C ATOM 0 H THR B 3 164.814 -6.938 -1.274 1.00 0.00 H new ATOM 0 HA THR B 3 164.940 -4.078 -0.693 1.00 0.00 H new ATOM 0 HB THR B 3 162.559 -4.434 -0.073 1.00 0.00 H new ATOM 0 HG1 THR B 3 161.738 -6.606 -0.253 1.00 0.00 H new ATOM 0 HG21 THR B 3 161.782 -5.273 -2.271 1.00 0.00 H new ATOM 0 HG22 THR B 3 163.169 -4.173 -2.459 1.00 0.00 H new ATOM 0 HG23 THR B 3 163.403 -5.933 -2.593 1.00 0.00 H new ATOM 1454 N SER B 4 164.459 -4.096 1.915 1.00 0.00 N ATOM 1455 CA SER B 4 164.680 -4.082 3.390 1.00 0.00 C ATOM 1456 C SER B 4 163.789 -5.133 4.054 1.00 0.00 C ATOM 1457 O SER B 4 162.850 -5.637 3.470 1.00 0.00 O ATOM 1458 CB SER B 4 164.334 -2.699 3.943 1.00 0.00 C ATOM 1459 OG SER B 4 162.933 -2.482 3.829 1.00 0.00 O ATOM 0 H SER B 4 163.976 -3.278 1.543 1.00 0.00 H new ATOM 0 HA SER B 4 165.725 -4.309 3.601 1.00 0.00 H new ATOM 0 HB2 SER B 4 164.641 -2.625 4.986 1.00 0.00 H new ATOM 0 HB3 SER B 4 164.878 -1.930 3.395 1.00 0.00 H new ATOM 0 HG SER B 4 162.709 -1.597 4.185 1.00 0.00 H new ATOM 1465 N GLN B 5 164.101 -5.474 5.275 1.00 0.00 N ATOM 1466 CA GLN B 5 163.313 -6.503 6.008 1.00 0.00 C ATOM 1467 C GLN B 5 161.894 -5.993 6.263 1.00 0.00 C ATOM 1468 O GLN B 5 160.985 -6.761 6.505 1.00 0.00 O ATOM 1469 CB GLN B 5 163.997 -6.791 7.346 1.00 0.00 C ATOM 1470 CG GLN B 5 165.319 -7.519 7.093 1.00 0.00 C ATOM 1471 CD GLN B 5 166.008 -7.810 8.428 1.00 0.00 C ATOM 1472 OE1 GLN B 5 165.642 -7.153 9.494 1.00 0.00 O flip ATOM 1473 NE2 GLN B 5 166.891 -8.641 8.500 1.00 0.00 N flip ATOM 0 H GLN B 5 164.879 -5.077 5.802 1.00 0.00 H new ATOM 0 HA GLN B 5 163.260 -7.413 5.411 1.00 0.00 H new ATOM 0 HB2 GLN B 5 164.179 -5.860 7.882 1.00 0.00 H new ATOM 0 HB3 GLN B 5 163.348 -7.400 7.975 1.00 0.00 H new ATOM 0 HG2 GLN B 5 165.136 -8.450 6.556 1.00 0.00 H new ATOM 0 HG3 GLN B 5 165.967 -6.909 6.463 1.00 0.00 H new ATOM 0 HE21 GLN B 5 167.177 -9.155 7.667 1.00 0.00 H new ATOM 0 HE22 GLN B 5 167.346 -8.825 9.394 1.00 0.00 H new ATOM 1482 N LYS B 6 161.690 -4.700 6.211 1.00 0.00 N ATOM 1483 CA LYS B 6 160.331 -4.143 6.450 1.00 0.00 C ATOM 1484 C LYS B 6 159.386 -4.624 5.346 1.00 0.00 C ATOM 1485 O LYS B 6 158.224 -4.884 5.583 1.00 0.00 O ATOM 1486 CB LYS B 6 160.394 -2.611 6.412 1.00 0.00 C ATOM 1487 CG LYS B 6 161.317 -2.082 7.518 1.00 0.00 C ATOM 1488 CD LYS B 6 160.617 -2.132 8.883 1.00 0.00 C ATOM 1489 CE LYS B 6 161.448 -1.345 9.900 1.00 0.00 C ATOM 1490 NZ LYS B 6 160.727 -1.296 11.203 1.00 0.00 N ATOM 0 H LYS B 6 162.412 -4.007 6.012 1.00 0.00 H new ATOM 0 HA LYS B 6 159.969 -4.476 7.423 1.00 0.00 H new ATOM 0 HB2 LYS B 6 160.757 -2.280 5.439 1.00 0.00 H new ATOM 0 HB3 LYS B 6 159.393 -2.197 6.537 1.00 0.00 H new ATOM 0 HG2 LYS B 6 162.230 -2.676 7.551 1.00 0.00 H new ATOM 0 HG3 LYS B 6 161.611 -1.057 7.293 1.00 0.00 H new ATOM 0 HD2 LYS B 6 159.615 -1.709 8.808 1.00 0.00 H new ATOM 0 HD3 LYS B 6 160.503 -3.166 9.210 1.00 0.00 H new ATOM 0 HE2 LYS B 6 162.423 -1.815 10.030 1.00 0.00 H new ATOM 0 HE3 LYS B 6 161.628 -0.334 9.534 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 161.293 -0.761 11.893 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 159.807 -0.829 11.073 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 160.578 -2.264 11.554 1.00 0.00 H new ATOM 1504 N HIS B 7 159.867 -4.719 4.137 1.00 0.00 N ATOM 1505 CA HIS B 7 158.984 -5.155 3.018 1.00 0.00 C ATOM 1506 C HIS B 7 158.421 -6.552 3.279 1.00 0.00 C ATOM 1507 O HIS B 7 157.230 -6.776 3.195 1.00 0.00 O ATOM 1508 CB HIS B 7 159.794 -5.175 1.717 1.00 0.00 C ATOM 1509 CG HIS B 7 158.948 -5.718 0.598 1.00 0.00 C ATOM 1510 ND1 HIS B 7 158.048 -4.929 -0.104 1.00 0.00 N ATOM 1511 CD2 HIS B 7 158.851 -6.975 0.050 1.00 0.00 C ATOM 1512 CE1 HIS B 7 157.455 -5.712 -1.026 1.00 0.00 C ATOM 1513 NE2 HIS B 7 157.909 -6.965 -0.971 1.00 0.00 N ATOM 0 H HIS B 7 160.831 -4.514 3.876 1.00 0.00 H new ATOM 0 HA HIS B 7 158.153 -4.454 2.938 1.00 0.00 H new ATOM 0 HB2 HIS B 7 160.133 -4.168 1.473 1.00 0.00 H new ATOM 0 HB3 HIS B 7 160.685 -5.790 1.842 1.00 0.00 H new ATOM 0 HD2 HIS B 7 159.420 -7.838 0.365 1.00 0.00 H new ATOM 0 HE1 HIS B 7 156.705 -5.368 -1.723 1.00 0.00 H new ATOM 0 HE2 HIS B 7 157.624 -7.751 -1.556 1.00 0.00 H new ATOM 1521 N ARG B 8 159.266 -7.497 3.592 1.00 0.00 N ATOM 1522 CA ARG B 8 158.786 -8.879 3.855 1.00 0.00 C ATOM 1523 C ARG B 8 158.009 -8.917 5.170 1.00 0.00 C ATOM 1524 O ARG B 8 157.080 -9.681 5.336 1.00 0.00 O ATOM 1525 CB ARG B 8 159.995 -9.815 3.939 1.00 0.00 C ATOM 1526 CG ARG B 8 160.616 -9.968 2.548 1.00 0.00 C ATOM 1527 CD ARG B 8 161.826 -10.899 2.626 1.00 0.00 C ATOM 1528 NE ARG B 8 162.839 -10.309 3.548 1.00 0.00 N ATOM 1529 CZ ARG B 8 163.830 -11.037 3.985 1.00 0.00 C ATOM 1530 NH1 ARG B 8 163.946 -12.279 3.603 1.00 0.00 N ATOM 1531 NH2 ARG B 8 164.708 -10.520 4.802 1.00 0.00 N ATOM 0 H ARG B 8 160.274 -7.367 3.677 1.00 0.00 H new ATOM 0 HA ARG B 8 158.127 -9.200 3.048 1.00 0.00 H new ATOM 0 HB2 ARG B 8 160.731 -9.415 4.636 1.00 0.00 H new ATOM 0 HB3 ARG B 8 159.689 -10.789 4.322 1.00 0.00 H new ATOM 0 HG2 ARG B 8 159.880 -10.370 1.852 1.00 0.00 H new ATOM 0 HG3 ARG B 8 160.918 -8.994 2.165 1.00 0.00 H new ATOM 0 HD2 ARG B 8 161.521 -11.883 2.983 1.00 0.00 H new ATOM 0 HD3 ARG B 8 162.257 -11.039 1.635 1.00 0.00 H new ATOM 0 HE ARG B 8 162.757 -9.334 3.838 1.00 0.00 H new ATOM 0 HH11 ARG B 8 163.262 -12.682 2.962 1.00 0.00 H new ATOM 0 HH12 ARG B 8 164.721 -12.847 3.945 1.00 0.00 H new ATOM 0 HH21 ARG B 8 164.619 -9.548 5.098 1.00 0.00 H new ATOM 0 HH22 ARG B 8 165.483 -11.088 5.144 1.00 0.00 H new ATOM 1545 N ASP B 9 158.383 -8.091 6.102 1.00 0.00 N ATOM 1546 CA ASP B 9 157.674 -8.063 7.410 1.00 0.00 C ATOM 1547 C ASP B 9 156.294 -7.421 7.255 1.00 0.00 C ATOM 1548 O ASP B 9 155.336 -7.843 7.864 1.00 0.00 O ATOM 1549 CB ASP B 9 158.491 -7.264 8.424 1.00 0.00 C ATOM 1550 CG ASP B 9 159.754 -8.043 8.795 1.00 0.00 C ATOM 1551 OD1 ASP B 9 159.761 -9.248 8.602 1.00 0.00 O ATOM 1552 OD2 ASP B 9 160.693 -7.422 9.266 1.00 0.00 O ATOM 0 H ASP B 9 159.154 -7.429 6.015 1.00 0.00 H new ATOM 0 HA ASP B 9 157.553 -9.088 7.761 1.00 0.00 H new ATOM 0 HB2 ASP B 9 158.760 -6.294 8.006 1.00 0.00 H new ATOM 0 HB3 ASP B 9 157.895 -7.072 9.316 1.00 0.00 H new ATOM 1557 N PHE B 10 156.191 -6.383 6.469 1.00 0.00 N ATOM 1558 CA PHE B 10 154.874 -5.698 6.314 1.00 0.00 C ATOM 1559 C PHE B 10 153.884 -6.609 5.583 1.00 0.00 C ATOM 1560 O PHE B 10 152.718 -6.665 5.922 1.00 0.00 O ATOM 1561 CB PHE B 10 155.070 -4.404 5.516 1.00 0.00 C ATOM 1562 CG PHE B 10 153.805 -3.577 5.557 1.00 0.00 C ATOM 1563 CD1 PHE B 10 153.613 -2.649 6.589 1.00 0.00 C ATOM 1564 CD2 PHE B 10 152.831 -3.730 4.563 1.00 0.00 C ATOM 1565 CE1 PHE B 10 152.445 -1.876 6.629 1.00 0.00 C ATOM 1566 CE2 PHE B 10 151.663 -2.957 4.603 1.00 0.00 C ATOM 1567 CZ PHE B 10 151.470 -2.031 5.636 1.00 0.00 C ATOM 0 H PHE B 10 156.958 -5.981 5.930 1.00 0.00 H new ATOM 0 HA PHE B 10 154.473 -5.467 7.301 1.00 0.00 H new ATOM 0 HB2 PHE B 10 155.901 -3.834 5.930 1.00 0.00 H new ATOM 0 HB3 PHE B 10 155.328 -4.639 4.483 1.00 0.00 H new ATOM 0 HD1 PHE B 10 154.366 -2.529 7.354 1.00 0.00 H new ATOM 0 HD2 PHE B 10 152.980 -4.443 3.766 1.00 0.00 H new ATOM 0 HE1 PHE B 10 152.297 -1.161 7.425 1.00 0.00 H new ATOM 0 HE2 PHE B 10 150.911 -3.075 3.837 1.00 0.00 H new ATOM 0 HZ PHE B 10 150.569 -1.436 5.667 1.00 0.00 H new ATOM 1577 N VAL B 11 154.329 -7.321 4.584 1.00 0.00 N ATOM 1578 CA VAL B 11 153.400 -8.220 3.838 1.00 0.00 C ATOM 1579 C VAL B 11 153.253 -9.553 4.577 1.00 0.00 C ATOM 1580 O VAL B 11 152.832 -10.540 4.007 1.00 0.00 O ATOM 1581 CB VAL B 11 153.961 -8.474 2.440 1.00 0.00 C ATOM 1582 CG1 VAL B 11 154.150 -7.139 1.717 1.00 0.00 C ATOM 1583 CG2 VAL B 11 155.308 -9.187 2.561 1.00 0.00 C ATOM 0 H VAL B 11 155.293 -7.320 4.252 1.00 0.00 H new ATOM 0 HA VAL B 11 152.422 -7.744 3.764 1.00 0.00 H new ATOM 0 HB VAL B 11 153.268 -9.096 1.873 1.00 0.00 H new ATOM 0 HG11 VAL B 11 154.550 -7.319 0.719 1.00 0.00 H new ATOM 0 HG12 VAL B 11 153.190 -6.630 1.636 1.00 0.00 H new ATOM 0 HG13 VAL B 11 154.845 -6.516 2.280 1.00 0.00 H new ATOM 0 HG21 VAL B 11 155.713 -9.371 1.566 1.00 0.00 H new ATOM 0 HG22 VAL B 11 156.001 -8.563 3.125 1.00 0.00 H new ATOM 0 HG23 VAL B 11 155.172 -10.137 3.078 1.00 0.00 H new ATOM 1593 N ALA B 12 153.614 -9.594 5.841 1.00 0.00 N ATOM 1594 CA ALA B 12 153.517 -10.869 6.628 1.00 0.00 C ATOM 1595 C ALA B 12 152.590 -10.687 7.836 1.00 0.00 C ATOM 1596 O ALA B 12 152.289 -11.634 8.535 1.00 0.00 O ATOM 1597 CB ALA B 12 154.910 -11.258 7.124 1.00 0.00 C ATOM 0 H ALA B 12 153.973 -8.795 6.363 1.00 0.00 H new ATOM 0 HA ALA B 12 153.111 -11.650 5.985 1.00 0.00 H new ATOM 0 HB1 ALA B 12 154.847 -12.183 7.697 1.00 0.00 H new ATOM 0 HB2 ALA B 12 155.573 -11.404 6.271 1.00 0.00 H new ATOM 0 HB3 ALA B 12 155.305 -10.465 7.759 1.00 0.00 H new ATOM 1603 N GLU B 13 152.117 -9.493 8.086 1.00 0.00 N ATOM 1604 CA GLU B 13 151.196 -9.290 9.249 1.00 0.00 C ATOM 1605 C GLU B 13 150.286 -8.077 8.986 1.00 0.00 C ATOM 1606 O GLU B 13 150.684 -7.143 8.320 1.00 0.00 O ATOM 1607 CB GLU B 13 152.016 -9.044 10.519 1.00 0.00 C ATOM 1608 CG GLU B 13 153.071 -7.973 10.248 1.00 0.00 C ATOM 1609 CD GLU B 13 153.864 -7.695 11.527 1.00 0.00 C ATOM 1610 OE1 GLU B 13 153.445 -6.835 12.284 1.00 0.00 O ATOM 1611 OE2 GLU B 13 154.876 -8.345 11.725 1.00 0.00 O ATOM 0 H GLU B 13 152.325 -8.656 7.542 1.00 0.00 H new ATOM 0 HA GLU B 13 150.583 -10.182 9.379 1.00 0.00 H new ATOM 0 HB2 GLU B 13 151.362 -8.727 11.331 1.00 0.00 H new ATOM 0 HB3 GLU B 13 152.496 -9.969 10.839 1.00 0.00 H new ATOM 0 HG2 GLU B 13 153.743 -8.303 9.456 1.00 0.00 H new ATOM 0 HG3 GLU B 13 152.593 -7.058 9.899 1.00 0.00 H new ATOM 1618 N PRO B 14 149.080 -8.067 9.520 1.00 0.00 N ATOM 1619 CA PRO B 14 148.140 -6.923 9.341 1.00 0.00 C ATOM 1620 C PRO B 14 148.856 -5.570 9.471 1.00 0.00 C ATOM 1621 O PRO B 14 149.937 -5.483 10.018 1.00 0.00 O ATOM 1622 CB PRO B 14 147.125 -7.107 10.476 1.00 0.00 C ATOM 1623 CG PRO B 14 147.098 -8.582 10.746 1.00 0.00 C ATOM 1624 CD PRO B 14 148.475 -9.139 10.339 1.00 0.00 C ATOM 0 HA PRO B 14 147.684 -6.916 8.351 1.00 0.00 H new ATOM 0 HB2 PRO B 14 147.423 -6.550 11.364 1.00 0.00 H new ATOM 0 HB3 PRO B 14 146.140 -6.742 10.186 1.00 0.00 H new ATOM 0 HG2 PRO B 14 146.899 -8.778 11.800 1.00 0.00 H new ATOM 0 HG3 PRO B 14 146.303 -9.064 10.177 1.00 0.00 H new ATOM 0 HD2 PRO B 14 149.086 -9.364 11.213 1.00 0.00 H new ATOM 0 HD3 PRO B 14 148.377 -10.065 9.772 1.00 0.00 H new ATOM 1632 N MET B 15 148.265 -4.514 8.972 1.00 0.00 N ATOM 1633 CA MET B 15 148.918 -3.173 9.071 1.00 0.00 C ATOM 1634 C MET B 15 148.438 -2.449 10.334 1.00 0.00 C ATOM 1635 O MET B 15 149.083 -1.542 10.824 1.00 0.00 O ATOM 1636 CB MET B 15 148.565 -2.340 7.837 1.00 0.00 C ATOM 1637 CG MET B 15 147.068 -2.457 7.541 1.00 0.00 C ATOM 1638 SD MET B 15 146.570 -1.145 6.392 1.00 0.00 S ATOM 1639 CE MET B 15 147.178 -1.899 4.861 1.00 0.00 C ATOM 0 H MET B 15 147.360 -4.522 8.501 1.00 0.00 H new ATOM 0 HA MET B 15 149.999 -3.305 9.125 1.00 0.00 H new ATOM 0 HB2 MET B 15 148.831 -1.296 8.004 1.00 0.00 H new ATOM 0 HB3 MET B 15 149.142 -2.683 6.978 1.00 0.00 H new ATOM 0 HG2 MET B 15 146.847 -3.434 7.111 1.00 0.00 H new ATOM 0 HG3 MET B 15 146.497 -2.380 8.466 1.00 0.00 H new ATOM 0 HE1 MET B 15 147.263 -1.135 4.088 1.00 0.00 H new ATOM 0 HE2 MET B 15 148.156 -2.345 5.039 1.00 0.00 H new ATOM 0 HE3 MET B 15 146.481 -2.671 4.534 1.00 0.00 H new ATOM 1649 N GLY B 16 147.314 -2.845 10.865 1.00 0.00 N ATOM 1650 CA GLY B 16 146.792 -2.182 12.098 1.00 0.00 C ATOM 1651 C GLY B 16 146.736 -0.667 11.888 1.00 0.00 C ATOM 1652 O GLY B 16 146.356 -0.189 10.837 1.00 0.00 O ATOM 0 H GLY B 16 146.733 -3.599 10.500 1.00 0.00 H new ATOM 0 HA2 GLY B 16 145.798 -2.563 12.334 1.00 0.00 H new ATOM 0 HA3 GLY B 16 147.433 -2.417 12.948 1.00 0.00 H new ATOM 1656 N GLU B 17 147.094 0.092 12.894 1.00 0.00 N ATOM 1657 CA GLU B 17 147.050 1.585 12.788 1.00 0.00 C ATOM 1658 C GLU B 17 148.467 2.137 12.625 1.00 0.00 C ATOM 1659 O GLU B 17 148.775 3.216 13.091 1.00 0.00 O ATOM 1660 CB GLU B 17 146.433 2.160 14.066 1.00 0.00 C ATOM 1661 CG GLU B 17 144.941 1.822 14.115 1.00 0.00 C ATOM 1662 CD GLU B 17 144.332 2.388 15.400 1.00 0.00 C ATOM 1663 OE1 GLU B 17 144.397 1.710 16.412 1.00 0.00 O ATOM 1664 OE2 GLU B 17 143.813 3.491 15.350 1.00 0.00 O ATOM 0 H GLU B 17 147.418 -0.262 13.794 1.00 0.00 H new ATOM 0 HA GLU B 17 146.451 1.867 11.922 1.00 0.00 H new ATOM 0 HB2 GLU B 17 146.938 1.751 14.941 1.00 0.00 H new ATOM 0 HB3 GLU B 17 146.572 3.241 14.094 1.00 0.00 H new ATOM 0 HG2 GLU B 17 144.434 2.239 13.245 1.00 0.00 H new ATOM 0 HG3 GLU B 17 144.800 0.742 14.078 1.00 0.00 H new ATOM 1671 N LYS B 18 149.339 1.410 11.980 1.00 0.00 N ATOM 1672 CA LYS B 18 150.734 1.901 11.809 1.00 0.00 C ATOM 1673 C LYS B 18 150.714 3.227 11.031 1.00 0.00 C ATOM 1674 O LYS B 18 149.833 3.460 10.225 1.00 0.00 O ATOM 1675 CB LYS B 18 151.540 0.856 11.029 1.00 0.00 C ATOM 1676 CG LYS B 18 151.822 -0.344 11.935 1.00 0.00 C ATOM 1677 CD LYS B 18 152.721 -1.344 11.205 1.00 0.00 C ATOM 1678 CE LYS B 18 152.716 -2.675 11.959 1.00 0.00 C ATOM 1679 NZ LYS B 18 153.738 -3.585 11.369 1.00 0.00 N ATOM 0 H LYS B 18 149.145 0.499 11.565 1.00 0.00 H new ATOM 0 HA LYS B 18 151.194 2.062 12.784 1.00 0.00 H new ATOM 0 HB2 LYS B 18 150.986 0.537 10.146 1.00 0.00 H new ATOM 0 HB3 LYS B 18 152.477 1.290 10.678 1.00 0.00 H new ATOM 0 HG2 LYS B 18 152.304 -0.012 12.855 1.00 0.00 H new ATOM 0 HG3 LYS B 18 150.886 -0.824 12.221 1.00 0.00 H new ATOM 0 HD2 LYS B 18 152.368 -1.490 10.184 1.00 0.00 H new ATOM 0 HD3 LYS B 18 153.737 -0.955 11.138 1.00 0.00 H new ATOM 0 HE2 LYS B 18 152.929 -2.508 13.015 1.00 0.00 H new ATOM 0 HE3 LYS B 18 151.729 -3.134 11.902 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 153.590 -4.551 11.725 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 153.650 -3.580 10.333 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 154.689 -3.260 11.637 1.00 0.00 H new ATOM 1693 N PRO B 19 151.666 4.101 11.277 1.00 0.00 N ATOM 1694 CA PRO B 19 151.735 5.431 10.594 1.00 0.00 C ATOM 1695 C PRO B 19 152.039 5.309 9.097 1.00 0.00 C ATOM 1696 O PRO B 19 152.586 4.327 8.636 1.00 0.00 O ATOM 1697 CB PRO B 19 152.869 6.168 11.328 1.00 0.00 C ATOM 1698 CG PRO B 19 153.722 5.087 11.913 1.00 0.00 C ATOM 1699 CD PRO B 19 152.780 3.923 12.227 1.00 0.00 C ATOM 0 HA PRO B 19 150.781 5.956 10.641 1.00 0.00 H new ATOM 0 HB2 PRO B 19 153.441 6.794 10.643 1.00 0.00 H new ATOM 0 HB3 PRO B 19 152.475 6.823 12.105 1.00 0.00 H new ATOM 0 HG2 PRO B 19 154.498 4.781 11.212 1.00 0.00 H new ATOM 0 HG3 PRO B 19 154.226 5.434 12.815 1.00 0.00 H new ATOM 0 HD2 PRO B 19 153.274 2.961 12.088 1.00 0.00 H new ATOM 0 HD3 PRO B 19 152.433 3.957 13.260 1.00 0.00 H new ATOM 1707 N VAL B 20 151.673 6.305 8.337 1.00 0.00 N ATOM 1708 CA VAL B 20 151.921 6.264 6.869 1.00 0.00 C ATOM 1709 C VAL B 20 153.405 6.017 6.586 1.00 0.00 C ATOM 1710 O VAL B 20 153.762 5.278 5.690 1.00 0.00 O ATOM 1711 CB VAL B 20 151.496 7.599 6.248 1.00 0.00 C ATOM 1712 CG1 VAL B 20 152.221 8.751 6.951 1.00 0.00 C ATOM 1713 CG2 VAL B 20 151.850 7.608 4.756 1.00 0.00 C ATOM 0 H VAL B 20 151.210 7.150 8.673 1.00 0.00 H new ATOM 0 HA VAL B 20 151.341 5.451 6.433 1.00 0.00 H new ATOM 0 HB VAL B 20 150.420 7.723 6.367 1.00 0.00 H new ATOM 0 HG11 VAL B 20 151.916 9.698 6.506 1.00 0.00 H new ATOM 0 HG12 VAL B 20 151.966 8.749 8.011 1.00 0.00 H new ATOM 0 HG13 VAL B 20 153.298 8.627 6.837 1.00 0.00 H new ATOM 0 HG21 VAL B 20 151.547 8.558 4.316 1.00 0.00 H new ATOM 0 HG22 VAL B 20 152.926 7.479 4.637 1.00 0.00 H new ATOM 0 HG23 VAL B 20 151.329 6.793 4.254 1.00 0.00 H new ATOM 1723 N GLY B 21 154.274 6.658 7.330 1.00 0.00 N ATOM 1724 CA GLY B 21 155.739 6.497 7.100 1.00 0.00 C ATOM 1725 C GLY B 21 156.172 5.053 7.353 1.00 0.00 C ATOM 1726 O GLY B 21 157.316 4.702 7.141 1.00 0.00 O ATOM 0 H GLY B 21 154.026 7.290 8.092 1.00 0.00 H new ATOM 0 HA2 GLY B 21 155.985 6.781 6.077 1.00 0.00 H new ATOM 0 HA3 GLY B 21 156.291 7.168 7.758 1.00 0.00 H new ATOM 1730 N SER B 22 155.287 4.206 7.800 1.00 0.00 N ATOM 1731 CA SER B 22 155.683 2.791 8.051 1.00 0.00 C ATOM 1732 C SER B 22 155.657 2.018 6.732 1.00 0.00 C ATOM 1733 O SER B 22 156.286 0.988 6.594 1.00 0.00 O ATOM 1734 CB SER B 22 154.706 2.154 9.039 1.00 0.00 C ATOM 1735 OG SER B 22 155.159 0.847 9.369 1.00 0.00 O ATOM 0 H SER B 22 154.312 4.430 8.002 1.00 0.00 H new ATOM 0 HA SER B 22 156.689 2.762 8.471 1.00 0.00 H new ATOM 0 HB2 SER B 22 154.631 2.764 9.939 1.00 0.00 H new ATOM 0 HB3 SER B 22 153.708 2.107 8.603 1.00 0.00 H new ATOM 0 HG SER B 22 154.393 0.238 9.421 1.00 0.00 H new ATOM 1741 N LEU B 23 154.936 2.507 5.759 1.00 0.00 N ATOM 1742 CA LEU B 23 154.876 1.796 4.451 1.00 0.00 C ATOM 1743 C LEU B 23 156.249 1.837 3.779 1.00 0.00 C ATOM 1744 O LEU B 23 156.952 2.826 3.821 1.00 0.00 O ATOM 1745 CB LEU B 23 153.842 2.463 3.544 1.00 0.00 C ATOM 1746 CG LEU B 23 152.449 2.346 4.175 1.00 0.00 C ATOM 1747 CD1 LEU B 23 151.461 3.193 3.367 1.00 0.00 C ATOM 1748 CD2 LEU B 23 151.986 0.874 4.191 1.00 0.00 C ATOM 0 H LEU B 23 154.388 3.365 5.814 1.00 0.00 H new ATOM 0 HA LEU B 23 154.587 0.759 4.622 1.00 0.00 H new ATOM 0 HB2 LEU B 23 154.097 3.512 3.395 1.00 0.00 H new ATOM 0 HB3 LEU B 23 153.848 1.991 2.561 1.00 0.00 H new ATOM 0 HG LEU B 23 152.490 2.705 5.203 1.00 0.00 H new ATOM 0 HD11 LEU B 23 150.468 3.115 3.810 1.00 0.00 H new ATOM 0 HD12 LEU B 23 151.782 4.235 3.377 1.00 0.00 H new ATOM 0 HD13 LEU B 23 151.429 2.833 2.339 1.00 0.00 H new ATOM 0 HD21 LEU B 23 150.996 0.809 4.642 1.00 0.00 H new ATOM 0 HD22 LEU B 23 151.945 0.494 3.170 1.00 0.00 H new ATOM 0 HD23 LEU B 23 152.689 0.278 4.772 1.00 0.00 H new ATOM 1760 N ALA B 24 156.620 0.762 3.157 1.00 0.00 N ATOM 1761 CA ALA B 24 157.941 0.718 2.473 1.00 0.00 C ATOM 1762 C ALA B 24 157.967 1.747 1.332 1.00 0.00 C ATOM 1763 O ALA B 24 157.035 1.866 0.563 1.00 0.00 O ATOM 1764 CB ALA B 24 158.178 -0.690 1.913 1.00 0.00 C ATOM 0 H ALA B 24 156.067 -0.093 3.090 1.00 0.00 H new ATOM 0 HA ALA B 24 158.729 0.959 3.186 1.00 0.00 H new ATOM 0 HB1 ALA B 24 159.145 -0.724 1.412 1.00 0.00 H new ATOM 0 HB2 ALA B 24 158.167 -1.413 2.729 1.00 0.00 H new ATOM 0 HB3 ALA B 24 157.391 -0.935 1.200 1.00 0.00 H new ATOM 1770 N GLY B 25 159.042 2.488 1.230 1.00 0.00 N ATOM 1771 CA GLY B 25 159.164 3.521 0.150 1.00 0.00 C ATOM 1772 C GLY B 25 158.932 4.920 0.732 1.00 0.00 C ATOM 1773 O GLY B 25 159.376 5.907 0.178 1.00 0.00 O ATOM 0 H GLY B 25 159.847 2.423 1.852 1.00 0.00 H new ATOM 0 HA2 GLY B 25 160.153 3.467 -0.306 1.00 0.00 H new ATOM 0 HA3 GLY B 25 158.438 3.322 -0.639 1.00 0.00 H new ATOM 1777 N ILE B 26 158.250 5.021 1.848 1.00 0.00 N ATOM 1778 CA ILE B 26 158.004 6.367 2.461 1.00 0.00 C ATOM 1779 C ILE B 26 159.025 6.588 3.577 1.00 0.00 C ATOM 1780 O ILE B 26 159.077 5.836 4.531 1.00 0.00 O ATOM 1781 CB ILE B 26 156.596 6.415 3.060 1.00 0.00 C ATOM 1782 CG1 ILE B 26 155.570 5.926 2.031 1.00 0.00 C ATOM 1783 CG2 ILE B 26 156.269 7.856 3.460 1.00 0.00 C ATOM 1784 CD1 ILE B 26 155.741 6.679 0.708 1.00 0.00 C ATOM 0 H ILE B 26 157.854 4.233 2.360 1.00 0.00 H new ATOM 0 HA ILE B 26 158.098 7.140 1.698 1.00 0.00 H new ATOM 0 HB ILE B 26 156.556 5.768 3.937 1.00 0.00 H new ATOM 0 HG12 ILE B 26 155.693 4.856 1.866 1.00 0.00 H new ATOM 0 HG13 ILE B 26 154.561 6.076 2.415 1.00 0.00 H new ATOM 0 HG21 ILE B 26 155.267 7.897 3.887 1.00 0.00 H new ATOM 0 HG22 ILE B 26 156.993 8.202 4.198 1.00 0.00 H new ATOM 0 HG23 ILE B 26 156.314 8.497 2.580 1.00 0.00 H new ATOM 0 HD11 ILE B 26 155.006 6.321 -0.012 1.00 0.00 H new ATOM 0 HD12 ILE B 26 155.595 7.746 0.875 1.00 0.00 H new ATOM 0 HD13 ILE B 26 156.744 6.507 0.318 1.00 0.00 H new ATOM 1796 N GLY B 27 159.839 7.609 3.485 1.00 0.00 N ATOM 1797 CA GLY B 27 160.844 7.863 4.560 1.00 0.00 C ATOM 1798 C GLY B 27 160.262 8.844 5.582 1.00 0.00 C ATOM 1799 O GLY B 27 159.145 9.305 5.446 1.00 0.00 O ATOM 0 H GLY B 27 159.851 8.276 2.713 1.00 0.00 H new ATOM 0 HA2 GLY B 27 161.112 6.927 5.050 1.00 0.00 H new ATOM 0 HA3 GLY B 27 161.758 8.270 4.129 1.00 0.00 H new ATOM 1803 N GLU B 28 161.001 9.149 6.613 1.00 0.00 N ATOM 1804 CA GLU B 28 160.475 10.082 7.651 1.00 0.00 C ATOM 1805 C GLU B 28 160.120 11.429 7.014 1.00 0.00 C ATOM 1806 O GLU B 28 159.125 12.039 7.351 1.00 0.00 O ATOM 1807 CB GLU B 28 161.538 10.305 8.729 1.00 0.00 C ATOM 1808 CG GLU B 28 161.712 9.025 9.548 1.00 0.00 C ATOM 1809 CD GLU B 28 162.762 9.256 10.636 1.00 0.00 C ATOM 1810 OE1 GLU B 28 163.936 9.109 10.340 1.00 0.00 O ATOM 1811 OE2 GLU B 28 162.373 9.574 11.747 1.00 0.00 O ATOM 0 H GLU B 28 161.942 8.795 6.782 1.00 0.00 H new ATOM 0 HA GLU B 28 159.582 9.644 8.097 1.00 0.00 H new ATOM 0 HB2 GLU B 28 162.485 10.586 8.268 1.00 0.00 H new ATOM 0 HB3 GLU B 28 161.244 11.128 9.380 1.00 0.00 H new ATOM 0 HG2 GLU B 28 160.762 8.737 9.999 1.00 0.00 H new ATOM 0 HG3 GLU B 28 162.019 8.204 8.900 1.00 0.00 H new ATOM 1818 N VAL B 29 160.923 11.902 6.101 1.00 0.00 N ATOM 1819 CA VAL B 29 160.623 13.213 5.457 1.00 0.00 C ATOM 1820 C VAL B 29 159.349 13.089 4.620 1.00 0.00 C ATOM 1821 O VAL B 29 158.476 13.933 4.665 1.00 0.00 O ATOM 1822 CB VAL B 29 161.795 13.613 4.556 1.00 0.00 C ATOM 1823 CG1 VAL B 29 161.425 14.854 3.737 1.00 0.00 C ATOM 1824 CG2 VAL B 29 163.023 13.912 5.421 1.00 0.00 C ATOM 0 H VAL B 29 161.771 11.440 5.774 1.00 0.00 H new ATOM 0 HA VAL B 29 160.478 13.974 6.223 1.00 0.00 H new ATOM 0 HB VAL B 29 162.021 12.793 3.874 1.00 0.00 H new ATOM 0 HG11 VAL B 29 162.264 15.132 3.099 1.00 0.00 H new ATOM 0 HG12 VAL B 29 160.555 14.635 3.118 1.00 0.00 H new ATOM 0 HG13 VAL B 29 161.193 15.679 4.411 1.00 0.00 H new ATOM 0 HG21 VAL B 29 163.858 14.197 4.781 1.00 0.00 H new ATOM 0 HG22 VAL B 29 162.795 14.729 6.106 1.00 0.00 H new ATOM 0 HG23 VAL B 29 163.291 13.023 5.993 1.00 0.00 H new ATOM 1834 N LEU B 30 159.246 12.044 3.849 1.00 0.00 N ATOM 1835 CA LEU B 30 158.045 11.852 2.991 1.00 0.00 C ATOM 1836 C LEU B 30 156.817 11.633 3.873 1.00 0.00 C ATOM 1837 O LEU B 30 155.730 12.083 3.570 1.00 0.00 O ATOM 1838 CB LEU B 30 158.250 10.627 2.095 1.00 0.00 C ATOM 1839 CG LEU B 30 159.482 10.828 1.201 1.00 0.00 C ATOM 1840 CD1 LEU B 30 159.695 9.568 0.357 1.00 0.00 C ATOM 1841 CD2 LEU B 30 159.277 12.040 0.275 1.00 0.00 C ATOM 0 H LEU B 30 159.949 11.308 3.776 1.00 0.00 H new ATOM 0 HA LEU B 30 157.896 12.737 2.373 1.00 0.00 H new ATOM 0 HB2 LEU B 30 158.378 9.735 2.709 1.00 0.00 H new ATOM 0 HB3 LEU B 30 157.366 10.466 1.478 1.00 0.00 H new ATOM 0 HG LEU B 30 160.356 11.010 1.827 1.00 0.00 H new ATOM 0 HD11 LEU B 30 160.568 9.701 -0.282 1.00 0.00 H new ATOM 0 HD12 LEU B 30 159.853 8.713 1.014 1.00 0.00 H new ATOM 0 HD13 LEU B 30 158.816 9.392 -0.263 1.00 0.00 H new ATOM 0 HD21 LEU B 30 160.158 12.171 -0.353 1.00 0.00 H new ATOM 0 HD22 LEU B 30 158.404 11.873 -0.355 1.00 0.00 H new ATOM 0 HD23 LEU B 30 159.124 12.936 0.877 1.00 0.00 H new ATOM 1853 N GLY B 31 156.984 10.943 4.962 1.00 0.00 N ATOM 1854 CA GLY B 31 155.830 10.694 5.868 1.00 0.00 C ATOM 1855 C GLY B 31 155.269 12.029 6.358 1.00 0.00 C ATOM 1856 O GLY B 31 154.073 12.203 6.487 1.00 0.00 O ATOM 0 H GLY B 31 157.870 10.539 5.266 1.00 0.00 H new ATOM 0 HA2 GLY B 31 155.057 10.133 5.343 1.00 0.00 H new ATOM 0 HA3 GLY B 31 156.145 10.086 6.716 1.00 0.00 H new ATOM 1860 N LYS B 32 156.127 12.969 6.650 1.00 0.00 N ATOM 1861 CA LYS B 32 155.652 14.291 7.151 1.00 0.00 C ATOM 1862 C LYS B 32 154.812 15.005 6.084 1.00 0.00 C ATOM 1863 O LYS B 32 153.817 15.630 6.394 1.00 0.00 O ATOM 1864 CB LYS B 32 156.865 15.149 7.514 1.00 0.00 C ATOM 1865 CG LYS B 32 156.401 16.448 8.174 1.00 0.00 C ATOM 1866 CD LYS B 32 157.623 17.298 8.532 1.00 0.00 C ATOM 1867 CE LYS B 32 157.166 18.609 9.172 1.00 0.00 C ATOM 1868 NZ LYS B 32 158.358 19.420 9.545 1.00 0.00 N ATOM 0 H LYS B 32 157.139 12.878 6.563 1.00 0.00 H new ATOM 0 HA LYS B 32 155.027 14.136 8.031 1.00 0.00 H new ATOM 0 HB2 LYS B 32 157.521 14.601 8.190 1.00 0.00 H new ATOM 0 HB3 LYS B 32 157.445 15.372 6.619 1.00 0.00 H new ATOM 0 HG2 LYS B 32 155.746 16.999 7.499 1.00 0.00 H new ATOM 0 HG3 LYS B 32 155.822 16.227 9.071 1.00 0.00 H new ATOM 0 HD2 LYS B 32 158.270 16.752 9.219 1.00 0.00 H new ATOM 0 HD3 LYS B 32 158.210 17.504 7.637 1.00 0.00 H new ATOM 0 HE2 LYS B 32 156.537 19.166 8.477 1.00 0.00 H new ATOM 0 HE3 LYS B 32 156.561 18.404 10.055 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 158.048 20.312 9.981 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 158.942 18.888 10.222 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 158.918 19.627 8.693 1.00 0.00 H new ATOM 1882 N LYS B 33 155.196 14.940 4.835 1.00 0.00 N ATOM 1883 CA LYS B 33 154.391 15.642 3.791 1.00 0.00 C ATOM 1884 C LYS B 33 153.018 14.983 3.652 1.00 0.00 C ATOM 1885 O LYS B 33 152.000 15.645 3.672 1.00 0.00 O ATOM 1886 CB LYS B 33 155.121 15.587 2.449 1.00 0.00 C ATOM 1887 CG LYS B 33 156.360 16.477 2.507 1.00 0.00 C ATOM 1888 CD LYS B 33 157.092 16.422 1.164 1.00 0.00 C ATOM 1889 CE LYS B 33 158.332 17.315 1.222 1.00 0.00 C ATOM 1890 NZ LYS B 33 157.962 18.636 1.806 1.00 0.00 N ATOM 0 H LYS B 33 156.018 14.440 4.497 1.00 0.00 H new ATOM 0 HA LYS B 33 154.259 16.682 4.090 1.00 0.00 H new ATOM 0 HB2 LYS B 33 155.408 14.560 2.221 1.00 0.00 H new ATOM 0 HB3 LYS B 33 154.459 15.918 1.649 1.00 0.00 H new ATOM 0 HG2 LYS B 33 156.073 17.504 2.735 1.00 0.00 H new ATOM 0 HG3 LYS B 33 157.021 16.146 3.308 1.00 0.00 H new ATOM 0 HD2 LYS B 33 157.380 15.396 0.937 1.00 0.00 H new ATOM 0 HD3 LYS B 33 156.430 16.752 0.363 1.00 0.00 H new ATOM 0 HE2 LYS B 33 159.107 16.842 1.825 1.00 0.00 H new ATOM 0 HE3 LYS B 33 158.744 17.449 0.222 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 158.687 19.340 1.560 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 157.043 18.938 1.426 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 157.898 18.552 2.841 1.00 0.00 H new ATOM 1904 N LEU B 34 152.974 13.688 3.529 1.00 0.00 N ATOM 1905 CA LEU B 34 151.658 13.002 3.413 1.00 0.00 C ATOM 1906 C LEU B 34 150.836 13.284 4.677 1.00 0.00 C ATOM 1907 O LEU B 34 149.639 13.489 4.626 1.00 0.00 O ATOM 1908 CB LEU B 34 151.880 11.493 3.238 1.00 0.00 C ATOM 1909 CG LEU B 34 152.481 11.202 1.847 1.00 0.00 C ATOM 1910 CD1 LEU B 34 153.175 9.838 1.863 1.00 0.00 C ATOM 1911 CD2 LEU B 34 151.371 11.175 0.779 1.00 0.00 C ATOM 0 H LEU B 34 153.789 13.075 3.504 1.00 0.00 H new ATOM 0 HA LEU B 34 151.115 13.375 2.545 1.00 0.00 H new ATOM 0 HB2 LEU B 34 152.548 11.124 4.016 1.00 0.00 H new ATOM 0 HB3 LEU B 34 150.934 10.963 3.352 1.00 0.00 H new ATOM 0 HG LEU B 34 153.198 11.988 1.608 1.00 0.00 H new ATOM 0 HD11 LEU B 34 153.599 9.634 0.880 1.00 0.00 H new ATOM 0 HD12 LEU B 34 153.971 9.844 2.607 1.00 0.00 H new ATOM 0 HD13 LEU B 34 152.450 9.064 2.113 1.00 0.00 H new ATOM 0 HD21 LEU B 34 151.810 10.969 -0.197 1.00 0.00 H new ATOM 0 HD22 LEU B 34 150.649 10.396 1.024 1.00 0.00 H new ATOM 0 HD23 LEU B 34 150.867 12.141 0.753 1.00 0.00 H new ATOM 1923 N GLU B 35 151.481 13.285 5.808 1.00 0.00 N ATOM 1924 CA GLU B 35 150.743 13.539 7.083 1.00 0.00 C ATOM 1925 C GLU B 35 150.084 14.923 7.036 1.00 0.00 C ATOM 1926 O GLU B 35 148.929 15.081 7.383 1.00 0.00 O ATOM 1927 CB GLU B 35 151.725 13.471 8.256 1.00 0.00 C ATOM 1928 CG GLU B 35 150.986 13.730 9.571 1.00 0.00 C ATOM 1929 CD GLU B 35 151.963 13.587 10.740 1.00 0.00 C ATOM 1930 OE1 GLU B 35 153.070 13.129 10.509 1.00 0.00 O ATOM 1931 OE2 GLU B 35 151.588 13.938 11.847 1.00 0.00 O ATOM 0 H GLU B 35 152.483 13.122 5.909 1.00 0.00 H new ATOM 0 HA GLU B 35 149.968 12.783 7.212 1.00 0.00 H new ATOM 0 HB2 GLU B 35 152.203 12.492 8.285 1.00 0.00 H new ATOM 0 HB3 GLU B 35 152.516 14.209 8.122 1.00 0.00 H new ATOM 0 HG2 GLU B 35 150.552 14.730 9.566 1.00 0.00 H new ATOM 0 HG3 GLU B 35 150.162 13.025 9.683 1.00 0.00 H new ATOM 1938 N GLU B 36 150.803 15.921 6.609 1.00 0.00 N ATOM 1939 CA GLU B 36 150.214 17.290 6.538 1.00 0.00 C ATOM 1940 C GLU B 36 149.081 17.291 5.510 1.00 0.00 C ATOM 1941 O GLU B 36 148.236 18.164 5.495 1.00 0.00 O ATOM 1942 CB GLU B 36 151.300 18.293 6.123 1.00 0.00 C ATOM 1943 CG GLU B 36 150.717 19.710 6.091 1.00 0.00 C ATOM 1944 CD GLU B 36 151.810 20.703 5.697 1.00 0.00 C ATOM 1945 OE1 GLU B 36 152.956 20.293 5.618 1.00 0.00 O ATOM 1946 OE2 GLU B 36 151.483 21.859 5.485 1.00 0.00 O ATOM 0 H GLU B 36 151.774 15.850 6.305 1.00 0.00 H new ATOM 0 HA GLU B 36 149.820 17.577 7.513 1.00 0.00 H new ATOM 0 HB2 GLU B 36 152.134 18.249 6.823 1.00 0.00 H new ATOM 0 HB3 GLU B 36 151.694 18.030 5.141 1.00 0.00 H new ATOM 0 HG2 GLU B 36 149.893 19.759 5.380 1.00 0.00 H new ATOM 0 HG3 GLU B 36 150.310 19.969 7.069 1.00 0.00 H new ATOM 1953 N ARG B 37 149.065 16.322 4.639 1.00 0.00 N ATOM 1954 CA ARG B 37 147.999 16.278 3.594 1.00 0.00 C ATOM 1955 C ARG B 37 146.779 15.498 4.098 1.00 0.00 C ATOM 1956 O ARG B 37 145.791 15.377 3.402 1.00 0.00 O ATOM 1957 CB ARG B 37 148.556 15.628 2.328 1.00 0.00 C ATOM 1958 CG ARG B 37 149.570 16.579 1.690 1.00 0.00 C ATOM 1959 CD ARG B 37 150.136 15.958 0.410 1.00 0.00 C ATOM 1960 NE ARG B 37 151.436 16.622 0.061 1.00 0.00 N ATOM 1961 CZ ARG B 37 151.534 17.922 -0.037 1.00 0.00 C ATOM 1962 NH1 ARG B 37 150.464 18.669 -0.065 1.00 0.00 N ATOM 1963 NH2 ARG B 37 152.710 18.473 -0.173 1.00 0.00 N ATOM 0 H ARG B 37 149.741 15.559 4.603 1.00 0.00 H new ATOM 0 HA ARG B 37 147.681 17.296 3.369 1.00 0.00 H new ATOM 0 HB2 ARG B 37 149.031 14.677 2.570 1.00 0.00 H new ATOM 0 HB3 ARG B 37 147.749 15.412 1.628 1.00 0.00 H new ATOM 0 HG2 ARG B 37 149.093 17.532 1.462 1.00 0.00 H new ATOM 0 HG3 ARG B 37 150.378 16.787 2.392 1.00 0.00 H new ATOM 0 HD2 ARG B 37 150.289 14.888 0.550 1.00 0.00 H new ATOM 0 HD3 ARG B 37 149.425 16.075 -0.408 1.00 0.00 H new ATOM 0 HE ARG B 37 152.262 16.046 -0.103 1.00 0.00 H new ATOM 0 HH11 ARG B 37 149.541 18.239 -0.010 1.00 0.00 H new ATOM 0 HH12 ARG B 37 150.551 19.682 -0.142 1.00 0.00 H new ATOM 0 HH21 ARG B 37 153.546 17.890 -0.202 1.00 0.00 H new ATOM 0 HH22 ARG B 37 152.792 19.487 -0.250 1.00 0.00 H new ATOM 1977 N GLY B 38 146.816 15.010 5.316 1.00 0.00 N ATOM 1978 CA GLY B 38 145.623 14.286 5.877 1.00 0.00 C ATOM 1979 C GLY B 38 145.842 12.774 5.911 1.00 0.00 C ATOM 1980 O GLY B 38 144.959 12.034 6.298 1.00 0.00 O ATOM 0 H GLY B 38 147.615 15.080 5.946 1.00 0.00 H new ATOM 0 HA2 GLY B 38 145.420 14.647 6.885 1.00 0.00 H new ATOM 0 HA3 GLY B 38 144.744 14.513 5.274 1.00 0.00 H new ATOM 1984 N PHE B 39 147.000 12.297 5.538 1.00 0.00 N ATOM 1985 CA PHE B 39 147.258 10.822 5.585 1.00 0.00 C ATOM 1986 C PHE B 39 148.154 10.534 6.790 1.00 0.00 C ATOM 1987 O PHE B 39 149.337 10.288 6.659 1.00 0.00 O ATOM 1988 CB PHE B 39 147.978 10.387 4.311 1.00 0.00 C ATOM 1989 CG PHE B 39 147.126 10.694 3.103 1.00 0.00 C ATOM 1990 CD1 PHE B 39 146.190 9.759 2.649 1.00 0.00 C ATOM 1991 CD2 PHE B 39 147.272 11.915 2.441 1.00 0.00 C ATOM 1992 CE1 PHE B 39 145.398 10.048 1.530 1.00 0.00 C ATOM 1993 CE2 PHE B 39 146.483 12.207 1.323 1.00 0.00 C ATOM 1994 CZ PHE B 39 145.544 11.272 0.867 1.00 0.00 C ATOM 0 H PHE B 39 147.780 12.862 5.202 1.00 0.00 H new ATOM 0 HA PHE B 39 146.317 10.279 5.668 1.00 0.00 H new ATOM 0 HB2 PHE B 39 148.935 10.902 4.231 1.00 0.00 H new ATOM 0 HB3 PHE B 39 148.193 9.319 4.352 1.00 0.00 H new ATOM 0 HD1 PHE B 39 146.078 8.815 3.161 1.00 0.00 H new ATOM 0 HD2 PHE B 39 147.996 12.635 2.793 1.00 0.00 H new ATOM 0 HE1 PHE B 39 144.675 9.327 1.179 1.00 0.00 H new ATOM 0 HE2 PHE B 39 146.597 13.152 0.812 1.00 0.00 H new ATOM 0 HZ PHE B 39 144.933 11.496 0.005 1.00 0.00 H new ATOM 2004 N ASP B 40 147.595 10.588 7.969 1.00 0.00 N ATOM 2005 CA ASP B 40 148.414 10.343 9.192 1.00 0.00 C ATOM 2006 C ASP B 40 148.573 8.841 9.441 1.00 0.00 C ATOM 2007 O ASP B 40 149.342 8.433 10.289 1.00 0.00 O ATOM 2008 CB ASP B 40 147.733 10.991 10.399 1.00 0.00 C ATOM 2009 CG ASP B 40 146.413 10.276 10.692 1.00 0.00 C ATOM 2010 OD1 ASP B 40 145.870 9.679 9.777 1.00 0.00 O ATOM 2011 OD2 ASP B 40 145.970 10.333 11.827 1.00 0.00 O ATOM 0 H ASP B 40 146.610 10.790 8.138 1.00 0.00 H new ATOM 0 HA ASP B 40 149.402 10.780 9.046 1.00 0.00 H new ATOM 0 HB2 ASP B 40 148.387 10.938 11.269 1.00 0.00 H new ATOM 0 HB3 ASP B 40 147.550 12.047 10.202 1.00 0.00 H new ATOM 2016 N LYS B 41 147.846 8.012 8.729 1.00 0.00 N ATOM 2017 CA LYS B 41 147.955 6.530 8.946 1.00 0.00 C ATOM 2018 C LYS B 41 148.016 5.804 7.598 1.00 0.00 C ATOM 2019 O LYS B 41 147.613 6.322 6.576 1.00 0.00 O ATOM 2020 CB LYS B 41 146.749 6.060 9.755 1.00 0.00 C ATOM 2021 CG LYS B 41 146.855 6.638 11.169 1.00 0.00 C ATOM 2022 CD LYS B 41 145.657 6.191 12.001 1.00 0.00 C ATOM 2023 CE LYS B 41 145.637 6.964 13.320 1.00 0.00 C ATOM 2024 NZ LYS B 41 146.839 6.609 14.128 1.00 0.00 N ATOM 0 H LYS B 41 147.183 8.295 8.008 1.00 0.00 H new ATOM 0 HA LYS B 41 148.869 6.302 9.495 1.00 0.00 H new ATOM 0 HB2 LYS B 41 145.824 6.388 9.281 1.00 0.00 H new ATOM 0 HB3 LYS B 41 146.720 4.971 9.792 1.00 0.00 H new ATOM 0 HG2 LYS B 41 147.780 6.305 11.639 1.00 0.00 H new ATOM 0 HG3 LYS B 41 146.893 7.726 11.125 1.00 0.00 H new ATOM 0 HD2 LYS B 41 144.733 6.366 11.450 1.00 0.00 H new ATOM 0 HD3 LYS B 41 145.715 5.120 12.195 1.00 0.00 H new ATOM 0 HE2 LYS B 41 145.622 8.036 13.124 1.00 0.00 H new ATOM 0 HE3 LYS B 41 144.730 6.729 13.877 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 146.733 6.985 15.092 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 146.937 5.574 14.169 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 147.687 7.019 13.688 1.00 0.00 H new ATOM 2038 N ALA B 42 148.562 4.618 7.596 1.00 0.00 N ATOM 2039 CA ALA B 42 148.713 3.843 6.329 1.00 0.00 C ATOM 2040 C ALA B 42 147.364 3.419 5.721 1.00 0.00 C ATOM 2041 O ALA B 42 147.205 3.425 4.517 1.00 0.00 O ATOM 2042 CB ALA B 42 149.537 2.588 6.620 1.00 0.00 C ATOM 0 H ALA B 42 148.915 4.147 8.429 1.00 0.00 H new ATOM 0 HA ALA B 42 149.206 4.492 5.605 1.00 0.00 H new ATOM 0 HB1 ALA B 42 149.656 2.010 5.703 1.00 0.00 H new ATOM 0 HB2 ALA B 42 150.518 2.876 6.998 1.00 0.00 H new ATOM 0 HB3 ALA B 42 149.025 1.981 7.367 1.00 0.00 H new ATOM 2048 N TYR B 43 146.409 3.002 6.512 1.00 0.00 N ATOM 2049 CA TYR B 43 145.121 2.526 5.910 1.00 0.00 C ATOM 2050 C TYR B 43 144.430 3.633 5.103 1.00 0.00 C ATOM 2051 O TYR B 43 143.610 3.350 4.252 1.00 0.00 O ATOM 2052 CB TYR B 43 144.173 1.957 6.981 1.00 0.00 C ATOM 2053 CG TYR B 43 143.617 3.041 7.879 1.00 0.00 C ATOM 2054 CD1 TYR B 43 142.602 3.892 7.414 1.00 0.00 C ATOM 2055 CD2 TYR B 43 144.091 3.174 9.189 1.00 0.00 C ATOM 2056 CE1 TYR B 43 142.069 4.871 8.258 1.00 0.00 C ATOM 2057 CE2 TYR B 43 143.558 4.155 10.030 1.00 0.00 C ATOM 2058 CZ TYR B 43 142.547 5.003 9.565 1.00 0.00 C ATOM 2059 OH TYR B 43 142.022 5.970 10.397 1.00 0.00 O ATOM 0 H TYR B 43 146.459 2.969 7.530 1.00 0.00 H new ATOM 0 HA TYR B 43 145.371 1.719 5.221 1.00 0.00 H new ATOM 0 HB2 TYR B 43 143.351 1.431 6.495 1.00 0.00 H new ATOM 0 HB3 TYR B 43 144.707 1.224 7.585 1.00 0.00 H new ATOM 0 HD1 TYR B 43 142.233 3.790 6.404 1.00 0.00 H new ATOM 0 HD2 TYR B 43 144.869 2.518 9.550 1.00 0.00 H new ATOM 0 HE1 TYR B 43 141.288 5.525 7.900 1.00 0.00 H new ATOM 0 HE2 TYR B 43 143.927 4.258 11.040 1.00 0.00 H new ATOM 0 HH TYR B 43 142.465 5.926 11.270 1.00 0.00 H new ATOM 2069 N VAL B 44 144.754 4.880 5.320 1.00 0.00 N ATOM 2070 CA VAL B 44 144.102 5.950 4.503 1.00 0.00 C ATOM 2071 C VAL B 44 144.789 5.965 3.136 1.00 0.00 C ATOM 2072 O VAL B 44 144.191 6.236 2.112 1.00 0.00 O ATOM 2073 CB VAL B 44 144.265 7.319 5.183 1.00 0.00 C ATOM 2074 CG1 VAL B 44 143.543 8.401 4.368 1.00 0.00 C ATOM 2075 CG2 VAL B 44 143.659 7.271 6.586 1.00 0.00 C ATOM 0 H VAL B 44 145.429 5.202 6.014 1.00 0.00 H new ATOM 0 HA VAL B 44 143.035 5.751 4.401 1.00 0.00 H new ATOM 0 HB VAL B 44 145.327 7.556 5.244 1.00 0.00 H new ATOM 0 HG11 VAL B 44 143.664 9.367 4.858 1.00 0.00 H new ATOM 0 HG12 VAL B 44 143.969 8.446 3.366 1.00 0.00 H new ATOM 0 HG13 VAL B 44 142.482 8.159 4.301 1.00 0.00 H new ATOM 0 HG21 VAL B 44 143.776 8.243 7.066 1.00 0.00 H new ATOM 0 HG22 VAL B 44 142.599 7.026 6.516 1.00 0.00 H new ATOM 0 HG23 VAL B 44 144.169 6.511 7.177 1.00 0.00 H new ATOM 2085 N VAL B 45 146.056 5.652 3.138 1.00 0.00 N ATOM 2086 CA VAL B 45 146.837 5.614 1.871 1.00 0.00 C ATOM 2087 C VAL B 45 146.462 4.338 1.118 1.00 0.00 C ATOM 2088 O VAL B 45 146.324 4.334 -0.088 1.00 0.00 O ATOM 2089 CB VAL B 45 148.333 5.603 2.185 1.00 0.00 C ATOM 2090 CG1 VAL B 45 149.127 5.386 0.894 1.00 0.00 C ATOM 2091 CG2 VAL B 45 148.734 6.942 2.809 1.00 0.00 C ATOM 0 H VAL B 45 146.589 5.418 3.975 1.00 0.00 H new ATOM 0 HA VAL B 45 146.613 6.492 1.265 1.00 0.00 H new ATOM 0 HB VAL B 45 148.549 4.795 2.884 1.00 0.00 H new ATOM 0 HG11 VAL B 45 150.193 5.378 1.120 1.00 0.00 H new ATOM 0 HG12 VAL B 45 148.844 4.432 0.448 1.00 0.00 H new ATOM 0 HG13 VAL B 45 148.910 6.192 0.194 1.00 0.00 H new ATOM 0 HG21 VAL B 45 149.801 6.934 3.033 1.00 0.00 H new ATOM 0 HG22 VAL B 45 148.516 7.749 2.110 1.00 0.00 H new ATOM 0 HG23 VAL B 45 148.171 7.098 3.729 1.00 0.00 H new ATOM 2101 N LEU B 46 146.266 3.260 1.827 1.00 0.00 N ATOM 2102 CA LEU B 46 145.870 1.993 1.155 1.00 0.00 C ATOM 2103 C LEU B 46 144.543 2.247 0.436 1.00 0.00 C ATOM 2104 O LEU B 46 144.311 1.773 -0.655 1.00 0.00 O ATOM 2105 CB LEU B 46 145.694 0.878 2.203 1.00 0.00 C ATOM 2106 CG LEU B 46 145.281 -0.449 1.520 1.00 0.00 C ATOM 2107 CD1 LEU B 46 146.453 -0.993 0.681 1.00 0.00 C ATOM 2108 CD2 LEU B 46 144.847 -1.501 2.580 1.00 0.00 C ATOM 0 H LEU B 46 146.363 3.203 2.841 1.00 0.00 H new ATOM 0 HA LEU B 46 146.636 1.679 0.446 1.00 0.00 H new ATOM 0 HB2 LEU B 46 146.625 0.737 2.752 1.00 0.00 H new ATOM 0 HB3 LEU B 46 144.936 1.171 2.930 1.00 0.00 H new ATOM 0 HG LEU B 46 144.432 -0.253 0.865 1.00 0.00 H new ATOM 0 HD11 LEU B 46 146.156 -1.927 0.203 1.00 0.00 H new ATOM 0 HD12 LEU B 46 146.723 -0.264 -0.083 1.00 0.00 H new ATOM 0 HD13 LEU B 46 147.311 -1.174 1.329 1.00 0.00 H new ATOM 0 HD21 LEU B 46 144.561 -2.426 2.079 1.00 0.00 H new ATOM 0 HD22 LEU B 46 145.677 -1.698 3.258 1.00 0.00 H new ATOM 0 HD23 LEU B 46 143.998 -1.118 3.147 1.00 0.00 H new ATOM 2120 N GLY B 47 143.671 2.994 1.055 1.00 0.00 N ATOM 2121 CA GLY B 47 142.352 3.284 0.426 1.00 0.00 C ATOM 2122 C GLY B 47 142.562 4.000 -0.910 1.00 0.00 C ATOM 2123 O GLY B 47 141.887 3.723 -1.882 1.00 0.00 O ATOM 0 H GLY B 47 143.816 3.417 1.972 1.00 0.00 H new ATOM 0 HA2 GLY B 47 141.801 2.356 0.269 1.00 0.00 H new ATOM 0 HA3 GLY B 47 141.750 3.904 1.091 1.00 0.00 H new ATOM 2127 N GLN B 48 143.494 4.914 -0.976 1.00 0.00 N ATOM 2128 CA GLN B 48 143.743 5.627 -2.260 1.00 0.00 C ATOM 2129 C GLN B 48 144.139 4.598 -3.326 1.00 0.00 C ATOM 2130 O GLN B 48 143.704 4.659 -4.458 1.00 0.00 O ATOM 2131 CB GLN B 48 144.879 6.637 -2.064 1.00 0.00 C ATOM 2132 CG GLN B 48 144.971 7.561 -3.284 1.00 0.00 C ATOM 2133 CD GLN B 48 143.871 8.625 -3.206 1.00 0.00 C ATOM 2134 OE1 GLN B 48 142.975 8.551 -2.260 1.00 0.00 O flip ATOM 2135 NE2 GLN B 48 143.830 9.533 -4.011 1.00 0.00 N flip ATOM 0 H GLN B 48 144.091 5.196 -0.198 1.00 0.00 H new ATOM 0 HA GLN B 48 142.845 6.156 -2.578 1.00 0.00 H new ATOM 0 HB2 GLN B 48 144.703 7.225 -1.164 1.00 0.00 H new ATOM 0 HB3 GLN B 48 145.824 6.112 -1.922 1.00 0.00 H new ATOM 0 HG2 GLN B 48 145.951 8.038 -3.319 1.00 0.00 H new ATOM 0 HG3 GLN B 48 144.866 6.981 -4.201 1.00 0.00 H new ATOM 0 HE21 GLN B 48 144.530 9.591 -4.750 1.00 0.00 H new ATOM 0 HE22 GLN B 48 143.095 10.238 -3.948 1.00 0.00 H new ATOM 2144 N PHE B 49 144.952 3.644 -2.956 1.00 0.00 N ATOM 2145 CA PHE B 49 145.378 2.586 -3.919 1.00 0.00 C ATOM 2146 C PHE B 49 144.125 1.848 -4.406 1.00 0.00 C ATOM 2147 O PHE B 49 143.989 1.515 -5.568 1.00 0.00 O ATOM 2148 CB PHE B 49 146.319 1.622 -3.188 1.00 0.00 C ATOM 2149 CG PHE B 49 146.803 0.534 -4.118 1.00 0.00 C ATOM 2150 CD1 PHE B 49 147.650 0.856 -5.184 1.00 0.00 C ATOM 2151 CD2 PHE B 49 146.426 -0.800 -3.901 1.00 0.00 C ATOM 2152 CE1 PHE B 49 148.120 -0.151 -6.033 1.00 0.00 C ATOM 2153 CE2 PHE B 49 146.894 -1.806 -4.754 1.00 0.00 C ATOM 2154 CZ PHE B 49 147.742 -1.481 -5.820 1.00 0.00 C ATOM 0 H PHE B 49 145.343 3.552 -2.018 1.00 0.00 H new ATOM 0 HA PHE B 49 145.898 3.014 -4.776 1.00 0.00 H new ATOM 0 HB2 PHE B 49 147.172 2.172 -2.790 1.00 0.00 H new ATOM 0 HB3 PHE B 49 145.802 1.176 -2.338 1.00 0.00 H new ATOM 0 HD1 PHE B 49 147.941 1.883 -5.351 1.00 0.00 H new ATOM 0 HD2 PHE B 49 145.775 -1.050 -3.076 1.00 0.00 H new ATOM 0 HE1 PHE B 49 148.776 0.098 -6.854 1.00 0.00 H new ATOM 0 HE2 PHE B 49 146.601 -2.833 -4.590 1.00 0.00 H new ATOM 0 HZ PHE B 49 148.104 -2.257 -6.478 1.00 0.00 H new ATOM 2164 N LEU B 50 143.214 1.609 -3.516 1.00 0.00 N ATOM 2165 CA LEU B 50 141.960 0.905 -3.909 1.00 0.00 C ATOM 2166 C LEU B 50 141.146 1.831 -4.818 1.00 0.00 C ATOM 2167 O LEU B 50 140.530 1.401 -5.773 1.00 0.00 O ATOM 2168 CB LEU B 50 141.142 0.553 -2.661 1.00 0.00 C ATOM 2169 CG LEU B 50 141.952 -0.375 -1.743 1.00 0.00 C ATOM 2170 CD1 LEU B 50 141.138 -0.666 -0.476 1.00 0.00 C ATOM 2171 CD2 LEU B 50 142.270 -1.697 -2.468 1.00 0.00 C ATOM 0 H LEU B 50 143.278 1.868 -2.532 1.00 0.00 H new ATOM 0 HA LEU B 50 142.204 -0.017 -4.436 1.00 0.00 H new ATOM 0 HB2 LEU B 50 140.873 1.463 -2.125 1.00 0.00 H new ATOM 0 HB3 LEU B 50 140.211 0.067 -2.952 1.00 0.00 H new ATOM 0 HG LEU B 50 142.889 0.113 -1.477 1.00 0.00 H new ATOM 0 HD11 LEU B 50 141.708 -1.324 0.179 1.00 0.00 H new ATOM 0 HD12 LEU B 50 140.927 0.269 0.043 1.00 0.00 H new ATOM 0 HD13 LEU B 50 140.200 -1.149 -0.749 1.00 0.00 H new ATOM 0 HD21 LEU B 50 142.844 -2.346 -1.807 1.00 0.00 H new ATOM 0 HD22 LEU B 50 141.340 -2.193 -2.745 1.00 0.00 H new ATOM 0 HD23 LEU B 50 142.851 -1.489 -3.366 1.00 0.00 H new ATOM 2183 N VAL B 51 141.136 3.100 -4.519 1.00 0.00 N ATOM 2184 CA VAL B 51 140.364 4.069 -5.350 1.00 0.00 C ATOM 2185 C VAL B 51 140.943 4.126 -6.772 1.00 0.00 C ATOM 2186 O VAL B 51 140.238 4.383 -7.728 1.00 0.00 O ATOM 2187 CB VAL B 51 140.433 5.459 -4.703 1.00 0.00 C ATOM 2188 CG1 VAL B 51 139.865 6.512 -5.662 1.00 0.00 C ATOM 2189 CG2 VAL B 51 139.611 5.451 -3.413 1.00 0.00 C ATOM 0 H VAL B 51 141.633 3.511 -3.729 1.00 0.00 H new ATOM 0 HA VAL B 51 139.325 3.745 -5.409 1.00 0.00 H new ATOM 0 HB VAL B 51 141.472 5.703 -4.481 1.00 0.00 H new ATOM 0 HG11 VAL B 51 139.918 7.496 -5.195 1.00 0.00 H new ATOM 0 HG12 VAL B 51 140.447 6.516 -6.584 1.00 0.00 H new ATOM 0 HG13 VAL B 51 138.826 6.274 -5.890 1.00 0.00 H new ATOM 0 HG21 VAL B 51 139.655 6.436 -2.947 1.00 0.00 H new ATOM 0 HG22 VAL B 51 138.574 5.205 -3.644 1.00 0.00 H new ATOM 0 HG23 VAL B 51 140.017 4.707 -2.728 1.00 0.00 H new ATOM 2199 N LEU B 52 142.222 3.903 -6.918 1.00 0.00 N ATOM 2200 CA LEU B 52 142.846 3.961 -8.278 1.00 0.00 C ATOM 2201 C LEU B 52 142.770 2.585 -8.948 1.00 0.00 C ATOM 2202 O LEU B 52 143.441 2.331 -9.927 1.00 0.00 O ATOM 2203 CB LEU B 52 144.312 4.386 -8.152 1.00 0.00 C ATOM 2204 CG LEU B 52 144.401 5.773 -7.496 1.00 0.00 C ATOM 2205 CD1 LEU B 52 145.874 6.136 -7.273 1.00 0.00 C ATOM 2206 CD2 LEU B 52 143.741 6.832 -8.404 1.00 0.00 C ATOM 0 H LEU B 52 142.864 3.683 -6.156 1.00 0.00 H new ATOM 0 HA LEU B 52 142.306 4.686 -8.887 1.00 0.00 H new ATOM 0 HB2 LEU B 52 144.861 3.657 -7.556 1.00 0.00 H new ATOM 0 HB3 LEU B 52 144.779 4.409 -9.137 1.00 0.00 H new ATOM 0 HG LEU B 52 143.879 5.750 -6.540 1.00 0.00 H new ATOM 0 HD11 LEU B 52 145.940 7.120 -6.808 1.00 0.00 H new ATOM 0 HD12 LEU B 52 146.337 5.395 -6.622 1.00 0.00 H new ATOM 0 HD13 LEU B 52 146.394 6.152 -8.231 1.00 0.00 H new ATOM 0 HD21 LEU B 52 143.809 7.811 -7.930 1.00 0.00 H new ATOM 0 HD22 LEU B 52 144.254 6.858 -9.365 1.00 0.00 H new ATOM 0 HD23 LEU B 52 142.693 6.576 -8.559 1.00 0.00 H new ATOM 2218 N LYS B 53 141.954 1.698 -8.447 1.00 0.00 N ATOM 2219 CA LYS B 53 141.841 0.354 -9.079 1.00 0.00 C ATOM 2220 C LYS B 53 143.230 -0.254 -9.282 1.00 0.00 C ATOM 2221 O LYS B 53 143.465 -0.987 -10.221 1.00 0.00 O ATOM 2222 CB LYS B 53 141.137 0.497 -10.428 1.00 0.00 C ATOM 2223 CG LYS B 53 139.739 1.074 -10.203 1.00 0.00 C ATOM 2224 CD LYS B 53 139.021 1.224 -11.545 1.00 0.00 C ATOM 2225 CE LYS B 53 137.623 1.802 -11.316 1.00 0.00 C ATOM 2226 NZ LYS B 53 137.731 3.265 -11.053 1.00 0.00 N ATOM 0 H LYS B 53 141.362 1.846 -7.629 1.00 0.00 H new ATOM 0 HA LYS B 53 141.265 -0.305 -8.429 1.00 0.00 H new ATOM 0 HB2 LYS B 53 141.712 1.149 -11.085 1.00 0.00 H new ATOM 0 HB3 LYS B 53 141.069 -0.473 -10.921 1.00 0.00 H new ATOM 0 HG2 LYS B 53 139.167 0.420 -9.545 1.00 0.00 H new ATOM 0 HG3 LYS B 53 139.810 2.042 -9.707 1.00 0.00 H new ATOM 0 HD2 LYS B 53 139.593 1.878 -12.204 1.00 0.00 H new ATOM 0 HD3 LYS B 53 138.949 0.256 -12.041 1.00 0.00 H new ATOM 0 HE2 LYS B 53 136.996 1.623 -12.189 1.00 0.00 H new ATOM 0 HE3 LYS B 53 137.145 1.304 -10.473 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 136.780 3.685 -11.031 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 138.198 3.419 -10.137 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 138.290 3.713 -11.807 1.00 0.00 H new ATOM 2240 N LYS B 54 144.144 0.038 -8.394 1.00 0.00 N ATOM 2241 CA LYS B 54 145.528 -0.517 -8.485 1.00 0.00 C ATOM 2242 C LYS B 54 146.207 -0.076 -9.787 1.00 0.00 C ATOM 2243 O LYS B 54 147.179 -0.670 -10.209 1.00 0.00 O ATOM 2244 CB LYS B 54 145.470 -2.046 -8.432 1.00 0.00 C ATOM 2245 CG LYS B 54 144.590 -2.479 -7.258 1.00 0.00 C ATOM 2246 CD LYS B 54 144.742 -3.984 -7.029 1.00 0.00 C ATOM 2247 CE LYS B 54 143.813 -4.424 -5.897 1.00 0.00 C ATOM 2248 NZ LYS B 54 142.395 -4.292 -6.336 1.00 0.00 N ATOM 0 H LYS B 54 143.986 0.650 -7.593 1.00 0.00 H new ATOM 0 HA LYS B 54 146.110 -0.138 -7.644 1.00 0.00 H new ATOM 0 HB2 LYS B 54 145.069 -2.439 -9.366 1.00 0.00 H new ATOM 0 HB3 LYS B 54 146.474 -2.456 -8.319 1.00 0.00 H new ATOM 0 HG2 LYS B 54 144.873 -1.934 -6.358 1.00 0.00 H new ATOM 0 HG3 LYS B 54 143.547 -2.236 -7.463 1.00 0.00 H new ATOM 0 HD2 LYS B 54 144.502 -4.528 -7.943 1.00 0.00 H new ATOM 0 HD3 LYS B 54 145.776 -4.222 -6.779 1.00 0.00 H new ATOM 0 HE2 LYS B 54 144.024 -5.457 -5.620 1.00 0.00 H new ATOM 0 HE3 LYS B 54 143.988 -3.814 -5.011 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 141.789 -4.886 -5.735 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 142.097 -3.299 -6.254 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 142.308 -4.599 -7.326 1.00 0.00 H new ATOM 2262 N ASP B 55 145.741 0.968 -10.414 1.00 0.00 N ATOM 2263 CA ASP B 55 146.418 1.427 -11.663 1.00 0.00 C ATOM 2264 C ASP B 55 147.820 1.929 -11.283 1.00 0.00 C ATOM 2265 O ASP B 55 147.968 2.877 -10.536 1.00 0.00 O ATOM 2266 CB ASP B 55 145.605 2.564 -12.283 1.00 0.00 C ATOM 2267 CG ASP B 55 144.388 1.993 -13.012 1.00 0.00 C ATOM 2268 OD1 ASP B 55 144.525 0.947 -13.624 1.00 0.00 O ATOM 2269 OD2 ASP B 55 143.338 2.611 -12.942 1.00 0.00 O ATOM 0 H ASP B 55 144.933 1.518 -10.123 1.00 0.00 H new ATOM 0 HA ASP B 55 146.496 0.615 -12.386 1.00 0.00 H new ATOM 0 HB2 ASP B 55 145.283 3.258 -11.507 1.00 0.00 H new ATOM 0 HB3 ASP B 55 146.225 3.129 -12.979 1.00 0.00 H new ATOM 2274 N GLU B 56 148.850 1.277 -11.763 1.00 0.00 N ATOM 2275 CA GLU B 56 150.249 1.677 -11.406 1.00 0.00 C ATOM 2276 C GLU B 56 150.643 3.053 -11.969 1.00 0.00 C ATOM 2277 O GLU B 56 151.302 3.829 -11.308 1.00 0.00 O ATOM 2278 CB GLU B 56 151.218 0.628 -11.952 1.00 0.00 C ATOM 2279 CG GLU B 56 152.634 0.939 -11.467 1.00 0.00 C ATOM 2280 CD GLU B 56 153.575 -0.193 -11.879 1.00 0.00 C ATOM 2281 OE1 GLU B 56 153.117 -1.101 -12.553 1.00 0.00 O ATOM 2282 OE2 GLU B 56 154.734 -0.138 -11.507 1.00 0.00 O ATOM 0 H GLU B 56 148.782 0.477 -12.393 1.00 0.00 H new ATOM 0 HA GLU B 56 150.299 1.743 -10.319 1.00 0.00 H new ATOM 0 HB2 GLU B 56 150.919 -0.366 -11.620 1.00 0.00 H new ATOM 0 HB3 GLU B 56 151.189 0.623 -13.042 1.00 0.00 H new ATOM 0 HG2 GLU B 56 152.976 1.883 -11.891 1.00 0.00 H new ATOM 0 HG3 GLU B 56 152.641 1.056 -10.383 1.00 0.00 H new ATOM 2289 N ASP B 57 150.273 3.356 -13.184 1.00 0.00 N ATOM 2290 CA ASP B 57 150.664 4.675 -13.776 1.00 0.00 C ATOM 2291 C ASP B 57 149.921 5.801 -13.059 1.00 0.00 C ATOM 2292 O ASP B 57 150.470 6.847 -12.779 1.00 0.00 O ATOM 2293 CB ASP B 57 150.299 4.695 -15.261 1.00 0.00 C ATOM 2294 CG ASP B 57 151.218 3.745 -16.032 1.00 0.00 C ATOM 2295 OD1 ASP B 57 152.193 3.294 -15.453 1.00 0.00 O ATOM 2296 OD2 ASP B 57 150.931 3.485 -17.190 1.00 0.00 O ATOM 0 H ASP B 57 149.720 2.753 -13.792 1.00 0.00 H new ATOM 0 HA ASP B 57 151.738 4.817 -13.660 1.00 0.00 H new ATOM 0 HB2 ASP B 57 149.259 4.397 -15.394 1.00 0.00 H new ATOM 0 HB3 ASP B 57 150.394 5.707 -15.655 1.00 0.00 H new ATOM 2301 N LEU B 58 148.685 5.582 -12.754 1.00 0.00 N ATOM 2302 CA LEU B 58 147.911 6.637 -12.044 1.00 0.00 C ATOM 2303 C LEU B 58 148.441 6.759 -10.617 1.00 0.00 C ATOM 2304 O LEU B 58 148.558 7.840 -10.075 1.00 0.00 O ATOM 2305 CB LEU B 58 146.426 6.272 -12.004 1.00 0.00 C ATOM 2306 CG LEU B 58 145.834 6.289 -13.419 1.00 0.00 C ATOM 2307 CD1 LEU B 58 144.381 5.803 -13.355 1.00 0.00 C ATOM 2308 CD2 LEU B 58 145.880 7.716 -14.003 1.00 0.00 C ATOM 0 H LEU B 58 148.172 4.725 -12.961 1.00 0.00 H new ATOM 0 HA LEU B 58 148.024 7.584 -12.572 1.00 0.00 H new ATOM 0 HB2 LEU B 58 146.299 5.284 -11.562 1.00 0.00 H new ATOM 0 HB3 LEU B 58 145.889 6.977 -11.369 1.00 0.00 H new ATOM 0 HG LEU B 58 146.419 5.632 -14.063 1.00 0.00 H new ATOM 0 HD11 LEU B 58 143.950 5.811 -14.356 1.00 0.00 H new ATOM 0 HD12 LEU B 58 144.354 4.789 -12.956 1.00 0.00 H new ATOM 0 HD13 LEU B 58 143.805 6.463 -12.707 1.00 0.00 H new ATOM 0 HD21 LEU B 58 145.457 7.712 -15.007 1.00 0.00 H new ATOM 0 HD22 LEU B 58 145.302 8.388 -13.368 1.00 0.00 H new ATOM 0 HD23 LEU B 58 146.914 8.058 -14.047 1.00 0.00 H new ATOM 2320 N PHE B 59 148.778 5.655 -10.012 1.00 0.00 N ATOM 2321 CA PHE B 59 149.321 5.697 -8.628 1.00 0.00 C ATOM 2322 C PHE B 59 150.648 6.460 -8.612 1.00 0.00 C ATOM 2323 O PHE B 59 150.883 7.299 -7.766 1.00 0.00 O ATOM 2324 CB PHE B 59 149.535 4.269 -8.119 1.00 0.00 C ATOM 2325 CG PHE B 59 150.170 4.305 -6.746 1.00 0.00 C ATOM 2326 CD1 PHE B 59 149.465 4.851 -5.664 1.00 0.00 C ATOM 2327 CD2 PHE B 59 151.459 3.788 -6.550 1.00 0.00 C ATOM 2328 CE1 PHE B 59 150.047 4.879 -4.390 1.00 0.00 C ATOM 2329 CE2 PHE B 59 152.041 3.819 -5.276 1.00 0.00 C ATOM 2330 CZ PHE B 59 151.335 4.364 -4.197 1.00 0.00 C ATOM 0 H PHE B 59 148.700 4.723 -10.418 1.00 0.00 H new ATOM 0 HA PHE B 59 148.611 6.209 -7.978 1.00 0.00 H new ATOM 0 HB2 PHE B 59 148.582 3.742 -8.075 1.00 0.00 H new ATOM 0 HB3 PHE B 59 150.173 3.718 -8.810 1.00 0.00 H new ATOM 0 HD1 PHE B 59 148.473 5.250 -5.813 1.00 0.00 H new ATOM 0 HD2 PHE B 59 152.003 3.366 -7.382 1.00 0.00 H new ATOM 0 HE1 PHE B 59 149.502 5.298 -3.557 1.00 0.00 H new ATOM 0 HE2 PHE B 59 153.034 3.422 -5.126 1.00 0.00 H new ATOM 0 HZ PHE B 59 151.784 4.387 -3.215 1.00 0.00 H new ATOM 2340 N ARG B 60 151.529 6.152 -9.528 1.00 0.00 N ATOM 2341 CA ARG B 60 152.853 6.838 -9.548 1.00 0.00 C ATOM 2342 C ARG B 60 152.694 8.350 -9.725 1.00 0.00 C ATOM 2343 O ARG B 60 153.320 9.124 -9.028 1.00 0.00 O ATOM 2344 CB ARG B 60 153.709 6.288 -10.692 1.00 0.00 C ATOM 2345 CG ARG B 60 154.199 4.878 -10.353 1.00 0.00 C ATOM 2346 CD ARG B 60 155.086 4.372 -11.491 1.00 0.00 C ATOM 2347 NE ARG B 60 155.649 3.040 -11.133 1.00 0.00 N ATOM 2348 CZ ARG B 60 156.238 2.314 -12.044 1.00 0.00 C ATOM 2349 NH1 ARG B 60 156.310 2.744 -13.273 1.00 0.00 N ATOM 2350 NH2 ARG B 60 156.753 1.159 -11.726 1.00 0.00 N ATOM 0 H ARG B 60 151.389 5.457 -10.261 1.00 0.00 H new ATOM 0 HA ARG B 60 153.340 6.648 -8.592 1.00 0.00 H new ATOM 0 HB2 ARG B 60 153.128 6.267 -11.614 1.00 0.00 H new ATOM 0 HB3 ARG B 60 154.561 6.945 -10.867 1.00 0.00 H new ATOM 0 HG2 ARG B 60 154.757 4.888 -9.417 1.00 0.00 H new ATOM 0 HG3 ARG B 60 153.351 4.209 -10.211 1.00 0.00 H new ATOM 0 HD2 ARG B 60 154.507 4.297 -12.411 1.00 0.00 H new ATOM 0 HD3 ARG B 60 155.893 5.080 -11.679 1.00 0.00 H new ATOM 0 HE ARG B 60 155.574 2.695 -10.176 1.00 0.00 H new ATOM 0 HH11 ARG B 60 155.906 3.647 -13.522 1.00 0.00 H new ATOM 0 HH12 ARG B 60 156.770 2.177 -13.985 1.00 0.00 H new ATOM 0 HH21 ARG B 60 156.696 0.822 -10.765 1.00 0.00 H new ATOM 0 HH22 ARG B 60 157.213 0.592 -12.438 1.00 0.00 H new ATOM 2364 N GLU B 61 151.876 8.791 -10.642 1.00 0.00 N ATOM 2365 CA GLU B 61 151.714 10.260 -10.829 1.00 0.00 C ATOM 2366 C GLU B 61 151.125 10.860 -9.553 1.00 0.00 C ATOM 2367 O GLU B 61 151.471 11.954 -9.151 1.00 0.00 O ATOM 2368 CB GLU B 61 150.773 10.532 -12.005 1.00 0.00 C ATOM 2369 CG GLU B 61 151.463 10.146 -13.315 1.00 0.00 C ATOM 2370 CD GLU B 61 152.602 11.126 -13.606 1.00 0.00 C ATOM 2371 OE1 GLU B 61 152.579 12.213 -13.051 1.00 0.00 O ATOM 2372 OE2 GLU B 61 153.477 10.774 -14.380 1.00 0.00 O ATOM 0 H GLU B 61 151.319 8.205 -11.263 1.00 0.00 H new ATOM 0 HA GLU B 61 152.684 10.712 -11.038 1.00 0.00 H new ATOM 0 HB2 GLU B 61 149.852 9.962 -11.886 1.00 0.00 H new ATOM 0 HB3 GLU B 61 150.495 11.586 -12.025 1.00 0.00 H new ATOM 0 HG2 GLU B 61 151.853 9.130 -13.246 1.00 0.00 H new ATOM 0 HG3 GLU B 61 150.743 10.157 -14.133 1.00 0.00 H new ATOM 2379 N TRP B 62 150.242 10.152 -8.911 1.00 0.00 N ATOM 2380 CA TRP B 62 149.636 10.679 -7.657 1.00 0.00 C ATOM 2381 C TRP B 62 150.701 10.853 -6.572 1.00 0.00 C ATOM 2382 O TRP B 62 150.757 11.860 -5.901 1.00 0.00 O ATOM 2383 CB TRP B 62 148.568 9.693 -7.157 1.00 0.00 C ATOM 2384 CG TRP B 62 148.139 10.064 -5.766 1.00 0.00 C ATOM 2385 CD1 TRP B 62 147.196 10.982 -5.454 1.00 0.00 C ATOM 2386 CD2 TRP B 62 148.643 9.547 -4.498 1.00 0.00 C ATOM 2387 NE1 TRP B 62 147.081 11.055 -4.077 1.00 0.00 N ATOM 2388 CE2 TRP B 62 147.953 10.190 -3.443 1.00 0.00 C ATOM 2389 CE3 TRP B 62 149.621 8.589 -4.164 1.00 0.00 C ATOM 2390 CZ2 TRP B 62 148.223 9.892 -2.103 1.00 0.00 C ATOM 2391 CZ3 TRP B 62 149.892 8.289 -2.820 1.00 0.00 C ATOM 2392 CH2 TRP B 62 149.194 8.938 -1.792 1.00 0.00 C ATOM 0 H TRP B 62 149.913 9.231 -9.199 1.00 0.00 H new ATOM 0 HA TRP B 62 149.187 11.649 -7.869 1.00 0.00 H new ATOM 0 HB2 TRP B 62 147.708 9.704 -7.827 1.00 0.00 H new ATOM 0 HB3 TRP B 62 148.965 8.678 -7.166 1.00 0.00 H new ATOM 0 HD1 TRP B 62 146.626 11.563 -6.164 1.00 0.00 H new ATOM 0 HE1 TRP B 62 146.432 11.672 -3.589 1.00 0.00 H new ATOM 0 HE3 TRP B 62 150.165 8.082 -4.947 1.00 0.00 H new ATOM 0 HZ2 TRP B 62 147.684 10.396 -1.315 1.00 0.00 H new ATOM 0 HZ3 TRP B 62 150.644 7.553 -2.576 1.00 0.00 H new ATOM 0 HH2 TRP B 62 149.407 8.700 -0.760 1.00 0.00 H new ATOM 2403 N LEU B 63 151.534 9.872 -6.385 1.00 0.00 N ATOM 2404 CA LEU B 63 152.576 9.975 -5.327 1.00 0.00 C ATOM 2405 C LEU B 63 153.600 11.051 -5.700 1.00 0.00 C ATOM 2406 O LEU B 63 153.950 11.892 -4.897 1.00 0.00 O ATOM 2407 CB LEU B 63 153.271 8.616 -5.187 1.00 0.00 C ATOM 2408 CG LEU B 63 154.355 8.673 -4.103 1.00 0.00 C ATOM 2409 CD1 LEU B 63 153.727 9.025 -2.742 1.00 0.00 C ATOM 2410 CD2 LEU B 63 155.043 7.307 -4.018 1.00 0.00 C ATOM 0 H LEU B 63 151.540 9.002 -6.918 1.00 0.00 H new ATOM 0 HA LEU B 63 152.113 10.253 -4.380 1.00 0.00 H new ATOM 0 HB2 LEU B 63 152.537 7.850 -4.935 1.00 0.00 H new ATOM 0 HB3 LEU B 63 153.716 8.329 -6.140 1.00 0.00 H new ATOM 0 HG LEU B 63 155.085 9.441 -4.358 1.00 0.00 H new ATOM 0 HD11 LEU B 63 154.506 9.063 -1.981 1.00 0.00 H new ATOM 0 HD12 LEU B 63 153.237 9.996 -2.808 1.00 0.00 H new ATOM 0 HD13 LEU B 63 152.993 8.266 -2.473 1.00 0.00 H new ATOM 0 HD21 LEU B 63 155.816 7.336 -3.250 1.00 0.00 H new ATOM 0 HD22 LEU B 63 154.307 6.544 -3.764 1.00 0.00 H new ATOM 0 HD23 LEU B 63 155.496 7.067 -4.980 1.00 0.00 H new ATOM 2422 N LYS B 64 154.081 11.031 -6.910 1.00 0.00 N ATOM 2423 CA LYS B 64 155.082 12.048 -7.342 1.00 0.00 C ATOM 2424 C LYS B 64 154.469 13.443 -7.215 1.00 0.00 C ATOM 2425 O LYS B 64 155.065 14.353 -6.671 1.00 0.00 O ATOM 2426 CB LYS B 64 155.474 11.774 -8.805 1.00 0.00 C ATOM 2427 CG LYS B 64 156.510 12.793 -9.319 1.00 0.00 C ATOM 2428 CD LYS B 64 157.892 12.506 -8.719 1.00 0.00 C ATOM 2429 CE LYS B 64 158.948 13.357 -9.435 1.00 0.00 C ATOM 2430 NZ LYS B 64 159.275 12.737 -10.751 1.00 0.00 N ATOM 0 H LYS B 64 153.823 10.350 -7.624 1.00 0.00 H new ATOM 0 HA LYS B 64 155.971 11.991 -6.714 1.00 0.00 H new ATOM 0 HB2 LYS B 64 155.882 10.767 -8.890 1.00 0.00 H new ATOM 0 HB3 LYS B 64 154.584 11.812 -9.433 1.00 0.00 H new ATOM 0 HG2 LYS B 64 156.563 12.749 -10.407 1.00 0.00 H new ATOM 0 HG3 LYS B 64 156.196 13.803 -9.056 1.00 0.00 H new ATOM 0 HD2 LYS B 64 157.891 12.731 -7.652 1.00 0.00 H new ATOM 0 HD3 LYS B 64 158.132 11.448 -8.822 1.00 0.00 H new ATOM 0 HE2 LYS B 64 158.576 14.371 -9.581 1.00 0.00 H new ATOM 0 HE3 LYS B 64 159.847 13.432 -8.823 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 160.125 13.188 -11.146 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 159.451 11.720 -10.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 158.477 12.870 -11.405 1.00 0.00 H new ATOM 2444 N ASP B 65 153.282 13.610 -7.723 1.00 0.00 N ATOM 2445 CA ASP B 65 152.611 14.936 -7.649 1.00 0.00 C ATOM 2446 C ASP B 65 152.248 15.248 -6.200 1.00 0.00 C ATOM 2447 O ASP B 65 152.197 16.393 -5.793 1.00 0.00 O ATOM 2448 CB ASP B 65 151.340 14.911 -8.501 1.00 0.00 C ATOM 2449 CG ASP B 65 150.746 16.319 -8.574 1.00 0.00 C ATOM 2450 OD1 ASP B 65 150.738 16.991 -7.557 1.00 0.00 O ATOM 2451 OD2 ASP B 65 150.316 16.703 -9.649 1.00 0.00 O ATOM 0 H ASP B 65 152.744 12.880 -8.190 1.00 0.00 H new ATOM 0 HA ASP B 65 153.286 15.705 -8.024 1.00 0.00 H new ATOM 0 HB2 ASP B 65 151.569 14.549 -9.503 1.00 0.00 H new ATOM 0 HB3 ASP B 65 150.615 14.221 -8.071 1.00 0.00 H new ATOM 2456 N THR B 66 151.954 14.241 -5.426 1.00 0.00 N ATOM 2457 CA THR B 66 151.546 14.477 -4.016 1.00 0.00 C ATOM 2458 C THR B 66 152.742 14.838 -3.129 1.00 0.00 C ATOM 2459 O THR B 66 152.604 15.657 -2.242 1.00 0.00 O ATOM 2460 CB THR B 66 150.862 13.221 -3.467 1.00 0.00 C ATOM 2461 OG1 THR B 66 149.655 12.994 -4.183 1.00 0.00 O ATOM 2462 CG2 THR B 66 150.541 13.406 -1.982 1.00 0.00 C ATOM 0 H THR B 66 151.979 13.262 -5.711 1.00 0.00 H new ATOM 0 HA THR B 66 150.855 15.320 -4.003 1.00 0.00 H new ATOM 0 HB THR B 66 151.530 12.368 -3.585 1.00 0.00 H new ATOM 0 HG1 THR B 66 149.865 12.738 -5.105 1.00 0.00 H new ATOM 0 HG21 THR B 66 150.055 12.508 -1.600 1.00 0.00 H new ATOM 0 HG22 THR B 66 151.464 13.582 -1.429 1.00 0.00 H new ATOM 0 HG23 THR B 66 149.875 14.260 -1.857 1.00 0.00 H new ATOM 2470 N CYS B 67 153.901 14.228 -3.301 1.00 0.00 N ATOM 2471 CA CYS B 67 155.055 14.553 -2.391 1.00 0.00 C ATOM 2472 C CYS B 67 156.356 14.788 -3.163 1.00 0.00 C ATOM 2473 O CYS B 67 157.200 15.550 -2.736 1.00 0.00 O ATOM 2474 CB CYS B 67 155.257 13.389 -1.421 1.00 0.00 C ATOM 2475 SG CYS B 67 155.814 11.930 -2.336 1.00 0.00 S ATOM 0 H CYS B 67 154.094 13.531 -4.020 1.00 0.00 H new ATOM 0 HA CYS B 67 154.814 15.474 -1.861 1.00 0.00 H new ATOM 0 HB2 CYS B 67 155.992 13.658 -0.662 1.00 0.00 H new ATOM 0 HB3 CYS B 67 154.325 13.170 -0.899 1.00 0.00 H new ATOM 0 HG CYS B 67 155.126 11.817 -3.433 1.00 0.00 H new ATOM 2481 N GLY B 68 156.535 14.135 -4.284 1.00 0.00 N ATOM 2482 CA GLY B 68 157.796 14.313 -5.077 1.00 0.00 C ATOM 2483 C GLY B 68 158.645 13.043 -4.982 1.00 0.00 C ATOM 2484 O GLY B 68 159.815 13.046 -5.307 1.00 0.00 O ATOM 0 H GLY B 68 155.862 13.484 -4.687 1.00 0.00 H new ATOM 0 HA2 GLY B 68 157.556 14.525 -6.119 1.00 0.00 H new ATOM 0 HA3 GLY B 68 158.358 15.167 -4.699 1.00 0.00 H new ATOM 2488 N ALA B 69 158.070 11.950 -4.547 1.00 0.00 N ATOM 2489 CA ALA B 69 158.861 10.687 -4.448 1.00 0.00 C ATOM 2490 C ALA B 69 159.596 10.453 -5.770 1.00 0.00 C ATOM 2491 O ALA B 69 159.170 10.911 -6.811 1.00 0.00 O ATOM 2492 CB ALA B 69 157.918 9.511 -4.179 1.00 0.00 C ATOM 0 H ALA B 69 157.094 11.878 -4.258 1.00 0.00 H new ATOM 0 HA ALA B 69 159.580 10.768 -3.633 1.00 0.00 H new ATOM 0 HB1 ALA B 69 158.496 8.590 -4.107 1.00 0.00 H new ATOM 0 HB2 ALA B 69 157.385 9.679 -3.243 1.00 0.00 H new ATOM 0 HB3 ALA B 69 157.200 9.426 -4.995 1.00 0.00 H new ATOM 2498 N ASN B 70 160.703 9.760 -5.743 1.00 0.00 N ATOM 2499 CA ASN B 70 161.465 9.521 -7.007 1.00 0.00 C ATOM 2500 C ASN B 70 160.975 8.233 -7.672 1.00 0.00 C ATOM 2501 O ASN B 70 160.184 7.495 -7.120 1.00 0.00 O ATOM 2502 CB ASN B 70 162.956 9.385 -6.683 1.00 0.00 C ATOM 2503 CG ASN B 70 163.413 10.577 -5.838 1.00 0.00 C ATOM 2504 OD1 ASN B 70 162.836 11.736 -5.997 1.00 0.00 O flip ATOM 2505 ND2 ASN B 70 164.305 10.451 -5.023 1.00 0.00 N flip ATOM 0 H ASN B 70 161.113 9.350 -4.904 1.00 0.00 H new ATOM 0 HA ASN B 70 161.309 10.360 -7.685 1.00 0.00 H new ATOM 0 HB2 ASN B 70 163.137 8.455 -6.145 1.00 0.00 H new ATOM 0 HB3 ASN B 70 163.535 9.338 -7.605 1.00 0.00 H new ATOM 0 HD21 ASN B 70 164.757 9.545 -4.898 1.00 0.00 H new ATOM 0 HD22 ASN B 70 164.602 11.251 -4.464 1.00 0.00 H new ATOM 2512 N ALA B 71 161.435 7.970 -8.864 1.00 0.00 N ATOM 2513 CA ALA B 71 160.998 6.743 -9.590 1.00 0.00 C ATOM 2514 C ALA B 71 161.364 5.487 -8.793 1.00 0.00 C ATOM 2515 O ALA B 71 160.643 4.509 -8.803 1.00 0.00 O ATOM 2516 CB ALA B 71 161.685 6.689 -10.956 1.00 0.00 C ATOM 0 H ALA B 71 162.099 8.556 -9.370 1.00 0.00 H new ATOM 0 HA ALA B 71 159.916 6.779 -9.716 1.00 0.00 H new ATOM 0 HB1 ALA B 71 161.367 5.793 -11.488 1.00 0.00 H new ATOM 0 HB2 ALA B 71 161.412 7.571 -11.535 1.00 0.00 H new ATOM 0 HB3 ALA B 71 162.766 6.665 -10.819 1.00 0.00 H new ATOM 2522 N LYS B 72 162.472 5.496 -8.106 1.00 0.00 N ATOM 2523 CA LYS B 72 162.855 4.286 -7.320 1.00 0.00 C ATOM 2524 C LYS B 72 161.931 4.147 -6.111 1.00 0.00 C ATOM 2525 O LYS B 72 161.526 3.061 -5.743 1.00 0.00 O ATOM 2526 CB LYS B 72 164.308 4.397 -6.847 1.00 0.00 C ATOM 2527 CG LYS B 72 164.749 3.053 -6.258 1.00 0.00 C ATOM 2528 CD LYS B 72 166.200 3.147 -5.780 1.00 0.00 C ATOM 2529 CE LYS B 72 166.635 1.801 -5.193 1.00 0.00 C ATOM 2530 NZ LYS B 72 166.692 0.779 -6.277 1.00 0.00 N ATOM 0 H LYS B 72 163.124 6.279 -8.053 1.00 0.00 H new ATOM 0 HA LYS B 72 162.758 3.407 -7.957 1.00 0.00 H new ATOM 0 HB2 LYS B 72 164.954 4.672 -7.680 1.00 0.00 H new ATOM 0 HB3 LYS B 72 164.400 5.184 -6.098 1.00 0.00 H new ATOM 0 HG2 LYS B 72 164.100 2.779 -5.426 1.00 0.00 H new ATOM 0 HG3 LYS B 72 164.654 2.268 -7.008 1.00 0.00 H new ATOM 0 HD2 LYS B 72 166.850 3.420 -6.611 1.00 0.00 H new ATOM 0 HD3 LYS B 72 166.296 3.931 -5.029 1.00 0.00 H new ATOM 0 HE2 LYS B 72 167.612 1.898 -4.719 1.00 0.00 H new ATOM 0 HE3 LYS B 72 165.935 1.487 -4.419 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 167.277 -0.023 -5.968 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 165.731 0.444 -6.489 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 167.108 1.202 -7.131 1.00 0.00 H new ATOM 2544 N GLN B 73 161.607 5.243 -5.482 1.00 0.00 N ATOM 2545 CA GLN B 73 160.727 5.206 -4.282 1.00 0.00 C ATOM 2546 C GLN B 73 159.316 4.761 -4.659 1.00 0.00 C ATOM 2547 O GLN B 73 158.676 4.027 -3.934 1.00 0.00 O ATOM 2548 CB GLN B 73 160.667 6.603 -3.661 1.00 0.00 C ATOM 2549 CG GLN B 73 162.019 6.940 -3.030 1.00 0.00 C ATOM 2550 CD GLN B 73 162.001 8.386 -2.535 1.00 0.00 C ATOM 2551 OE1 GLN B 73 161.567 9.276 -3.241 1.00 0.00 O ATOM 2552 NE2 GLN B 73 162.454 8.663 -1.343 1.00 0.00 N ATOM 0 H GLN B 73 161.920 6.175 -5.753 1.00 0.00 H new ATOM 0 HA GLN B 73 161.138 4.492 -3.568 1.00 0.00 H new ATOM 0 HB2 GLN B 73 160.416 7.341 -4.423 1.00 0.00 H new ATOM 0 HB3 GLN B 73 159.881 6.644 -2.906 1.00 0.00 H new ATOM 0 HG2 GLN B 73 162.225 6.263 -2.201 1.00 0.00 H new ATOM 0 HG3 GLN B 73 162.817 6.803 -3.759 1.00 0.00 H new ATOM 0 HE21 GLN B 73 162.818 7.917 -0.750 1.00 0.00 H new ATOM 0 HE22 GLN B 73 162.444 9.625 -1.004 1.00 0.00 H new ATOM 2561 N SER B 74 158.814 5.210 -5.778 1.00 0.00 N ATOM 2562 CA SER B 74 157.437 4.822 -6.179 1.00 0.00 C ATOM 2563 C SER B 74 157.382 3.325 -6.484 1.00 0.00 C ATOM 2564 O SER B 74 156.418 2.658 -6.166 1.00 0.00 O ATOM 2565 CB SER B 74 157.032 5.608 -7.426 1.00 0.00 C ATOM 2566 OG SER B 74 157.547 4.953 -8.578 1.00 0.00 O ATOM 0 H SER B 74 159.299 5.828 -6.429 1.00 0.00 H new ATOM 0 HA SER B 74 156.751 5.046 -5.362 1.00 0.00 H new ATOM 0 HB2 SER B 74 155.946 5.680 -7.489 1.00 0.00 H new ATOM 0 HB3 SER B 74 157.416 6.626 -7.370 1.00 0.00 H new ATOM 0 HG SER B 74 158.521 4.874 -8.501 1.00 0.00 H new ATOM 2572 N ARG B 75 158.401 2.781 -7.101 1.00 0.00 N ATOM 2573 CA ARG B 75 158.381 1.326 -7.417 1.00 0.00 C ATOM 2574 C ARG B 75 158.257 0.518 -6.126 1.00 0.00 C ATOM 2575 O ARG B 75 157.594 -0.499 -6.091 1.00 0.00 O ATOM 2576 CB ARG B 75 159.654 0.929 -8.167 1.00 0.00 C ATOM 2577 CG ARG B 75 159.606 1.498 -9.588 1.00 0.00 C ATOM 2578 CD ARG B 75 160.876 1.105 -10.344 1.00 0.00 C ATOM 2579 NE ARG B 75 160.915 -0.376 -10.512 1.00 0.00 N ATOM 2580 CZ ARG B 75 161.729 -0.915 -11.379 1.00 0.00 C ATOM 2581 NH1 ARG B 75 162.510 -0.158 -12.100 1.00 0.00 N ATOM 2582 NH2 ARG B 75 161.761 -2.212 -11.527 1.00 0.00 N ATOM 0 H ARG B 75 159.240 3.281 -7.397 1.00 0.00 H new ATOM 0 HA ARG B 75 157.522 1.114 -8.054 1.00 0.00 H new ATOM 0 HB2 ARG B 75 160.531 1.307 -7.642 1.00 0.00 H new ATOM 0 HB3 ARG B 75 159.746 -0.157 -8.201 1.00 0.00 H new ATOM 0 HG2 ARG B 75 158.728 1.120 -10.112 1.00 0.00 H new ATOM 0 HG3 ARG B 75 159.514 2.583 -9.552 1.00 0.00 H new ATOM 0 HD2 ARG B 75 160.898 1.593 -11.318 1.00 0.00 H new ATOM 0 HD3 ARG B 75 161.757 1.443 -9.798 1.00 0.00 H new ATOM 0 HE ARG B 75 160.305 -0.969 -9.949 1.00 0.00 H new ATOM 0 HH11 ARG B 75 162.485 0.855 -11.986 1.00 0.00 H new ATOM 0 HH12 ARG B 75 163.146 -0.580 -12.777 1.00 0.00 H new ATOM 0 HH21 ARG B 75 161.150 -2.805 -10.965 1.00 0.00 H new ATOM 0 HH22 ARG B 75 162.397 -2.632 -12.204 1.00 0.00 H new ATOM 2596 N ASP B 76 158.895 0.933 -5.066 1.00 0.00 N ATOM 2597 CA ASP B 76 158.820 0.161 -3.794 1.00 0.00 C ATOM 2598 C ASP B 76 157.411 0.228 -3.207 1.00 0.00 C ATOM 2599 O ASP B 76 156.910 -0.745 -2.679 1.00 0.00 O ATOM 2600 CB ASP B 76 159.815 0.747 -2.788 1.00 0.00 C ATOM 2601 CG ASP B 76 161.242 0.435 -3.240 1.00 0.00 C ATOM 2602 OD1 ASP B 76 161.412 -0.519 -3.982 1.00 0.00 O ATOM 2603 OD2 ASP B 76 162.140 1.157 -2.839 1.00 0.00 O ATOM 0 H ASP B 76 159.467 1.777 -5.026 1.00 0.00 H new ATOM 0 HA ASP B 76 159.065 -0.881 -4.001 1.00 0.00 H new ATOM 0 HB2 ASP B 76 159.675 1.825 -2.708 1.00 0.00 H new ATOM 0 HB3 ASP B 76 159.636 0.328 -1.798 1.00 0.00 H new ATOM 2608 N CYS B 77 156.758 1.354 -3.291 1.00 0.00 N ATOM 2609 CA CYS B 77 155.384 1.449 -2.728 1.00 0.00 C ATOM 2610 C CYS B 77 154.419 0.576 -3.535 1.00 0.00 C ATOM 2611 O CYS B 77 153.539 -0.052 -2.981 1.00 0.00 O ATOM 2612 CB CYS B 77 154.916 2.904 -2.783 1.00 0.00 C ATOM 2613 SG CYS B 77 155.853 3.887 -1.589 1.00 0.00 S ATOM 0 H CYS B 77 157.114 2.207 -3.722 1.00 0.00 H new ATOM 0 HA CYS B 77 155.398 1.101 -1.695 1.00 0.00 H new ATOM 0 HB2 CYS B 77 155.055 3.304 -3.787 1.00 0.00 H new ATOM 0 HB3 CYS B 77 153.850 2.963 -2.561 1.00 0.00 H new ATOM 0 HG CYS B 77 156.322 3.109 -0.659 1.00 0.00 H new ATOM 2619 N PHE B 78 154.541 0.544 -4.837 1.00 0.00 N ATOM 2620 CA PHE B 78 153.583 -0.277 -5.630 1.00 0.00 C ATOM 2621 C PHE B 78 153.675 -1.743 -5.209 1.00 0.00 C ATOM 2622 O PHE B 78 152.708 -2.335 -4.772 1.00 0.00 O ATOM 2623 CB PHE B 78 153.902 -0.160 -7.121 1.00 0.00 C ATOM 2624 CG PHE B 78 152.911 -0.987 -7.902 1.00 0.00 C ATOM 2625 CD1 PHE B 78 153.183 -2.333 -8.178 1.00 0.00 C ATOM 2626 CD2 PHE B 78 151.714 -0.410 -8.345 1.00 0.00 C ATOM 2627 CE1 PHE B 78 152.258 -3.101 -8.899 1.00 0.00 C ATOM 2628 CE2 PHE B 78 150.791 -1.177 -9.064 1.00 0.00 C ATOM 2629 CZ PHE B 78 151.062 -2.522 -9.342 1.00 0.00 C ATOM 0 H PHE B 78 155.250 1.042 -5.376 1.00 0.00 H new ATOM 0 HA PHE B 78 152.574 0.091 -5.445 1.00 0.00 H new ATOM 0 HB2 PHE B 78 153.853 0.882 -7.436 1.00 0.00 H new ATOM 0 HB3 PHE B 78 154.917 -0.505 -7.317 1.00 0.00 H new ATOM 0 HD1 PHE B 78 154.105 -2.779 -7.835 1.00 0.00 H new ATOM 0 HD2 PHE B 78 151.504 0.628 -8.131 1.00 0.00 H new ATOM 0 HE1 PHE B 78 152.467 -4.139 -9.113 1.00 0.00 H new ATOM 0 HE2 PHE B 78 149.868 -0.731 -9.405 1.00 0.00 H new ATOM 0 HZ PHE B 78 150.349 -3.113 -9.898 1.00 0.00 H new ATOM 2639 N GLY B 79 154.829 -2.338 -5.341 1.00 0.00 N ATOM 2640 CA GLY B 79 154.979 -3.769 -4.957 1.00 0.00 C ATOM 2641 C GLY B 79 154.650 -3.946 -3.475 1.00 0.00 C ATOM 2642 O GLY B 79 154.142 -4.967 -3.056 1.00 0.00 O ATOM 0 H GLY B 79 155.675 -1.894 -5.699 1.00 0.00 H new ATOM 0 HA2 GLY B 79 154.317 -4.388 -5.562 1.00 0.00 H new ATOM 0 HA3 GLY B 79 155.997 -4.103 -5.155 1.00 0.00 H new ATOM 2646 N CYS B 80 154.933 -2.957 -2.678 1.00 0.00 N ATOM 2647 CA CYS B 80 154.633 -3.074 -1.225 1.00 0.00 C ATOM 2648 C CYS B 80 153.115 -3.067 -1.011 1.00 0.00 C ATOM 2649 O CYS B 80 152.573 -3.935 -0.357 1.00 0.00 O ATOM 2650 CB CYS B 80 155.265 -1.897 -0.477 1.00 0.00 C ATOM 2651 SG CYS B 80 155.024 -2.111 1.303 1.00 0.00 S ATOM 0 H CYS B 80 155.357 -2.076 -2.967 1.00 0.00 H new ATOM 0 HA CYS B 80 155.045 -4.008 -0.843 1.00 0.00 H new ATOM 0 HB2 CYS B 80 156.329 -1.837 -0.706 1.00 0.00 H new ATOM 0 HB3 CYS B 80 154.815 -0.960 -0.805 1.00 0.00 H new ATOM 0 HG CYS B 80 154.001 -2.886 1.512 1.00 0.00 H new ATOM 2657 N LEU B 81 152.418 -2.112 -1.568 1.00 0.00 N ATOM 2658 CA LEU B 81 150.935 -2.105 -1.387 1.00 0.00 C ATOM 2659 C LEU B 81 150.314 -3.257 -2.189 1.00 0.00 C ATOM 2660 O LEU B 81 149.392 -3.908 -1.738 1.00 0.00 O ATOM 2661 CB LEU B 81 150.352 -0.775 -1.877 1.00 0.00 C ATOM 2662 CG LEU B 81 150.933 0.394 -1.066 1.00 0.00 C ATOM 2663 CD1 LEU B 81 150.372 1.710 -1.616 1.00 0.00 C ATOM 2664 CD2 LEU B 81 150.550 0.252 0.419 1.00 0.00 C ATOM 0 H LEU B 81 152.800 -1.351 -2.129 1.00 0.00 H new ATOM 0 HA LEU B 81 150.707 -2.229 -0.328 1.00 0.00 H new ATOM 0 HB2 LEU B 81 150.577 -0.640 -2.935 1.00 0.00 H new ATOM 0 HB3 LEU B 81 149.266 -0.789 -1.781 1.00 0.00 H new ATOM 0 HG LEU B 81 152.020 0.388 -1.151 1.00 0.00 H new ATOM 0 HD11 LEU B 81 150.779 2.545 -1.046 1.00 0.00 H new ATOM 0 HD12 LEU B 81 150.652 1.815 -2.664 1.00 0.00 H new ATOM 0 HD13 LEU B 81 149.285 1.707 -1.529 1.00 0.00 H new ATOM 0 HD21 LEU B 81 150.967 1.086 0.984 1.00 0.00 H new ATOM 0 HD22 LEU B 81 149.464 0.255 0.517 1.00 0.00 H new ATOM 0 HD23 LEU B 81 150.947 -0.685 0.809 1.00 0.00 H new ATOM 2676 N ARG B 82 150.801 -3.511 -3.378 1.00 0.00 N ATOM 2677 CA ARG B 82 150.221 -4.615 -4.203 1.00 0.00 C ATOM 2678 C ARG B 82 150.380 -5.956 -3.483 1.00 0.00 C ATOM 2679 O ARG B 82 149.492 -6.785 -3.498 1.00 0.00 O ATOM 2680 CB ARG B 82 150.936 -4.666 -5.565 1.00 0.00 C ATOM 2681 CG ARG B 82 150.443 -5.854 -6.419 1.00 0.00 C ATOM 2682 CD ARG B 82 148.936 -5.751 -6.689 1.00 0.00 C ATOM 2683 NE ARG B 82 148.549 -6.751 -7.724 1.00 0.00 N ATOM 2684 CZ ARG B 82 147.292 -7.056 -7.898 1.00 0.00 C ATOM 2685 NH1 ARG B 82 146.376 -6.504 -7.150 1.00 0.00 N ATOM 2686 NH2 ARG B 82 146.949 -7.919 -8.816 1.00 0.00 N ATOM 0 H ARG B 82 151.572 -3.004 -3.812 1.00 0.00 H new ATOM 0 HA ARG B 82 149.159 -4.425 -4.356 1.00 0.00 H new ATOM 0 HB2 ARG B 82 150.763 -3.734 -6.103 1.00 0.00 H new ATOM 0 HB3 ARG B 82 152.012 -4.750 -5.410 1.00 0.00 H new ATOM 0 HG2 ARG B 82 150.985 -5.876 -7.365 1.00 0.00 H new ATOM 0 HG3 ARG B 82 150.661 -6.790 -5.905 1.00 0.00 H new ATOM 0 HD2 ARG B 82 148.378 -5.928 -5.770 1.00 0.00 H new ATOM 0 HD3 ARG B 82 148.684 -4.746 -7.026 1.00 0.00 H new ATOM 0 HE ARG B 82 149.266 -7.197 -8.296 1.00 0.00 H new ATOM 0 HH11 ARG B 82 146.642 -5.834 -6.429 1.00 0.00 H new ATOM 0 HH12 ARG B 82 145.394 -6.743 -7.287 1.00 0.00 H new ATOM 0 HH21 ARG B 82 147.664 -8.356 -9.398 1.00 0.00 H new ATOM 0 HH22 ARG B 82 145.966 -8.157 -8.951 1.00 0.00 H new ATOM 2700 N GLU B 83 151.505 -6.184 -2.866 1.00 0.00 N ATOM 2701 CA GLU B 83 151.723 -7.480 -2.160 1.00 0.00 C ATOM 2702 C GLU B 83 150.842 -7.568 -0.910 1.00 0.00 C ATOM 2703 O GLU B 83 150.299 -8.614 -0.613 1.00 0.00 O ATOM 2704 CB GLU B 83 153.204 -7.616 -1.771 1.00 0.00 C ATOM 2705 CG GLU B 83 154.026 -8.114 -2.970 1.00 0.00 C ATOM 2706 CD GLU B 83 153.705 -7.284 -4.217 1.00 0.00 C ATOM 2707 OE1 GLU B 83 152.576 -7.349 -4.674 1.00 0.00 O ATOM 2708 OE2 GLU B 83 154.597 -6.605 -4.697 1.00 0.00 O ATOM 0 H GLU B 83 152.285 -5.529 -2.819 1.00 0.00 H new ATOM 0 HA GLU B 83 151.450 -8.294 -2.831 1.00 0.00 H new ATOM 0 HB2 GLU B 83 153.588 -6.654 -1.432 1.00 0.00 H new ATOM 0 HB3 GLU B 83 153.306 -8.311 -0.938 1.00 0.00 H new ATOM 0 HG2 GLU B 83 155.090 -8.046 -2.744 1.00 0.00 H new ATOM 0 HG3 GLU B 83 153.807 -9.165 -3.158 1.00 0.00 H new ATOM 2715 N TRP B 84 150.662 -6.497 -0.177 1.00 0.00 N ATOM 2716 CA TRP B 84 149.787 -6.576 1.025 1.00 0.00 C ATOM 2717 C TRP B 84 148.381 -6.985 0.576 1.00 0.00 C ATOM 2718 O TRP B 84 147.754 -7.849 1.154 1.00 0.00 O ATOM 2719 CB TRP B 84 149.733 -5.218 1.728 1.00 0.00 C ATOM 2720 CG TRP B 84 149.018 -5.379 3.030 1.00 0.00 C ATOM 2721 CD1 TRP B 84 149.611 -5.702 4.202 1.00 0.00 C ATOM 2722 CD2 TRP B 84 147.596 -5.247 3.312 1.00 0.00 C ATOM 2723 NE1 TRP B 84 148.643 -5.776 5.187 1.00 0.00 N ATOM 2724 CE2 TRP B 84 147.385 -5.505 4.688 1.00 0.00 C ATOM 2725 CE3 TRP B 84 146.481 -4.933 2.518 1.00 0.00 C ATOM 2726 CZ2 TRP B 84 146.112 -5.453 5.253 1.00 0.00 C ATOM 2727 CZ3 TRP B 84 145.197 -4.880 3.085 1.00 0.00 C ATOM 2728 CH2 TRP B 84 145.014 -5.140 4.449 1.00 0.00 C ATOM 0 H TRP B 84 151.079 -5.584 -0.358 1.00 0.00 H new ATOM 0 HA TRP B 84 150.186 -7.311 1.724 1.00 0.00 H new ATOM 0 HB2 TRP B 84 150.741 -4.839 1.895 1.00 0.00 H new ATOM 0 HB3 TRP B 84 149.218 -4.489 1.102 1.00 0.00 H new ATOM 0 HD1 TRP B 84 150.668 -5.874 4.345 1.00 0.00 H new ATOM 0 HE1 TRP B 84 148.835 -6.003 6.163 1.00 0.00 H new ATOM 0 HE3 TRP B 84 146.612 -4.731 1.465 1.00 0.00 H new ATOM 0 HZ2 TRP B 84 145.976 -5.653 6.305 1.00 0.00 H new ATOM 0 HZ3 TRP B 84 144.346 -4.637 2.466 1.00 0.00 H new ATOM 0 HH2 TRP B 84 144.024 -5.098 4.879 1.00 0.00 H new ATOM 2739 N CYS B 85 147.886 -6.362 -0.458 1.00 0.00 N ATOM 2740 CA CYS B 85 146.523 -6.705 -0.953 1.00 0.00 C ATOM 2741 C CYS B 85 146.495 -8.181 -1.356 1.00 0.00 C ATOM 2742 O CYS B 85 145.538 -8.888 -1.109 1.00 0.00 O ATOM 2743 CB CYS B 85 146.192 -5.831 -2.166 1.00 0.00 C ATOM 2744 SG CYS B 85 145.865 -4.137 -1.618 1.00 0.00 S ATOM 0 H CYS B 85 148.367 -5.630 -0.981 1.00 0.00 H new ATOM 0 HA CYS B 85 145.786 -6.528 -0.170 1.00 0.00 H new ATOM 0 HB2 CYS B 85 147.022 -5.842 -2.873 1.00 0.00 H new ATOM 0 HB3 CYS B 85 145.323 -6.230 -2.689 1.00 0.00 H new ATOM 0 HG CYS B 85 145.586 -3.394 -2.648 1.00 0.00 H new ATOM 2750 N ASP B 86 147.542 -8.646 -1.973 1.00 0.00 N ATOM 2751 CA ASP B 86 147.599 -10.075 -2.397 1.00 0.00 C ATOM 2752 C ASP B 86 147.474 -10.999 -1.181 1.00 0.00 C ATOM 2753 O ASP B 86 146.902 -12.068 -1.264 1.00 0.00 O ATOM 2754 CB ASP B 86 148.928 -10.346 -3.106 1.00 0.00 C ATOM 2755 CG ASP B 86 148.929 -9.655 -4.471 1.00 0.00 C ATOM 2756 OD1 ASP B 86 147.869 -9.218 -4.890 1.00 0.00 O ATOM 2757 OD2 ASP B 86 149.985 -9.582 -5.076 1.00 0.00 O ATOM 0 H ASP B 86 148.369 -8.095 -2.205 1.00 0.00 H new ATOM 0 HA ASP B 86 146.770 -10.272 -3.077 1.00 0.00 H new ATOM 0 HB2 ASP B 86 149.757 -9.979 -2.500 1.00 0.00 H new ATOM 0 HB3 ASP B 86 149.074 -11.419 -3.230 1.00 0.00 H new ATOM 2762 N ALA B 87 148.018 -10.610 -0.057 1.00 0.00 N ATOM 2763 CA ALA B 87 147.941 -11.490 1.151 1.00 0.00 C ATOM 2764 C ALA B 87 146.646 -11.224 1.918 1.00 0.00 C ATOM 2765 O ALA B 87 146.076 -12.123 2.504 1.00 0.00 O ATOM 2766 CB ALA B 87 149.133 -11.208 2.069 1.00 0.00 C ATOM 0 H ALA B 87 148.510 -9.727 0.078 1.00 0.00 H new ATOM 0 HA ALA B 87 147.960 -12.531 0.827 1.00 0.00 H new ATOM 0 HB1 ALA B 87 149.075 -11.850 2.948 1.00 0.00 H new ATOM 0 HB2 ALA B 87 150.061 -11.409 1.533 1.00 0.00 H new ATOM 0 HB3 ALA B 87 149.113 -10.164 2.380 1.00 0.00 H new ATOM 2772 N PHE B 88 146.191 -9.996 1.947 1.00 0.00 N ATOM 2773 CA PHE B 88 144.943 -9.672 2.707 1.00 0.00 C ATOM 2774 C PHE B 88 143.777 -9.458 1.744 1.00 0.00 C ATOM 2775 O PHE B 88 143.026 -10.369 1.462 1.00 0.00 O ATOM 2776 CB PHE B 88 145.174 -8.399 3.526 1.00 0.00 C ATOM 2777 CG PHE B 88 146.191 -8.686 4.604 1.00 0.00 C ATOM 2778 CD1 PHE B 88 145.790 -9.298 5.798 1.00 0.00 C ATOM 2779 CD2 PHE B 88 147.538 -8.354 4.407 1.00 0.00 C ATOM 2780 CE1 PHE B 88 146.733 -9.574 6.795 1.00 0.00 C ATOM 2781 CE2 PHE B 88 148.481 -8.631 5.403 1.00 0.00 C ATOM 2782 CZ PHE B 88 148.078 -9.241 6.597 1.00 0.00 C ATOM 0 H PHE B 88 146.629 -9.204 1.478 1.00 0.00 H new ATOM 0 HA PHE B 88 144.700 -10.502 3.370 1.00 0.00 H new ATOM 0 HB2 PHE B 88 145.527 -7.595 2.880 1.00 0.00 H new ATOM 0 HB3 PHE B 88 144.238 -8.063 3.972 1.00 0.00 H new ATOM 0 HD1 PHE B 88 144.753 -9.557 5.950 1.00 0.00 H new ATOM 0 HD2 PHE B 88 147.849 -7.884 3.486 1.00 0.00 H new ATOM 0 HE1 PHE B 88 146.423 -10.044 7.717 1.00 0.00 H new ATOM 0 HE2 PHE B 88 149.519 -8.374 5.251 1.00 0.00 H new ATOM 0 HZ PHE B 88 148.806 -9.455 7.366 1.00 0.00 H new ATOM 2792 N LEU B 89 143.612 -8.265 1.230 1.00 0.00 N ATOM 2793 CA LEU B 89 142.487 -8.002 0.281 1.00 0.00 C ATOM 2794 C LEU B 89 142.945 -8.328 -1.142 1.00 0.00 C ATOM 2795 O LEU B 89 142.672 -9.428 -1.594 1.00 0.00 O ATOM 2796 CB LEU B 89 142.089 -6.521 0.369 1.00 0.00 C ATOM 2797 CG LEU B 89 141.058 -6.173 -0.718 1.00 0.00 C ATOM 2798 CD1 LEU B 89 139.859 -7.130 -0.635 1.00 0.00 C ATOM 2799 CD2 LEU B 89 140.576 -4.731 -0.508 1.00 0.00 C ATOM 2800 OXT LEU B 89 143.557 -7.472 -1.755 1.00 0.00 O ATOM 0 H LEU B 89 144.208 -7.461 1.427 1.00 0.00 H new ATOM 0 HA LEU B 89 141.630 -8.624 0.538 1.00 0.00 H new ATOM 0 HB2 LEU B 89 141.673 -6.308 1.354 1.00 0.00 H new ATOM 0 HB3 LEU B 89 142.973 -5.894 0.254 1.00 0.00 H new ATOM 0 HG LEU B 89 141.522 -6.272 -1.699 1.00 0.00 H new ATOM 0 HD11 LEU B 89 139.135 -6.875 -1.409 1.00 0.00 H new ATOM 0 HD12 LEU B 89 140.201 -8.155 -0.781 1.00 0.00 H new ATOM 0 HD13 LEU B 89 139.389 -7.041 0.345 1.00 0.00 H new ATOM 0 HD21 LEU B 89 139.845 -4.477 -1.275 1.00 0.00 H new ATOM 0 HD22 LEU B 89 140.116 -4.641 0.476 1.00 0.00 H new ATOM 0 HD23 LEU B 89 141.425 -4.050 -0.576 1.00 0.00 H new TER 2812 LEU B 89