USER MOD reduce.3.24.130724 H: found=0, std=0, add=1300, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1298 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 171 HIS : no HD1:sc= -0.0101 X(o=-0.01,f=0.26) USER MOD Set 2.1: A 3 MET CE :methyl 177:sc= -0.352 (180deg=-0.374) USER MOD Set 2.2: A 168 MET CE :methyl 170:sc= -2.27 (180deg=-2.38) USER MOD Set 3.1: A 90 GLN :FLIP amide:sc= 0.793 F(o=0.54,f=2) USER MOD Set 3.2: A 148 ASN :FLIP amide:sc= 1.07 F(o=1.3,f=2) USER MOD Set 3.3: A 149 GLN :FLIP amide:sc= 0.121 F(o=1.3,f=2) USER MOD Set 4.1: A 105 HIS : no HD1:sc= -1.66 K(o=-1.7,f=-4.2!) USER MOD Set 4.2: A 118 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 10 SER OG : rot 145:sc= 0.851 USER MOD Set 5.2: A 62 GLN : amide:sc= -0.317 K(o=0.53,f=-3.6!) USER MOD Set 6.1: A 33 HIS : no HD1:sc= -0.175 X(o=-0.17,f=-0.16) USER MOD Set 6.2: A 46 TYR OH : rot 180:sc= 0 USER MOD Set 7.1: A 12 CYS SG : rot 180:sc=-0.00318 USER MOD Set 7.2: A 16 MET CE :methyl -168:sc= -0.571 (180deg=-0.785) USER MOD Set 8.1: A 9 SER OG : rot 130:sc= 0.043 USER MOD Set 8.2: A 34 ASN : amide:sc= 0.556 K(o=0.6,f=-8.2!) USER MOD Single : A 1 MET CE :methyl -173:sc= -4.6! (180deg=-5.06!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0.235 X(o=0.24,f=0) USER MOD Single : A 7 TYR OH : rot -178:sc= 1.26 USER MOD Single : A 11 THR OG1 : rot 171:sc= 2.2 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 171:sc= 0.0892 USER MOD Single : A 20 LYS NZ :NH3+ -170:sc= 1.35 (180deg=1.22) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -154:sc= 1.22 (180deg=0.83) USER MOD Single : A 43 MET CE :methyl 151:sc= -0.812 (180deg=-1.94) USER MOD Single : A 45 GLN : amide:sc= 0.488 X(o=0.49,f=0) USER MOD Single : A 55 THR OG1 : rot 77:sc= 0.353 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -163:sc= 2.17 (180deg=1.75) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 167:sc= -0.121 (180deg=-0.52) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= -0.0264 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 179:sc= 1.64 (180deg=1.62) USER MOD Single : A 121 THR OG1 : rot -160:sc= 0.269 USER MOD Single : A 127 THR OG1 : rot -37:sc= 0.038 USER MOD Single : A 128 SER OG : rot 140:sc= 0.00244 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 151:sc= 1.28 USER MOD Single : A 158 GLN : amide:sc= 0.245 X(o=0.24,f=-0.13) USER MOD Single : A 159 SER OG : rot 72:sc= 0.0802 USER MOD Single : A 161 CYS SG : rot 75:sc= -0.906 USER MOD Single : A 163 GLN : amide:sc= 1.44 K(o=1.4,f=-0.46) USER MOD Single : A 166 ASN : amide:sc= 0.979 K(o=0.98,f=0) USER MOD Single : A 172 TYR OH : rot -40:sc= 0.286 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.931 -0.224 -0.159 1.00 0.00 N ATOM 2 CA MET A 1 2.218 0.076 -1.601 1.00 0.00 C ATOM 3 C MET A 1 2.427 1.582 -1.829 1.00 0.00 C ATOM 4 O MET A 1 1.747 2.421 -1.244 1.00 0.00 O ATOM 5 CB MET A 1 1.124 -0.524 -2.544 1.00 0.00 C ATOM 6 CG MET A 1 1.054 0.003 -3.985 1.00 0.00 C ATOM 7 SD MET A 1 -0.485 -0.439 -4.835 1.00 0.00 S ATOM 8 CE MET A 1 -0.398 -2.258 -4.935 1.00 0.00 C ATOM 0 H1 MET A 1 1.795 -1.248 -0.038 1.00 0.00 H new ATOM 0 H2 MET A 1 2.731 0.091 0.427 1.00 0.00 H new ATOM 0 H3 MET A 1 1.068 0.277 0.135 1.00 0.00 H new ATOM 0 HA MET A 1 3.155 -0.416 -1.861 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.275 -1.603 -2.589 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.153 -0.357 -2.079 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.156 1.088 -3.973 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.899 -0.390 -4.550 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.223 -2.629 -5.543 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.548 -2.553 -5.388 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.468 -2.681 -3.933 1.00 0.00 H new ATOM 20 N ASN A 2 3.344 1.905 -2.750 1.00 0.00 N ATOM 21 CA ASN A 2 3.589 3.230 -3.320 1.00 0.00 C ATOM 22 C ASN A 2 3.621 3.047 -4.832 1.00 0.00 C ATOM 23 O ASN A 2 4.096 2.016 -5.306 1.00 0.00 O ATOM 24 CB ASN A 2 4.867 3.874 -2.760 1.00 0.00 C ATOM 25 CG ASN A 2 6.098 2.973 -2.617 1.00 0.00 C ATOM 26 OD1 ASN A 2 6.733 2.955 -1.566 1.00 0.00 O ATOM 27 ND2 ASN A 2 6.480 2.209 -3.632 1.00 0.00 N ATOM 0 H ASN A 2 3.972 1.202 -3.139 1.00 0.00 H new ATOM 0 HA ASN A 2 2.799 3.929 -3.045 1.00 0.00 H new ATOM 0 HB2 ASN A 2 5.134 4.712 -3.404 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.635 4.288 -1.779 1.00 0.00 H new ATOM 0 HD21 ASN A 2 7.299 1.609 -3.538 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.954 2.222 -4.506 1.00 0.00 H new ATOM 34 N MET A 3 3.118 4.019 -5.582 1.00 0.00 N ATOM 35 CA MET A 3 2.813 3.913 -7.001 1.00 0.00 C ATOM 36 C MET A 3 3.491 5.043 -7.760 1.00 0.00 C ATOM 37 O MET A 3 3.602 6.155 -7.250 1.00 0.00 O ATOM 38 CB MET A 3 1.287 3.944 -7.210 1.00 0.00 C ATOM 39 CG MET A 3 0.543 3.046 -6.206 1.00 0.00 C ATOM 40 SD MET A 3 -1.146 2.547 -6.627 1.00 0.00 S ATOM 41 CE MET A 3 -1.975 4.132 -6.863 1.00 0.00 C ATOM 0 H MET A 3 2.903 4.941 -5.201 1.00 0.00 H new ATOM 0 HA MET A 3 3.192 2.967 -7.386 1.00 0.00 H new ATOM 0 HB2 MET A 3 0.930 4.969 -7.112 1.00 0.00 H new ATOM 0 HB3 MET A 3 1.055 3.621 -8.225 1.00 0.00 H new ATOM 0 HG2 MET A 3 1.135 2.142 -6.060 1.00 0.00 H new ATOM 0 HG3 MET A 3 0.512 3.565 -5.248 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.005 3.961 -7.177 1.00 0.00 H new ATOM 0 HE2 MET A 3 -1.969 4.689 -5.926 1.00 0.00 H new ATOM 0 HE3 MET A 3 -1.453 4.705 -7.629 1.00 0.00 H new ATOM 51 N GLY A 4 3.911 4.774 -8.991 1.00 0.00 N ATOM 52 CA GLY A 4 4.644 5.744 -9.794 1.00 0.00 C ATOM 53 C GLY A 4 3.778 6.249 -10.933 1.00 0.00 C ATOM 54 O GLY A 4 3.424 5.459 -11.807 1.00 0.00 O ATOM 0 H GLY A 4 3.754 3.881 -9.458 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.958 6.580 -9.169 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.549 5.286 -10.192 1.00 0.00 H new ATOM 58 N LEU A 5 3.411 7.532 -10.942 1.00 0.00 N ATOM 59 CA LEU A 5 2.670 8.136 -12.046 1.00 0.00 C ATOM 60 C LEU A 5 3.630 8.688 -13.103 1.00 0.00 C ATOM 61 O LEU A 5 4.139 9.793 -12.971 1.00 0.00 O ATOM 62 CB LEU A 5 1.724 9.200 -11.477 1.00 0.00 C ATOM 63 CG LEU A 5 0.726 9.858 -12.454 1.00 0.00 C ATOM 64 CD1 LEU A 5 0.852 9.564 -13.956 1.00 0.00 C ATOM 65 CD2 LEU A 5 -0.674 9.433 -12.047 1.00 0.00 C ATOM 0 H LEU A 5 3.620 8.180 -10.183 1.00 0.00 H new ATOM 0 HA LEU A 5 2.065 7.387 -12.556 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.153 8.745 -10.668 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.332 9.989 -11.034 1.00 0.00 H new ATOM 0 HG LEU A 5 0.955 10.920 -12.363 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.076 10.104 -14.499 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.832 9.885 -14.309 1.00 0.00 H new ATOM 0 HD13 LEU A 5 0.738 8.494 -14.128 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.402 9.884 -12.722 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.754 8.347 -12.100 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.872 9.762 -11.027 1.00 0.00 H new ATOM 77 N PHE A 6 3.816 7.962 -14.195 1.00 0.00 N ATOM 78 CA PHE A 6 4.641 8.364 -15.333 1.00 0.00 C ATOM 79 C PHE A 6 3.795 8.914 -16.470 1.00 0.00 C ATOM 80 O PHE A 6 2.683 8.459 -16.721 1.00 0.00 O ATOM 81 CB PHE A 6 5.474 7.176 -15.804 1.00 0.00 C ATOM 82 CG PHE A 6 6.449 6.701 -14.761 1.00 0.00 C ATOM 83 CD1 PHE A 6 6.044 5.802 -13.762 1.00 0.00 C ATOM 84 CD2 PHE A 6 7.749 7.224 -14.747 1.00 0.00 C ATOM 85 CE1 PHE A 6 6.935 5.448 -12.739 1.00 0.00 C ATOM 86 CE2 PHE A 6 8.641 6.856 -13.736 1.00 0.00 C ATOM 87 CZ PHE A 6 8.238 5.972 -12.717 1.00 0.00 C ATOM 0 H PHE A 6 3.384 7.046 -14.321 1.00 0.00 H new ATOM 0 HA PHE A 6 5.306 9.165 -15.011 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.809 6.356 -16.074 1.00 0.00 H new ATOM 0 HB3 PHE A 6 6.020 7.455 -16.706 1.00 0.00 H new ATOM 0 HD1 PHE A 6 5.048 5.384 -13.781 1.00 0.00 H new ATOM 0 HD2 PHE A 6 8.062 7.912 -15.518 1.00 0.00 H new ATOM 0 HE1 PHE A 6 6.617 4.768 -11.963 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.646 7.252 -13.736 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.923 5.700 -11.927 1.00 0.00 H new ATOM 97 N TYR A 7 4.339 9.879 -17.198 1.00 0.00 N ATOM 98 CA TYR A 7 3.692 10.511 -18.345 1.00 0.00 C ATOM 99 C TYR A 7 4.732 11.268 -19.167 1.00 0.00 C ATOM 100 O TYR A 7 5.877 11.417 -18.738 1.00 0.00 O ATOM 101 CB TYR A 7 2.616 11.490 -17.847 1.00 0.00 C ATOM 102 CG TYR A 7 3.174 12.633 -17.028 1.00 0.00 C ATOM 103 CD1 TYR A 7 3.483 12.430 -15.671 1.00 0.00 C ATOM 104 CD2 TYR A 7 3.440 13.877 -17.628 1.00 0.00 C ATOM 105 CE1 TYR A 7 4.024 13.467 -14.901 1.00 0.00 C ATOM 106 CE2 TYR A 7 3.962 14.921 -16.852 1.00 0.00 C ATOM 107 CZ TYR A 7 4.251 14.729 -15.481 1.00 0.00 C ATOM 108 OH TYR A 7 4.767 15.722 -14.709 1.00 0.00 O ATOM 0 H TYR A 7 5.267 10.256 -17.004 1.00 0.00 H new ATOM 0 HA TYR A 7 3.228 9.746 -18.968 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.080 11.896 -18.705 1.00 0.00 H new ATOM 0 HB3 TYR A 7 1.889 10.944 -17.246 1.00 0.00 H new ATOM 0 HD1 TYR A 7 3.301 11.466 -15.219 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.243 14.027 -18.679 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.267 13.298 -13.862 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.146 15.883 -17.306 1.00 0.00 H new ATOM 0 HH TYR A 7 4.839 16.544 -15.238 1.00 0.00 H new ATOM 118 N GLY A 8 4.312 11.793 -20.318 1.00 0.00 N ATOM 119 CA GLY A 8 5.077 12.732 -21.127 1.00 0.00 C ATOM 120 C GLY A 8 4.074 13.690 -21.754 1.00 0.00 C ATOM 121 O GLY A 8 2.971 13.272 -22.106 1.00 0.00 O ATOM 0 H GLY A 8 3.403 11.568 -20.722 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.797 13.273 -20.514 1.00 0.00 H new ATOM 0 HA3 GLY A 8 5.644 12.207 -21.896 1.00 0.00 H new ATOM 125 N SER A 9 4.411 14.972 -21.817 1.00 0.00 N ATOM 126 CA SER A 9 3.522 16.042 -22.231 1.00 0.00 C ATOM 127 C SER A 9 4.248 17.012 -23.168 1.00 0.00 C ATOM 128 O SER A 9 5.358 17.456 -22.867 1.00 0.00 O ATOM 129 CB SER A 9 3.007 16.733 -20.958 1.00 0.00 C ATOM 130 OG SER A 9 4.061 16.930 -20.019 1.00 0.00 O ATOM 0 H SER A 9 5.344 15.303 -21.572 1.00 0.00 H new ATOM 0 HA SER A 9 2.675 15.653 -22.796 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.562 17.694 -21.217 1.00 0.00 H new ATOM 0 HB3 SER A 9 2.221 16.129 -20.505 1.00 0.00 H new ATOM 0 HG SER A 9 4.059 17.862 -19.716 1.00 0.00 H new ATOM 136 N SER A 10 3.602 17.366 -24.280 1.00 0.00 N ATOM 137 CA SER A 10 4.096 18.363 -25.223 1.00 0.00 C ATOM 138 C SER A 10 3.648 19.755 -24.769 1.00 0.00 C ATOM 139 O SER A 10 4.435 20.707 -24.800 1.00 0.00 O ATOM 140 CB SER A 10 3.550 18.061 -26.622 1.00 0.00 C ATOM 141 OG SER A 10 3.417 16.663 -26.832 1.00 0.00 O ATOM 0 H SER A 10 2.707 16.960 -24.552 1.00 0.00 H new ATOM 0 HA SER A 10 5.185 18.332 -25.256 1.00 0.00 H new ATOM 0 HB2 SER A 10 2.581 18.544 -26.749 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.217 18.482 -27.374 1.00 0.00 H new ATOM 0 HG SER A 10 2.631 16.489 -27.390 1.00 0.00 H new ATOM 147 N THR A 11 2.391 19.858 -24.327 1.00 0.00 N ATOM 148 CA THR A 11 1.736 21.091 -23.944 1.00 0.00 C ATOM 149 C THR A 11 1.848 21.196 -22.415 1.00 0.00 C ATOM 150 O THR A 11 2.786 21.801 -21.888 1.00 0.00 O ATOM 151 CB THR A 11 0.304 21.084 -24.522 1.00 0.00 C ATOM 152 OG1 THR A 11 -0.392 19.951 -24.039 1.00 0.00 O ATOM 153 CG2 THR A 11 0.289 20.943 -26.043 1.00 0.00 C ATOM 0 H THR A 11 1.785 19.044 -24.226 1.00 0.00 H new ATOM 0 HA THR A 11 2.196 21.992 -24.351 1.00 0.00 H new ATOM 0 HB THR A 11 -0.149 22.030 -24.224 1.00 0.00 H new ATOM 0 HG1 THR A 11 -1.337 20.016 -24.291 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.741 20.944 -26.398 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.828 21.778 -26.491 1.00 0.00 H new ATOM 0 HG23 THR A 11 0.770 20.007 -26.326 1.00 0.00 H new ATOM 161 N CYS A 12 0.912 20.543 -21.719 1.00 0.00 N ATOM 162 CA CYS A 12 0.801 20.399 -20.274 1.00 0.00 C ATOM 163 C CYS A 12 -0.353 19.462 -19.872 1.00 0.00 C ATOM 164 O CYS A 12 -0.510 19.172 -18.692 1.00 0.00 O ATOM 165 CB CYS A 12 0.579 21.779 -19.621 1.00 0.00 C ATOM 166 SG CYS A 12 -0.743 22.727 -20.450 1.00 0.00 S ATOM 0 H CYS A 12 0.150 20.063 -22.198 1.00 0.00 H new ATOM 0 HA CYS A 12 1.734 19.959 -19.922 1.00 0.00 H new ATOM 0 HB2 CYS A 12 0.324 21.645 -18.570 1.00 0.00 H new ATOM 0 HB3 CYS A 12 1.508 22.349 -19.654 1.00 0.00 H new ATOM 0 HG CYS A 12 -0.889 23.876 -19.860 1.00 0.00 H new ATOM 172 N TYR A 13 -1.190 18.974 -20.793 1.00 0.00 N ATOM 173 CA TYR A 13 -2.434 18.290 -20.413 1.00 0.00 C ATOM 174 C TYR A 13 -2.151 16.962 -19.723 1.00 0.00 C ATOM 175 O TYR A 13 -2.779 16.640 -18.719 1.00 0.00 O ATOM 176 CB TYR A 13 -3.352 18.076 -21.624 1.00 0.00 C ATOM 177 CG TYR A 13 -3.460 19.213 -22.619 1.00 0.00 C ATOM 178 CD1 TYR A 13 -3.663 20.536 -22.186 1.00 0.00 C ATOM 179 CD2 TYR A 13 -3.349 18.931 -23.993 1.00 0.00 C ATOM 180 CE1 TYR A 13 -3.725 21.586 -23.117 1.00 0.00 C ATOM 181 CE2 TYR A 13 -3.407 19.983 -24.929 1.00 0.00 C ATOM 182 CZ TYR A 13 -3.594 21.315 -24.497 1.00 0.00 C ATOM 183 OH TYR A 13 -3.641 22.324 -25.416 1.00 0.00 O ATOM 0 H TYR A 13 -1.033 19.038 -21.799 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.950 18.939 -19.706 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -3.006 17.191 -22.158 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.353 17.854 -21.254 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -3.772 20.746 -21.132 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -3.220 17.913 -24.329 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -3.873 22.601 -22.778 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -3.308 19.770 -25.983 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.532 21.952 -26.316 1.00 0.00 H new ATOM 193 N THR A 14 -1.168 16.208 -20.223 1.00 0.00 N ATOM 194 CA THR A 14 -0.801 14.913 -19.647 1.00 0.00 C ATOM 195 C THR A 14 -0.211 15.145 -18.254 1.00 0.00 C ATOM 196 O THR A 14 -0.467 14.384 -17.328 1.00 0.00 O ATOM 197 CB THR A 14 0.168 14.147 -20.569 1.00 0.00 C ATOM 198 OG1 THR A 14 0.170 14.716 -21.866 1.00 0.00 O ATOM 199 CG2 THR A 14 -0.213 12.679 -20.719 1.00 0.00 C ATOM 0 H THR A 14 -0.608 16.476 -21.032 1.00 0.00 H new ATOM 0 HA THR A 14 -1.688 14.287 -19.552 1.00 0.00 H new ATOM 0 HB THR A 14 1.151 14.219 -20.103 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.890 14.317 -22.397 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.500 12.184 -21.378 1.00 0.00 H new ATOM 0 HG22 THR A 14 -0.199 12.198 -19.741 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.213 12.604 -21.146 1.00 0.00 H new ATOM 207 N GLU A 15 0.510 16.258 -18.095 1.00 0.00 N ATOM 208 CA GLU A 15 1.096 16.669 -16.840 1.00 0.00 C ATOM 209 C GLU A 15 -0.003 16.977 -15.830 1.00 0.00 C ATOM 210 O GLU A 15 -0.004 16.436 -14.731 1.00 0.00 O ATOM 211 CB GLU A 15 2.048 17.847 -17.113 1.00 0.00 C ATOM 212 CG GLU A 15 2.783 18.319 -15.853 1.00 0.00 C ATOM 213 CD GLU A 15 4.224 18.761 -16.163 1.00 0.00 C ATOM 214 OE1 GLU A 15 5.129 17.889 -16.126 1.00 0.00 O ATOM 215 OE2 GLU A 15 4.458 19.962 -16.436 1.00 0.00 O1- ATOM 0 H GLU A 15 0.700 16.905 -18.860 1.00 0.00 H new ATOM 0 HA GLU A 15 1.689 15.872 -16.392 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.779 17.551 -17.865 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.480 18.679 -17.530 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.237 19.149 -15.403 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.800 17.513 -15.119 1.00 0.00 H new ATOM 222 N MET A 16 -1.002 17.762 -16.222 1.00 0.00 N ATOM 223 CA MET A 16 -2.090 18.108 -15.320 1.00 0.00 C ATOM 224 C MET A 16 -2.935 16.887 -14.971 1.00 0.00 C ATOM 225 O MET A 16 -3.345 16.738 -13.825 1.00 0.00 O ATOM 226 CB MET A 16 -2.944 19.244 -15.909 1.00 0.00 C ATOM 227 CG MET A 16 -2.155 20.549 -16.076 1.00 0.00 C ATOM 228 SD MET A 16 -3.098 21.928 -16.775 1.00 0.00 S ATOM 229 CE MET A 16 -3.383 21.286 -18.448 1.00 0.00 C ATOM 0 H MET A 16 -1.079 18.168 -17.155 1.00 0.00 H new ATOM 0 HA MET A 16 -1.655 18.469 -14.388 1.00 0.00 H new ATOM 0 HB2 MET A 16 -3.336 18.934 -16.878 1.00 0.00 H new ATOM 0 HB3 MET A 16 -3.802 19.423 -15.260 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.768 20.849 -15.102 1.00 0.00 H new ATOM 0 HG3 MET A 16 -1.294 20.356 -16.716 1.00 0.00 H new ATOM 0 HE1 MET A 16 -3.762 22.085 -19.085 1.00 0.00 H new ATOM 0 HE2 MET A 16 -2.446 20.909 -18.858 1.00 0.00 H new ATOM 0 HE3 MET A 16 -4.112 20.477 -18.408 1.00 0.00 H new ATOM 239 N ALA A 17 -3.154 15.975 -15.915 1.00 0.00 N ATOM 240 CA ALA A 17 -3.852 14.730 -15.636 1.00 0.00 C ATOM 241 C ALA A 17 -3.073 13.889 -14.625 1.00 0.00 C ATOM 242 O ALA A 17 -3.668 13.403 -13.670 1.00 0.00 O ATOM 243 CB ALA A 17 -4.142 13.973 -16.932 1.00 0.00 C ATOM 0 H ALA A 17 -2.855 16.079 -16.885 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.816 14.958 -15.180 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.665 13.045 -16.702 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.765 14.588 -17.581 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.204 13.745 -17.438 1.00 0.00 H new ATOM 249 N ALA A 18 -1.756 13.776 -14.778 1.00 0.00 N ATOM 250 CA ALA A 18 -0.878 13.054 -13.868 1.00 0.00 C ATOM 251 C ALA A 18 -0.982 13.601 -12.448 1.00 0.00 C ATOM 252 O ALA A 18 -1.120 12.829 -11.497 1.00 0.00 O ATOM 253 CB ALA A 18 0.557 13.171 -14.392 1.00 0.00 C ATOM 0 H ALA A 18 -1.258 14.197 -15.562 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.177 12.007 -13.828 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.233 12.636 -13.724 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.616 12.738 -15.391 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.844 14.222 -14.434 1.00 0.00 H new ATOM 259 N GLU A 19 -0.969 14.927 -12.313 1.00 0.00 N ATOM 260 CA GLU A 19 -1.124 15.624 -11.038 1.00 0.00 C ATOM 261 C GLU A 19 -2.448 15.241 -10.419 1.00 0.00 C ATOM 262 O GLU A 19 -2.505 14.853 -9.254 1.00 0.00 O ATOM 263 CB GLU A 19 -1.114 17.153 -11.224 1.00 0.00 C ATOM 264 CG GLU A 19 0.212 17.675 -11.757 1.00 0.00 C ATOM 265 CD GLU A 19 1.253 17.911 -10.653 1.00 0.00 C ATOM 266 OE1 GLU A 19 1.340 17.076 -9.722 1.00 0.00 O1- ATOM 267 OE2 GLU A 19 1.970 18.940 -10.700 1.00 0.00 O ATOM 0 H GLU A 19 -0.848 15.559 -13.104 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.288 15.337 -10.400 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -1.912 17.436 -11.910 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -1.330 17.632 -10.269 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.612 16.963 -12.479 1.00 0.00 H new ATOM 0 HG3 GLU A 19 0.040 18.609 -12.292 1.00 0.00 H new ATOM 274 N LYS A 20 -3.495 15.314 -11.238 1.00 0.00 N ATOM 275 CA LYS A 20 -4.861 15.071 -10.830 1.00 0.00 C ATOM 276 C LYS A 20 -4.948 13.669 -10.300 1.00 0.00 C ATOM 277 O LYS A 20 -5.310 13.504 -9.146 1.00 0.00 O ATOM 278 CB LYS A 20 -5.835 15.351 -11.986 1.00 0.00 C ATOM 279 CG LYS A 20 -6.034 16.860 -12.178 1.00 0.00 C ATOM 280 CD LYS A 20 -6.697 17.115 -13.536 1.00 0.00 C ATOM 281 CE LYS A 20 -6.712 18.595 -13.941 1.00 0.00 C ATOM 282 NZ LYS A 20 -7.508 19.449 -13.016 1.00 0.00 N1+ ATOM 0 H LYS A 20 -3.406 15.550 -12.226 1.00 0.00 H new ATOM 0 HA LYS A 20 -5.157 15.754 -10.033 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.451 14.910 -12.906 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.795 14.876 -11.782 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.654 17.261 -11.377 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.074 17.374 -12.127 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.172 16.542 -14.301 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.722 16.744 -13.507 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.688 18.966 -13.976 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.118 18.685 -14.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.621 20.397 -13.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.444 19.021 -12.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.015 19.526 -12.104 1.00 0.00 H new ATOM 296 N ILE A 21 -4.563 12.670 -11.090 1.00 0.00 N ATOM 297 CA ILE A 21 -4.628 11.271 -10.674 1.00 0.00 C ATOM 298 C ILE A 21 -3.966 11.099 -9.306 1.00 0.00 C ATOM 299 O ILE A 21 -4.589 10.594 -8.377 1.00 0.00 O ATOM 300 CB ILE A 21 -3.940 10.400 -11.739 1.00 0.00 C ATOM 301 CG1 ILE A 21 -4.775 10.244 -13.017 1.00 0.00 C ATOM 302 CG2 ILE A 21 -3.667 8.999 -11.188 1.00 0.00 C ATOM 303 CD1 ILE A 21 -3.898 10.213 -14.268 1.00 0.00 C ATOM 0 H ILE A 21 -4.199 12.806 -12.033 1.00 0.00 H new ATOM 0 HA ILE A 21 -5.668 10.957 -10.581 1.00 0.00 H new ATOM 0 HB ILE A 21 -3.012 10.915 -11.990 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -5.359 9.325 -12.960 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.484 11.068 -13.091 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -3.180 8.395 -11.954 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -3.018 9.071 -10.316 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.609 8.531 -10.901 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.527 10.101 -15.151 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.334 11.143 -14.340 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.207 9.373 -14.207 1.00 0.00 H new ATOM 315 N ARG A 22 -2.700 11.505 -9.191 1.00 0.00 N ATOM 316 CA ARG A 22 -1.908 11.385 -7.968 1.00 0.00 C ATOM 317 C ARG A 22 -2.639 12.021 -6.802 1.00 0.00 C ATOM 318 O ARG A 22 -2.669 11.446 -5.720 1.00 0.00 O ATOM 319 CB ARG A 22 -0.525 12.011 -8.270 1.00 0.00 C ATOM 320 CG ARG A 22 0.451 12.318 -7.116 1.00 0.00 C ATOM 321 CD ARG A 22 0.136 13.568 -6.282 1.00 0.00 C ATOM 322 NE ARG A 22 0.023 14.788 -7.096 1.00 0.00 N ATOM 323 CZ ARG A 22 -0.256 16.027 -6.643 1.00 0.00 C ATOM 324 NH1 ARG A 22 -0.649 16.237 -5.387 1.00 0.00 N1+ ATOM 325 NH2 ARG A 22 -0.140 17.073 -7.447 1.00 0.00 N ATOM 0 H ARG A 22 -2.188 11.935 -9.961 1.00 0.00 H new ATOM 0 HA ARG A 22 -1.759 10.348 -7.667 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.011 11.343 -8.961 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.701 12.945 -8.803 1.00 0.00 H new ATOM 0 HG2 ARG A 22 0.475 11.457 -6.448 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.452 12.426 -7.533 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -0.797 13.411 -5.741 1.00 0.00 H new ATOM 0 HD3 ARG A 22 0.918 13.707 -5.536 1.00 0.00 H new ATOM 0 HE ARG A 22 0.170 14.687 -8.100 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -0.745 15.451 -4.744 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -0.854 17.184 -5.068 1.00 0.00 H new ATOM 0 HH21 ARG A 22 0.161 16.943 -8.413 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -0.352 18.009 -7.100 1.00 0.00 H new ATOM 339 N ASP A 23 -3.222 13.187 -7.024 1.00 0.00 N ATOM 340 CA ASP A 23 -3.887 13.953 -5.980 1.00 0.00 C ATOM 341 C ASP A 23 -5.194 13.279 -5.547 1.00 0.00 C ATOM 342 O ASP A 23 -5.476 13.169 -4.352 1.00 0.00 O ATOM 343 CB ASP A 23 -4.166 15.380 -6.451 1.00 0.00 C ATOM 344 CG ASP A 23 -4.846 16.177 -5.325 1.00 0.00 C ATOM 345 OD1 ASP A 23 -4.142 16.561 -4.361 1.00 0.00 O ATOM 346 OD2 ASP A 23 -6.068 16.440 -5.414 1.00 0.00 O1- ATOM 0 H ASP A 23 -3.248 13.633 -7.941 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.218 13.990 -5.120 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.234 15.866 -6.741 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -4.805 15.363 -7.334 1.00 0.00 H new ATOM 351 N ILE A 24 -5.964 12.787 -6.522 1.00 0.00 N ATOM 352 CA ILE A 24 -7.251 12.136 -6.319 1.00 0.00 C ATOM 353 C ILE A 24 -7.029 10.832 -5.541 1.00 0.00 C ATOM 354 O ILE A 24 -7.703 10.572 -4.543 1.00 0.00 O ATOM 355 CB ILE A 24 -7.976 11.918 -7.676 1.00 0.00 C ATOM 356 CG1 ILE A 24 -8.330 13.236 -8.420 1.00 0.00 C ATOM 357 CG2 ILE A 24 -9.275 11.116 -7.469 1.00 0.00 C ATOM 358 CD1 ILE A 24 -8.252 13.121 -9.946 1.00 0.00 C ATOM 0 H ILE A 24 -5.695 12.835 -7.505 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.909 12.772 -5.727 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.267 11.370 -8.296 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.337 13.543 -8.138 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.653 14.023 -8.089 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.771 10.972 -8.429 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.038 10.145 -7.034 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.937 11.663 -6.797 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.512 14.079 -10.397 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.239 12.845 -10.239 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -8.950 12.357 -10.289 1.00 0.00 H new ATOM 370 N ILE A 25 -6.082 10.014 -6.004 1.00 0.00 N ATOM 371 CA ILE A 25 -5.826 8.680 -5.479 1.00 0.00 C ATOM 372 C ILE A 25 -5.178 8.770 -4.105 1.00 0.00 C ATOM 373 O ILE A 25 -5.654 8.152 -3.150 1.00 0.00 O ATOM 374 CB ILE A 25 -4.988 7.905 -6.512 1.00 0.00 C ATOM 375 CG1 ILE A 25 -5.885 7.644 -7.731 1.00 0.00 C ATOM 376 CG2 ILE A 25 -4.395 6.588 -5.988 1.00 0.00 C ATOM 377 CD1 ILE A 25 -5.161 6.905 -8.840 1.00 0.00 C ATOM 0 H ILE A 25 -5.461 10.270 -6.771 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.754 8.129 -5.329 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.122 8.516 -6.767 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.754 7.064 -7.420 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.256 8.594 -8.115 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.820 6.107 -6.780 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.742 6.795 -5.140 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.201 5.926 -5.672 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.842 6.747 -9.677 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.307 7.495 -9.173 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.813 5.941 -8.468 1.00 0.00 H new ATOM 389 N GLY A 26 -4.101 9.542 -4.012 1.00 0.00 N ATOM 390 CA GLY A 26 -3.431 9.813 -2.757 1.00 0.00 C ATOM 391 C GLY A 26 -1.982 10.194 -3.004 1.00 0.00 C ATOM 392 O GLY A 26 -1.188 9.323 -3.359 1.00 0.00 O ATOM 0 H GLY A 26 -3.669 9.999 -4.815 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.942 10.620 -2.231 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.478 8.934 -2.114 1.00 0.00 H new ATOM 396 N PRO A 27 -1.577 11.447 -2.741 1.00 0.00 N ATOM 397 CA PRO A 27 -0.186 11.888 -2.881 1.00 0.00 C ATOM 398 C PRO A 27 0.754 11.230 -1.845 1.00 0.00 C ATOM 399 O PRO A 27 1.964 11.448 -1.866 1.00 0.00 O ATOM 400 CB PRO A 27 -0.258 13.410 -2.698 1.00 0.00 C ATOM 401 CG PRO A 27 -1.438 13.599 -1.757 1.00 0.00 C ATOM 402 CD PRO A 27 -2.410 12.535 -2.240 1.00 0.00 C ATOM 0 HA PRO A 27 0.236 11.599 -3.844 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.663 13.807 -2.271 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.416 13.921 -3.648 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.155 13.449 -0.715 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.861 14.601 -1.831 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -3.055 12.195 -1.429 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -3.061 12.924 -3.023 1.00 0.00 H new ATOM 410 N GLU A 28 0.194 10.434 -0.927 1.00 0.00 N ATOM 411 CA GLU A 28 0.899 9.752 0.151 1.00 0.00 C ATOM 412 C GLU A 28 1.653 8.546 -0.413 1.00 0.00 C ATOM 413 O GLU A 28 2.723 8.177 0.072 1.00 0.00 O ATOM 414 CB GLU A 28 -0.092 9.254 1.227 1.00 0.00 C ATOM 415 CG GLU A 28 -1.398 10.049 1.340 1.00 0.00 C ATOM 416 CD GLU A 28 -2.220 9.622 2.571 1.00 0.00 C ATOM 417 OE1 GLU A 28 -2.023 10.198 3.667 1.00 0.00 O1- ATOM 418 OE2 GLU A 28 -3.080 8.718 2.442 1.00 0.00 O ATOM 0 H GLU A 28 -0.808 10.243 -0.920 1.00 0.00 H new ATOM 0 HA GLU A 28 1.594 10.459 0.604 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.338 8.213 1.016 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.409 9.273 2.195 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.172 11.113 1.405 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -1.992 9.904 0.438 1.00 0.00 H new ATOM 425 N LEU A 29 1.046 7.919 -1.428 1.00 0.00 N ATOM 426 CA LEU A 29 1.475 6.685 -2.047 1.00 0.00 C ATOM 427 C LEU A 29 1.817 6.928 -3.508 1.00 0.00 C ATOM 428 O LEU A 29 2.660 6.206 -4.014 1.00 0.00 O ATOM 429 CB LEU A 29 0.428 5.575 -1.836 1.00 0.00 C ATOM 430 CG LEU A 29 -1.020 5.898 -2.274 1.00 0.00 C ATOM 431 CD1 LEU A 29 -1.606 4.706 -3.029 1.00 0.00 C ATOM 432 CD2 LEU A 29 -1.924 6.231 -1.085 1.00 0.00 C ATOM 0 H LEU A 29 0.197 8.290 -1.854 1.00 0.00 H new ATOM 0 HA LEU A 29 2.387 6.330 -1.567 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.758 4.688 -2.377 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.414 5.316 -0.777 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.977 6.776 -2.918 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.626 4.936 -3.337 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.999 4.500 -3.911 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.611 3.831 -2.379 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.930 6.451 -1.443 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.959 5.380 -0.405 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.528 7.100 -0.559 1.00 0.00 H new ATOM 444 N VAL A 30 1.231 7.910 -4.196 1.00 0.00 N ATOM 445 CA VAL A 30 1.559 8.165 -5.599 1.00 0.00 C ATOM 446 C VAL A 30 2.657 9.228 -5.680 1.00 0.00 C ATOM 447 O VAL A 30 2.599 10.223 -4.961 1.00 0.00 O ATOM 448 CB VAL A 30 0.296 8.542 -6.394 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.616 8.711 -7.898 1.00 0.00 C ATOM 450 CG2 VAL A 30 -0.823 7.513 -6.221 1.00 0.00 C ATOM 0 H VAL A 30 0.530 8.539 -3.806 1.00 0.00 H new ATOM 0 HA VAL A 30 1.947 7.257 -6.061 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.052 9.493 -5.991 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.294 8.977 -8.436 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.357 9.500 -8.026 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.011 7.775 -8.293 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.693 7.821 -6.800 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.480 6.540 -6.572 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.094 7.444 -5.167 1.00 0.00 H new ATOM 460 N THR A 31 3.613 9.049 -6.599 1.00 0.00 N ATOM 461 CA THR A 31 4.663 10.002 -6.908 1.00 0.00 C ATOM 462 C THR A 31 4.711 10.122 -8.424 1.00 0.00 C ATOM 463 O THR A 31 4.696 9.085 -9.079 1.00 0.00 O ATOM 464 CB THR A 31 5.988 9.516 -6.284 1.00 0.00 C ATOM 465 OG1 THR A 31 5.844 9.320 -4.885 1.00 0.00 O ATOM 466 CG2 THR A 31 7.142 10.504 -6.495 1.00 0.00 C ATOM 0 H THR A 31 3.671 8.202 -7.164 1.00 0.00 H new ATOM 0 HA THR A 31 4.478 10.991 -6.488 1.00 0.00 H new ATOM 0 HB THR A 31 6.225 8.580 -6.789 1.00 0.00 H new ATOM 0 HG1 THR A 31 6.694 9.010 -4.509 1.00 0.00 H new ATOM 0 HG21 THR A 31 8.048 10.109 -6.035 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.309 10.645 -7.563 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.890 11.461 -6.037 1.00 0.00 H new ATOM 474 N LEU A 32 4.691 11.336 -8.992 1.00 0.00 N ATOM 475 CA LEU A 32 4.646 11.537 -10.436 1.00 0.00 C ATOM 476 C LEU A 32 6.005 11.897 -11.032 1.00 0.00 C ATOM 477 O LEU A 32 6.874 12.423 -10.336 1.00 0.00 O ATOM 478 CB LEU A 32 3.481 12.421 -10.899 1.00 0.00 C ATOM 479 CG LEU A 32 3.747 13.928 -10.895 1.00 0.00 C ATOM 480 CD1 LEU A 32 2.592 14.597 -11.639 1.00 0.00 C ATOM 481 CD2 LEU A 32 3.877 14.456 -9.472 1.00 0.00 C ATOM 0 H LEU A 32 4.706 12.204 -8.457 1.00 0.00 H new ATOM 0 HA LEU A 32 4.413 10.563 -10.866 1.00 0.00 H new ATOM 0 HB2 LEU A 32 3.203 12.123 -11.910 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.621 12.221 -10.260 1.00 0.00 H new ATOM 0 HG LEU A 32 4.691 14.152 -11.392 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.747 15.676 -11.657 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.550 14.219 -12.661 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.654 14.374 -11.131 1.00 0.00 H new ATOM 0 HD21 LEU A 32 4.066 15.529 -9.498 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.953 14.263 -8.927 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.705 13.954 -8.972 1.00 0.00 H new ATOM 493 N HIS A 33 6.153 11.626 -12.332 1.00 0.00 N ATOM 494 CA HIS A 33 7.413 11.620 -13.044 1.00 0.00 C ATOM 495 C HIS A 33 7.176 12.059 -14.481 1.00 0.00 C ATOM 496 O HIS A 33 6.521 11.332 -15.237 1.00 0.00 O ATOM 497 CB HIS A 33 7.963 10.186 -13.044 1.00 0.00 C ATOM 498 CG HIS A 33 8.290 9.652 -11.674 1.00 0.00 C ATOM 499 ND1 HIS A 33 9.394 10.021 -10.903 1.00 0.00 N ATOM 500 CD2 HIS A 33 7.513 8.778 -10.967 1.00 0.00 C ATOM 501 CE1 HIS A 33 9.250 9.364 -9.740 1.00 0.00 C ATOM 502 NE2 HIS A 33 8.138 8.605 -9.753 1.00 0.00 N ATOM 0 H HIS A 33 5.360 11.397 -12.932 1.00 0.00 H new ATOM 0 HA HIS A 33 8.120 12.298 -12.565 1.00 0.00 H new ATOM 0 HB2 HIS A 33 7.232 9.528 -13.514 1.00 0.00 H new ATOM 0 HB3 HIS A 33 8.862 10.153 -13.659 1.00 0.00 H new ATOM 0 HD2 HIS A 33 6.594 8.316 -11.295 1.00 0.00 H new ATOM 0 HE1 HIS A 33 9.934 9.435 -8.907 1.00 0.00 H new ATOM 0 HE2 HIS A 33 7.815 8.005 -8.994 1.00 0.00 H new ATOM 510 N ASN A 34 7.708 13.214 -14.887 1.00 0.00 N ATOM 511 CA ASN A 34 7.688 13.589 -16.287 1.00 0.00 C ATOM 512 C ASN A 34 8.853 12.919 -16.991 1.00 0.00 C ATOM 513 O ASN A 34 10.012 13.282 -16.785 1.00 0.00 O ATOM 514 CB ASN A 34 7.741 15.095 -16.502 1.00 0.00 C ATOM 515 CG ASN A 34 7.275 15.372 -17.922 1.00 0.00 C ATOM 516 OD1 ASN A 34 7.627 14.683 -18.870 1.00 0.00 O ATOM 517 ND2 ASN A 34 6.451 16.373 -18.096 1.00 0.00 N ATOM 0 H ASN A 34 8.151 13.893 -14.268 1.00 0.00 H new ATOM 0 HA ASN A 34 6.739 13.253 -16.706 1.00 0.00 H new ATOM 0 HB2 ASN A 34 7.102 15.607 -15.782 1.00 0.00 H new ATOM 0 HB3 ASN A 34 8.754 15.468 -16.352 1.00 0.00 H new ATOM 0 HD21 ASN A 34 6.096 16.585 -19.028 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.164 16.941 -17.299 1.00 0.00 H new ATOM 524 N LEU A 35 8.540 11.984 -17.876 1.00 0.00 N ATOM 525 CA LEU A 35 9.526 11.206 -18.627 1.00 0.00 C ATOM 526 C LEU A 35 10.385 12.061 -19.568 1.00 0.00 C ATOM 527 O LEU A 35 11.395 11.570 -20.075 1.00 0.00 O ATOM 528 CB LEU A 35 8.834 10.077 -19.396 1.00 0.00 C ATOM 529 CG LEU A 35 8.351 8.950 -18.469 1.00 0.00 C ATOM 530 CD1 LEU A 35 7.409 8.051 -19.261 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.510 8.119 -17.903 1.00 0.00 C ATOM 0 H LEU A 35 7.576 11.737 -18.100 1.00 0.00 H new ATOM 0 HA LEU A 35 10.213 10.779 -17.896 1.00 0.00 H new ATOM 0 HB2 LEU A 35 7.984 10.482 -19.945 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.524 9.667 -20.134 1.00 0.00 H new ATOM 0 HG LEU A 35 7.841 9.400 -17.617 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.054 7.243 -18.621 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.559 8.635 -19.613 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.940 7.631 -20.115 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.114 7.337 -17.255 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.066 7.664 -18.723 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.174 8.765 -17.328 1.00 0.00 H new ATOM 543 N LYS A 36 10.040 13.340 -19.786 1.00 0.00 N ATOM 544 CA LYS A 36 10.928 14.277 -20.472 1.00 0.00 C ATOM 545 C LYS A 36 12.281 14.407 -19.758 1.00 0.00 C ATOM 546 O LYS A 36 13.286 14.713 -20.401 1.00 0.00 O ATOM 547 CB LYS A 36 10.252 15.620 -20.738 1.00 0.00 C ATOM 548 CG LYS A 36 10.297 16.470 -19.487 1.00 0.00 C ATOM 549 CD LYS A 36 9.406 17.698 -19.589 1.00 0.00 C ATOM 550 CE LYS A 36 9.419 18.143 -18.137 1.00 0.00 C ATOM 551 NZ LYS A 36 8.722 19.442 -17.901 1.00 0.00 N1+ ATOM 0 H LYS A 36 9.150 13.744 -19.495 1.00 0.00 H new ATOM 0 HA LYS A 36 11.146 13.859 -21.455 1.00 0.00 H new ATOM 0 HB2 LYS A 36 10.754 16.135 -21.557 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.218 15.463 -21.046 1.00 0.00 H new ATOM 0 HG2 LYS A 36 9.987 15.870 -18.632 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.324 16.784 -19.301 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.811 18.454 -20.262 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.404 17.459 -19.944 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.949 17.372 -17.526 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.453 18.229 -17.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 8.770 19.683 -16.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.183 20.190 -18.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 7.726 19.359 -18.190 1.00 0.00 H new ATOM 565 N ASP A 37 12.295 14.212 -18.436 1.00 0.00 N ATOM 566 CA ASP A 37 13.451 14.440 -17.572 1.00 0.00 C ATOM 567 C ASP A 37 13.727 13.236 -16.665 1.00 0.00 C ATOM 568 O ASP A 37 14.889 12.929 -16.391 1.00 0.00 O ATOM 569 CB ASP A 37 13.204 15.682 -16.712 1.00 0.00 C ATOM 570 CG ASP A 37 14.402 15.955 -15.786 1.00 0.00 C ATOM 571 OD1 ASP A 37 15.467 16.387 -16.289 1.00 0.00 O ATOM 572 OD2 ASP A 37 14.273 15.783 -14.551 1.00 0.00 O1- ATOM 0 H ASP A 37 11.477 13.881 -17.925 1.00 0.00 H new ATOM 0 HA ASP A 37 14.324 14.587 -18.208 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.031 16.546 -17.354 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.302 15.543 -16.116 1.00 0.00 H new ATOM 577 N ASP A 38 12.684 12.527 -16.224 1.00 0.00 N ATOM 578 CA ASP A 38 12.796 11.362 -15.365 1.00 0.00 C ATOM 579 C ASP A 38 13.068 10.137 -16.227 1.00 0.00 C ATOM 580 O ASP A 38 12.490 9.979 -17.305 1.00 0.00 O ATOM 581 CB ASP A 38 11.541 11.148 -14.502 1.00 0.00 C ATOM 582 CG ASP A 38 11.454 12.161 -13.347 1.00 0.00 C ATOM 583 OD1 ASP A 38 12.349 12.145 -12.464 1.00 0.00 O1- ATOM 584 OD2 ASP A 38 10.499 12.975 -13.321 1.00 0.00 O ATOM 0 H ASP A 38 11.720 12.759 -16.464 1.00 0.00 H new ATOM 0 HA ASP A 38 13.623 11.526 -14.674 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.652 11.234 -15.127 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.548 10.136 -14.097 1.00 0.00 H new ATOM 589 N SER A 39 13.919 9.239 -15.731 1.00 0.00 N ATOM 590 CA SER A 39 14.177 7.954 -16.363 1.00 0.00 C ATOM 591 C SER A 39 13.106 6.975 -15.889 1.00 0.00 C ATOM 592 O SER A 39 12.778 6.992 -14.709 1.00 0.00 O ATOM 593 CB SER A 39 15.589 7.456 -16.008 1.00 0.00 C ATOM 594 OG SER A 39 16.581 8.398 -16.401 1.00 0.00 O ATOM 0 H SER A 39 14.450 9.388 -14.873 1.00 0.00 H new ATOM 0 HA SER A 39 14.134 8.045 -17.448 1.00 0.00 H new ATOM 0 HB2 SER A 39 15.656 7.280 -14.934 1.00 0.00 H new ATOM 0 HB3 SER A 39 15.775 6.501 -16.500 1.00 0.00 H new ATOM 0 HG SER A 39 17.468 8.057 -16.162 1.00 0.00 H new ATOM 600 N PRO A 40 12.603 6.051 -16.721 1.00 0.00 N ATOM 601 CA PRO A 40 11.621 5.071 -16.276 1.00 0.00 C ATOM 602 C PRO A 40 12.259 3.986 -15.394 1.00 0.00 C ATOM 603 O PRO A 40 11.525 3.199 -14.819 1.00 0.00 O ATOM 604 CB PRO A 40 11.033 4.536 -17.584 1.00 0.00 C ATOM 605 CG PRO A 40 12.251 4.515 -18.499 1.00 0.00 C ATOM 606 CD PRO A 40 12.920 5.839 -18.128 1.00 0.00 C ATOM 0 HA PRO A 40 10.848 5.491 -15.633 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.600 3.544 -17.460 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.245 5.182 -17.970 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.897 3.659 -18.306 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.974 4.474 -19.553 1.00 0.00 H new ATOM 0 HD2 PRO A 40 13.998 5.793 -18.285 1.00 0.00 H new ATOM 0 HD3 PRO A 40 12.543 6.656 -18.743 1.00 0.00 H new ATOM 614 N LYS A 41 13.587 3.936 -15.221 1.00 0.00 N ATOM 615 CA LYS A 41 14.278 2.919 -14.412 1.00 0.00 C ATOM 616 C LYS A 41 13.724 2.870 -12.992 1.00 0.00 C ATOM 617 O LYS A 41 13.522 1.802 -12.433 1.00 0.00 O ATOM 618 CB LYS A 41 15.787 3.225 -14.366 1.00 0.00 C ATOM 619 CG LYS A 41 16.536 3.002 -15.695 1.00 0.00 C ATOM 620 CD LYS A 41 17.046 1.561 -15.871 1.00 0.00 C ATOM 621 CE LYS A 41 17.948 1.474 -17.117 1.00 0.00 C ATOM 622 NZ LYS A 41 18.565 0.132 -17.288 1.00 0.00 N1+ ATOM 0 H LYS A 41 14.223 4.611 -15.646 1.00 0.00 H new ATOM 0 HA LYS A 41 14.112 1.948 -14.878 1.00 0.00 H new ATOM 0 HB2 LYS A 41 15.923 4.262 -14.059 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.246 2.602 -13.598 1.00 0.00 H new ATOM 0 HG2 LYS A 41 15.873 3.249 -16.524 1.00 0.00 H new ATOM 0 HG3 LYS A 41 17.381 3.688 -15.747 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.602 1.252 -14.986 1.00 0.00 H new ATOM 0 HD3 LYS A 41 16.203 0.877 -15.973 1.00 0.00 H new ATOM 0 HE2 LYS A 41 17.360 1.714 -18.003 1.00 0.00 H new ATOM 0 HE3 LYS A 41 18.735 2.224 -17.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 19.452 0.223 -17.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 18.764 -0.280 -16.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 17.910 -0.487 -17.807 1.00 0.00 H new ATOM 636 N LEU A 42 13.377 4.024 -12.428 1.00 0.00 N ATOM 637 CA LEU A 42 12.788 4.104 -11.094 1.00 0.00 C ATOM 638 C LEU A 42 11.408 3.461 -11.004 1.00 0.00 C ATOM 639 O LEU A 42 11.005 3.029 -9.928 1.00 0.00 O ATOM 640 CB LEU A 42 12.827 5.529 -10.522 1.00 0.00 C ATOM 641 CG LEU A 42 12.866 6.746 -11.446 1.00 0.00 C ATOM 642 CD1 LEU A 42 11.493 6.965 -12.053 1.00 0.00 C ATOM 643 CD2 LEU A 42 13.284 7.997 -10.671 1.00 0.00 C ATOM 0 H LEU A 42 13.496 4.929 -12.882 1.00 0.00 H new ATOM 0 HA LEU A 42 13.426 3.500 -10.449 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.951 5.641 -9.883 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.703 5.590 -9.876 1.00 0.00 H new ATOM 0 HG LEU A 42 13.595 6.562 -12.235 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.521 7.833 -12.712 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.204 6.084 -12.626 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.767 7.136 -11.258 1.00 0.00 H new ATOM 0 HD21 LEU A 42 13.306 8.853 -11.346 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.569 8.185 -9.870 1.00 0.00 H new ATOM 0 HD23 LEU A 42 14.276 7.846 -10.244 1.00 0.00 H new ATOM 655 N MET A 43 10.712 3.302 -12.125 1.00 0.00 N ATOM 656 CA MET A 43 9.480 2.515 -12.231 1.00 0.00 C ATOM 657 C MET A 43 9.701 1.032 -11.885 1.00 0.00 C ATOM 658 O MET A 43 8.735 0.313 -11.648 1.00 0.00 O ATOM 659 CB MET A 43 8.756 2.781 -13.575 1.00 0.00 C ATOM 660 CG MET A 43 8.792 1.664 -14.629 1.00 0.00 C ATOM 661 SD MET A 43 7.680 1.872 -16.062 1.00 0.00 S ATOM 662 CE MET A 43 7.711 3.666 -16.344 1.00 0.00 C ATOM 0 H MET A 43 10.993 3.726 -13.009 1.00 0.00 H new ATOM 0 HA MET A 43 8.785 2.858 -11.465 1.00 0.00 H new ATOM 0 HB2 MET A 43 7.712 3.005 -13.357 1.00 0.00 H new ATOM 0 HB3 MET A 43 9.188 3.678 -14.019 1.00 0.00 H new ATOM 0 HG2 MET A 43 9.814 1.574 -14.998 1.00 0.00 H new ATOM 0 HG3 MET A 43 8.546 0.722 -14.139 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.539 3.871 -17.401 1.00 0.00 H new ATOM 0 HE2 MET A 43 6.930 4.141 -15.750 1.00 0.00 H new ATOM 0 HE3 MET A 43 8.682 4.064 -16.050 1.00 0.00 H new ATOM 672 N GLU A 44 10.946 0.555 -11.808 1.00 0.00 N ATOM 673 CA GLU A 44 11.246 -0.803 -11.362 1.00 0.00 C ATOM 674 C GLU A 44 11.031 -0.936 -9.847 1.00 0.00 C ATOM 675 O GLU A 44 10.725 -2.034 -9.385 1.00 0.00 O ATOM 676 CB GLU A 44 12.677 -1.199 -11.763 1.00 0.00 C ATOM 677 CG GLU A 44 12.860 -1.229 -13.286 1.00 0.00 C ATOM 678 CD GLU A 44 14.284 -1.652 -13.689 1.00 0.00 C ATOM 679 OE1 GLU A 44 15.254 -0.889 -13.465 1.00 0.00 O1- ATOM 680 OE2 GLU A 44 14.425 -2.755 -14.264 1.00 0.00 O ATOM 0 H GLU A 44 11.772 1.101 -12.053 1.00 0.00 H new ATOM 0 HA GLU A 44 10.559 -1.491 -11.855 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.384 -0.493 -11.327 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.911 -2.180 -11.350 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.139 -1.920 -13.724 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.646 -0.242 -13.696 1.00 0.00 H new ATOM 687 N GLN A 45 11.142 0.155 -9.075 1.00 0.00 N ATOM 688 CA GLN A 45 11.045 0.113 -7.614 1.00 0.00 C ATOM 689 C GLN A 45 9.585 -0.005 -7.184 1.00 0.00 C ATOM 690 O GLN A 45 9.224 -0.840 -6.355 1.00 0.00 O ATOM 691 CB GLN A 45 11.637 1.366 -6.943 1.00 0.00 C ATOM 692 CG GLN A 45 12.928 1.924 -7.551 1.00 0.00 C ATOM 693 CD GLN A 45 13.096 3.392 -7.160 1.00 0.00 C ATOM 694 OE1 GLN A 45 14.011 3.776 -6.435 1.00 0.00 O ATOM 695 NE2 GLN A 45 12.183 4.235 -7.631 1.00 0.00 N ATOM 0 H GLN A 45 11.302 1.090 -9.449 1.00 0.00 H new ATOM 0 HA GLN A 45 11.620 -0.757 -7.296 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.883 2.153 -6.964 1.00 0.00 H new ATOM 0 HB3 GLN A 45 11.826 1.134 -5.895 1.00 0.00 H new ATOM 0 HG2 GLN A 45 13.784 1.346 -7.203 1.00 0.00 H new ATOM 0 HG3 GLN A 45 12.900 1.829 -8.636 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.433 3.892 -8.231 1.00 0.00 H new ATOM 0 HE22 GLN A 45 12.232 5.225 -7.392 1.00 0.00 H new ATOM 704 N TYR A 46 8.760 0.885 -7.748 1.00 0.00 N ATOM 705 CA TYR A 46 7.367 1.065 -7.385 1.00 0.00 C ATOM 706 C TYR A 46 6.630 -0.207 -7.776 1.00 0.00 C ATOM 707 O TYR A 46 6.891 -0.790 -8.826 1.00 0.00 O ATOM 708 CB TYR A 46 6.772 2.305 -8.077 1.00 0.00 C ATOM 709 CG TYR A 46 7.416 3.639 -7.746 1.00 0.00 C ATOM 710 CD1 TYR A 46 7.041 4.380 -6.608 1.00 0.00 C ATOM 711 CD2 TYR A 46 8.376 4.169 -8.629 1.00 0.00 C ATOM 712 CE1 TYR A 46 7.658 5.618 -6.340 1.00 0.00 C ATOM 713 CE2 TYR A 46 8.997 5.401 -8.371 1.00 0.00 C ATOM 714 CZ TYR A 46 8.652 6.124 -7.205 1.00 0.00 C ATOM 715 OH TYR A 46 9.255 7.313 -6.915 1.00 0.00 O ATOM 0 H TYR A 46 9.062 1.515 -8.492 1.00 0.00 H new ATOM 0 HA TYR A 46 7.267 1.238 -6.314 1.00 0.00 H new ATOM 0 HB2 TYR A 46 6.831 2.156 -9.155 1.00 0.00 H new ATOM 0 HB3 TYR A 46 5.714 2.364 -7.821 1.00 0.00 H new ATOM 0 HD1 TYR A 46 6.281 3.999 -5.942 1.00 0.00 H new ATOM 0 HD2 TYR A 46 8.639 3.618 -9.520 1.00 0.00 H new ATOM 0 HE1 TYR A 46 7.368 6.184 -5.467 1.00 0.00 H new ATOM 0 HE2 TYR A 46 9.733 5.794 -9.057 1.00 0.00 H new ATOM 0 HH TYR A 46 9.916 7.522 -7.607 1.00 0.00 H new ATOM 725 N ASP A 47 5.714 -0.660 -6.934 1.00 0.00 N ATOM 726 CA ASP A 47 5.008 -1.926 -7.168 1.00 0.00 C ATOM 727 C ASP A 47 3.923 -1.771 -8.235 1.00 0.00 C ATOM 728 O ASP A 47 3.521 -2.736 -8.879 1.00 0.00 O ATOM 729 CB ASP A 47 4.423 -2.456 -5.858 1.00 0.00 C ATOM 730 CG ASP A 47 3.897 -3.892 -6.042 1.00 0.00 C ATOM 731 OD1 ASP A 47 4.710 -4.796 -6.353 1.00 0.00 O1- ATOM 732 OD2 ASP A 47 2.687 -4.131 -5.819 1.00 0.00 O ATOM 0 H ASP A 47 5.437 -0.175 -6.080 1.00 0.00 H new ATOM 0 HA ASP A 47 5.728 -2.653 -7.543 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.186 -2.439 -5.080 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.614 -1.806 -5.525 1.00 0.00 H new ATOM 737 N VAL A 48 3.466 -0.533 -8.450 1.00 0.00 N ATOM 738 CA VAL A 48 2.342 -0.203 -9.305 1.00 0.00 C ATOM 739 C VAL A 48 2.714 1.062 -10.041 1.00 0.00 C ATOM 740 O VAL A 48 3.309 1.955 -9.438 1.00 0.00 O ATOM 741 CB VAL A 48 1.121 0.024 -8.416 1.00 0.00 C ATOM 742 CG1 VAL A 48 -0.068 0.594 -9.183 1.00 0.00 C ATOM 743 CG2 VAL A 48 0.760 -1.274 -7.698 1.00 0.00 C ATOM 0 H VAL A 48 3.888 0.287 -8.015 1.00 0.00 H new ATOM 0 HA VAL A 48 2.111 -0.994 -10.018 1.00 0.00 H new ATOM 0 HB VAL A 48 1.382 0.779 -7.674 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.907 0.735 -8.501 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.208 1.553 -9.622 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.356 -0.098 -9.975 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.111 -1.109 -7.064 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.533 -2.046 -8.434 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.600 -1.595 -7.083 1.00 0.00 H new ATOM 753 N LEU A 49 2.341 1.176 -11.309 1.00 0.00 N ATOM 754 CA LEU A 49 2.545 2.387 -12.063 1.00 0.00 C ATOM 755 C LEU A 49 1.263 2.815 -12.749 1.00 0.00 C ATOM 756 O LEU A 49 0.393 1.994 -13.029 1.00 0.00 O ATOM 757 CB LEU A 49 3.646 2.245 -13.121 1.00 0.00 C ATOM 758 CG LEU A 49 5.008 1.589 -12.846 1.00 0.00 C ATOM 759 CD1 LEU A 49 5.621 1.922 -11.487 1.00 0.00 C ATOM 760 CD2 LEU A 49 4.997 0.075 -13.041 1.00 0.00 C ATOM 0 H LEU A 49 1.890 0.428 -11.835 1.00 0.00 H new ATOM 0 HA LEU A 49 2.858 3.143 -11.343 1.00 0.00 H new ATOM 0 HB2 LEU A 49 3.204 1.696 -13.952 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.858 3.252 -13.481 1.00 0.00 H new ATOM 0 HG LEU A 49 5.648 2.040 -13.604 1.00 0.00 H new ATOM 0 HD11 LEU A 49 6.580 1.413 -11.386 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.772 2.999 -11.410 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.950 1.592 -10.694 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.989 -0.326 -12.831 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.273 -0.374 -12.362 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.722 -0.157 -14.070 1.00 0.00 H new ATOM 772 N ILE A 50 1.177 4.096 -13.088 1.00 0.00 N ATOM 773 CA ILE A 50 0.147 4.637 -13.962 1.00 0.00 C ATOM 774 C ILE A 50 0.913 5.330 -15.064 1.00 0.00 C ATOM 775 O ILE A 50 1.750 6.165 -14.739 1.00 0.00 O ATOM 776 CB ILE A 50 -0.775 5.576 -13.179 1.00 0.00 C ATOM 777 CG1 ILE A 50 -1.536 4.771 -12.108 1.00 0.00 C ATOM 778 CG2 ILE A 50 -1.776 6.312 -14.078 1.00 0.00 C ATOM 779 CD1 ILE A 50 -1.033 5.200 -10.737 1.00 0.00 C ATOM 0 H ILE A 50 1.835 4.801 -12.755 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.517 3.878 -14.376 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.145 6.334 -12.714 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.608 4.948 -12.191 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.377 3.702 -12.253 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.403 6.963 -13.468 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.235 6.911 -14.810 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.403 5.586 -14.595 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.561 4.641 -9.964 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.036 5.001 -10.663 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.214 6.266 -10.600 1.00 0.00 H new ATOM 791 N LEU A 51 0.706 4.960 -16.324 1.00 0.00 N ATOM 792 CA LEU A 51 1.478 5.487 -17.446 1.00 0.00 C ATOM 793 C LEU A 51 0.519 6.177 -18.399 1.00 0.00 C ATOM 794 O LEU A 51 -0.534 5.622 -18.709 1.00 0.00 O ATOM 795 CB LEU A 51 2.270 4.370 -18.152 1.00 0.00 C ATOM 796 CG LEU A 51 3.629 4.027 -17.530 1.00 0.00 C ATOM 797 CD1 LEU A 51 3.532 3.619 -16.068 1.00 0.00 C ATOM 798 CD2 LEU A 51 4.241 2.847 -18.283 1.00 0.00 C ATOM 0 H LEU A 51 -0.006 4.283 -16.598 1.00 0.00 H new ATOM 0 HA LEU A 51 2.214 6.205 -17.084 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.658 3.468 -18.165 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.429 4.662 -19.190 1.00 0.00 H new ATOM 0 HG LEU A 51 4.236 4.930 -17.599 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.527 3.389 -15.688 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.102 4.437 -15.490 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.897 2.738 -15.978 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.208 2.598 -17.845 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.577 1.985 -18.210 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.375 3.114 -19.331 1.00 0.00 H new ATOM 810 N GLY A 52 0.889 7.373 -18.853 1.00 0.00 N ATOM 811 CA GLY A 52 0.011 8.224 -19.645 1.00 0.00 C ATOM 812 C GLY A 52 0.653 8.688 -20.932 1.00 0.00 C ATOM 813 O GLY A 52 1.656 9.392 -20.851 1.00 0.00 O ATOM 0 H GLY A 52 1.809 7.778 -18.680 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.904 7.679 -19.876 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.276 9.093 -19.053 1.00 0.00 H new ATOM 817 N ILE A 53 0.091 8.351 -22.098 1.00 0.00 N ATOM 818 CA ILE A 53 0.613 8.775 -23.404 1.00 0.00 C ATOM 819 C ILE A 53 -0.447 9.556 -24.188 1.00 0.00 C ATOM 820 O ILE A 53 -1.583 9.099 -24.292 1.00 0.00 O ATOM 821 CB ILE A 53 1.177 7.622 -24.276 1.00 0.00 C ATOM 822 CG1 ILE A 53 0.194 6.502 -24.650 1.00 0.00 C ATOM 823 CG2 ILE A 53 2.438 6.981 -23.687 1.00 0.00 C ATOM 824 CD1 ILE A 53 -0.321 5.688 -23.463 1.00 0.00 C ATOM 0 H ILE A 53 -0.746 7.772 -22.163 1.00 0.00 H new ATOM 0 HA ILE A 53 1.460 9.422 -23.175 1.00 0.00 H new ATOM 0 HB ILE A 53 1.414 8.152 -25.198 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.657 6.942 -25.170 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.682 5.827 -25.353 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.781 6.182 -24.345 1.00 0.00 H new ATOM 0 HG22 ILE A 53 3.220 7.735 -23.593 1.00 0.00 H new ATOM 0 HG23 ILE A 53 2.211 6.569 -22.704 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.008 4.920 -23.819 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.519 5.215 -22.954 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.842 6.347 -22.768 1.00 0.00 H new ATOM 836 N PRO A 54 -0.110 10.713 -24.769 1.00 0.00 N ATOM 837 CA PRO A 54 -0.960 11.370 -25.750 1.00 0.00 C ATOM 838 C PRO A 54 -0.707 10.721 -27.119 1.00 0.00 C ATOM 839 O PRO A 54 0.413 10.284 -27.393 1.00 0.00 O ATOM 840 CB PRO A 54 -0.525 12.833 -25.700 1.00 0.00 C ATOM 841 CG PRO A 54 0.987 12.713 -25.429 1.00 0.00 C ATOM 842 CD PRO A 54 1.100 11.491 -24.529 1.00 0.00 C ATOM 0 HA PRO A 54 -2.030 11.283 -25.559 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.731 13.351 -26.636 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -1.038 13.384 -24.911 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.550 12.582 -26.353 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.378 13.606 -24.942 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.992 10.911 -24.766 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.178 11.782 -23.481 1.00 0.00 H new ATOM 850 N THR A 55 -1.715 10.674 -27.989 1.00 0.00 N ATOM 851 CA THR A 55 -1.494 10.286 -29.378 1.00 0.00 C ATOM 852 C THR A 55 -1.300 11.573 -30.178 1.00 0.00 C ATOM 853 O THR A 55 -2.126 12.483 -30.079 1.00 0.00 O ATOM 854 CB THR A 55 -2.647 9.430 -29.892 1.00 0.00 C ATOM 855 OG1 THR A 55 -2.859 8.341 -29.006 1.00 0.00 O ATOM 856 CG2 THR A 55 -2.308 8.838 -31.258 1.00 0.00 C ATOM 0 H THR A 55 -2.683 10.898 -27.758 1.00 0.00 H new ATOM 0 HA THR A 55 -0.606 9.663 -29.482 1.00 0.00 H new ATOM 0 HB THR A 55 -3.531 10.063 -29.963 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.332 8.656 -28.208 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.142 8.230 -31.608 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.123 9.644 -31.968 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.417 8.216 -31.174 1.00 0.00 H new ATOM 864 N TRP A 56 -0.248 11.652 -30.984 1.00 0.00 N ATOM 865 CA TRP A 56 0.077 12.767 -31.848 1.00 0.00 C ATOM 866 C TRP A 56 0.225 12.270 -33.289 1.00 0.00 C ATOM 867 O TRP A 56 0.220 11.064 -33.526 1.00 0.00 O ATOM 868 CB TRP A 56 1.348 13.466 -31.336 1.00 0.00 C ATOM 869 CG TRP A 56 1.163 14.403 -30.177 1.00 0.00 C ATOM 870 CD1 TRP A 56 1.396 14.121 -28.876 1.00 0.00 C ATOM 871 CD2 TRP A 56 0.780 15.815 -30.208 1.00 0.00 C ATOM 872 NE1 TRP A 56 1.218 15.256 -28.103 1.00 0.00 N ATOM 873 CE2 TRP A 56 0.809 16.323 -28.875 1.00 0.00 C ATOM 874 CE3 TRP A 56 0.457 16.731 -31.235 1.00 0.00 C ATOM 875 CZ2 TRP A 56 0.513 17.659 -28.577 1.00 0.00 C ATOM 876 CZ3 TRP A 56 0.187 18.082 -30.946 1.00 0.00 C ATOM 877 CH2 TRP A 56 0.195 18.543 -29.618 1.00 0.00 C ATOM 0 H TRP A 56 0.434 10.897 -31.052 1.00 0.00 H new ATOM 0 HA TRP A 56 -0.726 13.504 -31.835 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.068 12.701 -31.047 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.789 14.024 -32.162 1.00 0.00 H new ATOM 0 HD1 TRP A 56 1.680 13.151 -28.495 1.00 0.00 H new ATOM 0 HE1 TRP A 56 1.369 15.297 -27.095 1.00 0.00 H new ATOM 0 HE3 TRP A 56 0.417 16.389 -32.259 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 0.530 18.005 -27.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -0.028 18.770 -31.751 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -0.043 19.574 -29.400 1.00 0.00 H new ATOM 888 N ASP A 57 0.340 13.210 -34.235 1.00 0.00 N ATOM 889 CA ASP A 57 0.709 13.026 -35.646 1.00 0.00 C ATOM 890 C ASP A 57 0.265 11.689 -36.275 1.00 0.00 C ATOM 891 O ASP A 57 1.077 10.945 -36.832 1.00 0.00 O ATOM 892 CB ASP A 57 2.208 13.315 -35.831 1.00 0.00 C ATOM 893 CG ASP A 57 2.612 13.371 -37.319 1.00 0.00 C ATOM 894 OD1 ASP A 57 1.859 13.952 -38.139 1.00 0.00 O1- ATOM 895 OD2 ASP A 57 3.733 12.916 -37.659 1.00 0.00 O ATOM 0 H ASP A 57 0.165 14.192 -34.020 1.00 0.00 H new ATOM 0 HA ASP A 57 0.134 13.756 -36.216 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.455 14.263 -35.353 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.790 12.543 -35.327 1.00 0.00 H new ATOM 900 N PHE A 58 -1.042 11.395 -36.194 1.00 0.00 N ATOM 901 CA PHE A 58 -1.666 10.178 -36.719 1.00 0.00 C ATOM 902 C PHE A 58 -1.048 8.895 -36.139 1.00 0.00 C ATOM 903 O PHE A 58 -0.302 8.174 -36.815 1.00 0.00 O ATOM 904 CB PHE A 58 -1.682 10.183 -38.258 1.00 0.00 C ATOM 905 CG PHE A 58 -2.313 11.406 -38.892 1.00 0.00 C ATOM 906 CD1 PHE A 58 -3.644 11.732 -38.585 1.00 0.00 C ATOM 907 CD2 PHE A 58 -1.585 12.207 -39.792 1.00 0.00 C ATOM 908 CE1 PHE A 58 -4.262 12.837 -39.198 1.00 0.00 C ATOM 909 CE2 PHE A 58 -2.195 13.323 -40.391 1.00 0.00 C ATOM 910 CZ PHE A 58 -3.535 13.638 -40.098 1.00 0.00 C ATOM 0 H PHE A 58 -1.712 12.020 -35.746 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.703 10.178 -36.384 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -0.656 10.096 -38.616 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.217 9.298 -38.603 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.195 11.132 -37.876 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.558 11.964 -40.022 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.293 13.070 -38.978 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.634 13.940 -41.077 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.004 14.492 -40.563 1.00 0.00 H new ATOM 920 N GLY A 59 -1.405 8.567 -34.892 1.00 0.00 N ATOM 921 CA GLY A 59 -0.971 7.326 -34.265 1.00 0.00 C ATOM 922 C GLY A 59 0.524 7.270 -33.936 1.00 0.00 C ATOM 923 O GLY A 59 1.100 6.184 -33.852 1.00 0.00 O ATOM 0 H GLY A 59 -1.996 9.151 -34.300 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.538 7.180 -33.346 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -1.216 6.495 -34.926 1.00 0.00 H new ATOM 927 N GLU A 60 1.152 8.424 -33.748 1.00 0.00 N ATOM 928 CA GLU A 60 2.490 8.581 -33.225 1.00 0.00 C ATOM 929 C GLU A 60 2.442 8.892 -31.726 1.00 0.00 C ATOM 930 O GLU A 60 1.401 9.248 -31.164 1.00 0.00 O ATOM 931 CB GLU A 60 3.285 9.628 -34.021 1.00 0.00 C ATOM 932 CG GLU A 60 3.561 9.160 -35.457 1.00 0.00 C ATOM 933 CD GLU A 60 4.442 7.899 -35.559 1.00 0.00 C ATOM 934 OE1 GLU A 60 5.235 7.600 -34.633 1.00 0.00 O ATOM 935 OE2 GLU A 60 4.370 7.203 -36.602 1.00 0.00 O1- ATOM 0 H GLU A 60 0.713 9.318 -33.970 1.00 0.00 H new ATOM 0 HA GLU A 60 3.024 7.639 -33.345 1.00 0.00 H new ATOM 0 HB2 GLU A 60 2.730 10.566 -34.044 1.00 0.00 H new ATOM 0 HB3 GLU A 60 4.230 9.829 -33.516 1.00 0.00 H new ATOM 0 HG2 GLU A 60 2.609 8.964 -35.951 1.00 0.00 H new ATOM 0 HG3 GLU A 60 4.043 9.970 -36.004 1.00 0.00 H new ATOM 942 N ILE A 61 3.592 8.734 -31.079 1.00 0.00 N ATOM 943 CA ILE A 61 3.813 8.947 -29.657 1.00 0.00 C ATOM 944 C ILE A 61 4.504 10.318 -29.523 1.00 0.00 C ATOM 945 O ILE A 61 5.217 10.739 -30.440 1.00 0.00 O ATOM 946 CB ILE A 61 4.680 7.780 -29.122 1.00 0.00 C ATOM 947 CG1 ILE A 61 4.112 6.366 -29.403 1.00 0.00 C ATOM 948 CG2 ILE A 61 4.919 7.892 -27.612 1.00 0.00 C ATOM 949 CD1 ILE A 61 5.242 5.328 -29.493 1.00 0.00 C ATOM 0 H ILE A 61 4.440 8.437 -31.561 1.00 0.00 H new ATOM 0 HA ILE A 61 2.894 8.958 -29.072 1.00 0.00 H new ATOM 0 HB ILE A 61 5.612 7.884 -29.677 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.417 6.085 -28.612 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.547 6.376 -30.335 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.531 7.054 -27.277 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.434 8.828 -27.394 1.00 0.00 H new ATOM 0 HG23 ILE A 61 3.962 7.874 -27.090 1.00 0.00 H new ATOM 0 HD11 ILE A 61 4.817 4.344 -29.691 1.00 0.00 H new ATOM 0 HD12 ILE A 61 5.921 5.599 -30.301 1.00 0.00 H new ATOM 0 HD13 ILE A 61 5.790 5.304 -28.551 1.00 0.00 H new ATOM 961 N GLN A 62 4.318 11.016 -28.392 1.00 0.00 N ATOM 962 CA GLN A 62 5.095 12.211 -28.101 1.00 0.00 C ATOM 963 C GLN A 62 6.554 11.805 -27.904 1.00 0.00 C ATOM 964 O GLN A 62 6.860 10.768 -27.315 1.00 0.00 O ATOM 965 CB GLN A 62 4.509 13.004 -26.914 1.00 0.00 C ATOM 966 CG GLN A 62 5.375 14.154 -26.358 1.00 0.00 C ATOM 967 CD GLN A 62 5.884 15.203 -27.365 1.00 0.00 C ATOM 968 OE1 GLN A 62 5.594 15.171 -28.559 1.00 0.00 O ATOM 969 NE2 GLN A 62 6.729 16.113 -26.912 1.00 0.00 N ATOM 0 H GLN A 62 3.638 10.768 -27.673 1.00 0.00 H new ATOM 0 HA GLN A 62 5.045 12.902 -28.942 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.549 13.418 -27.222 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.309 12.305 -26.102 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.797 14.673 -25.593 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.240 13.715 -25.861 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.968 16.138 -25.921 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.142 16.790 -27.554 1.00 0.00 H new ATOM 978 N GLU A 63 7.465 12.658 -28.348 1.00 0.00 N ATOM 979 CA GLU A 63 8.884 12.319 -28.446 1.00 0.00 C ATOM 980 C GLU A 63 9.511 12.055 -27.071 1.00 0.00 C ATOM 981 O GLU A 63 10.443 11.261 -26.952 1.00 0.00 O ATOM 982 CB GLU A 63 9.660 13.387 -29.238 1.00 0.00 C ATOM 983 CG GLU A 63 9.856 14.700 -28.471 1.00 0.00 C ATOM 984 CD GLU A 63 10.545 15.763 -29.345 1.00 0.00 C ATOM 985 OE1 GLU A 63 11.798 15.777 -29.414 1.00 0.00 O1- ATOM 986 OE2 GLU A 63 9.841 16.605 -29.955 1.00 0.00 O ATOM 0 H GLU A 63 7.245 13.607 -28.652 1.00 0.00 H new ATOM 0 HA GLU A 63 8.956 11.385 -29.003 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.636 12.987 -29.511 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.129 13.595 -30.167 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.889 15.074 -28.134 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.455 14.516 -27.579 1.00 0.00 H new ATOM 993 N ASP A 64 8.963 12.663 -26.016 1.00 0.00 N ATOM 994 CA ASP A 64 9.429 12.484 -24.640 1.00 0.00 C ATOM 995 C ASP A 64 9.169 11.052 -24.164 1.00 0.00 C ATOM 996 O ASP A 64 9.892 10.537 -23.312 1.00 0.00 O ATOM 997 CB ASP A 64 8.722 13.477 -23.709 1.00 0.00 C ATOM 998 CG ASP A 64 8.998 14.936 -24.108 1.00 0.00 C ATOM 999 OD1 ASP A 64 10.175 15.371 -24.074 1.00 0.00 O1- ATOM 1000 OD2 ASP A 64 8.026 15.629 -24.493 1.00 0.00 O ATOM 0 H ASP A 64 8.172 13.302 -26.095 1.00 0.00 H new ATOM 0 HA ASP A 64 10.503 12.671 -24.615 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.648 13.292 -23.730 1.00 0.00 H new ATOM 0 HB3 ASP A 64 9.054 13.312 -22.684 1.00 0.00 H new ATOM 1005 N TRP A 65 8.157 10.395 -24.741 1.00 0.00 N ATOM 1006 CA TRP A 65 7.868 8.992 -24.527 1.00 0.00 C ATOM 1007 C TRP A 65 8.704 8.122 -25.449 1.00 0.00 C ATOM 1008 O TRP A 65 9.267 7.137 -24.983 1.00 0.00 O ATOM 1009 CB TRP A 65 6.371 8.718 -24.669 1.00 0.00 C ATOM 1010 CG TRP A 65 5.650 8.596 -23.377 1.00 0.00 C ATOM 1011 CD1 TRP A 65 4.733 9.459 -22.895 1.00 0.00 C ATOM 1012 CD2 TRP A 65 5.729 7.504 -22.418 1.00 0.00 C ATOM 1013 NE1 TRP A 65 4.204 8.940 -21.733 1.00 0.00 N ATOM 1014 CE2 TRP A 65 4.780 7.741 -21.389 1.00 0.00 C ATOM 1015 CE3 TRP A 65 6.489 6.319 -22.338 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 4.584 6.853 -20.326 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 6.331 5.438 -21.257 1.00 0.00 C ATOM 1018 CH2 TRP A 65 5.392 5.708 -20.255 1.00 0.00 C ATOM 0 H TRP A 65 7.506 10.845 -25.384 1.00 0.00 H new ATOM 0 HA TRP A 65 8.144 8.731 -23.505 1.00 0.00 H new ATOM 0 HB2 TRP A 65 5.919 9.522 -25.250 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.234 7.798 -25.237 1.00 0.00 H new ATOM 0 HD1 TRP A 65 4.458 10.401 -23.345 1.00 0.00 H new ATOM 0 HE1 TRP A 65 3.469 9.394 -21.191 1.00 0.00 H new ATOM 0 HE3 TRP A 65 7.200 6.087 -23.117 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 3.829 7.044 -19.578 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 6.938 4.546 -21.198 1.00 0.00 H new ATOM 0 HH2 TRP A 65 5.288 5.030 -19.421 1.00 0.00 H new ATOM 1029 N GLU A 66 8.840 8.494 -26.724 1.00 0.00 N ATOM 1030 CA GLU A 66 9.682 7.768 -27.680 1.00 0.00 C ATOM 1031 C GLU A 66 11.111 7.621 -27.143 1.00 0.00 C ATOM 1032 O GLU A 66 11.743 6.578 -27.322 1.00 0.00 O ATOM 1033 CB GLU A 66 9.740 8.478 -29.041 1.00 0.00 C ATOM 1034 CG GLU A 66 8.400 8.522 -29.778 1.00 0.00 C ATOM 1035 CD GLU A 66 8.597 9.029 -31.217 1.00 0.00 C ATOM 1036 OE1 GLU A 66 8.800 10.251 -31.418 1.00 0.00 O ATOM 1037 OE2 GLU A 66 8.580 8.198 -32.159 1.00 0.00 O1- ATOM 0 H GLU A 66 8.370 9.306 -27.123 1.00 0.00 H new ATOM 0 HA GLU A 66 9.231 6.785 -27.813 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.095 9.498 -28.892 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.473 7.974 -29.671 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.953 7.528 -29.794 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.707 9.175 -29.247 1.00 0.00 H new ATOM 1044 N ALA A 67 11.598 8.647 -26.437 1.00 0.00 N ATOM 1045 CA ALA A 67 12.934 8.692 -25.864 1.00 0.00 C ATOM 1046 C ALA A 67 13.155 7.589 -24.827 1.00 0.00 C ATOM 1047 O ALA A 67 14.283 7.111 -24.686 1.00 0.00 O ATOM 1048 CB ALA A 67 13.167 10.073 -25.238 1.00 0.00 C ATOM 0 H ALA A 67 11.054 9.488 -26.247 1.00 0.00 H new ATOM 0 HA ALA A 67 13.654 8.520 -26.664 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.167 10.113 -24.807 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.072 10.841 -26.006 1.00 0.00 H new ATOM 0 HB3 ALA A 67 12.428 10.248 -24.456 1.00 0.00 H new ATOM 1054 N VAL A 68 12.105 7.174 -24.111 1.00 0.00 N ATOM 1055 CA VAL A 68 12.197 6.136 -23.089 1.00 0.00 C ATOM 1056 C VAL A 68 11.568 4.814 -23.521 1.00 0.00 C ATOM 1057 O VAL A 68 11.798 3.807 -22.859 1.00 0.00 O ATOM 1058 CB VAL A 68 11.663 6.655 -21.744 1.00 0.00 C ATOM 1059 CG1 VAL A 68 12.333 7.966 -21.305 1.00 0.00 C ATOM 1060 CG2 VAL A 68 10.138 6.801 -21.695 1.00 0.00 C ATOM 0 H VAL A 68 11.165 7.553 -24.227 1.00 0.00 H new ATOM 0 HA VAL A 68 13.252 5.902 -22.950 1.00 0.00 H new ATOM 0 HB VAL A 68 11.933 5.875 -21.032 1.00 0.00 H new ATOM 0 HG11 VAL A 68 11.917 8.285 -20.349 1.00 0.00 H new ATOM 0 HG12 VAL A 68 13.406 7.808 -21.199 1.00 0.00 H new ATOM 0 HG13 VAL A 68 12.152 8.736 -22.055 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.839 7.172 -20.714 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.815 7.504 -22.463 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.674 5.831 -21.873 1.00 0.00 H new ATOM 1070 N TRP A 69 10.831 4.789 -24.633 1.00 0.00 N ATOM 1071 CA TRP A 69 10.143 3.615 -25.177 1.00 0.00 C ATOM 1072 C TRP A 69 11.099 2.434 -25.356 1.00 0.00 C ATOM 1073 O TRP A 69 10.706 1.277 -25.220 1.00 0.00 O ATOM 1074 CB TRP A 69 9.508 4.014 -26.517 1.00 0.00 C ATOM 1075 CG TRP A 69 8.245 3.300 -26.878 1.00 0.00 C ATOM 1076 CD1 TRP A 69 8.131 2.225 -27.691 1.00 0.00 C ATOM 1077 CD2 TRP A 69 6.879 3.677 -26.535 1.00 0.00 C ATOM 1078 NE1 TRP A 69 6.794 1.890 -27.816 1.00 0.00 N ATOM 1079 CE2 TRP A 69 5.989 2.784 -27.184 1.00 0.00 C ATOM 1080 CE3 TRP A 69 6.296 4.712 -25.782 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 4.605 2.912 -27.142 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 4.897 4.856 -25.721 1.00 0.00 C ATOM 1083 CH2 TRP A 69 4.054 3.980 -26.435 1.00 0.00 C ATOM 0 H TRP A 69 10.691 5.622 -25.204 1.00 0.00 H new ATOM 0 HA TRP A 69 9.373 3.288 -24.478 1.00 0.00 H new ATOM 0 HB2 TRP A 69 9.304 5.085 -26.496 1.00 0.00 H new ATOM 0 HB3 TRP A 69 10.238 3.844 -27.308 1.00 0.00 H new ATOM 0 HD1 TRP A 69 8.952 1.710 -28.167 1.00 0.00 H new ATOM 0 HE1 TRP A 69 6.454 1.072 -28.321 1.00 0.00 H new ATOM 0 HE3 TRP A 69 6.928 5.404 -25.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 3.970 2.199 -27.647 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 4.466 5.644 -25.122 1.00 0.00 H new ATOM 0 HH2 TRP A 69 2.985 4.136 -26.434 1.00 0.00 H new ATOM 1094 N ASP A 70 12.369 2.741 -25.599 1.00 0.00 N ATOM 1095 CA ASP A 70 13.445 1.773 -25.771 1.00 0.00 C ATOM 1096 C ASP A 70 13.792 1.093 -24.447 1.00 0.00 C ATOM 1097 O ASP A 70 13.922 -0.129 -24.375 1.00 0.00 O ATOM 1098 CB ASP A 70 14.672 2.471 -26.360 1.00 0.00 C ATOM 1099 CG ASP A 70 15.859 1.494 -26.457 1.00 0.00 C ATOM 1100 OD1 ASP A 70 15.877 0.654 -27.388 1.00 0.00 O ATOM 1101 OD2 ASP A 70 16.785 1.581 -25.617 1.00 0.00 O1- ATOM 0 H ASP A 70 12.688 3.706 -25.685 1.00 0.00 H new ATOM 0 HA ASP A 70 13.111 0.997 -26.459 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.434 2.862 -27.349 1.00 0.00 H new ATOM 0 HB3 ASP A 70 14.946 3.323 -25.738 1.00 0.00 H new ATOM 1106 N GLN A 71 13.873 1.886 -23.378 1.00 0.00 N ATOM 1107 CA GLN A 71 14.187 1.421 -22.035 1.00 0.00 C ATOM 1108 C GLN A 71 13.074 0.591 -21.447 1.00 0.00 C ATOM 1109 O GLN A 71 13.379 -0.299 -20.669 1.00 0.00 O ATOM 1110 CB GLN A 71 14.507 2.601 -21.104 1.00 0.00 C ATOM 1111 CG GLN A 71 15.964 3.048 -21.219 1.00 0.00 C ATOM 1112 CD GLN A 71 16.166 4.381 -20.502 1.00 0.00 C ATOM 1113 OE1 GLN A 71 16.436 4.425 -19.304 1.00 0.00 O ATOM 1114 NE2 GLN A 71 15.985 5.488 -21.206 1.00 0.00 N ATOM 0 H GLN A 71 13.718 2.893 -23.428 1.00 0.00 H new ATOM 0 HA GLN A 71 15.069 0.786 -22.121 1.00 0.00 H new ATOM 0 HB2 GLN A 71 13.852 3.439 -21.343 1.00 0.00 H new ATOM 0 HB3 GLN A 71 14.296 2.316 -20.073 1.00 0.00 H new ATOM 0 HG2 GLN A 71 16.619 2.292 -20.787 1.00 0.00 H new ATOM 0 HG3 GLN A 71 16.240 3.146 -22.269 1.00 0.00 H new ATOM 0 HE21 GLN A 71 15.762 5.430 -22.200 1.00 0.00 H new ATOM 0 HE22 GLN A 71 16.069 6.399 -20.755 1.00 0.00 H new ATOM 1123 N LEU A 72 11.809 0.817 -21.807 1.00 0.00 N ATOM 1124 CA LEU A 72 10.681 0.072 -21.223 1.00 0.00 C ATOM 1125 C LEU A 72 10.854 -1.435 -21.425 1.00 0.00 C ATOM 1126 O LEU A 72 10.429 -2.229 -20.589 1.00 0.00 O ATOM 1127 CB LEU A 72 9.349 0.492 -21.863 1.00 0.00 C ATOM 1128 CG LEU A 72 9.088 2.001 -21.933 1.00 0.00 C ATOM 1129 CD1 LEU A 72 7.731 2.263 -22.583 1.00 0.00 C ATOM 1130 CD2 LEU A 72 9.207 2.702 -20.575 1.00 0.00 C ATOM 0 H LEU A 72 11.535 1.511 -22.502 1.00 0.00 H new ATOM 0 HA LEU A 72 10.667 0.304 -20.158 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.311 0.089 -22.875 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.537 0.028 -21.304 1.00 0.00 H new ATOM 0 HG LEU A 72 9.872 2.436 -22.552 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.551 3.337 -22.630 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.725 1.850 -23.592 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.947 1.789 -21.992 1.00 0.00 H new ATOM 0 HD21 LEU A 72 9.010 3.767 -20.697 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.482 2.276 -19.881 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.213 2.562 -20.180 1.00 0.00 H new ATOM 1142 N ASP A 73 11.502 -1.817 -22.525 1.00 0.00 N ATOM 1143 CA ASP A 73 11.786 -3.211 -22.853 1.00 0.00 C ATOM 1144 C ASP A 73 12.843 -3.794 -21.919 1.00 0.00 C ATOM 1145 O ASP A 73 12.804 -4.987 -21.619 1.00 0.00 O ATOM 1146 CB ASP A 73 12.254 -3.331 -24.303 1.00 0.00 C ATOM 1147 CG ASP A 73 12.553 -4.796 -24.667 1.00 0.00 C ATOM 1148 OD1 ASP A 73 11.595 -5.601 -24.746 1.00 0.00 O ATOM 1149 OD2 ASP A 73 13.737 -5.135 -24.907 1.00 0.00 O1- ATOM 0 H ASP A 73 11.848 -1.157 -23.222 1.00 0.00 H new ATOM 0 HA ASP A 73 10.864 -3.778 -22.724 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.488 -2.936 -24.970 1.00 0.00 H new ATOM 0 HB3 ASP A 73 13.148 -2.726 -24.451 1.00 0.00 H new ATOM 1154 N ASP A 74 13.737 -2.957 -21.391 1.00 0.00 N ATOM 1155 CA ASP A 74 14.817 -3.384 -20.510 1.00 0.00 C ATOM 1156 C ASP A 74 14.323 -3.545 -19.070 1.00 0.00 C ATOM 1157 O ASP A 74 14.902 -4.310 -18.295 1.00 0.00 O ATOM 1158 CB ASP A 74 15.971 -2.375 -20.577 1.00 0.00 C ATOM 1159 CG ASP A 74 17.079 -2.696 -19.561 1.00 0.00 C ATOM 1160 OD1 ASP A 74 17.829 -3.680 -19.769 1.00 0.00 O ATOM 1161 OD2 ASP A 74 17.234 -1.924 -18.583 1.00 0.00 O1- ATOM 0 H ASP A 74 13.729 -1.952 -21.567 1.00 0.00 H new ATOM 0 HA ASP A 74 15.175 -4.357 -20.847 1.00 0.00 H new ATOM 0 HB2 ASP A 74 16.392 -2.372 -21.583 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.587 -1.372 -20.389 1.00 0.00 H new ATOM 1166 N LEU A 75 13.230 -2.857 -18.710 1.00 0.00 N ATOM 1167 CA LEU A 75 12.821 -2.734 -17.320 1.00 0.00 C ATOM 1168 C LEU A 75 12.185 -4.005 -16.803 1.00 0.00 C ATOM 1169 O LEU A 75 11.605 -4.809 -17.534 1.00 0.00 O ATOM 1170 CB LEU A 75 11.872 -1.554 -17.055 1.00 0.00 C ATOM 1171 CG LEU A 75 12.332 -0.249 -17.678 1.00 0.00 C ATOM 1172 CD1 LEU A 75 11.416 0.915 -17.339 1.00 0.00 C ATOM 1173 CD2 LEU A 75 13.788 0.166 -17.454 1.00 0.00 C ATOM 0 H LEU A 75 12.617 -2.379 -19.371 1.00 0.00 H new ATOM 0 HA LEU A 75 13.748 -2.541 -16.779 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.883 -1.801 -17.440 1.00 0.00 H new ATOM 0 HB3 LEU A 75 11.770 -1.416 -15.979 1.00 0.00 H new ATOM 0 HG LEU A 75 12.270 -0.490 -18.739 1.00 0.00 H new ATOM 0 HD11 LEU A 75 11.792 1.823 -17.810 1.00 0.00 H new ATOM 0 HD12 LEU A 75 10.411 0.706 -17.705 1.00 0.00 H new ATOM 0 HD13 LEU A 75 11.387 1.052 -16.258 1.00 0.00 H new ATOM 0 HD21 LEU A 75 13.977 1.116 -17.954 1.00 0.00 H new ATOM 0 HD22 LEU A 75 13.975 0.275 -16.386 1.00 0.00 H new ATOM 0 HD23 LEU A 75 14.451 -0.597 -17.862 1.00 0.00 H new ATOM 1185 N ASN A 76 12.223 -4.099 -15.491 1.00 0.00 N ATOM 1186 CA ASN A 76 11.594 -5.136 -14.698 1.00 0.00 C ATOM 1187 C ASN A 76 10.196 -4.673 -14.300 1.00 0.00 C ATOM 1188 O ASN A 76 10.073 -3.897 -13.354 1.00 0.00 O ATOM 1189 CB ASN A 76 12.458 -5.460 -13.468 1.00 0.00 C ATOM 1190 CG ASN A 76 11.754 -6.459 -12.551 1.00 0.00 C ATOM 1191 OD1 ASN A 76 11.728 -7.655 -12.824 1.00 0.00 O ATOM 1192 ND2 ASN A 76 11.134 -5.993 -11.476 1.00 0.00 N ATOM 0 H ASN A 76 12.720 -3.418 -14.917 1.00 0.00 H new ATOM 0 HA ASN A 76 11.504 -6.053 -15.280 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.416 -5.869 -13.790 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.671 -4.544 -12.918 1.00 0.00 H new ATOM 0 HD21 ASN A 76 10.627 -6.631 -10.863 1.00 0.00 H new ATOM 0 HD22 ASN A 76 11.164 -4.996 -11.262 1.00 0.00 H new ATOM 1199 N LEU A 77 9.145 -5.129 -15.001 1.00 0.00 N ATOM 1200 CA LEU A 77 7.748 -4.830 -14.655 1.00 0.00 C ATOM 1201 C LEU A 77 6.922 -6.063 -14.330 1.00 0.00 C ATOM 1202 O LEU A 77 5.705 -5.986 -14.192 1.00 0.00 O ATOM 1203 CB LEU A 77 7.019 -3.981 -15.721 1.00 0.00 C ATOM 1204 CG LEU A 77 7.799 -2.833 -16.368 1.00 0.00 C ATOM 1205 CD1 LEU A 77 6.961 -2.208 -17.488 1.00 0.00 C ATOM 1206 CD2 LEU A 77 8.181 -1.734 -15.378 1.00 0.00 C ATOM 0 H LEU A 77 9.242 -5.718 -15.828 1.00 0.00 H new ATOM 0 HA LEU A 77 7.831 -4.235 -13.746 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.687 -4.651 -16.514 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.124 -3.562 -15.262 1.00 0.00 H new ATOM 0 HG LEU A 77 8.721 -3.265 -16.756 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.518 -1.391 -17.947 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.739 -2.964 -18.241 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.029 -1.824 -17.074 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.731 -0.950 -15.899 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.278 -1.312 -14.937 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.807 -2.155 -14.591 1.00 0.00 H new ATOM 1218 N GLU A 78 7.585 -7.196 -14.216 1.00 0.00 N ATOM 1219 CA GLU A 78 6.911 -8.476 -14.076 1.00 0.00 C ATOM 1220 C GLU A 78 6.134 -8.481 -12.758 1.00 0.00 C ATOM 1221 O GLU A 78 6.697 -8.266 -11.681 1.00 0.00 O ATOM 1222 CB GLU A 78 7.897 -9.652 -14.164 1.00 0.00 C ATOM 1223 CG GLU A 78 8.407 -9.875 -15.594 1.00 0.00 C ATOM 1224 CD GLU A 78 9.381 -11.067 -15.661 1.00 0.00 C ATOM 1225 OE1 GLU A 78 8.917 -12.234 -15.699 1.00 0.00 O1- ATOM 1226 OE2 GLU A 78 10.618 -10.850 -15.695 1.00 0.00 O ATOM 0 H GLU A 78 8.603 -7.258 -14.217 1.00 0.00 H new ATOM 0 HA GLU A 78 6.213 -8.607 -14.903 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.743 -9.464 -13.503 1.00 0.00 H new ATOM 0 HB3 GLU A 78 7.410 -10.560 -13.808 1.00 0.00 H new ATOM 0 HG2 GLU A 78 7.563 -10.054 -16.260 1.00 0.00 H new ATOM 0 HG3 GLU A 78 8.907 -8.974 -15.949 1.00 0.00 H new ATOM 1233 N GLY A 79 4.825 -8.700 -12.861 1.00 0.00 N ATOM 1234 CA GLY A 79 3.897 -8.741 -11.742 1.00 0.00 C ATOM 1235 C GLY A 79 3.521 -7.376 -11.181 1.00 0.00 C ATOM 1236 O GLY A 79 2.891 -7.304 -10.126 1.00 0.00 O ATOM 0 H GLY A 79 4.369 -8.859 -13.759 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.988 -9.252 -12.059 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.337 -9.339 -10.944 1.00 0.00 H new ATOM 1240 N LYS A 80 3.854 -6.294 -11.882 1.00 0.00 N ATOM 1241 CA LYS A 80 3.458 -4.946 -11.507 1.00 0.00 C ATOM 1242 C LYS A 80 2.070 -4.658 -11.994 1.00 0.00 C ATOM 1243 O LYS A 80 1.676 -5.121 -13.064 1.00 0.00 O ATOM 1244 CB LYS A 80 4.407 -3.871 -12.053 1.00 0.00 C ATOM 1245 CG LYS A 80 5.732 -3.985 -11.324 1.00 0.00 C ATOM 1246 CD LYS A 80 6.595 -2.748 -11.567 1.00 0.00 C ATOM 1247 CE LYS A 80 8.042 -2.949 -11.103 1.00 0.00 C ATOM 1248 NZ LYS A 80 8.171 -3.137 -9.629 1.00 0.00 N1+ ATOM 0 H LYS A 80 4.412 -6.333 -12.735 1.00 0.00 H new ATOM 0 HA LYS A 80 3.499 -4.906 -10.418 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.552 -4.003 -13.125 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.979 -2.879 -11.909 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.555 -4.106 -10.255 1.00 0.00 H new ATOM 0 HG3 LYS A 80 6.262 -4.876 -11.662 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.587 -2.505 -12.629 1.00 0.00 H new ATOM 0 HD3 LYS A 80 6.162 -1.897 -11.042 1.00 0.00 H new ATOM 0 HE2 LYS A 80 8.461 -3.818 -11.611 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.636 -2.086 -11.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 9.159 -2.980 -9.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.557 -2.457 -9.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.887 -4.105 -9.376 1.00 0.00 H new ATOM 1262 N ILE A 81 1.352 -3.850 -11.228 1.00 0.00 N ATOM 1263 CA ILE A 81 0.109 -3.287 -11.733 1.00 0.00 C ATOM 1264 C ILE A 81 0.461 -2.089 -12.606 1.00 0.00 C ATOM 1265 O ILE A 81 1.330 -1.295 -12.250 1.00 0.00 O ATOM 1266 CB ILE A 81 -0.905 -2.970 -10.624 1.00 0.00 C ATOM 1267 CG1 ILE A 81 -1.296 -4.247 -9.849 1.00 0.00 C ATOM 1268 CG2 ILE A 81 -2.155 -2.399 -11.305 1.00 0.00 C ATOM 1269 CD1 ILE A 81 -1.283 -4.145 -8.325 1.00 0.00 C ATOM 0 H ILE A 81 1.600 -3.575 -10.278 1.00 0.00 H new ATOM 0 HA ILE A 81 -0.411 -4.028 -12.340 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.470 -2.265 -9.916 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.296 -4.545 -10.163 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -0.617 -5.047 -10.144 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -2.903 -2.159 -10.550 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -1.890 -1.495 -11.853 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -2.561 -3.137 -11.997 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.575 -5.103 -7.894 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -0.280 -3.885 -7.986 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -1.985 -3.375 -8.006 1.00 0.00 H new ATOM 1281 N VAL A 82 -0.230 -1.948 -13.728 1.00 0.00 N ATOM 1282 CA VAL A 82 -0.127 -0.824 -14.629 1.00 0.00 C ATOM 1283 C VAL A 82 -1.531 -0.326 -14.971 1.00 0.00 C ATOM 1284 O VAL A 82 -2.349 -1.095 -15.466 1.00 0.00 O ATOM 1285 CB VAL A 82 0.690 -1.225 -15.873 1.00 0.00 C ATOM 1286 CG1 VAL A 82 0.810 -0.066 -16.872 1.00 0.00 C ATOM 1287 CG2 VAL A 82 2.104 -1.673 -15.475 1.00 0.00 C ATOM 0 H VAL A 82 -0.904 -2.646 -14.043 1.00 0.00 H new ATOM 0 HA VAL A 82 0.406 0.002 -14.157 1.00 0.00 H new ATOM 0 HB VAL A 82 0.156 -2.049 -16.346 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.393 -0.388 -17.735 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.185 0.237 -17.199 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.307 0.777 -16.393 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.663 -1.951 -16.369 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.615 -0.855 -14.967 1.00 0.00 H new ATOM 0 HG23 VAL A 82 2.039 -2.531 -14.806 1.00 0.00 H new ATOM 1297 N ALA A 83 -1.829 0.950 -14.737 1.00 0.00 N ATOM 1298 CA ALA A 83 -3.018 1.588 -15.252 1.00 0.00 C ATOM 1299 C ALA A 83 -2.611 2.484 -16.418 1.00 0.00 C ATOM 1300 O ALA A 83 -1.871 3.443 -16.205 1.00 0.00 O ATOM 1301 CB ALA A 83 -3.726 2.343 -14.131 1.00 0.00 C ATOM 0 H ALA A 83 -1.240 1.568 -14.178 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.734 0.856 -15.626 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.622 2.822 -14.525 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.005 1.645 -13.342 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.057 3.102 -13.725 1.00 0.00 H new ATOM 1307 N LEU A 84 -3.060 2.194 -17.638 1.00 0.00 N ATOM 1308 CA LEU A 84 -2.821 3.084 -18.773 1.00 0.00 C ATOM 1309 C LEU A 84 -3.916 4.122 -18.907 1.00 0.00 C ATOM 1310 O LEU A 84 -5.100 3.820 -18.774 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.674 2.315 -20.097 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.384 1.492 -20.229 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -1.275 0.883 -21.625 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -0.146 2.361 -19.974 1.00 0.00 C ATOM 0 H LEU A 84 -3.590 1.353 -17.866 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.877 3.589 -18.567 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.527 1.646 -20.208 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.719 3.028 -20.921 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.427 0.699 -19.483 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.355 0.304 -21.698 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.129 0.231 -21.805 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.263 1.679 -22.369 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.753 1.752 -20.074 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.116 3.174 -20.700 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.193 2.775 -18.967 1.00 0.00 H new ATOM 1326 N TYR A 85 -3.515 5.334 -19.266 1.00 0.00 N ATOM 1327 CA TYR A 85 -4.407 6.411 -19.662 1.00 0.00 C ATOM 1328 C TYR A 85 -3.776 7.156 -20.830 1.00 0.00 C ATOM 1329 O TYR A 85 -2.586 6.997 -21.101 1.00 0.00 O ATOM 1330 CB TYR A 85 -4.707 7.326 -18.469 1.00 0.00 C ATOM 1331 CG TYR A 85 -3.634 8.310 -18.059 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -2.523 7.885 -17.306 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -3.768 9.665 -18.414 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -1.541 8.813 -16.910 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -2.795 10.595 -18.016 1.00 0.00 C ATOM 1336 CZ TYR A 85 -1.686 10.175 -17.258 1.00 0.00 C ATOM 1337 OH TYR A 85 -0.732 11.082 -16.931 1.00 0.00 O ATOM 0 H TYR A 85 -2.531 5.601 -19.290 1.00 0.00 H new ATOM 0 HA TYR A 85 -5.368 6.013 -19.989 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.612 7.890 -18.696 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -4.932 6.695 -17.609 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -2.424 6.845 -17.032 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -4.620 9.990 -18.993 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -0.682 8.486 -16.343 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -2.897 11.634 -18.292 1.00 0.00 H new ATOM 0 HH TYR A 85 -1.000 11.969 -17.251 1.00 0.00 H new ATOM 1347 N GLY A 86 -4.545 7.949 -21.562 1.00 0.00 N ATOM 1348 CA GLY A 86 -3.976 8.754 -22.623 1.00 0.00 C ATOM 1349 C GLY A 86 -4.898 9.862 -23.065 1.00 0.00 C ATOM 1350 O GLY A 86 -6.015 9.996 -22.559 1.00 0.00 O ATOM 0 H GLY A 86 -5.553 8.049 -21.440 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.034 9.184 -22.283 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.746 8.115 -23.476 1.00 0.00 H new ATOM 1354 N LEU A 87 -4.419 10.645 -24.029 1.00 0.00 N ATOM 1355 CA LEU A 87 -5.122 11.802 -24.568 1.00 0.00 C ATOM 1356 C LEU A 87 -5.268 11.630 -26.075 1.00 0.00 C ATOM 1357 O LEU A 87 -4.402 11.013 -26.706 1.00 0.00 O ATOM 1358 CB LEU A 87 -4.358 13.113 -24.296 1.00 0.00 C ATOM 1359 CG LEU A 87 -3.753 13.295 -22.895 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -3.055 14.645 -22.849 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -4.786 13.263 -21.770 1.00 0.00 C ATOM 0 H LEU A 87 -3.511 10.487 -24.465 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.095 11.864 -24.080 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.552 13.192 -25.025 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.038 13.945 -24.481 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.072 12.460 -22.733 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.618 14.795 -21.862 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.268 14.674 -23.603 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.778 15.436 -23.049 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.285 13.398 -20.812 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.509 14.065 -21.917 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.302 12.303 -21.777 1.00 0.00 H new ATOM 1373 N GLY A 88 -6.302 12.234 -26.648 1.00 0.00 N ATOM 1374 CA GLY A 88 -6.503 12.303 -28.080 1.00 0.00 C ATOM 1375 C GLY A 88 -7.476 13.422 -28.451 1.00 0.00 C ATOM 1376 O GLY A 88 -7.758 14.313 -27.644 1.00 0.00 O ATOM 0 H GLY A 88 -7.037 12.698 -26.114 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.547 12.470 -28.576 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.887 11.349 -28.442 1.00 0.00 H new ATOM 1380 N ASP A 89 -8.005 13.364 -29.672 1.00 0.00 N ATOM 1381 CA ASP A 89 -9.051 14.224 -30.211 1.00 0.00 C ATOM 1382 C ASP A 89 -9.863 13.351 -31.166 1.00 0.00 C ATOM 1383 O ASP A 89 -9.307 12.829 -32.133 1.00 0.00 O ATOM 1384 CB ASP A 89 -8.451 15.447 -30.911 1.00 0.00 C ATOM 1385 CG ASP A 89 -9.401 16.163 -31.898 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -10.624 15.883 -31.934 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -8.897 17.035 -32.646 1.00 0.00 O1- ATOM 0 H ASP A 89 -7.693 12.671 -30.352 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.689 14.625 -29.424 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -8.133 16.162 -30.152 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -7.557 15.136 -31.451 1.00 0.00 H new ATOM 1392 N GLN A 90 -11.150 13.137 -30.879 1.00 0.00 N ATOM 1393 CA GLN A 90 -11.963 12.177 -31.613 1.00 0.00 C ATOM 1394 C GLN A 90 -12.557 12.799 -32.873 1.00 0.00 C ATOM 1395 O GLN A 90 -12.819 12.101 -33.849 1.00 0.00 O ATOM 1396 CB GLN A 90 -13.037 11.550 -30.696 1.00 0.00 C ATOM 1397 CG GLN A 90 -14.314 12.392 -30.513 1.00 0.00 C ATOM 1398 CD GLN A 90 -14.793 12.504 -29.072 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -14.005 13.172 -28.248 1.00 0.00 O flip ATOM 1400 NE2 GLN A 90 -15.896 12.094 -28.714 1.00 0.00 N flip ATOM 0 H GLN A 90 -11.651 13.623 -30.135 1.00 0.00 H new ATOM 0 HA GLN A 90 -11.317 11.365 -31.946 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.317 10.578 -31.102 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.595 11.371 -29.716 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.132 13.394 -30.902 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -15.111 11.956 -31.115 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -16.486 11.581 -29.369 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -16.220 12.267 -27.763 1.00 0.00 H new ATOM 1409 N LEU A 91 -12.785 14.112 -32.843 1.00 0.00 N ATOM 1410 CA LEU A 91 -13.369 14.840 -33.950 1.00 0.00 C ATOM 1411 C LEU A 91 -12.360 14.978 -35.082 1.00 0.00 C ATOM 1412 O LEU A 91 -12.691 14.747 -36.247 1.00 0.00 O ATOM 1413 CB LEU A 91 -13.844 16.224 -33.485 1.00 0.00 C ATOM 1414 CG LEU A 91 -14.989 16.177 -32.458 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -15.338 17.609 -32.033 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -16.257 15.489 -32.978 1.00 0.00 C ATOM 0 H LEU A 91 -12.564 14.698 -32.038 1.00 0.00 H new ATOM 0 HA LEU A 91 -14.230 14.283 -34.319 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -13.000 16.760 -33.050 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -14.171 16.796 -34.353 1.00 0.00 H new ATOM 0 HG LEU A 91 -14.631 15.583 -31.617 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -16.149 17.585 -31.305 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -14.462 18.079 -31.586 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -15.651 18.182 -32.906 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -17.019 15.494 -32.199 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -16.628 16.023 -33.853 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -16.026 14.460 -33.253 1.00 0.00 H new ATOM 1428 N GLY A 92 -11.131 15.350 -34.733 1.00 0.00 N ATOM 1429 CA GLY A 92 -10.056 15.541 -35.688 1.00 0.00 C ATOM 1430 C GLY A 92 -9.386 14.219 -36.057 1.00 0.00 C ATOM 1431 O GLY A 92 -9.029 14.027 -37.222 1.00 0.00 O ATOM 0 H GLY A 92 -10.856 15.528 -33.767 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.449 16.014 -36.588 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.314 16.221 -35.269 1.00 0.00 H new ATOM 1435 N TYR A 93 -9.254 13.297 -35.091 1.00 0.00 N ATOM 1436 CA TYR A 93 -8.413 12.115 -35.223 1.00 0.00 C ATOM 1437 C TYR A 93 -9.091 10.829 -34.733 1.00 0.00 C ATOM 1438 O TYR A 93 -8.410 9.971 -34.178 1.00 0.00 O ATOM 1439 CB TYR A 93 -7.046 12.350 -34.540 1.00 0.00 C ATOM 1440 CG TYR A 93 -6.339 13.627 -34.947 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -6.692 14.840 -34.335 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -5.359 13.616 -35.955 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -6.116 16.047 -34.756 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -4.764 14.819 -36.378 1.00 0.00 C ATOM 1445 CZ TYR A 93 -5.153 16.047 -35.792 1.00 0.00 C ATOM 1446 OH TYR A 93 -4.631 17.232 -36.231 1.00 0.00 O ATOM 0 H TYR A 93 -9.734 13.358 -34.193 1.00 0.00 H new ATOM 0 HA TYR A 93 -8.244 11.958 -36.288 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -7.193 12.362 -33.460 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -6.395 11.505 -34.763 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -7.414 14.844 -33.532 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -5.062 12.681 -36.406 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -6.408 16.976 -34.289 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -4.010 14.805 -37.151 1.00 0.00 H new ATOM 0 HH TYR A 93 -3.982 17.059 -36.945 1.00 0.00 H new ATOM 1456 N GLY A 94 -10.397 10.641 -34.958 1.00 0.00 N ATOM 1457 CA GLY A 94 -11.123 9.438 -34.534 1.00 0.00 C ATOM 1458 C GLY A 94 -10.459 8.173 -35.067 1.00 0.00 C ATOM 1459 O GLY A 94 -10.270 7.223 -34.314 1.00 0.00 O ATOM 0 H GLY A 94 -10.982 11.322 -35.441 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.163 9.399 -33.445 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.152 9.488 -34.889 1.00 0.00 H new ATOM 1463 N GLU A 95 -9.976 8.196 -36.314 1.00 0.00 N ATOM 1464 CA GLU A 95 -9.327 7.031 -36.928 1.00 0.00 C ATOM 1465 C GLU A 95 -8.043 6.604 -36.182 1.00 0.00 C ATOM 1466 O GLU A 95 -7.581 5.474 -36.366 1.00 0.00 O ATOM 1467 CB GLU A 95 -8.998 7.320 -38.401 1.00 0.00 C ATOM 1468 CG GLU A 95 -10.215 7.380 -39.331 1.00 0.00 C ATOM 1469 CD GLU A 95 -10.827 5.988 -39.581 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -10.308 5.243 -40.451 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -11.837 5.638 -38.926 1.00 0.00 O ATOM 0 H GLU A 95 -10.023 9.014 -36.922 1.00 0.00 H new ATOM 0 HA GLU A 95 -10.034 6.204 -36.861 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.466 8.269 -38.460 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.318 6.550 -38.765 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -10.971 8.034 -38.896 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.921 7.822 -40.283 1.00 0.00 H new ATOM 1478 N TRP A 96 -7.481 7.484 -35.341 1.00 0.00 N ATOM 1479 CA TRP A 96 -6.263 7.276 -34.573 1.00 0.00 C ATOM 1480 C TRP A 96 -6.447 7.609 -33.085 1.00 0.00 C ATOM 1481 O TRP A 96 -5.458 7.776 -32.370 1.00 0.00 O ATOM 1482 CB TRP A 96 -5.101 8.066 -35.187 1.00 0.00 C ATOM 1483 CG TRP A 96 -4.944 7.977 -36.675 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -4.175 7.101 -37.362 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -5.604 8.798 -37.682 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -4.322 7.325 -38.719 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -5.201 8.354 -38.972 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -6.513 9.872 -37.623 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -5.680 8.943 -40.149 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -6.986 10.491 -38.800 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -6.574 10.024 -40.061 1.00 0.00 C ATOM 0 H TRP A 96 -7.891 8.403 -35.176 1.00 0.00 H new ATOM 0 HA TRP A 96 -6.021 6.214 -34.622 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -5.223 9.116 -34.919 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -4.175 7.724 -34.725 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -3.544 6.344 -36.919 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -3.839 6.793 -39.443 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -6.854 10.228 -36.662 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -5.366 8.571 -41.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -7.667 11.327 -38.732 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -6.944 10.495 -40.960 1.00 0.00 H new ATOM 1502 N PHE A 97 -7.683 7.773 -32.614 1.00 0.00 N ATOM 1503 CA PHE A 97 -8.038 7.999 -31.230 1.00 0.00 C ATOM 1504 C PHE A 97 -7.262 7.053 -30.334 1.00 0.00 C ATOM 1505 O PHE A 97 -7.304 5.844 -30.560 1.00 0.00 O ATOM 1506 CB PHE A 97 -9.553 7.832 -31.025 1.00 0.00 C ATOM 1507 CG PHE A 97 -10.097 8.611 -29.850 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -9.812 9.985 -29.754 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -10.897 7.990 -28.874 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -10.273 10.722 -28.649 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -11.413 8.743 -27.804 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.086 10.103 -27.683 1.00 0.00 C ATOM 0 H PHE A 97 -8.499 7.749 -33.226 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.775 9.022 -30.962 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -10.070 8.149 -31.931 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.777 6.775 -30.884 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -9.239 10.474 -30.529 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -11.115 6.935 -28.946 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -10.003 11.762 -28.542 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -12.060 8.276 -27.076 1.00 0.00 H new ATOM 0 HZ PHE A 97 -11.460 10.675 -26.846 1.00 0.00 H new ATOM 1522 N LEU A 98 -6.566 7.604 -29.335 1.00 0.00 N ATOM 1523 CA LEU A 98 -5.839 6.861 -28.302 1.00 0.00 C ATOM 1524 C LEU A 98 -4.900 5.794 -28.870 1.00 0.00 C ATOM 1525 O LEU A 98 -4.589 4.812 -28.208 1.00 0.00 O ATOM 1526 CB LEU A 98 -6.806 6.315 -27.242 1.00 0.00 C ATOM 1527 CG LEU A 98 -7.240 7.290 -26.144 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -6.090 7.919 -25.364 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -8.135 8.423 -26.637 1.00 0.00 C ATOM 0 H LEU A 98 -6.491 8.615 -29.220 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.176 7.567 -27.803 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.700 5.954 -27.750 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.339 5.452 -26.767 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.807 6.638 -25.479 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.490 8.595 -24.608 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.508 7.135 -24.879 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.449 8.477 -26.047 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.398 9.069 -25.800 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.604 9.004 -27.391 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.043 8.006 -27.073 1.00 0.00 H new ATOM 1541 N ASP A 99 -4.425 5.954 -30.093 1.00 0.00 N ATOM 1542 CA ASP A 99 -3.687 4.892 -30.778 1.00 0.00 C ATOM 1543 C ASP A 99 -2.406 4.546 -30.017 1.00 0.00 C ATOM 1544 O ASP A 99 -2.101 3.368 -29.810 1.00 0.00 O ATOM 1545 CB ASP A 99 -3.432 5.269 -32.233 1.00 0.00 C ATOM 1546 CG ASP A 99 -2.614 4.192 -32.961 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -1.368 4.198 -32.851 1.00 0.00 O ATOM 1548 OD2 ASP A 99 -3.224 3.375 -33.690 1.00 0.00 O1- ATOM 0 H ASP A 99 -4.534 6.809 -30.638 1.00 0.00 H new ATOM 0 HA ASP A 99 -4.294 3.987 -30.792 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -4.384 5.412 -32.745 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.902 6.220 -32.275 1.00 0.00 H new ATOM 1553 N ALA A 100 -1.748 5.559 -29.441 1.00 0.00 N ATOM 1554 CA ALA A 100 -0.581 5.372 -28.592 1.00 0.00 C ATOM 1555 C ALA A 100 -0.909 4.551 -27.339 1.00 0.00 C ATOM 1556 O ALA A 100 -0.065 3.792 -26.863 1.00 0.00 O ATOM 1557 CB ALA A 100 0.002 6.736 -28.209 1.00 0.00 C ATOM 0 H ALA A 100 -2.018 6.536 -29.556 1.00 0.00 H new ATOM 0 HA ALA A 100 0.161 4.807 -29.157 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.876 6.593 -27.573 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.294 7.273 -29.111 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.748 7.314 -27.670 1.00 0.00 H new ATOM 1563 N LEU A 101 -2.130 4.673 -26.807 1.00 0.00 N ATOM 1564 CA LEU A 101 -2.608 3.900 -25.670 1.00 0.00 C ATOM 1565 C LEU A 101 -2.601 2.416 -25.987 1.00 0.00 C ATOM 1566 O LEU A 101 -2.113 1.615 -25.192 1.00 0.00 O ATOM 1567 CB LEU A 101 -4.035 4.350 -25.317 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.498 3.966 -23.916 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -3.717 4.728 -22.872 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -5.984 4.312 -23.758 1.00 0.00 C ATOM 0 H LEU A 101 -2.824 5.328 -27.167 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.945 4.072 -24.822 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.095 5.433 -25.420 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.726 3.922 -26.043 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.337 2.897 -23.780 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.061 4.441 -21.878 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.656 4.496 -22.970 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.869 5.798 -23.013 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.317 4.038 -22.757 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.126 5.382 -23.908 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -6.566 3.762 -24.497 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.115 2.067 -27.165 1.00 0.00 N ATOM 1583 CA GLY A 102 -3.118 0.691 -27.635 1.00 0.00 C ATOM 1584 C GLY A 102 -1.687 0.196 -27.803 1.00 0.00 C ATOM 1585 O GLY A 102 -1.376 -0.919 -27.384 1.00 0.00 O ATOM 0 H GLY A 102 -3.538 2.730 -27.815 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -3.650 0.057 -26.926 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.649 0.623 -28.584 1.00 0.00 H new ATOM 1589 N MET A 103 -0.794 1.046 -28.330 1.00 0.00 N ATOM 1590 CA MET A 103 0.605 0.671 -28.491 1.00 0.00 C ATOM 1591 C MET A 103 1.264 0.376 -27.151 1.00 0.00 C ATOM 1592 O MET A 103 1.909 -0.663 -27.024 1.00 0.00 O ATOM 1593 CB MET A 103 1.405 1.687 -29.316 1.00 0.00 C ATOM 1594 CG MET A 103 0.902 1.785 -30.762 1.00 0.00 C ATOM 1595 SD MET A 103 2.176 2.228 -31.976 1.00 0.00 S ATOM 1596 CE MET A 103 2.549 3.908 -31.419 1.00 0.00 C ATOM 0 H MET A 103 -1.020 1.989 -28.648 1.00 0.00 H new ATOM 0 HA MET A 103 0.612 -0.254 -29.068 1.00 0.00 H new ATOM 0 HB2 MET A 103 1.340 2.667 -28.844 1.00 0.00 H new ATOM 0 HB3 MET A 103 2.457 1.403 -29.318 1.00 0.00 H new ATOM 0 HG2 MET A 103 0.465 0.828 -31.046 1.00 0.00 H new ATOM 0 HG3 MET A 103 0.104 2.526 -30.806 1.00 0.00 H new ATOM 0 HE1 MET A 103 3.465 4.255 -31.897 1.00 0.00 H new ATOM 0 HE2 MET A 103 1.727 4.571 -31.687 1.00 0.00 H new ATOM 0 HE3 MET A 103 2.680 3.912 -30.337 1.00 0.00 H new ATOM 1606 N LEU A 104 1.068 1.213 -26.128 1.00 0.00 N ATOM 1607 CA LEU A 104 1.650 0.902 -24.833 1.00 0.00 C ATOM 1608 C LEU A 104 1.045 -0.348 -24.229 1.00 0.00 C ATOM 1609 O LEU A 104 1.734 -1.066 -23.515 1.00 0.00 O ATOM 1610 CB LEU A 104 1.519 2.025 -23.796 1.00 0.00 C ATOM 1611 CG LEU A 104 2.811 2.826 -23.579 1.00 0.00 C ATOM 1612 CD1 LEU A 104 2.732 3.626 -22.286 1.00 0.00 C ATOM 1613 CD2 LEU A 104 4.091 1.994 -23.572 1.00 0.00 C ATOM 0 H LEU A 104 0.530 2.079 -26.172 1.00 0.00 H new ATOM 0 HA LEU A 104 2.708 0.758 -25.053 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.729 2.707 -24.111 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.207 1.593 -22.845 1.00 0.00 H new ATOM 0 HG LEU A 104 2.878 3.484 -24.445 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.656 4.187 -22.148 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.891 4.318 -22.337 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.592 2.946 -21.446 1.00 0.00 H new ATOM 0 HD21 LEU A 104 4.949 2.647 -23.412 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.042 1.257 -22.770 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.198 1.482 -24.529 1.00 0.00 H new ATOM 1625 N HIS A 105 -0.233 -0.603 -24.472 1.00 0.00 N ATOM 1626 CA HIS A 105 -0.868 -1.761 -23.864 1.00 0.00 C ATOM 1627 C HIS A 105 -0.187 -3.050 -24.339 1.00 0.00 C ATOM 1628 O HIS A 105 0.101 -3.931 -23.538 1.00 0.00 O ATOM 1629 CB HIS A 105 -2.377 -1.741 -24.119 1.00 0.00 C ATOM 1630 CG HIS A 105 -3.128 -2.380 -22.984 1.00 0.00 C ATOM 1631 ND1 HIS A 105 -3.651 -1.697 -21.891 1.00 0.00 N ATOM 1632 CD2 HIS A 105 -3.312 -3.714 -22.801 1.00 0.00 C ATOM 1633 CE1 HIS A 105 -4.159 -2.634 -21.082 1.00 0.00 C ATOM 1634 NE2 HIS A 105 -3.990 -3.857 -21.610 1.00 0.00 N ATOM 0 H HIS A 105 -0.837 -0.039 -25.070 1.00 0.00 H new ATOM 0 HA HIS A 105 -0.741 -1.723 -22.782 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -2.713 -0.712 -24.248 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.599 -2.267 -25.047 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -2.990 -4.507 -23.460 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -4.639 -2.434 -20.135 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -4.307 -4.736 -21.202 1.00 0.00 H new ATOM 1642 N ASP A 106 0.176 -3.105 -25.621 1.00 0.00 N ATOM 1643 CA ASP A 106 0.931 -4.185 -26.249 1.00 0.00 C ATOM 1644 C ASP A 106 2.406 -4.176 -25.836 1.00 0.00 C ATOM 1645 O ASP A 106 3.019 -5.220 -25.615 1.00 0.00 O ATOM 1646 CB ASP A 106 0.814 -4.073 -27.770 1.00 0.00 C ATOM 1647 CG ASP A 106 1.675 -5.145 -28.461 1.00 0.00 C ATOM 1648 OD1 ASP A 106 1.230 -6.314 -28.547 1.00 0.00 O ATOM 1649 OD2 ASP A 106 2.782 -4.815 -28.947 1.00 0.00 O1- ATOM 0 H ASP A 106 -0.060 -2.362 -26.279 1.00 0.00 H new ATOM 0 HA ASP A 106 0.505 -5.129 -25.909 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -0.228 -4.188 -28.069 1.00 0.00 H new ATOM 0 HB3 ASP A 106 1.131 -3.081 -28.092 1.00 0.00 H new ATOM 1654 N LYS A 107 2.971 -2.977 -25.667 1.00 0.00 N ATOM 1655 CA LYS A 107 4.318 -2.784 -25.151 1.00 0.00 C ATOM 1656 C LYS A 107 4.446 -3.427 -23.781 1.00 0.00 C ATOM 1657 O LYS A 107 5.443 -4.086 -23.517 1.00 0.00 O ATOM 1658 CB LYS A 107 4.649 -1.292 -25.124 1.00 0.00 C ATOM 1659 CG LYS A 107 6.088 -1.019 -24.694 1.00 0.00 C ATOM 1660 CD LYS A 107 7.144 -1.626 -25.618 1.00 0.00 C ATOM 1661 CE LYS A 107 8.326 -0.658 -25.782 1.00 0.00 C ATOM 1662 NZ LYS A 107 9.333 -1.147 -26.771 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.493 -2.104 -25.890 1.00 0.00 H new ATOM 0 HA LYS A 107 5.041 -3.270 -25.805 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.483 -0.869 -26.115 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.967 -0.784 -24.442 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.242 0.059 -24.643 1.00 0.00 H new ATOM 0 HG3 LYS A 107 6.235 -1.410 -23.687 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.495 -2.573 -25.208 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.704 -1.843 -26.592 1.00 0.00 H new ATOM 0 HE2 LYS A 107 7.953 0.316 -26.100 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.810 -0.514 -24.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 10.109 -0.459 -26.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.711 -2.063 -26.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 8.880 -1.259 -27.701 1.00 0.00 H new ATOM 1676 N LEU A 108 3.477 -3.207 -22.895 1.00 0.00 N ATOM 1677 CA LEU A 108 3.587 -3.629 -21.508 1.00 0.00 C ATOM 1678 C LEU A 108 2.953 -4.991 -21.258 1.00 0.00 C ATOM 1679 O LEU A 108 3.351 -5.643 -20.298 1.00 0.00 O ATOM 1680 CB LEU A 108 3.093 -2.525 -20.563 1.00 0.00 C ATOM 1681 CG LEU A 108 3.763 -1.163 -20.842 1.00 0.00 C ATOM 1682 CD1 LEU A 108 3.193 -0.126 -19.877 1.00 0.00 C ATOM 1683 CD2 LEU A 108 5.302 -1.191 -20.804 1.00 0.00 C ATOM 0 H LEU A 108 2.601 -2.735 -23.120 1.00 0.00 H new ATOM 0 HA LEU A 108 4.643 -3.778 -21.282 1.00 0.00 H new ATOM 0 HB2 LEU A 108 2.013 -2.422 -20.664 1.00 0.00 H new ATOM 0 HB3 LEU A 108 3.290 -2.819 -19.532 1.00 0.00 H new ATOM 0 HG LEU A 108 3.527 -0.891 -21.871 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.659 0.841 -20.065 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.116 -0.044 -20.025 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.396 -0.433 -18.851 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.689 -0.193 -21.011 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.636 -1.513 -19.818 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.672 -1.887 -21.557 1.00 0.00 H new ATOM 1695 N SER A 109 2.066 -5.496 -22.116 1.00 0.00 N ATOM 1696 CA SER A 109 1.498 -6.831 -21.921 1.00 0.00 C ATOM 1697 C SER A 109 2.577 -7.921 -21.949 1.00 0.00 C ATOM 1698 O SER A 109 2.488 -8.902 -21.209 1.00 0.00 O ATOM 1699 CB SER A 109 0.418 -7.098 -22.976 1.00 0.00 C ATOM 1700 OG SER A 109 0.940 -7.012 -24.291 1.00 0.00 O ATOM 0 H SER A 109 1.728 -5.007 -22.945 1.00 0.00 H new ATOM 0 HA SER A 109 1.042 -6.863 -20.932 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.009 -8.088 -22.818 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.392 -6.379 -22.858 1.00 0.00 H new ATOM 0 HG SER A 109 0.226 -7.189 -24.939 1.00 0.00 H new ATOM 1706 N THR A 110 3.646 -7.722 -22.732 1.00 0.00 N ATOM 1707 CA THR A 110 4.718 -8.705 -22.879 1.00 0.00 C ATOM 1708 C THR A 110 5.661 -8.657 -21.660 1.00 0.00 C ATOM 1709 O THR A 110 6.381 -9.614 -21.375 1.00 0.00 O ATOM 1710 CB THR A 110 5.396 -8.487 -24.253 1.00 0.00 C ATOM 1711 OG1 THR A 110 6.059 -9.654 -24.714 1.00 0.00 O ATOM 1712 CG2 THR A 110 6.400 -7.329 -24.250 1.00 0.00 C ATOM 0 H THR A 110 3.788 -6.873 -23.280 1.00 0.00 H new ATOM 0 HA THR A 110 4.336 -9.726 -22.883 1.00 0.00 H new ATOM 0 HB THR A 110 4.578 -8.239 -24.929 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.472 -9.474 -25.584 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.841 -7.227 -25.242 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.888 -6.404 -23.984 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.186 -7.531 -23.522 1.00 0.00 H new ATOM 1720 N LYS A 111 5.619 -7.554 -20.894 1.00 0.00 N ATOM 1721 CA LYS A 111 6.394 -7.348 -19.677 1.00 0.00 C ATOM 1722 C LYS A 111 5.779 -8.076 -18.472 1.00 0.00 C ATOM 1723 O LYS A 111 6.299 -7.944 -17.368 1.00 0.00 O ATOM 1724 CB LYS A 111 6.537 -5.833 -19.424 1.00 0.00 C ATOM 1725 CG LYS A 111 7.140 -5.032 -20.584 1.00 0.00 C ATOM 1726 CD LYS A 111 8.597 -5.402 -20.886 1.00 0.00 C ATOM 1727 CE LYS A 111 9.552 -5.359 -19.673 1.00 0.00 C ATOM 1728 NZ LYS A 111 10.840 -6.075 -19.918 1.00 0.00 N1+ ATOM 0 H LYS A 111 5.021 -6.759 -21.120 1.00 0.00 H new ATOM 0 HA LYS A 111 7.385 -7.781 -19.811 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.553 -5.425 -19.194 1.00 0.00 H new ATOM 0 HB3 LYS A 111 7.158 -5.685 -18.540 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.539 -5.194 -21.479 1.00 0.00 H new ATOM 0 HG3 LYS A 111 7.084 -3.969 -20.350 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.620 -6.406 -21.310 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.976 -4.724 -21.651 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.763 -4.320 -19.420 1.00 0.00 H new ATOM 0 HE3 LYS A 111 9.055 -5.802 -18.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 11.446 -5.998 -19.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.648 -7.078 -20.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 11.325 -5.649 -20.733 1.00 0.00 H new ATOM 1742 N GLY A 112 4.677 -8.806 -18.656 1.00 0.00 N ATOM 1743 CA GLY A 112 4.078 -9.634 -17.614 1.00 0.00 C ATOM 1744 C GLY A 112 3.420 -8.793 -16.528 1.00 0.00 C ATOM 1745 O GLY A 112 3.463 -9.162 -15.355 1.00 0.00 O ATOM 0 H GLY A 112 4.173 -8.837 -19.542 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.336 -10.297 -18.059 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.845 -10.267 -17.168 1.00 0.00 H new ATOM 1749 N VAL A 113 2.864 -7.634 -16.889 1.00 0.00 N ATOM 1750 CA VAL A 113 2.165 -6.752 -15.968 1.00 0.00 C ATOM 1751 C VAL A 113 0.709 -7.211 -15.821 1.00 0.00 C ATOM 1752 O VAL A 113 0.229 -8.059 -16.580 1.00 0.00 O ATOM 1753 CB VAL A 113 2.339 -5.266 -16.363 1.00 0.00 C ATOM 1754 CG1 VAL A 113 3.766 -4.994 -16.855 1.00 0.00 C ATOM 1755 CG2 VAL A 113 1.342 -4.757 -17.415 1.00 0.00 C ATOM 0 H VAL A 113 2.891 -7.282 -17.846 1.00 0.00 H new ATOM 0 HA VAL A 113 2.611 -6.820 -14.976 1.00 0.00 H new ATOM 0 HB VAL A 113 2.133 -4.714 -15.446 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.863 -3.943 -17.127 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.476 -5.231 -16.062 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.975 -5.615 -17.726 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.542 -3.707 -17.627 1.00 0.00 H new ATOM 0 HG22 VAL A 113 1.450 -5.339 -18.330 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.326 -4.863 -17.035 1.00 0.00 H new ATOM 1765 N LYS A 114 -0.004 -6.624 -14.860 1.00 0.00 N ATOM 1766 CA LYS A 114 -1.450 -6.786 -14.704 1.00 0.00 C ATOM 1767 C LYS A 114 -2.059 -5.402 -14.871 1.00 0.00 C ATOM 1768 O LYS A 114 -1.497 -4.448 -14.337 1.00 0.00 O ATOM 1769 CB LYS A 114 -1.776 -7.520 -13.403 1.00 0.00 C ATOM 1770 CG LYS A 114 -1.489 -6.698 -12.147 1.00 0.00 C ATOM 1771 CD LYS A 114 -1.488 -7.593 -10.904 1.00 0.00 C ATOM 1772 CE LYS A 114 -0.053 -7.857 -10.416 1.00 0.00 C ATOM 1773 NZ LYS A 114 0.022 -8.795 -9.258 1.00 0.00 N1+ ATOM 0 H LYS A 114 0.413 -6.013 -14.157 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.897 -7.431 -15.461 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.829 -7.802 -13.409 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.198 -8.443 -13.362 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -0.524 -6.201 -12.244 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.241 -5.916 -12.038 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.065 -7.119 -10.110 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.978 -8.539 -11.132 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.533 -8.263 -11.240 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.406 -6.909 -10.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 1.016 -8.927 -8.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.510 -8.400 -8.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.387 -9.712 -9.527 1.00 0.00 H new ATOM 1787 N PHE A 115 -3.139 -5.253 -15.628 1.00 0.00 N ATOM 1788 CA PHE A 115 -3.671 -3.954 -15.979 1.00 0.00 C ATOM 1789 C PHE A 115 -4.901 -3.621 -15.142 1.00 0.00 C ATOM 1790 O PHE A 115 -5.681 -4.517 -14.805 1.00 0.00 O ATOM 1791 CB PHE A 115 -3.950 -3.856 -17.480 1.00 0.00 C ATOM 1792 CG PHE A 115 -2.714 -3.821 -18.362 1.00 0.00 C ATOM 1793 CD1 PHE A 115 -1.999 -2.617 -18.525 1.00 0.00 C ATOM 1794 CD2 PHE A 115 -2.321 -4.966 -19.080 1.00 0.00 C ATOM 1795 CE1 PHE A 115 -0.936 -2.544 -19.442 1.00 0.00 C ATOM 1796 CE2 PHE A 115 -1.261 -4.891 -20.002 1.00 0.00 C ATOM 1797 CZ PHE A 115 -0.585 -3.677 -20.196 1.00 0.00 C ATOM 0 H PHE A 115 -3.668 -6.035 -16.014 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.914 -3.205 -15.748 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.565 -4.706 -17.776 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -4.537 -2.957 -17.667 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.269 -1.748 -17.943 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -2.834 -5.903 -18.923 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.391 -1.620 -19.567 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -0.968 -5.768 -20.560 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.207 -3.613 -20.927 1.00 0.00 H new ATOM 1807 N VAL A 116 -5.084 -2.334 -14.841 1.00 0.00 N ATOM 1808 CA VAL A 116 -6.313 -1.799 -14.275 1.00 0.00 C ATOM 1809 C VAL A 116 -6.766 -0.628 -15.146 1.00 0.00 C ATOM 1810 O VAL A 116 -6.045 -0.219 -16.063 1.00 0.00 O ATOM 1811 CB VAL A 116 -6.166 -1.440 -12.782 1.00 0.00 C ATOM 1812 CG1 VAL A 116 -5.672 -2.629 -11.952 1.00 0.00 C ATOM 1813 CG2 VAL A 116 -5.291 -0.213 -12.509 1.00 0.00 C ATOM 0 H VAL A 116 -4.366 -1.625 -14.989 1.00 0.00 H new ATOM 0 HA VAL A 116 -7.091 -2.562 -14.286 1.00 0.00 H new ATOM 0 HB VAL A 116 -7.176 -1.177 -12.468 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -5.583 -2.331 -10.907 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -6.382 -3.451 -12.036 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -4.699 -2.951 -12.322 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -5.242 -0.033 -11.435 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.286 -0.390 -12.893 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -5.721 0.658 -13.004 1.00 0.00 H new ATOM 1823 N GLY A 117 -7.927 -0.047 -14.854 1.00 0.00 N ATOM 1824 CA GLY A 117 -8.372 1.148 -15.524 1.00 0.00 C ATOM 1825 C GLY A 117 -8.986 0.919 -16.901 1.00 0.00 C ATOM 1826 O GLY A 117 -8.879 1.811 -17.738 1.00 0.00 O ATOM 0 H GLY A 117 -8.575 -0.398 -14.148 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -9.106 1.649 -14.893 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -7.525 1.826 -15.628 1.00 0.00 H new ATOM 1830 N TYR A 118 -9.649 -0.209 -17.159 1.00 0.00 N ATOM 1831 CA TYR A 118 -10.429 -0.367 -18.383 1.00 0.00 C ATOM 1832 C TYR A 118 -11.693 0.486 -18.252 1.00 0.00 C ATOM 1833 O TYR A 118 -12.192 0.689 -17.147 1.00 0.00 O ATOM 1834 CB TYR A 118 -10.765 -1.847 -18.631 1.00 0.00 C ATOM 1835 CG TYR A 118 -9.570 -2.765 -18.857 1.00 0.00 C ATOM 1836 CD1 TYR A 118 -8.630 -2.460 -19.859 1.00 0.00 C ATOM 1837 CD2 TYR A 118 -9.418 -3.950 -18.108 1.00 0.00 C ATOM 1838 CE1 TYR A 118 -7.564 -3.333 -20.133 1.00 0.00 C ATOM 1839 CE2 TYR A 118 -8.347 -4.826 -18.368 1.00 0.00 C ATOM 1840 CZ TYR A 118 -7.417 -4.525 -19.391 1.00 0.00 C ATOM 1841 OH TYR A 118 -6.389 -5.373 -19.681 1.00 0.00 O ATOM 0 H TYR A 118 -9.661 -1.020 -16.541 1.00 0.00 H new ATOM 0 HA TYR A 118 -9.852 -0.031 -19.245 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -11.331 -2.220 -17.777 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -11.419 -1.912 -19.500 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -8.729 -1.545 -20.424 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -10.128 -4.187 -17.330 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -6.856 -3.092 -20.912 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -8.235 -5.729 -17.786 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.425 -6.147 -19.081 1.00 0.00 H new ATOM 1851 N TRP A 119 -12.224 0.971 -19.370 1.00 0.00 N ATOM 1852 CA TRP A 119 -13.473 1.739 -19.420 1.00 0.00 C ATOM 1853 C TRP A 119 -14.369 1.155 -20.494 1.00 0.00 C ATOM 1854 O TRP A 119 -13.822 0.795 -21.531 1.00 0.00 O ATOM 1855 CB TRP A 119 -13.219 3.192 -19.807 1.00 0.00 C ATOM 1856 CG TRP A 119 -13.031 4.196 -18.725 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -12.358 5.333 -18.958 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -13.596 4.324 -17.372 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -12.405 6.129 -17.844 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -13.189 5.590 -16.854 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -14.441 3.564 -16.528 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -13.583 6.072 -15.599 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -14.836 4.027 -15.258 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -14.412 5.280 -14.790 1.00 0.00 C ATOM 0 H TRP A 119 -11.794 0.841 -20.286 1.00 0.00 H new ATOM 0 HA TRP A 119 -13.928 1.692 -18.431 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -12.331 3.216 -20.438 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -14.056 3.522 -20.422 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -11.856 5.582 -19.881 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -11.914 7.019 -17.760 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -14.793 2.601 -16.868 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -13.252 7.042 -15.258 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.471 3.412 -14.638 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.721 5.631 -13.817 1.00 0.00 H new ATOM 1875 N PRO A 120 -15.699 1.129 -20.348 1.00 0.00 N ATOM 1876 CA PRO A 120 -16.566 0.806 -21.467 1.00 0.00 C ATOM 1877 C PRO A 120 -16.534 1.961 -22.483 1.00 0.00 C ATOM 1878 O PRO A 120 -16.494 3.135 -22.105 1.00 0.00 O ATOM 1879 CB PRO A 120 -17.940 0.553 -20.850 1.00 0.00 C ATOM 1880 CG PRO A 120 -17.944 1.472 -19.628 1.00 0.00 C ATOM 1881 CD PRO A 120 -16.484 1.479 -19.170 1.00 0.00 C ATOM 0 HA PRO A 120 -16.258 -0.076 -22.029 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -18.745 0.799 -21.543 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.070 -0.492 -20.569 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.288 2.474 -19.883 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -18.606 1.097 -18.848 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.199 2.459 -18.786 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -16.323 0.762 -18.365 1.00 0.00 H new ATOM 1889 N THR A 121 -16.556 1.634 -23.773 1.00 0.00 N ATOM 1890 CA THR A 121 -16.509 2.568 -24.890 1.00 0.00 C ATOM 1891 C THR A 121 -17.833 3.311 -25.137 1.00 0.00 C ATOM 1892 O THR A 121 -17.896 4.187 -26.004 1.00 0.00 O ATOM 1893 CB THR A 121 -15.992 1.833 -26.140 1.00 0.00 C ATOM 1894 OG1 THR A 121 -16.870 0.769 -26.472 1.00 0.00 O ATOM 1895 CG2 THR A 121 -14.586 1.251 -25.955 1.00 0.00 C ATOM 0 H THR A 121 -16.610 0.663 -24.080 1.00 0.00 H new ATOM 0 HA THR A 121 -15.811 3.364 -24.632 1.00 0.00 H new ATOM 0 HB THR A 121 -15.949 2.576 -26.936 1.00 0.00 H new ATOM 0 HG1 THR A 121 -16.404 0.127 -27.048 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.278 0.746 -26.870 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.886 2.056 -25.732 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.593 0.537 -25.131 1.00 0.00 H new ATOM 1946 N GLU A 125 -17.583 8.439 -29.330 1.00 0.00 N ATOM 1947 CA GLU A 125 -17.551 8.190 -30.757 1.00 0.00 C ATOM 1948 C GLU A 125 -16.070 8.304 -31.118 1.00 0.00 C ATOM 1949 O GLU A 125 -15.421 9.253 -30.681 1.00 0.00 O ATOM 1950 CB GLU A 125 -18.423 9.213 -31.505 1.00 0.00 C ATOM 1951 CG GLU A 125 -19.849 9.286 -30.936 1.00 0.00 C ATOM 1952 CD GLU A 125 -20.739 10.225 -31.769 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -21.386 9.753 -32.737 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -20.811 11.439 -31.456 1.00 0.00 O ATOM 0 HA GLU A 125 -17.956 7.218 -31.037 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.959 10.197 -31.444 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -18.468 8.946 -32.561 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -20.287 8.288 -30.919 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -19.813 9.636 -29.904 1.00 0.00 H new ATOM 1961 N PHE A 126 -15.500 7.318 -31.819 1.00 0.00 N ATOM 1962 CA PHE A 126 -14.052 7.234 -32.014 1.00 0.00 C ATOM 1963 C PHE A 126 -13.731 6.346 -33.211 1.00 0.00 C ATOM 1964 O PHE A 126 -13.083 6.809 -34.136 1.00 0.00 O ATOM 1965 CB PHE A 126 -13.345 6.730 -30.734 1.00 0.00 C ATOM 1966 CG PHE A 126 -13.727 5.340 -30.243 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -14.990 5.116 -29.665 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -12.848 4.251 -30.421 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -15.395 3.815 -29.321 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -13.255 2.950 -30.081 1.00 0.00 C ATOM 1971 CZ PHE A 126 -14.531 2.730 -29.537 1.00 0.00 C ATOM 0 H PHE A 126 -16.025 6.564 -32.262 1.00 0.00 H new ATOM 0 HA PHE A 126 -13.673 8.235 -32.221 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -12.270 6.744 -30.911 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -13.545 7.441 -29.932 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -15.653 5.949 -29.484 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.858 4.418 -30.820 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -16.372 3.650 -28.890 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -12.585 2.117 -30.238 1.00 0.00 H new ATOM 0 HZ PHE A 126 -14.847 1.728 -29.285 1.00 0.00 H new ATOM 1981 N THR A 127 -14.201 5.091 -33.188 1.00 0.00 N ATOM 1982 CA THR A 127 -14.025 4.044 -34.199 1.00 0.00 C ATOM 1983 C THR A 127 -12.548 3.681 -34.501 1.00 0.00 C ATOM 1984 O THR A 127 -12.262 2.904 -35.417 1.00 0.00 O ATOM 1985 CB THR A 127 -14.986 4.296 -35.385 1.00 0.00 C ATOM 1986 OG1 THR A 127 -15.206 3.149 -36.197 1.00 0.00 O ATOM 1987 CG2 THR A 127 -14.596 5.482 -36.270 1.00 0.00 C ATOM 0 H THR A 127 -14.757 4.758 -32.400 1.00 0.00 H new ATOM 0 HA THR A 127 -14.341 3.083 -33.793 1.00 0.00 H new ATOM 0 HB THR A 127 -15.923 4.548 -34.888 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.375 2.634 -36.267 1.00 0.00 H new ATOM 0 HG21 THR A 127 -15.322 5.588 -37.076 1.00 0.00 H new ATOM 0 HG22 THR A 127 -14.582 6.393 -35.672 1.00 0.00 H new ATOM 0 HG23 THR A 127 -13.606 5.310 -36.693 1.00 0.00 H new ATOM 1995 N SER A 128 -11.600 4.167 -33.687 1.00 0.00 N ATOM 1996 CA SER A 128 -10.215 3.695 -33.701 1.00 0.00 C ATOM 1997 C SER A 128 -10.233 2.212 -33.302 1.00 0.00 C ATOM 1998 O SER A 128 -10.844 1.883 -32.282 1.00 0.00 O ATOM 1999 CB SER A 128 -9.346 4.490 -32.718 1.00 0.00 C ATOM 2000 OG SER A 128 -7.995 4.068 -32.754 1.00 0.00 O ATOM 0 H SER A 128 -11.776 4.900 -33.000 1.00 0.00 H new ATOM 0 HA SER A 128 -9.787 3.831 -34.694 1.00 0.00 H new ATOM 0 HB2 SER A 128 -9.402 5.552 -32.959 1.00 0.00 H new ATOM 0 HB3 SER A 128 -9.738 4.371 -31.708 1.00 0.00 H new ATOM 0 HG SER A 128 -7.407 4.849 -32.693 1.00 0.00 H new ATOM 2006 N PRO A 129 -9.558 1.309 -34.035 1.00 0.00 N ATOM 2007 CA PRO A 129 -9.532 -0.110 -33.697 1.00 0.00 C ATOM 2008 C PRO A 129 -8.458 -0.455 -32.651 1.00 0.00 C ATOM 2009 O PRO A 129 -8.464 -1.560 -32.109 1.00 0.00 O ATOM 2010 CB PRO A 129 -9.259 -0.807 -35.035 1.00 0.00 C ATOM 2011 CG PRO A 129 -8.361 0.189 -35.770 1.00 0.00 C ATOM 2012 CD PRO A 129 -8.911 1.543 -35.322 1.00 0.00 C ATOM 0 HA PRO A 129 -10.466 -0.430 -33.235 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -8.764 -1.768 -34.895 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -10.181 -1.000 -35.584 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -7.313 0.068 -35.494 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -8.422 0.066 -36.851 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -8.111 2.277 -35.229 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -9.621 1.936 -36.050 1.00 0.00 H new ATOM 2020 N LYS A 130 -7.515 0.458 -32.375 1.00 0.00 N ATOM 2021 CA LYS A 130 -6.321 0.172 -31.583 1.00 0.00 C ATOM 2022 C LYS A 130 -6.562 0.188 -30.064 1.00 0.00 C ATOM 2023 O LYS A 130 -6.114 -0.743 -29.402 1.00 0.00 O ATOM 2024 CB LYS A 130 -5.160 1.095 -32.020 1.00 0.00 C ATOM 2025 CG LYS A 130 -3.763 0.536 -31.685 1.00 0.00 C ATOM 2026 CD LYS A 130 -3.255 -0.546 -32.656 1.00 0.00 C ATOM 2027 CE LYS A 130 -2.905 0.031 -34.040 1.00 0.00 C ATOM 2028 NZ LYS A 130 -2.380 -1.006 -34.970 1.00 0.00 N1+ ATOM 0 H LYS A 130 -7.565 1.423 -32.701 1.00 0.00 H new ATOM 0 HA LYS A 130 -6.035 -0.859 -31.792 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.226 1.263 -33.095 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.278 2.066 -31.538 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.049 1.360 -31.675 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.785 0.120 -30.678 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.374 -1.027 -32.232 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.017 -1.317 -32.768 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.793 0.489 -34.475 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -2.163 0.821 -33.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -2.159 -0.569 -35.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -1.517 -1.426 -34.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -3.097 -1.748 -35.103 1.00 0.00 H new ATOM 2042 N PRO A 131 -7.227 1.194 -29.454 1.00 0.00 N ATOM 2043 CA PRO A 131 -7.248 1.342 -27.996 1.00 0.00 C ATOM 2044 C PRO A 131 -8.388 0.555 -27.352 1.00 0.00 C ATOM 2045 O PRO A 131 -9.006 1.046 -26.414 1.00 0.00 O ATOM 2046 CB PRO A 131 -7.394 2.851 -27.772 1.00 0.00 C ATOM 2047 CG PRO A 131 -8.366 3.222 -28.887 1.00 0.00 C ATOM 2048 CD PRO A 131 -7.841 2.383 -30.054 1.00 0.00 C ATOM 0 HA PRO A 131 -6.347 0.941 -27.531 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -7.792 3.084 -26.784 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -6.443 3.375 -27.864 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -9.395 2.969 -28.633 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -8.345 4.289 -29.109 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -8.650 2.105 -30.730 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -7.114 2.943 -30.641 1.00 0.00 H new ATOM 2056 N VAL A 132 -8.693 -0.643 -27.824 1.00 0.00 N ATOM 2057 CA VAL A 132 -9.909 -1.360 -27.486 1.00 0.00 C ATOM 2058 C VAL A 132 -9.589 -2.846 -27.303 1.00 0.00 C ATOM 2059 O VAL A 132 -8.697 -3.363 -27.978 1.00 0.00 O ATOM 2060 CB VAL A 132 -11.014 -1.121 -28.542 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -12.315 -0.696 -27.856 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -10.714 -0.071 -29.632 1.00 0.00 C ATOM 0 H VAL A 132 -8.088 -1.154 -28.467 1.00 0.00 H new ATOM 0 HA VAL A 132 -10.303 -0.979 -26.544 1.00 0.00 H new ATOM 0 HB VAL A 132 -11.085 -2.083 -29.050 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.086 -0.530 -28.609 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.638 -1.480 -27.172 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -12.148 0.226 -27.299 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -11.565 0.003 -30.310 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -10.536 0.898 -29.165 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -9.829 -0.371 -30.193 1.00 0.00 H new ATOM 2072 N ILE A 133 -10.306 -3.520 -26.397 1.00 0.00 N ATOM 2073 CA ILE A 133 -10.214 -4.943 -26.128 1.00 0.00 C ATOM 2074 C ILE A 133 -11.588 -5.577 -26.240 1.00 0.00 C ATOM 2075 O ILE A 133 -12.575 -4.912 -26.560 1.00 0.00 O ATOM 2076 CB ILE A 133 -9.529 -5.280 -24.782 1.00 0.00 C ATOM 2077 CG1 ILE A 133 -10.332 -4.840 -23.539 1.00 0.00 C ATOM 2078 CG2 ILE A 133 -8.120 -4.718 -24.840 1.00 0.00 C ATOM 2079 CD1 ILE A 133 -10.049 -3.405 -23.131 1.00 0.00 C ATOM 0 H ILE A 133 -10.998 -3.057 -25.807 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.560 -5.372 -26.887 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.486 -6.362 -24.654 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -11.397 -4.951 -23.742 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -10.096 -5.503 -22.706 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.603 -4.936 -23.906 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -7.580 -5.175 -25.669 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.164 -3.639 -24.987 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -10.642 -3.153 -22.252 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -8.990 -3.295 -22.898 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -10.312 -2.735 -23.950 1.00 0.00 H new ATOM 2091 N ALA A 134 -11.645 -6.849 -25.861 1.00 0.00 N ATOM 2092 CA ALA A 134 -12.825 -7.673 -25.887 1.00 0.00 C ATOM 2093 C ALA A 134 -13.325 -7.715 -27.333 1.00 0.00 C ATOM 2094 O ALA A 134 -12.597 -8.172 -28.216 1.00 0.00 O ATOM 2095 CB ALA A 134 -13.786 -7.194 -24.782 1.00 0.00 C ATOM 0 H ALA A 134 -10.826 -7.347 -25.513 1.00 0.00 H new ATOM 0 HA ALA A 134 -12.665 -8.720 -25.631 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -14.685 -7.810 -24.790 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -13.296 -7.279 -23.812 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -14.057 -6.154 -24.961 1.00 0.00 H new ATOM 2101 N ASP A 135 -14.521 -7.188 -27.584 1.00 0.00 N ATOM 2102 CA ASP A 135 -15.112 -7.060 -28.911 1.00 0.00 C ATOM 2103 C ASP A 135 -15.075 -5.613 -29.423 1.00 0.00 C ATOM 2104 O ASP A 135 -15.695 -5.276 -30.433 1.00 0.00 O ATOM 2105 CB ASP A 135 -16.531 -7.617 -28.875 1.00 0.00 C ATOM 2106 CG ASP A 135 -17.141 -7.806 -30.278 1.00 0.00 C ATOM 2107 OD1 ASP A 135 -16.508 -8.470 -31.135 1.00 0.00 O ATOM 2108 OD2 ASP A 135 -18.290 -7.352 -30.507 1.00 0.00 O ATOM 0 H ASP A 135 -15.124 -6.827 -26.845 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.520 -7.638 -29.620 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -16.526 -8.575 -28.355 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -17.165 -6.944 -28.297 1.00 0.00 H new ATOM 2113 N GLY A 136 -14.385 -4.728 -28.692 1.00 0.00 N ATOM 2114 CA GLY A 136 -14.362 -3.294 -28.935 1.00 0.00 C ATOM 2115 C GLY A 136 -15.314 -2.530 -28.014 1.00 0.00 C ATOM 2116 O GLY A 136 -15.697 -1.405 -28.324 1.00 0.00 O ATOM 0 H GLY A 136 -13.813 -5.006 -27.894 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -13.348 -2.921 -28.794 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.632 -3.100 -29.973 1.00 0.00 H new ATOM 2120 N GLN A 137 -15.702 -3.142 -26.886 1.00 0.00 N ATOM 2121 CA GLN A 137 -16.720 -2.640 -25.973 1.00 0.00 C ATOM 2122 C GLN A 137 -16.080 -1.955 -24.769 1.00 0.00 C ATOM 2123 O GLN A 137 -16.751 -1.223 -24.049 1.00 0.00 O ATOM 2124 CB GLN A 137 -17.644 -3.777 -25.502 1.00 0.00 C ATOM 2125 CG GLN A 137 -17.807 -4.897 -26.530 1.00 0.00 C ATOM 2126 CD GLN A 137 -18.697 -6.022 -26.004 1.00 0.00 C ATOM 2127 OE1 GLN A 137 -19.866 -6.148 -26.359 1.00 0.00 O ATOM 2128 NE2 GLN A 137 -18.142 -6.852 -25.131 1.00 0.00 N ATOM 0 H GLN A 137 -15.299 -4.028 -26.581 1.00 0.00 H new ATOM 0 HA GLN A 137 -17.318 -1.907 -26.514 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -17.247 -4.198 -24.578 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -18.625 -3.364 -25.268 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -18.237 -4.491 -27.446 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -16.827 -5.299 -26.789 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -17.169 -6.724 -24.854 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -18.688 -7.618 -24.737 1.00 0.00 H new ATOM 2137 N LEU A 138 -14.788 -2.224 -24.527 1.00 0.00 N ATOM 2138 CA LEU A 138 -14.003 -1.512 -23.516 1.00 0.00 C ATOM 2139 C LEU A 138 -12.680 -1.040 -24.097 1.00 0.00 C ATOM 2140 O LEU A 138 -12.079 -1.739 -24.910 1.00 0.00 O ATOM 2141 CB LEU A 138 -13.799 -2.249 -22.167 1.00 0.00 C ATOM 2142 CG LEU A 138 -13.891 -3.783 -22.102 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -13.198 -4.288 -20.829 1.00 0.00 C ATOM 2144 CD2 LEU A 138 -15.352 -4.243 -22.049 1.00 0.00 C ATOM 0 H LEU A 138 -14.262 -2.940 -25.027 1.00 0.00 H new ATOM 0 HA LEU A 138 -14.618 -0.653 -23.249 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -12.815 -1.968 -21.791 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -14.534 -1.851 -21.467 1.00 0.00 H new ATOM 0 HG LEU A 138 -13.411 -4.183 -22.995 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -13.265 -5.375 -20.785 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -12.150 -3.989 -20.842 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -13.687 -3.859 -19.954 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -15.389 -5.331 -22.004 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -15.833 -3.826 -21.164 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -15.874 -3.899 -22.942 1.00 0.00 H new ATOM 2156 N PHE A 139 -12.231 0.136 -23.664 1.00 0.00 N ATOM 2157 CA PHE A 139 -10.946 0.703 -24.001 1.00 0.00 C ATOM 2158 C PHE A 139 -9.873 0.029 -23.170 1.00 0.00 C ATOM 2159 O PHE A 139 -10.128 -0.396 -22.044 1.00 0.00 O ATOM 2160 CB PHE A 139 -10.893 2.204 -23.694 1.00 0.00 C ATOM 2161 CG PHE A 139 -11.858 3.058 -24.471 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -11.745 3.162 -25.867 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -12.867 3.759 -23.792 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -12.606 4.018 -26.573 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -13.739 4.590 -24.503 1.00 0.00 C ATOM 2166 CZ PHE A 139 -13.596 4.748 -25.890 1.00 0.00 C ATOM 0 H PHE A 139 -12.779 0.735 -23.047 1.00 0.00 H new ATOM 0 HA PHE A 139 -10.786 0.549 -25.068 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -11.084 2.347 -22.630 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -9.882 2.561 -23.887 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -10.999 2.586 -26.395 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -12.970 3.657 -22.722 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.508 4.116 -27.644 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -14.527 5.113 -23.981 1.00 0.00 H new ATOM 0 HZ PHE A 139 -14.241 5.425 -26.429 1.00 0.00 H new ATOM 2176 N VAL A 140 -8.646 0.058 -23.673 1.00 0.00 N ATOM 2177 CA VAL A 140 -7.467 -0.415 -22.970 1.00 0.00 C ATOM 2178 C VAL A 140 -7.142 0.443 -21.725 1.00 0.00 C ATOM 2179 O VAL A 140 -6.359 0.002 -20.887 1.00 0.00 O ATOM 2180 CB VAL A 140 -6.283 -0.468 -23.957 1.00 0.00 C ATOM 2181 CG1 VAL A 140 -6.426 -1.532 -25.047 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -5.991 0.889 -24.588 1.00 0.00 C ATOM 0 H VAL A 140 -8.441 0.420 -24.604 1.00 0.00 H new ATOM 0 HA VAL A 140 -7.664 -1.418 -22.592 1.00 0.00 H new ATOM 0 HB VAL A 140 -5.433 -0.759 -23.340 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.553 -1.504 -25.699 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -6.504 -2.517 -24.586 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -7.323 -1.334 -25.633 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.149 0.798 -25.274 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -6.869 1.233 -25.135 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -5.745 1.608 -23.807 1.00 0.00 H new ATOM 2192 N GLY A 141 -7.707 1.651 -21.577 1.00 0.00 N ATOM 2193 CA GLY A 141 -7.317 2.568 -20.506 1.00 0.00 C ATOM 2194 C GLY A 141 -8.251 3.770 -20.423 1.00 0.00 C ATOM 2195 O GLY A 141 -9.208 3.851 -21.196 1.00 0.00 O ATOM 0 H GLY A 141 -8.438 2.012 -22.190 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -7.321 2.038 -19.554 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.296 2.911 -20.675 1.00 0.00 H new ATOM 2199 N LEU A 142 -7.962 4.722 -19.526 1.00 0.00 N ATOM 2200 CA LEU A 142 -8.669 6.004 -19.485 1.00 0.00 C ATOM 2201 C LEU A 142 -8.387 6.741 -20.781 1.00 0.00 C ATOM 2202 O LEU A 142 -7.232 6.944 -21.154 1.00 0.00 O ATOM 2203 CB LEU A 142 -8.284 6.830 -18.244 1.00 0.00 C ATOM 2204 CG LEU A 142 -8.597 8.342 -18.198 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.104 8.619 -18.185 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -7.996 8.961 -16.937 1.00 0.00 C ATOM 0 H LEU A 142 -7.237 4.625 -18.815 1.00 0.00 H new ATOM 0 HA LEU A 142 -9.742 5.832 -19.396 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -8.772 6.371 -17.384 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.210 6.716 -18.099 1.00 0.00 H new ATOM 0 HG LEU A 142 -8.164 8.781 -19.097 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.276 9.695 -18.152 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -10.558 8.206 -19.086 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -10.552 8.153 -17.307 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.221 10.027 -16.912 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -8.422 8.480 -16.057 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.915 8.818 -16.941 1.00 0.00 H new ATOM 2218 N ALA A 143 -9.462 7.152 -21.441 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.411 7.870 -22.699 1.00 0.00 C ATOM 2220 C ALA A 143 -9.856 9.295 -22.410 1.00 0.00 C ATOM 2221 O ALA A 143 -10.974 9.482 -21.926 1.00 0.00 O ATOM 2222 CB ALA A 143 -10.316 7.157 -23.715 1.00 0.00 C ATOM 0 H ALA A 143 -10.412 6.990 -21.106 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.411 7.894 -23.132 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.285 7.689 -24.666 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -9.966 6.135 -23.860 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -11.340 7.140 -23.341 1.00 0.00 H new ATOM 2228 N LEU A 144 -9.002 10.285 -22.663 1.00 0.00 N ATOM 2229 CA LEU A 144 -9.358 11.695 -22.553 1.00 0.00 C ATOM 2230 C LEU A 144 -9.318 12.298 -23.948 1.00 0.00 C ATOM 2231 O LEU A 144 -8.468 11.940 -24.765 1.00 0.00 O ATOM 2232 CB LEU A 144 -8.402 12.450 -21.612 1.00 0.00 C ATOM 2233 CG LEU A 144 -8.344 11.916 -20.173 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -7.431 12.779 -19.301 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -9.735 11.867 -19.530 1.00 0.00 C ATOM 0 H LEU A 144 -8.037 10.128 -22.952 1.00 0.00 H new ATOM 0 HA LEU A 144 -10.357 11.784 -22.125 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.398 12.416 -22.036 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.700 13.498 -21.582 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.944 10.904 -20.234 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.409 12.377 -18.288 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -6.423 12.775 -19.715 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.810 13.801 -19.278 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.652 11.484 -18.513 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -10.161 12.870 -19.506 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.382 11.212 -20.113 1.00 0.00 H new ATOM 2247 N ASP A 145 -10.204 13.250 -24.195 1.00 0.00 N ATOM 2248 CA ASP A 145 -10.204 14.086 -25.383 1.00 0.00 C ATOM 2249 C ASP A 145 -10.045 15.505 -24.898 1.00 0.00 C ATOM 2250 O ASP A 145 -10.707 15.936 -23.954 1.00 0.00 O ATOM 2251 CB ASP A 145 -11.438 13.826 -26.228 1.00 0.00 C ATOM 2252 CG ASP A 145 -11.685 14.911 -27.262 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -11.959 16.056 -26.859 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -11.746 14.588 -28.472 1.00 0.00 O ATOM 0 H ASP A 145 -10.966 13.468 -23.553 1.00 0.00 H new ATOM 0 HA ASP A 145 -9.381 13.860 -26.061 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -11.330 12.867 -26.734 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -12.308 13.747 -25.577 1.00 0.00 H new ATOM 2259 N GLU A 146 -9.107 16.197 -25.530 1.00 0.00 N ATOM 2260 CA GLU A 146 -8.663 17.513 -25.108 1.00 0.00 C ATOM 2261 C GLU A 146 -9.095 18.571 -26.129 1.00 0.00 C ATOM 2262 O GLU A 146 -8.433 19.600 -26.284 1.00 0.00 O ATOM 2263 CB GLU A 146 -7.161 17.504 -24.762 1.00 0.00 C ATOM 2264 CG GLU A 146 -6.865 16.753 -23.452 1.00 0.00 C ATOM 2265 CD GLU A 146 -7.594 17.366 -22.235 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -7.536 18.603 -22.035 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -8.218 16.605 -21.456 1.00 0.00 O1- ATOM 0 H GLU A 146 -8.628 15.853 -26.362 1.00 0.00 H new ATOM 0 HA GLU A 146 -9.155 17.795 -24.177 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.606 17.040 -25.577 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -6.804 18.531 -24.678 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -7.162 15.710 -23.561 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -5.791 16.761 -23.268 1.00 0.00 H new ATOM 2274 N THR A 147 -10.229 18.338 -26.813 1.00 0.00 N ATOM 2275 CA THR A 147 -10.845 19.394 -27.615 1.00 0.00 C ATOM 2276 C THR A 147 -12.364 19.527 -27.468 1.00 0.00 C ATOM 2277 O THR A 147 -12.862 20.656 -27.464 1.00 0.00 O ATOM 2278 CB THR A 147 -10.325 19.320 -29.069 1.00 0.00 C ATOM 2279 OG1 THR A 147 -10.331 20.591 -29.700 1.00 0.00 O ATOM 2280 CG2 THR A 147 -11.126 18.351 -29.940 1.00 0.00 C ATOM 0 H THR A 147 -10.724 17.446 -26.824 1.00 0.00 H new ATOM 0 HA THR A 147 -10.518 20.348 -27.202 1.00 0.00 H new ATOM 0 HB THR A 147 -9.302 18.953 -28.982 1.00 0.00 H new ATOM 0 HG1 THR A 147 -9.994 20.503 -30.616 1.00 0.00 H new ATOM 0 HG21 THR A 147 -10.714 18.343 -30.949 1.00 0.00 H new ATOM 0 HG22 THR A 147 -11.069 17.348 -29.516 1.00 0.00 H new ATOM 0 HG23 THR A 147 -12.167 18.670 -29.976 1.00 0.00 H new ATOM 2288 N ASN A 148 -13.117 18.440 -27.275 1.00 0.00 N ATOM 2289 CA ASN A 148 -14.554 18.499 -27.006 1.00 0.00 C ATOM 2290 C ASN A 148 -14.896 17.939 -25.627 1.00 0.00 C ATOM 2291 O ASN A 148 -15.822 18.446 -24.994 1.00 0.00 O ATOM 2292 CB ASN A 148 -15.334 17.784 -28.106 1.00 0.00 C ATOM 2293 CG ASN A 148 -14.844 16.364 -28.288 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -13.908 16.151 -29.201 1.00 0.00 O flip ATOM 2295 ND2 ASN A 148 -15.228 15.492 -27.515 1.00 0.00 N flip ATOM 0 H ASN A 148 -12.744 17.491 -27.301 1.00 0.00 H new ATOM 0 HA ASN A 148 -14.850 19.548 -27.004 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -16.395 17.776 -27.857 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -15.230 18.331 -29.043 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -15.952 15.702 -26.828 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -14.823 14.557 -27.560 1.00 0.00 H new ATOM 2302 N GLN A 149 -14.131 16.965 -25.121 1.00 0.00 N ATOM 2303 CA GLN A 149 -14.239 16.547 -23.726 1.00 0.00 C ATOM 2304 C GLN A 149 -13.292 17.358 -22.839 1.00 0.00 C ATOM 2305 O GLN A 149 -13.249 17.104 -21.640 1.00 0.00 O ATOM 2306 CB GLN A 149 -14.029 15.047 -23.481 1.00 0.00 C ATOM 2307 CG GLN A 149 -14.764 14.069 -24.401 1.00 0.00 C ATOM 2308 CD GLN A 149 -16.287 14.158 -24.318 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -16.916 14.852 -25.255 1.00 0.00 O flip ATOM 2310 NE2 GLN A 149 -16.908 13.607 -23.414 1.00 0.00 N flip ATOM 0 H GLN A 149 -13.432 16.454 -25.660 1.00 0.00 H new ATOM 0 HA GLN A 149 -15.276 16.749 -23.456 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -12.961 14.841 -23.556 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -14.325 14.830 -22.455 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -14.456 14.254 -25.430 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -14.456 13.053 -24.153 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -16.407 13.077 -22.701 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -17.925 13.679 -23.376 1.00 0.00 H new ATOM 2319 N TYR A 150 -12.570 18.347 -23.383 1.00 0.00 N ATOM 2320 CA TYR A 150 -11.573 19.105 -22.612 1.00 0.00 C ATOM 2321 C TYR A 150 -12.191 19.792 -21.383 1.00 0.00 C ATOM 2322 O TYR A 150 -11.489 20.134 -20.428 1.00 0.00 O ATOM 2323 CB TYR A 150 -10.885 20.159 -23.495 1.00 0.00 C ATOM 2324 CG TYR A 150 -11.606 21.494 -23.605 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -12.827 21.591 -24.297 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -11.073 22.635 -22.972 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -13.511 22.818 -24.368 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -11.749 23.864 -23.036 1.00 0.00 C ATOM 2329 CZ TYR A 150 -12.974 23.962 -23.737 1.00 0.00 C ATOM 2330 OH TYR A 150 -13.621 25.165 -23.790 1.00 0.00 O ATOM 0 H TYR A 150 -12.657 18.642 -24.356 1.00 0.00 H new ATOM 0 HA TYR A 150 -10.834 18.384 -22.262 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -9.884 20.338 -23.103 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -10.766 19.747 -24.497 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -13.242 20.717 -24.777 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -10.139 22.564 -22.434 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -14.446 22.885 -24.904 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -11.334 24.735 -22.550 1.00 0.00 H new ATOM 0 HH TYR A 150 -13.104 25.837 -23.299 1.00 0.00 H new ATOM 2340 N ASP A 151 -13.512 20.005 -21.419 1.00 0.00 N ATOM 2341 CA ASP A 151 -14.264 20.664 -20.364 1.00 0.00 C ATOM 2342 C ASP A 151 -14.548 19.712 -19.198 1.00 0.00 C ATOM 2343 O ASP A 151 -14.732 20.166 -18.067 1.00 0.00 O ATOM 2344 CB ASP A 151 -15.566 21.206 -20.963 1.00 0.00 C ATOM 2345 CG ASP A 151 -16.419 21.919 -19.901 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -16.039 23.034 -19.463 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -17.499 21.394 -19.538 1.00 0.00 O ATOM 0 H ASP A 151 -14.094 19.714 -22.204 1.00 0.00 H new ATOM 0 HA ASP A 151 -13.674 21.486 -19.959 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -15.335 21.899 -21.772 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -16.136 20.386 -21.399 1.00 0.00 H new ATOM 2352 N LEU A 152 -14.563 18.392 -19.451 1.00 0.00 N ATOM 2353 CA LEU A 152 -15.013 17.387 -18.491 1.00 0.00 C ATOM 2354 C LEU A 152 -13.979 16.289 -18.253 1.00 0.00 C ATOM 2355 O LEU A 152 -14.172 15.458 -17.371 1.00 0.00 O ATOM 2356 CB LEU A 152 -16.368 16.861 -18.953 1.00 0.00 C ATOM 2357 CG LEU A 152 -16.305 15.962 -20.201 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -16.163 14.488 -19.816 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -17.555 16.211 -21.043 1.00 0.00 C ATOM 0 H LEU A 152 -14.258 17.995 -20.340 1.00 0.00 H new ATOM 0 HA LEU A 152 -15.131 17.846 -17.509 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -16.824 16.300 -18.138 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -17.022 17.708 -19.162 1.00 0.00 H new ATOM 0 HG LEU A 152 -15.422 16.211 -20.790 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -16.121 13.879 -20.719 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -15.247 14.349 -19.241 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -17.019 14.185 -19.213 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -17.526 15.581 -21.932 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -18.442 15.971 -20.457 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -17.590 17.259 -21.342 1.00 0.00 H new ATOM 2371 N SER A 153 -12.869 16.274 -18.990 1.00 0.00 N ATOM 2372 CA SER A 153 -11.818 15.273 -18.836 1.00 0.00 C ATOM 2373 C SER A 153 -11.298 15.259 -17.395 1.00 0.00 C ATOM 2374 O SER A 153 -10.978 14.200 -16.857 1.00 0.00 O ATOM 2375 CB SER A 153 -10.708 15.536 -19.867 1.00 0.00 C ATOM 2376 OG SER A 153 -10.306 16.885 -19.937 1.00 0.00 O ATOM 0 H SER A 153 -12.674 16.963 -19.717 1.00 0.00 H new ATOM 0 HA SER A 153 -12.219 14.278 -19.029 1.00 0.00 H new ATOM 0 HB2 SER A 153 -9.843 14.921 -19.620 1.00 0.00 H new ATOM 0 HB3 SER A 153 -11.055 15.218 -20.850 1.00 0.00 H new ATOM 0 HG SER A 153 -9.368 16.933 -20.218 1.00 0.00 H new ATOM 2382 N ASP A 154 -11.352 16.416 -16.733 1.00 0.00 N ATOM 2383 CA ASP A 154 -11.043 16.607 -15.322 1.00 0.00 C ATOM 2384 C ASP A 154 -11.844 15.661 -14.436 1.00 0.00 C ATOM 2385 O ASP A 154 -11.320 15.111 -13.472 1.00 0.00 O ATOM 2386 CB ASP A 154 -11.363 18.056 -14.941 1.00 0.00 C ATOM 2387 CG ASP A 154 -11.205 18.283 -13.431 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -10.043 18.369 -12.969 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -12.230 18.405 -12.723 1.00 0.00 O ATOM 0 H ASP A 154 -11.626 17.285 -17.192 1.00 0.00 H new ATOM 0 HA ASP A 154 -9.986 16.391 -15.168 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -10.702 18.732 -15.484 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -12.382 18.297 -15.243 1.00 0.00 H new ATOM 2394 N GLU A 155 -13.103 15.417 -14.782 1.00 0.00 N ATOM 2395 CA GLU A 155 -14.022 14.589 -14.026 1.00 0.00 C ATOM 2396 C GLU A 155 -13.819 13.121 -14.389 1.00 0.00 C ATOM 2397 O GLU A 155 -13.835 12.239 -13.533 1.00 0.00 O ATOM 2398 CB GLU A 155 -15.455 15.126 -14.221 1.00 0.00 C ATOM 2399 CG GLU A 155 -16.369 14.286 -15.122 1.00 0.00 C ATOM 2400 CD GLU A 155 -17.812 14.832 -15.135 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -18.051 15.946 -15.661 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -18.724 14.146 -14.610 1.00 0.00 O ATOM 0 H GLU A 155 -13.522 15.806 -15.627 1.00 0.00 H new ATOM 0 HA GLU A 155 -13.826 14.641 -12.955 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -15.925 15.215 -13.242 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -15.392 16.132 -14.637 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -15.973 14.279 -16.137 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -16.373 13.253 -14.775 1.00 0.00 H new ATOM 2409 N ARG A 156 -13.531 12.874 -15.666 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.346 11.529 -16.219 1.00 0.00 C ATOM 2411 C ARG A 156 -12.085 10.908 -15.635 1.00 0.00 C ATOM 2412 O ARG A 156 -12.018 9.692 -15.482 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.383 11.636 -17.761 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.431 10.333 -18.585 1.00 0.00 C ATOM 2415 CD ARG A 156 -14.328 9.226 -18.013 1.00 0.00 C ATOM 2416 NE ARG A 156 -14.654 8.205 -19.035 1.00 0.00 N ATOM 2417 CZ ARG A 156 -15.533 7.196 -18.907 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -16.152 6.979 -17.750 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -15.784 6.400 -19.939 1.00 0.00 N ATOM 0 H ARG A 156 -13.417 13.614 -16.359 1.00 0.00 H new ATOM 0 HA ARG A 156 -14.148 10.845 -15.940 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.254 12.232 -18.032 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.503 12.196 -18.076 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.774 10.572 -19.592 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.417 9.944 -18.678 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -13.827 8.750 -17.170 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -15.249 9.665 -17.630 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.162 8.274 -19.926 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.962 7.581 -16.949 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -16.817 6.211 -17.664 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.310 6.554 -20.829 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -16.451 5.634 -19.842 1.00 0.00 H new ATOM 2433 N ILE A 157 -11.129 11.739 -15.228 1.00 0.00 N ATOM 2434 CA ILE A 157 -9.975 11.309 -14.467 1.00 0.00 C ATOM 2435 C ILE A 157 -10.433 10.804 -13.101 1.00 0.00 C ATOM 2436 O ILE A 157 -10.141 9.673 -12.750 1.00 0.00 O ATOM 2437 CB ILE A 157 -8.939 12.452 -14.369 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -8.266 12.763 -15.719 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -7.860 12.045 -13.356 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -7.640 14.162 -15.754 1.00 0.00 C ATOM 0 H ILE A 157 -11.140 12.740 -15.423 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.475 10.483 -14.973 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.466 13.353 -14.055 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.495 12.018 -15.917 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -9.004 12.678 -16.517 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -7.119 12.841 -13.274 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -8.320 11.876 -12.383 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -7.373 11.129 -13.691 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -7.179 14.330 -16.727 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -8.413 14.911 -15.584 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -6.882 14.241 -14.975 1.00 0.00 H new ATOM 2452 N GLN A 158 -11.122 11.628 -12.317 1.00 0.00 N ATOM 2453 CA GLN A 158 -11.574 11.325 -10.949 1.00 0.00 C ATOM 2454 C GLN A 158 -12.275 9.998 -10.907 1.00 0.00 C ATOM 2455 O GLN A 158 -11.959 9.135 -10.093 1.00 0.00 O ATOM 2456 CB GLN A 158 -12.544 12.384 -10.392 1.00 0.00 C ATOM 2457 CG GLN A 158 -11.854 13.727 -10.443 1.00 0.00 C ATOM 2458 CD GLN A 158 -12.744 14.920 -10.151 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -13.399 15.028 -9.118 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -12.748 15.833 -11.100 1.00 0.00 N ATOM 0 H GLN A 158 -11.395 12.562 -12.622 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.674 11.314 -10.334 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -13.462 12.405 -10.979 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -12.826 12.140 -9.368 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -11.032 13.723 -9.727 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -11.415 13.855 -11.432 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -12.186 15.697 -11.941 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -13.313 16.676 -10.994 1.00 0.00 H new ATOM 2469 N SER A 159 -13.187 9.838 -11.846 1.00 0.00 N ATOM 2470 CA SER A 159 -13.980 8.617 -11.885 1.00 0.00 C ATOM 2471 C SER A 159 -13.089 7.413 -12.189 1.00 0.00 C ATOM 2472 O SER A 159 -13.258 6.344 -11.604 1.00 0.00 O ATOM 2473 CB SER A 159 -15.110 8.727 -12.898 1.00 0.00 C ATOM 2474 OG SER A 159 -15.874 9.903 -12.674 1.00 0.00 O ATOM 0 H SER A 159 -13.397 10.517 -12.577 1.00 0.00 H new ATOM 0 HA SER A 159 -14.431 8.473 -10.903 1.00 0.00 H new ATOM 0 HB2 SER A 159 -14.699 8.741 -13.908 1.00 0.00 H new ATOM 0 HB3 SER A 159 -15.754 7.850 -12.828 1.00 0.00 H new ATOM 0 HG SER A 159 -15.350 10.688 -12.936 1.00 0.00 H new ATOM 2480 N TRP A 160 -12.088 7.584 -13.061 1.00 0.00 N ATOM 2481 CA TRP A 160 -11.152 6.517 -13.379 1.00 0.00 C ATOM 2482 C TRP A 160 -10.311 6.177 -12.166 1.00 0.00 C ATOM 2483 O TRP A 160 -10.125 5.016 -11.821 1.00 0.00 O ATOM 2484 CB TRP A 160 -10.250 6.980 -14.514 1.00 0.00 C ATOM 2485 CG TRP A 160 -9.369 5.903 -15.025 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -9.800 4.830 -15.719 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -7.914 5.818 -14.991 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -8.711 4.101 -16.132 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -7.527 4.658 -15.710 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -6.884 6.644 -14.496 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -6.190 4.319 -15.922 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -5.530 6.333 -14.733 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.186 5.170 -15.442 1.00 0.00 C ATOM 0 H TRP A 160 -11.911 8.458 -13.557 1.00 0.00 H new ATOM 0 HA TRP A 160 -11.704 5.626 -13.679 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -10.866 7.357 -15.330 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.636 7.811 -14.168 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -10.833 4.584 -15.918 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -8.774 3.247 -16.686 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -7.136 7.527 -13.928 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -5.933 3.412 -16.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -4.755 6.991 -14.369 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.147 4.932 -15.617 1.00 0.00 H new ATOM 2504 N CYS A 161 -9.849 7.210 -11.473 1.00 0.00 N ATOM 2505 CA CYS A 161 -9.081 7.077 -10.262 1.00 0.00 C ATOM 2506 C CYS A 161 -9.888 6.298 -9.234 1.00 0.00 C ATOM 2507 O CYS A 161 -9.313 5.487 -8.512 1.00 0.00 O ATOM 2508 CB CYS A 161 -8.727 8.472 -9.746 1.00 0.00 C ATOM 2509 SG CYS A 161 -7.609 9.276 -10.918 1.00 0.00 S ATOM 0 H CYS A 161 -10.006 8.179 -11.750 1.00 0.00 H new ATOM 0 HA CYS A 161 -8.158 6.530 -10.453 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -9.632 9.067 -9.622 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.255 8.401 -8.766 1.00 0.00 H new ATOM 0 HG CYS A 161 -8.279 9.656 -11.965 1.00 0.00 H new ATOM 2515 N GLU A 162 -11.209 6.492 -9.216 1.00 0.00 N ATOM 2516 CA GLU A 162 -12.073 5.867 -8.227 1.00 0.00 C ATOM 2517 C GLU A 162 -12.094 4.352 -8.432 1.00 0.00 C ATOM 2518 O GLU A 162 -12.129 3.603 -7.451 1.00 0.00 O ATOM 2519 CB GLU A 162 -13.456 6.553 -8.213 1.00 0.00 C ATOM 2520 CG GLU A 162 -14.671 5.643 -8.450 1.00 0.00 C ATOM 2521 CD GLU A 162 -15.984 6.446 -8.370 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -16.529 6.613 -7.250 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -16.489 6.902 -9.425 1.00 0.00 O ATOM 0 H GLU A 162 -11.702 7.084 -9.885 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.679 6.013 -7.221 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.582 7.048 -7.250 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.459 7.332 -8.975 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -14.589 5.168 -9.428 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -14.683 4.845 -7.708 1.00 0.00 H new ATOM 2530 N GLN A 163 -11.998 3.885 -9.682 1.00 0.00 N ATOM 2531 CA GLN A 163 -11.874 2.462 -9.943 1.00 0.00 C ATOM 2532 C GLN A 163 -10.446 1.975 -9.757 1.00 0.00 C ATOM 2533 O GLN A 163 -10.273 0.979 -9.069 1.00 0.00 O ATOM 2534 CB GLN A 163 -12.484 2.032 -11.276 1.00 0.00 C ATOM 2535 CG GLN A 163 -11.901 2.701 -12.519 1.00 0.00 C ATOM 2536 CD GLN A 163 -12.364 2.014 -13.806 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -13.348 1.276 -13.847 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -11.638 2.233 -14.889 1.00 0.00 N ATOM 0 H GLN A 163 -12.004 4.472 -10.516 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.477 1.960 -9.186 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.365 0.953 -11.377 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -13.555 2.234 -11.246 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -12.198 3.750 -12.540 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -10.812 2.679 -12.467 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -10.825 2.847 -14.842 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -11.891 1.788 -15.771 1.00 0.00 H new ATOM 2547 N ILE A 164 -9.409 2.645 -10.272 1.00 0.00 N ATOM 2548 CA ILE A 164 -8.081 2.047 -10.274 1.00 0.00 C ATOM 2549 C ILE A 164 -7.592 1.865 -8.847 1.00 0.00 C ATOM 2550 O ILE A 164 -7.046 0.818 -8.517 1.00 0.00 O ATOM 2551 CB ILE A 164 -7.075 2.797 -11.171 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -6.453 4.090 -10.595 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -7.613 2.940 -12.596 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.464 4.787 -11.547 1.00 0.00 C ATOM 0 H ILE A 164 -9.465 3.577 -10.682 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.160 1.060 -10.730 1.00 0.00 H new ATOM 0 HB ILE A 164 -6.198 2.150 -11.204 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.254 4.786 -10.346 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -5.938 3.850 -9.665 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -6.885 3.472 -13.208 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -7.789 1.951 -13.019 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -8.549 3.499 -12.577 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.072 5.685 -11.070 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.642 4.110 -11.777 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -5.978 5.060 -12.469 1.00 0.00 H new ATOM 2566 N LEU A 165 -7.852 2.832 -7.964 1.00 0.00 N ATOM 2567 CA LEU A 165 -7.429 2.732 -6.572 1.00 0.00 C ATOM 2568 C LEU A 165 -8.109 1.545 -5.882 1.00 0.00 C ATOM 2569 O LEU A 165 -7.584 1.043 -4.896 1.00 0.00 O ATOM 2570 CB LEU A 165 -7.657 4.073 -5.843 1.00 0.00 C ATOM 2571 CG LEU A 165 -9.117 4.450 -5.490 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -9.631 3.788 -4.204 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -9.214 5.969 -5.279 1.00 0.00 C ATOM 0 H LEU A 165 -8.353 3.691 -8.191 1.00 0.00 H new ATOM 0 HA LEU A 165 -6.358 2.534 -6.533 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.080 4.057 -4.918 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.244 4.869 -6.463 1.00 0.00 H new ATOM 0 HG LEU A 165 -9.725 4.100 -6.324 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.660 4.099 -4.021 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -9.593 2.704 -4.313 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -9.006 4.091 -3.364 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.241 6.237 -5.030 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.554 6.266 -4.464 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.916 6.483 -6.193 1.00 0.00 H new ATOM 2585 N ASN A 166 -9.247 1.075 -6.407 1.00 0.00 N ATOM 2586 CA ASN A 166 -9.955 -0.083 -5.887 1.00 0.00 C ATOM 2587 C ASN A 166 -9.426 -1.315 -6.582 1.00 0.00 C ATOM 2588 O ASN A 166 -9.148 -2.295 -5.915 1.00 0.00 O ATOM 2589 CB ASN A 166 -11.474 0.025 -6.083 1.00 0.00 C ATOM 2590 CG ASN A 166 -12.149 0.756 -4.932 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -12.315 0.196 -3.851 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -12.540 2.009 -5.117 1.00 0.00 N ATOM 0 H ASN A 166 -9.701 1.500 -7.215 1.00 0.00 H new ATOM 0 HA ASN A 166 -9.782 -0.141 -4.812 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -11.682 0.548 -7.016 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -11.899 -0.974 -6.176 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -12.986 2.522 -4.356 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -12.395 2.460 -6.020 1.00 0.00 H new ATOM 2599 N GLU A 167 -9.210 -1.268 -7.894 1.00 0.00 N ATOM 2600 CA GLU A 167 -8.754 -2.407 -8.668 1.00 0.00 C ATOM 2601 C GLU A 167 -7.415 -2.905 -8.125 1.00 0.00 C ATOM 2602 O GLU A 167 -7.148 -4.102 -8.164 1.00 0.00 O ATOM 2603 CB GLU A 167 -8.624 -2.034 -10.152 1.00 0.00 C ATOM 2604 CG GLU A 167 -9.957 -1.865 -10.888 1.00 0.00 C ATOM 2605 CD GLU A 167 -9.741 -1.375 -12.328 1.00 0.00 C ATOM 2606 OE1 GLU A 167 -9.628 -0.146 -12.543 1.00 0.00 O ATOM 2607 OE2 GLU A 167 -9.631 -2.216 -13.251 1.00 0.00 O1- ATOM 0 H GLU A 167 -9.350 -0.425 -8.451 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.490 -3.206 -8.580 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -8.060 -1.104 -10.231 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.041 -2.804 -10.657 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -10.491 -2.815 -10.901 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -10.584 -1.154 -10.350 1.00 0.00 H new ATOM 2614 N MET A 168 -6.595 -1.999 -7.583 1.00 0.00 N ATOM 2615 CA MET A 168 -5.292 -2.287 -7.041 1.00 0.00 C ATOM 2616 C MET A 168 -5.443 -2.721 -5.589 1.00 0.00 C ATOM 2617 O MET A 168 -4.893 -3.747 -5.228 1.00 0.00 O ATOM 2618 CB MET A 168 -4.381 -1.070 -7.298 1.00 0.00 C ATOM 2619 CG MET A 168 -4.359 -0.867 -8.815 1.00 0.00 C ATOM 2620 SD MET A 168 -3.272 0.385 -9.519 1.00 0.00 S ATOM 2621 CE MET A 168 -4.129 1.884 -9.013 1.00 0.00 C ATOM 0 H MET A 168 -6.843 -1.012 -7.514 1.00 0.00 H new ATOM 0 HA MET A 168 -4.799 -3.127 -7.531 1.00 0.00 H new ATOM 0 HB2 MET A 168 -4.763 -0.184 -6.792 1.00 0.00 H new ATOM 0 HB3 MET A 168 -3.376 -1.248 -6.914 1.00 0.00 H new ATOM 0 HG2 MET A 168 -4.097 -1.822 -9.270 1.00 0.00 H new ATOM 0 HG3 MET A 168 -5.376 -0.633 -9.129 1.00 0.00 H new ATOM 0 HE1 MET A 168 -3.498 2.750 -9.214 1.00 0.00 H new ATOM 0 HE2 MET A 168 -5.061 1.977 -9.571 1.00 0.00 H new ATOM 0 HE3 MET A 168 -4.349 1.835 -7.946 1.00 0.00 H new ATOM 2631 N ALA A 169 -6.267 -2.037 -4.796 1.00 0.00 N ATOM 2632 CA ALA A 169 -6.550 -2.386 -3.397 1.00 0.00 C ATOM 2633 C ALA A 169 -7.113 -3.796 -3.264 1.00 0.00 C ATOM 2634 O ALA A 169 -6.751 -4.557 -2.371 1.00 0.00 O ATOM 2635 CB ALA A 169 -7.565 -1.403 -2.803 1.00 0.00 C ATOM 0 H ALA A 169 -6.769 -1.207 -5.111 1.00 0.00 H new ATOM 0 HA ALA A 169 -5.604 -2.334 -2.859 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -7.767 -1.671 -1.766 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -7.159 -0.392 -2.844 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -8.491 -1.446 -3.376 1.00 0.00 H new ATOM 2641 N GLU A 170 -8.004 -4.144 -4.176 1.00 0.00 N ATOM 2642 CA GLU A 170 -8.606 -5.452 -4.288 1.00 0.00 C ATOM 2643 C GLU A 170 -7.570 -6.457 -4.804 1.00 0.00 C ATOM 2644 O GLU A 170 -7.648 -7.637 -4.465 1.00 0.00 O ATOM 2645 CB GLU A 170 -9.786 -5.337 -5.257 1.00 0.00 C ATOM 2646 CG GLU A 170 -10.916 -4.405 -4.757 1.00 0.00 C ATOM 2647 CD GLU A 170 -11.880 -5.145 -3.811 1.00 0.00 C ATOM 2648 OE1 GLU A 170 -11.608 -5.213 -2.586 1.00 0.00 O ATOM 2649 OE2 GLU A 170 -12.928 -5.654 -4.279 1.00 0.00 O ATOM 0 H GLU A 170 -8.339 -3.492 -4.886 1.00 0.00 H new ATOM 0 HA GLU A 170 -8.956 -5.806 -3.318 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -9.422 -4.969 -6.216 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -10.198 -6.331 -5.433 1.00 0.00 H new ATOM 0 HG2 GLU A 170 -10.482 -3.550 -4.239 1.00 0.00 H new ATOM 0 HG3 GLU A 170 -11.470 -4.013 -5.610 1.00 0.00 H new ATOM 2656 N HIS A 171 -6.568 -6.007 -5.572 1.00 0.00 N ATOM 2657 CA HIS A 171 -5.432 -6.826 -5.940 1.00 0.00 C ATOM 2658 C HIS A 171 -4.558 -7.151 -4.727 1.00 0.00 C ATOM 2659 O HIS A 171 -3.958 -8.230 -4.672 1.00 0.00 O ATOM 2660 CB HIS A 171 -4.584 -6.134 -7.011 1.00 0.00 C ATOM 2661 CG HIS A 171 -4.051 -7.179 -7.941 1.00 0.00 C ATOM 2662 ND1 HIS A 171 -3.052 -8.091 -7.606 1.00 0.00 N ATOM 2663 CD2 HIS A 171 -4.748 -7.649 -9.016 1.00 0.00 C ATOM 2664 CE1 HIS A 171 -3.220 -9.126 -8.441 1.00 0.00 C ATOM 2665 NE2 HIS A 171 -4.201 -8.875 -9.327 1.00 0.00 N ATOM 0 H HIS A 171 -6.534 -5.060 -5.951 1.00 0.00 H new ATOM 0 HA HIS A 171 -5.827 -7.759 -6.343 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -5.185 -5.409 -7.560 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -3.764 -5.584 -6.549 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -5.566 -7.158 -9.522 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -2.645 -10.039 -8.407 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -4.489 -9.484 -10.093 1.00 0.00 H new ATOM 2673 N TYR A 172 -4.486 -6.239 -3.743 1.00 0.00 N ATOM 2674 CA TYR A 172 -3.710 -6.489 -2.532 1.00 0.00 C ATOM 2675 C TYR A 172 -4.220 -7.750 -1.829 1.00 0.00 C ATOM 2676 O TYR A 172 -3.463 -8.412 -1.109 1.00 0.00 O ATOM 2677 CB TYR A 172 -3.789 -5.384 -1.474 1.00 0.00 C ATOM 2678 CG TYR A 172 -3.462 -3.961 -1.845 1.00 0.00 C ATOM 2679 CD1 TYR A 172 -3.026 -3.597 -3.133 1.00 0.00 C ATOM 2680 CD2 TYR A 172 -3.697 -2.969 -0.873 1.00 0.00 C ATOM 2681 CE1 TYR A 172 -3.023 -2.244 -3.472 1.00 0.00 C ATOM 2682 CE2 TYR A 172 -3.566 -1.609 -1.192 1.00 0.00 C ATOM 2683 CZ TYR A 172 -3.254 -1.232 -2.513 1.00 0.00 C ATOM 2684 OH TYR A 172 -3.228 0.090 -2.849 1.00 0.00 O ATOM 0 H TYR A 172 -4.953 -5.333 -3.768 1.00 0.00 H new ATOM 0 HA TYR A 172 -2.684 -6.566 -2.891 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -4.803 -5.390 -1.074 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -3.123 -5.668 -0.659 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -2.702 -4.346 -3.840 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -3.981 -3.258 0.128 1.00 0.00 H new ATOM 0 HE1 TYR A 172 -2.839 -1.961 -4.498 1.00 0.00 H new ATOM 0 HE2 TYR A 172 -3.703 -0.856 -0.430 1.00 0.00 H new ATOM 0 HH TYR A 172 -2.492 0.254 -3.475 1.00 0.00 H new ATOM 2694 N ALA A 173 -5.522 -8.024 -1.991 1.00 0.00 N ATOM 2695 CA ALA A 173 -6.220 -9.007 -1.204 1.00 0.00 C ATOM 2696 C ALA A 173 -5.799 -10.427 -1.596 1.00 0.00 C ATOM 2697 O ALA A 173 -5.780 -10.752 -2.807 1.00 0.00 O ATOM 2698 CB ALA A 173 -7.735 -8.793 -1.318 1.00 0.00 C ATOM 2699 OXT ALA A 173 -5.520 -11.234 -0.680 1.00 0.00 O1- ATOM 0 H ALA A 173 -6.110 -7.557 -2.681 1.00 0.00 H new ATOM 0 HA ALA A 173 -5.948 -8.882 -0.156 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -8.254 -9.541 -0.719 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -7.990 -7.797 -0.955 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -8.038 -8.888 -2.361 1.00 0.00 H new