USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1069 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 51 SER OG : rot 160:sc= 0.00883 USER MOD Set 1.2: A 126 HIS : no HD1:sc= 0.00679 X(o=0.016,f=-0.067) USER MOD Set 2.1: A 7 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 57 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A -1 ASN : amide:sc= 0.793 X(o=1.5,f=1.3) USER MOD Set 3.2: A -3 SER OG : rot -150:sc= 0.7 USER MOD Set 4.1: A 9 SER OG : rot -160:sc= 0.598 USER MOD Set 4.2: A 52 LYS NZ :NH3+ -150:sc= 0.674 (180deg=0) USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -177:sc= 0 (180deg=-0.0139) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A -4 GLY N :NH3+ -123:sc= 0.0613 (180deg=0) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.0965 USER MOD Single : A 14 LYS NZ :NH3+ -176:sc= 2.52 (180deg=2.43) USER MOD Single : A 18 SER OG : rot 180:sc=-0.00265 USER MOD Single : A 20 TYR OH : rot 30:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0.61 USER MOD Single : A 28 ASN : amide:sc=-0.00747 X(o=-0.0075,f=-0.14) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.267 X(o=-0.27,f=-0.54) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 1:sc= -0.0639 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -165:sc= 1.34 (180deg=1.11) USER MOD Single : A 63 LYS NZ :NH3+ -157:sc= 1.65 (180deg=1) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0.641 K(o=0.64,f=0) USER MOD Single : A 76 GLN : amide:sc=-0.00458 X(o=-0.0046,f=0) USER MOD Single : A 77 TYR OH : rot 30:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot -120:sc= 0.773 USER MOD Single : A 91 TYR OH : rot 30:sc= 0.552 USER MOD Single : A 97 GLN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 100 THR OG1 : rot -33:sc= 0.146 USER MOD Single : A 103 SER OG : rot -70:sc= 0.744 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -0.0671 K(o=-0.067,f=-1.3) USER MOD Single : A 122 SER OG : rot -150:sc=-0.00459 USER MOD Single : A 124 GLN : amide:sc= 0.798 K(o=0.8,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 169:sc= 1.24 (180deg=1.13) USER MOD Single : A 131 LYS NZ :NH3+ 165:sc= 1.29 (180deg=1.08) USER MOD Single : A 132 GLN : amide:sc= 0.918 K(o=0.92,f=-0.066) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 0.366 30.282 19.036 1.00 0.00 N ATOM 2 CA GLY A -4 0.375 29.252 17.973 1.00 0.00 C ATOM 3 C GLY A -4 1.696 29.224 17.217 1.00 0.00 C ATOM 4 O GLY A -4 2.704 29.758 17.685 1.00 0.00 O ATOM 0 H1 GLY A -4 0.160 29.834 19.952 1.00 0.00 H new ATOM 0 H2 GLY A -4 1.296 30.745 19.078 1.00 0.00 H new ATOM 0 H3 GLY A -4 -0.365 30.991 18.826 1.00 0.00 H new ATOM 0 HA2 GLY A -4 0.190 28.273 18.415 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -0.439 29.445 17.274 1.00 0.00 H new ATOM 10 N SER A -3 1.707 28.593 16.038 1.00 0.00 N ATOM 11 CA SER A -3 2.874 28.490 15.140 1.00 0.00 C ATOM 12 C SER A -3 2.445 28.428 13.657 1.00 0.00 C ATOM 13 O SER A -3 1.293 28.078 13.376 1.00 0.00 O ATOM 14 CB SER A -3 3.714 27.258 15.524 1.00 0.00 C ATOM 15 OG SER A -3 3.093 26.047 15.118 1.00 0.00 O ATOM 0 H SER A -3 0.881 28.124 15.666 1.00 0.00 H new ATOM 0 HA SER A -3 3.482 29.387 15.259 1.00 0.00 H new ATOM 0 HB2 SER A -3 4.699 27.333 15.064 1.00 0.00 H new ATOM 0 HB3 SER A -3 3.866 27.244 16.603 1.00 0.00 H new ATOM 0 HG SER A -3 3.342 25.328 15.736 1.00 0.00 H new ATOM 21 N PRO A -2 3.335 28.726 12.685 1.00 0.00 N ATOM 22 CA PRO A -2 3.005 28.682 11.253 1.00 0.00 C ATOM 23 C PRO A -2 2.815 27.261 10.684 1.00 0.00 C ATOM 24 O PRO A -2 2.427 27.115 9.524 1.00 0.00 O ATOM 25 CB PRO A -2 4.150 29.431 10.557 1.00 0.00 C ATOM 26 CG PRO A -2 5.339 29.193 11.483 1.00 0.00 C ATOM 27 CD PRO A -2 4.694 29.226 12.866 1.00 0.00 C ATOM 0 HA PRO A -2 2.034 29.145 11.079 1.00 0.00 H new ATOM 0 HB2 PRO A -2 4.336 29.042 9.556 1.00 0.00 H new ATOM 0 HB3 PRO A -2 3.930 30.493 10.450 1.00 0.00 H new ATOM 0 HG2 PRO A -2 5.823 28.237 11.284 1.00 0.00 H new ATOM 0 HG3 PRO A -2 6.100 29.965 11.372 1.00 0.00 H new ATOM 0 HD2 PRO A -2 5.248 28.605 13.570 1.00 0.00 H new ATOM 0 HD3 PRO A -2 4.687 30.238 13.270 1.00 0.00 H new ATOM 35 N ASN A -1 3.054 26.207 11.476 1.00 0.00 N ATOM 36 CA ASN A -1 2.931 24.805 11.049 1.00 0.00 C ATOM 37 C ASN A -1 1.509 24.422 10.590 1.00 0.00 C ATOM 38 O ASN A -1 1.351 23.495 9.796 1.00 0.00 O ATOM 39 CB ASN A -1 3.397 23.886 12.193 1.00 0.00 C ATOM 40 CG ASN A -1 4.873 24.052 12.517 1.00 0.00 C ATOM 41 OD1 ASN A -1 5.748 23.610 11.785 1.00 0.00 O ATOM 42 ND2 ASN A -1 5.200 24.708 13.607 1.00 0.00 N ATOM 0 H ASN A -1 3.343 26.306 12.449 1.00 0.00 H new ATOM 0 HA ASN A -1 3.568 24.676 10.174 1.00 0.00 H new ATOM 0 HB2 ASN A -1 2.808 24.097 13.085 1.00 0.00 H new ATOM 0 HB3 ASN A -1 3.204 22.848 11.921 1.00 0.00 H new ATOM 0 HD21 ASN A -1 6.183 24.848 13.842 1.00 0.00 H new ATOM 0 HD22 ASN A -1 4.471 25.077 14.218 1.00 0.00 H new ATOM 49 N SER A 0 0.475 25.160 11.014 1.00 0.00 N ATOM 50 CA SER A 0 -0.914 24.988 10.556 1.00 0.00 C ATOM 51 C SER A 0 -1.110 25.217 9.047 1.00 0.00 C ATOM 52 O SER A 0 -2.085 24.730 8.475 1.00 0.00 O ATOM 53 CB SER A 0 -1.829 25.936 11.341 1.00 0.00 C ATOM 54 OG SER A 0 -1.431 27.286 11.149 1.00 0.00 O ATOM 0 H SER A 0 0.580 25.909 11.699 1.00 0.00 H new ATOM 0 HA SER A 0 -1.173 23.946 10.742 1.00 0.00 H new ATOM 0 HB2 SER A 0 -2.861 25.806 11.017 1.00 0.00 H new ATOM 0 HB3 SER A 0 -1.795 25.688 12.402 1.00 0.00 H new ATOM 0 HG SER A 0 -2.026 27.878 11.655 1.00 0.00 H new ATOM 60 N MET A 1 -0.169 25.901 8.380 1.00 0.00 N ATOM 61 CA MET A 1 -0.153 26.120 6.924 1.00 0.00 C ATOM 62 C MET A 1 0.521 24.976 6.134 1.00 0.00 C ATOM 63 O MET A 1 0.625 25.053 4.907 1.00 0.00 O ATOM 64 CB MET A 1 0.512 27.474 6.615 1.00 0.00 C ATOM 65 CG MET A 1 -0.221 28.653 7.271 1.00 0.00 C ATOM 66 SD MET A 1 0.433 30.293 6.841 1.00 0.00 S ATOM 67 CE MET A 1 2.006 30.266 7.747 1.00 0.00 C ATOM 0 H MET A 1 0.627 26.331 8.852 1.00 0.00 H new ATOM 0 HA MET A 1 -1.190 26.132 6.589 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.545 27.455 6.961 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.540 27.623 5.536 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.273 28.611 6.988 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.177 28.533 8.353 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.509 31.226 7.631 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.814 30.082 8.804 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.641 29.473 7.351 1.00 0.00 H new ATOM 77 N ALA A 2 0.990 23.921 6.817 1.00 0.00 N ATOM 78 CA ALA A 2 1.719 22.788 6.233 1.00 0.00 C ATOM 79 C ALA A 2 1.221 21.416 6.739 1.00 0.00 C ATOM 80 O ALA A 2 1.171 20.458 5.964 1.00 0.00 O ATOM 81 CB ALA A 2 3.211 22.983 6.538 1.00 0.00 C ATOM 0 H ALA A 2 0.867 23.831 7.826 1.00 0.00 H new ATOM 0 HA ALA A 2 1.541 22.776 5.158 1.00 0.00 H new ATOM 0 HB1 ALA A 2 3.780 22.155 6.116 1.00 0.00 H new ATOM 0 HB2 ALA A 2 3.553 23.920 6.098 1.00 0.00 H new ATOM 0 HB3 ALA A 2 3.361 23.013 7.617 1.00 0.00 H new ATOM 87 N THR A 3 0.806 21.331 8.008 1.00 0.00 N ATOM 88 CA THR A 3 0.263 20.124 8.651 1.00 0.00 C ATOM 89 C THR A 3 -1.123 20.431 9.216 1.00 0.00 C ATOM 90 O THR A 3 -1.269 21.082 10.251 1.00 0.00 O ATOM 91 CB THR A 3 1.206 19.598 9.749 1.00 0.00 C ATOM 92 OG1 THR A 3 2.501 19.378 9.222 1.00 0.00 O ATOM 93 CG2 THR A 3 0.724 18.259 10.314 1.00 0.00 C ATOM 0 H THR A 3 0.839 22.130 8.641 1.00 0.00 H new ATOM 0 HA THR A 3 0.177 19.336 7.903 1.00 0.00 H new ATOM 0 HB THR A 3 1.219 20.353 10.535 1.00 0.00 H new ATOM 0 HG1 THR A 3 3.090 19.046 9.931 1.00 0.00 H new ATOM 0 HG21 THR A 3 1.415 17.920 11.086 1.00 0.00 H new ATOM 0 HG22 THR A 3 -0.270 18.382 10.745 1.00 0.00 H new ATOM 0 HG23 THR A 3 0.683 17.520 9.514 1.00 0.00 H new ATOM 101 N GLU A 4 -2.151 19.968 8.507 1.00 0.00 N ATOM 102 CA GLU A 4 -3.575 20.207 8.812 1.00 0.00 C ATOM 103 C GLU A 4 -4.460 18.961 8.575 1.00 0.00 C ATOM 104 O GLU A 4 -5.685 19.051 8.474 1.00 0.00 O ATOM 105 CB GLU A 4 -4.060 21.460 8.053 1.00 0.00 C ATOM 106 CG GLU A 4 -3.884 21.375 6.528 1.00 0.00 C ATOM 107 CD GLU A 4 -4.514 22.589 5.815 1.00 0.00 C ATOM 108 OE1 GLU A 4 -3.768 23.411 5.228 1.00 0.00 O ATOM 109 OE2 GLU A 4 -5.764 22.717 5.804 1.00 0.00 O ATOM 0 H GLU A 4 -2.019 19.395 7.674 1.00 0.00 H new ATOM 0 HA GLU A 4 -3.673 20.402 9.880 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -5.114 21.623 8.278 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.517 22.329 8.423 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -2.823 21.321 6.286 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -4.342 20.457 6.159 1.00 0.00 H new ATOM 116 N LEU A 5 -3.834 17.779 8.502 1.00 0.00 N ATOM 117 CA LEU A 5 -4.437 16.479 8.175 1.00 0.00 C ATOM 118 C LEU A 5 -5.130 15.834 9.401 1.00 0.00 C ATOM 119 O LEU A 5 -4.893 14.681 9.761 1.00 0.00 O ATOM 120 CB LEU A 5 -3.354 15.609 7.497 1.00 0.00 C ATOM 121 CG LEU A 5 -3.873 14.746 6.336 1.00 0.00 C ATOM 122 CD1 LEU A 5 -2.694 14.065 5.638 1.00 0.00 C ATOM 123 CD2 LEU A 5 -4.855 13.658 6.764 1.00 0.00 C ATOM 0 H LEU A 5 -2.833 17.699 8.680 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.256 16.596 7.465 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -2.562 16.259 7.125 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -2.906 14.957 8.247 1.00 0.00 H new ATOM 0 HG LEU A 5 -4.405 15.428 5.673 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -3.063 13.453 4.815 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -2.014 14.823 5.250 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -2.165 13.433 6.351 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -5.175 13.092 5.889 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -4.369 12.987 7.472 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -5.723 14.117 7.237 1.00 0.00 H new ATOM 135 N GLU A 6 -5.971 16.610 10.084 1.00 0.00 N ATOM 136 CA GLU A 6 -6.655 16.247 11.339 1.00 0.00 C ATOM 137 C GLU A 6 -7.964 15.458 11.084 1.00 0.00 C ATOM 138 O GLU A 6 -9.007 15.705 11.696 1.00 0.00 O ATOM 139 CB GLU A 6 -6.829 17.519 12.195 1.00 0.00 C ATOM 140 CG GLU A 6 -7.013 17.220 13.690 1.00 0.00 C ATOM 141 CD GLU A 6 -7.144 18.525 14.501 1.00 0.00 C ATOM 142 OE1 GLU A 6 -6.114 19.050 14.990 1.00 0.00 O ATOM 143 OE2 GLU A 6 -8.281 19.033 14.669 1.00 0.00 O ATOM 0 H GLU A 6 -6.209 17.551 9.770 1.00 0.00 H new ATOM 0 HA GLU A 6 -6.042 15.550 11.911 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -5.957 18.160 12.064 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -7.692 18.077 11.834 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -7.902 16.606 13.835 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -6.164 16.643 14.057 1.00 0.00 H new ATOM 150 N TYR A 7 -7.931 14.542 10.111 1.00 0.00 N ATOM 151 CA TYR A 7 -9.074 13.837 9.547 1.00 0.00 C ATOM 152 C TYR A 7 -8.622 12.521 8.909 1.00 0.00 C ATOM 153 O TYR A 7 -7.496 12.407 8.423 1.00 0.00 O ATOM 154 CB TYR A 7 -9.757 14.755 8.519 1.00 0.00 C ATOM 155 CG TYR A 7 -8.875 15.277 7.391 1.00 0.00 C ATOM 156 CD1 TYR A 7 -8.498 14.421 6.341 1.00 0.00 C ATOM 157 CD2 TYR A 7 -8.461 16.624 7.364 1.00 0.00 C ATOM 158 CE1 TYR A 7 -7.785 14.906 5.234 1.00 0.00 C ATOM 159 CE2 TYR A 7 -7.706 17.109 6.276 1.00 0.00 C ATOM 160 CZ TYR A 7 -7.375 16.255 5.200 1.00 0.00 C ATOM 161 OH TYR A 7 -6.662 16.731 4.144 1.00 0.00 O ATOM 0 H TYR A 7 -7.053 14.261 9.675 1.00 0.00 H new ATOM 0 HA TYR A 7 -9.789 13.588 10.331 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -10.593 14.212 8.077 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -10.177 15.610 9.049 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -8.761 13.375 6.387 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -8.722 17.285 8.177 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.551 14.248 4.410 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -7.379 18.138 6.265 1.00 0.00 H new ATOM 0 HH TYR A 7 -6.464 17.681 4.284 1.00 0.00 H new ATOM 171 N GLU A 8 -9.513 11.529 8.890 1.00 0.00 N ATOM 172 CA GLU A 8 -9.402 10.291 8.129 1.00 0.00 C ATOM 173 C GLU A 8 -10.760 9.575 8.199 1.00 0.00 C ATOM 174 O GLU A 8 -11.316 9.374 9.281 1.00 0.00 O ATOM 175 CB GLU A 8 -8.243 9.406 8.640 1.00 0.00 C ATOM 176 CG GLU A 8 -8.409 8.799 10.042 1.00 0.00 C ATOM 177 CD GLU A 8 -7.133 8.099 10.552 1.00 0.00 C ATOM 178 OE1 GLU A 8 -6.007 8.558 10.241 1.00 0.00 O ATOM 179 OE2 GLU A 8 -7.256 7.094 11.291 1.00 0.00 O ATOM 0 H GLU A 8 -10.375 11.573 9.434 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.159 10.510 7.089 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.098 8.591 7.931 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -7.330 10.002 8.632 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.689 9.587 10.742 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.229 8.081 10.026 1.00 0.00 H new ATOM 186 N SER A 9 -11.314 9.211 7.046 1.00 0.00 N ATOM 187 CA SER A 9 -12.467 8.302 6.957 1.00 0.00 C ATOM 188 C SER A 9 -11.980 6.928 6.495 1.00 0.00 C ATOM 189 O SER A 9 -11.573 6.761 5.347 1.00 0.00 O ATOM 190 CB SER A 9 -13.560 8.864 6.040 1.00 0.00 C ATOM 191 OG SER A 9 -14.469 9.664 6.780 1.00 0.00 O ATOM 0 H SER A 9 -10.979 9.536 6.139 1.00 0.00 H new ATOM 0 HA SER A 9 -12.924 8.201 7.942 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.107 9.458 5.246 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.095 8.045 5.559 1.00 0.00 H new ATOM 0 HG SER A 9 -15.308 9.751 6.282 1.00 0.00 H new ATOM 197 N VAL A 10 -11.963 5.965 7.418 1.00 0.00 N ATOM 198 CA VAL A 10 -11.475 4.581 7.216 1.00 0.00 C ATOM 199 C VAL A 10 -12.322 3.805 6.196 1.00 0.00 C ATOM 200 O VAL A 10 -13.540 3.984 6.121 1.00 0.00 O ATOM 201 CB VAL A 10 -11.411 3.831 8.568 1.00 0.00 C ATOM 202 CG1 VAL A 10 -10.809 2.426 8.440 1.00 0.00 C ATOM 203 CG2 VAL A 10 -10.554 4.580 9.602 1.00 0.00 C ATOM 0 H VAL A 10 -12.300 6.124 8.367 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.469 4.648 6.801 1.00 0.00 H new ATOM 0 HB VAL A 10 -12.449 3.767 8.893 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -10.789 1.948 9.419 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -11.416 1.831 7.758 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -9.793 2.499 8.052 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -10.537 4.018 10.536 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -9.537 4.686 9.224 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -10.980 5.567 9.781 1.00 0.00 H new ATOM 213 N LEU A 11 -11.665 2.933 5.420 1.00 0.00 N ATOM 214 CA LEU A 11 -12.238 2.182 4.295 1.00 0.00 C ATOM 215 C LEU A 11 -11.909 0.679 4.370 1.00 0.00 C ATOM 216 O LEU A 11 -12.782 -0.154 4.119 1.00 0.00 O ATOM 217 CB LEU A 11 -11.707 2.759 2.968 1.00 0.00 C ATOM 218 CG LEU A 11 -11.984 4.244 2.681 1.00 0.00 C ATOM 219 CD1 LEU A 11 -11.312 4.616 1.360 1.00 0.00 C ATOM 220 CD2 LEU A 11 -13.479 4.544 2.558 1.00 0.00 C ATOM 0 H LEU A 11 -10.678 2.723 5.565 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.322 2.285 4.348 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -10.628 2.607 2.942 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.131 2.173 2.152 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.590 4.824 3.516 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.498 5.667 1.140 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -10.238 4.446 1.438 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.720 4.000 0.558 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.622 5.605 2.355 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.902 3.959 1.741 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.981 4.282 3.490 1.00 0.00 H new ATOM 232 N CYS A 12 -10.671 0.330 4.742 1.00 0.00 N ATOM 233 CA CYS A 12 -10.224 -1.049 4.972 1.00 0.00 C ATOM 234 C CYS A 12 -9.142 -1.094 6.052 1.00 0.00 C ATOM 235 O CYS A 12 -8.219 -0.279 6.051 1.00 0.00 O ATOM 236 CB CYS A 12 -9.688 -1.646 3.665 1.00 0.00 C ATOM 237 SG CYS A 12 -9.351 -3.421 3.849 1.00 0.00 S ATOM 0 H CYS A 12 -9.933 1.017 4.895 1.00 0.00 H new ATOM 0 HA CYS A 12 -11.075 -1.638 5.314 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -10.413 -1.491 2.866 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -8.775 -1.128 3.372 1.00 0.00 H new ATOM 0 HG CYS A 12 -8.901 -3.896 2.726 1.00 0.00 H new ATOM 243 N VAL A 13 -9.237 -2.076 6.945 1.00 0.00 N ATOM 244 CA VAL A 13 -8.221 -2.393 7.957 1.00 0.00 C ATOM 245 C VAL A 13 -7.910 -3.889 7.917 1.00 0.00 C ATOM 246 O VAL A 13 -8.819 -4.717 8.001 1.00 0.00 O ATOM 247 CB VAL A 13 -8.675 -1.934 9.359 1.00 0.00 C ATOM 248 CG1 VAL A 13 -7.709 -2.357 10.474 1.00 0.00 C ATOM 249 CG2 VAL A 13 -8.796 -0.407 9.414 1.00 0.00 C ATOM 0 H VAL A 13 -10.047 -2.695 6.989 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.305 -1.848 7.731 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.638 -2.417 9.525 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.085 -2.004 11.434 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.629 -3.444 10.493 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.726 -1.924 10.288 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.117 -0.103 10.410 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -7.828 0.043 9.192 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.529 -0.073 8.679 1.00 0.00 H new ATOM 259 N LYS A 14 -6.620 -4.229 7.809 1.00 0.00 N ATOM 260 CA LYS A 14 -6.088 -5.605 7.896 1.00 0.00 C ATOM 261 C LYS A 14 -4.980 -5.678 8.966 1.00 0.00 C ATOM 262 O LYS A 14 -4.093 -4.822 8.954 1.00 0.00 O ATOM 263 CB LYS A 14 -5.584 -6.105 6.524 1.00 0.00 C ATOM 264 CG LYS A 14 -6.640 -6.136 5.402 1.00 0.00 C ATOM 265 CD LYS A 14 -7.734 -7.188 5.623 1.00 0.00 C ATOM 266 CE LYS A 14 -8.699 -7.216 4.438 1.00 0.00 C ATOM 267 NZ LYS A 14 -9.729 -8.269 4.615 1.00 0.00 N ATOM 0 H LYS A 14 -5.889 -3.535 7.653 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.899 -6.268 8.196 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.759 -5.468 6.205 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -5.181 -7.110 6.648 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.103 -5.153 5.322 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -6.144 -6.333 4.452 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.281 -8.171 5.753 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.281 -6.965 6.539 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.182 -6.244 4.335 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.144 -7.396 3.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.330 -8.313 3.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.264 -9.188 4.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.316 -8.045 5.444 1.00 0.00 H new ATOM 281 N PRO A 15 -4.991 -6.666 9.881 1.00 0.00 N ATOM 282 CA PRO A 15 -4.092 -6.701 11.044 1.00 0.00 C ATOM 283 C PRO A 15 -2.665 -7.187 10.761 1.00 0.00 C ATOM 284 O PRO A 15 -1.808 -7.099 11.645 1.00 0.00 O ATOM 285 CB PRO A 15 -4.760 -7.650 12.035 1.00 0.00 C ATOM 286 CG PRO A 15 -5.524 -8.619 11.133 1.00 0.00 C ATOM 287 CD PRO A 15 -5.986 -7.725 9.989 1.00 0.00 C ATOM 0 HA PRO A 15 -3.960 -5.682 11.407 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -4.026 -8.168 12.652 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -5.429 -7.119 12.713 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -4.887 -9.430 10.780 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -6.365 -9.077 11.653 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -6.059 -8.288 9.059 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -6.975 -7.313 10.191 1.00 0.00 H new ATOM 295 N ASP A 16 -2.396 -7.742 9.577 1.00 0.00 N ATOM 296 CA ASP A 16 -1.069 -8.234 9.214 1.00 0.00 C ATOM 297 C ASP A 16 -0.677 -7.841 7.788 1.00 0.00 C ATOM 298 O ASP A 16 -1.242 -8.319 6.801 1.00 0.00 O ATOM 299 CB ASP A 16 -0.977 -9.748 9.433 1.00 0.00 C ATOM 300 CG ASP A 16 0.489 -10.205 9.417 1.00 0.00 C ATOM 301 OD1 ASP A 16 0.844 -11.100 8.617 1.00 0.00 O ATOM 302 OD2 ASP A 16 1.278 -9.663 10.231 1.00 0.00 O ATOM 0 H ASP A 16 -3.094 -7.862 8.843 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.347 -7.753 9.873 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.436 -10.012 10.386 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.535 -10.269 8.655 1.00 0.00 H new ATOM 307 N VAL A 17 0.317 -6.959 7.710 1.00 0.00 N ATOM 308 CA VAL A 17 0.957 -6.507 6.471 1.00 0.00 C ATOM 309 C VAL A 17 2.456 -6.284 6.702 1.00 0.00 C ATOM 310 O VAL A 17 2.875 -5.849 7.780 1.00 0.00 O ATOM 311 CB VAL A 17 0.235 -5.264 5.908 1.00 0.00 C ATOM 312 CG1 VAL A 17 0.476 -3.987 6.720 1.00 0.00 C ATOM 313 CG2 VAL A 17 0.613 -4.985 4.452 1.00 0.00 C ATOM 0 H VAL A 17 0.716 -6.521 8.540 1.00 0.00 H new ATOM 0 HA VAL A 17 0.868 -7.282 5.710 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.822 -5.519 5.977 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.064 -3.158 6.263 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.121 -4.132 7.740 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.542 -3.762 6.736 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.080 -4.102 4.101 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.687 -4.813 4.382 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.342 -5.842 3.835 1.00 0.00 H new ATOM 323 N SER A 18 3.263 -6.599 5.690 1.00 0.00 N ATOM 324 CA SER A 18 4.729 -6.641 5.784 1.00 0.00 C ATOM 325 C SER A 18 5.383 -5.770 4.715 1.00 0.00 C ATOM 326 O SER A 18 5.068 -5.917 3.538 1.00 0.00 O ATOM 327 CB SER A 18 5.211 -8.089 5.635 1.00 0.00 C ATOM 328 OG SER A 18 4.650 -8.921 6.639 1.00 0.00 O ATOM 0 H SER A 18 2.913 -6.837 4.762 1.00 0.00 H new ATOM 0 HA SER A 18 5.017 -6.250 6.760 1.00 0.00 H new ATOM 0 HB2 SER A 18 4.937 -8.467 4.650 1.00 0.00 H new ATOM 0 HB3 SER A 18 6.299 -8.122 5.697 1.00 0.00 H new ATOM 0 HG SER A 18 4.972 -9.839 6.521 1.00 0.00 H new ATOM 334 N VAL A 19 6.293 -4.877 5.113 1.00 0.00 N ATOM 335 CA VAL A 19 7.024 -3.952 4.229 1.00 0.00 C ATOM 336 C VAL A 19 8.354 -4.528 3.778 1.00 0.00 C ATOM 337 O VAL A 19 9.149 -5.021 4.580 1.00 0.00 O ATOM 338 CB VAL A 19 7.213 -2.562 4.867 1.00 0.00 C ATOM 339 CG1 VAL A 19 8.161 -1.639 4.080 1.00 0.00 C ATOM 340 CG2 VAL A 19 5.868 -1.838 4.950 1.00 0.00 C ATOM 0 H VAL A 19 6.554 -4.771 6.093 1.00 0.00 H new ATOM 0 HA VAL A 19 6.403 -3.822 3.343 1.00 0.00 H new ATOM 0 HB VAL A 19 7.648 -2.754 5.848 1.00 0.00 H new ATOM 0 HG11 VAL A 19 8.243 -0.680 4.592 1.00 0.00 H new ATOM 0 HG12 VAL A 19 9.146 -2.100 4.014 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.766 -1.482 3.076 1.00 0.00 H new ATOM 0 HG21 VAL A 19 6.010 -0.856 5.402 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.456 -1.720 3.948 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.178 -2.421 5.559 1.00 0.00 H new ATOM 350 N TYR A 20 8.625 -4.356 2.489 1.00 0.00 N ATOM 351 CA TYR A 20 9.908 -4.627 1.865 1.00 0.00 C ATOM 352 C TYR A 20 10.334 -3.411 1.035 1.00 0.00 C ATOM 353 O TYR A 20 9.586 -2.906 0.198 1.00 0.00 O ATOM 354 CB TYR A 20 9.848 -5.901 1.009 1.00 0.00 C ATOM 355 CG TYR A 20 8.826 -6.941 1.430 1.00 0.00 C ATOM 356 CD1 TYR A 20 9.124 -7.870 2.441 1.00 0.00 C ATOM 357 CD2 TYR A 20 7.563 -6.959 0.812 1.00 0.00 C ATOM 358 CE1 TYR A 20 8.164 -8.823 2.836 1.00 0.00 C ATOM 359 CE2 TYR A 20 6.610 -7.922 1.184 1.00 0.00 C ATOM 360 CZ TYR A 20 6.903 -8.855 2.200 1.00 0.00 C ATOM 361 OH TYR A 20 5.976 -9.790 2.546 1.00 0.00 O ATOM 0 H TYR A 20 7.929 -4.011 1.828 1.00 0.00 H new ATOM 0 HA TYR A 20 10.654 -4.801 2.640 1.00 0.00 H new ATOM 0 HB2 TYR A 20 9.639 -5.613 -0.021 1.00 0.00 H new ATOM 0 HB3 TYR A 20 10.834 -6.366 1.016 1.00 0.00 H new ATOM 0 HD1 TYR A 20 10.093 -7.854 2.918 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.325 -6.231 0.050 1.00 0.00 H new ATOM 0 HE1 TYR A 20 8.392 -9.527 3.623 1.00 0.00 H new ATOM 0 HE2 TYR A 20 5.650 -7.948 0.690 1.00 0.00 H new ATOM 0 HH TYR A 20 6.092 -10.033 3.488 1.00 0.00 H new ATOM 371 N ARG A 21 11.557 -2.938 1.264 1.00 0.00 N ATOM 372 CA ARG A 21 12.199 -1.885 0.455 1.00 0.00 C ATOM 373 C ARG A 21 12.670 -2.497 -0.874 1.00 0.00 C ATOM 374 O ARG A 21 13.524 -3.384 -0.886 1.00 0.00 O ATOM 375 CB ARG A 21 13.329 -1.192 1.248 1.00 0.00 C ATOM 376 CG ARG A 21 12.971 -0.842 2.707 1.00 0.00 C ATOM 377 CD ARG A 21 11.731 0.049 2.896 1.00 0.00 C ATOM 378 NE ARG A 21 12.064 1.483 2.798 1.00 0.00 N ATOM 379 CZ ARG A 21 12.455 2.268 3.790 1.00 0.00 C ATOM 380 NH1 ARG A 21 12.685 3.530 3.567 1.00 0.00 N ATOM 381 NH2 ARG A 21 12.632 1.841 5.009 1.00 0.00 N ATOM 0 H ARG A 21 12.145 -3.275 2.026 1.00 0.00 H new ATOM 0 HA ARG A 21 11.483 -1.097 0.221 1.00 0.00 H new ATOM 0 HB2 ARG A 21 14.205 -1.841 1.249 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.611 -0.277 0.728 1.00 0.00 H new ATOM 0 HG2 ARG A 21 12.815 -1.771 3.256 1.00 0.00 H new ATOM 0 HG3 ARG A 21 13.827 -0.343 3.162 1.00 0.00 H new ATOM 0 HD2 ARG A 21 10.985 -0.203 2.142 1.00 0.00 H new ATOM 0 HD3 ARG A 21 11.283 -0.154 3.869 1.00 0.00 H new ATOM 0 HE ARG A 21 11.985 1.912 1.876 1.00 0.00 H new ATOM 0 HH11 ARG A 21 12.564 3.913 2.629 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.986 4.136 4.330 1.00 0.00 H new ATOM 0 HH21 ARG A 21 12.468 0.860 5.235 1.00 0.00 H new ATOM 0 HH22 ARG A 21 12.934 2.488 5.737 1.00 0.00 H new ATOM 395 N ILE A 22 12.044 -2.086 -1.976 1.00 0.00 N ATOM 396 CA ILE A 22 12.083 -2.799 -3.269 1.00 0.00 C ATOM 397 C ILE A 22 13.343 -2.508 -4.115 1.00 0.00 C ATOM 398 O ILE A 22 13.915 -1.417 -4.007 1.00 0.00 O ATOM 399 CB ILE A 22 10.791 -2.540 -4.081 1.00 0.00 C ATOM 400 CG1 ILE A 22 10.579 -1.041 -4.395 1.00 0.00 C ATOM 401 CG2 ILE A 22 9.586 -3.161 -3.355 1.00 0.00 C ATOM 402 CD1 ILE A 22 9.296 -0.770 -5.180 1.00 0.00 C ATOM 0 H ILE A 22 11.484 -1.234 -2.004 1.00 0.00 H new ATOM 0 HA ILE A 22 12.141 -3.859 -3.020 1.00 0.00 H new ATOM 0 HB ILE A 22 10.896 -3.027 -5.051 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.552 -0.480 -3.461 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.432 -0.671 -4.964 1.00 0.00 H new ATOM 0 HG21 ILE A 22 8.679 -2.976 -3.931 1.00 0.00 H new ATOM 0 HG22 ILE A 22 9.737 -4.236 -3.252 1.00 0.00 H new ATOM 0 HG23 ILE A 22 9.486 -2.712 -2.367 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.204 0.300 -5.369 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.330 -1.305 -6.129 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.437 -1.111 -4.602 1.00 0.00 H new ATOM 414 N PRO A 23 13.768 -3.446 -4.989 1.00 0.00 N ATOM 415 CA PRO A 23 14.801 -3.205 -6.004 1.00 0.00 C ATOM 416 C PRO A 23 14.335 -2.209 -7.094 1.00 0.00 C ATOM 417 O PRO A 23 13.129 -1.979 -7.246 1.00 0.00 O ATOM 418 CB PRO A 23 15.111 -4.589 -6.591 1.00 0.00 C ATOM 419 CG PRO A 23 13.791 -5.341 -6.441 1.00 0.00 C ATOM 420 CD PRO A 23 13.255 -4.807 -5.116 1.00 0.00 C ATOM 0 HA PRO A 23 15.685 -2.739 -5.569 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.419 -4.523 -7.634 1.00 0.00 H new ATOM 0 HB3 PRO A 23 15.918 -5.083 -6.051 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.110 -5.134 -7.267 1.00 0.00 H new ATOM 0 HG3 PRO A 23 13.940 -6.420 -6.413 1.00 0.00 H new ATOM 0 HD2 PRO A 23 12.165 -4.815 -5.105 1.00 0.00 H new ATOM 0 HD3 PRO A 23 13.587 -5.427 -4.283 1.00 0.00 H new ATOM 428 N PRO A 24 15.263 -1.621 -7.879 1.00 0.00 N ATOM 429 CA PRO A 24 14.933 -0.697 -8.968 1.00 0.00 C ATOM 430 C PRO A 24 14.119 -1.363 -10.094 1.00 0.00 C ATOM 431 O PRO A 24 14.238 -2.565 -10.353 1.00 0.00 O ATOM 432 CB PRO A 24 16.274 -0.148 -9.468 1.00 0.00 C ATOM 433 CG PRO A 24 17.264 -1.258 -9.114 1.00 0.00 C ATOM 434 CD PRO A 24 16.708 -1.796 -7.798 1.00 0.00 C ATOM 0 HA PRO A 24 14.284 0.103 -8.611 1.00 0.00 H new ATOM 0 HB2 PRO A 24 16.254 0.046 -10.540 1.00 0.00 H new ATOM 0 HB3 PRO A 24 16.531 0.791 -8.979 1.00 0.00 H new ATOM 0 HG2 PRO A 24 17.300 -2.029 -9.884 1.00 0.00 H new ATOM 0 HG3 PRO A 24 18.278 -0.875 -8.999 1.00 0.00 H new ATOM 0 HD2 PRO A 24 16.968 -2.846 -7.663 1.00 0.00 H new ATOM 0 HD3 PRO A 24 17.121 -1.253 -6.948 1.00 0.00 H new ATOM 442 N ARG A 25 13.287 -0.562 -10.775 1.00 0.00 N ATOM 443 CA ARG A 25 12.303 -1.007 -11.779 1.00 0.00 C ATOM 444 C ARG A 25 12.778 -0.809 -13.218 1.00 0.00 C ATOM 445 O ARG A 25 13.446 0.174 -13.543 1.00 0.00 O ATOM 446 CB ARG A 25 10.997 -0.219 -11.570 1.00 0.00 C ATOM 447 CG ARG A 25 9.738 -0.790 -12.258 1.00 0.00 C ATOM 448 CD ARG A 25 9.017 0.308 -13.049 1.00 0.00 C ATOM 449 NE ARG A 25 7.752 -0.156 -13.644 1.00 0.00 N ATOM 450 CZ ARG A 25 6.594 -0.330 -13.033 1.00 0.00 C ATOM 451 NH1 ARG A 25 5.525 -0.628 -13.703 1.00 0.00 N ATOM 452 NH2 ARG A 25 6.427 -0.213 -11.750 1.00 0.00 N ATOM 0 H ARG A 25 13.278 0.449 -10.639 1.00 0.00 H new ATOM 0 HA ARG A 25 12.156 -2.078 -11.637 1.00 0.00 H new ATOM 0 HB2 ARG A 25 10.803 -0.155 -10.499 1.00 0.00 H new ATOM 0 HB3 ARG A 25 11.150 0.799 -11.927 1.00 0.00 H new ATOM 0 HG2 ARG A 25 10.019 -1.604 -12.926 1.00 0.00 H new ATOM 0 HG3 ARG A 25 9.065 -1.209 -11.510 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.815 1.152 -12.389 1.00 0.00 H new ATOM 0 HD3 ARG A 25 9.674 0.671 -13.840 1.00 0.00 H new ATOM 0 HE ARG A 25 7.773 -0.367 -14.642 1.00 0.00 H new ATOM 0 HH11 ARG A 25 5.571 -0.731 -14.717 1.00 0.00 H new ATOM 0 HH12 ARG A 25 4.638 -0.759 -13.216 1.00 0.00 H new ATOM 0 HH21 ARG A 25 7.218 0.027 -11.152 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.505 -0.361 -11.340 1.00 0.00 H new ATOM 466 N ALA A 26 12.274 -1.674 -14.091 1.00 0.00 N ATOM 467 CA ALA A 26 11.907 -1.329 -15.464 1.00 0.00 C ATOM 468 C ALA A 26 10.666 -2.141 -15.874 1.00 0.00 C ATOM 469 O ALA A 26 10.563 -3.314 -15.526 1.00 0.00 O ATOM 470 CB ALA A 26 13.104 -1.577 -16.385 1.00 0.00 C ATOM 0 H ALA A 26 12.105 -2.654 -13.862 1.00 0.00 H new ATOM 0 HA ALA A 26 11.649 -0.273 -15.545 1.00 0.00 H new ATOM 0 HB1 ALA A 26 12.834 -1.321 -17.410 1.00 0.00 H new ATOM 0 HB2 ALA A 26 13.943 -0.959 -16.066 1.00 0.00 H new ATOM 0 HB3 ALA A 26 13.389 -2.628 -16.337 1.00 0.00 H new ATOM 476 N SER A 27 9.714 -1.550 -16.595 1.00 0.00 N ATOM 477 CA SER A 27 8.403 -2.157 -16.909 1.00 0.00 C ATOM 478 C SER A 27 8.461 -3.343 -17.882 1.00 0.00 C ATOM 479 O SER A 27 7.544 -4.166 -17.896 1.00 0.00 O ATOM 480 CB SER A 27 7.462 -1.092 -17.473 1.00 0.00 C ATOM 481 OG SER A 27 7.230 -0.091 -16.492 1.00 0.00 O ATOM 0 H SER A 27 9.826 -0.616 -16.989 1.00 0.00 H new ATOM 0 HA SER A 27 8.034 -2.557 -15.965 1.00 0.00 H new ATOM 0 HB2 SER A 27 7.897 -0.645 -18.367 1.00 0.00 H new ATOM 0 HB3 SER A 27 6.518 -1.548 -17.772 1.00 0.00 H new ATOM 0 HG SER A 27 6.628 0.591 -16.857 1.00 0.00 H new ATOM 487 N ASN A 28 9.552 -3.494 -18.644 1.00 0.00 N ATOM 488 CA ASN A 28 9.841 -4.720 -19.407 1.00 0.00 C ATOM 489 C ASN A 28 10.233 -5.917 -18.503 1.00 0.00 C ATOM 490 O ASN A 28 10.275 -7.058 -18.967 1.00 0.00 O ATOM 491 CB ASN A 28 10.889 -4.420 -20.498 1.00 0.00 C ATOM 492 CG ASN A 28 12.253 -4.029 -19.951 1.00 0.00 C ATOM 493 OD1 ASN A 28 13.032 -4.854 -19.500 1.00 0.00 O ATOM 494 ND2 ASN A 28 12.581 -2.756 -19.951 1.00 0.00 N ATOM 0 H ASN A 28 10.262 -2.769 -18.750 1.00 0.00 H new ATOM 0 HA ASN A 28 8.922 -5.038 -19.899 1.00 0.00 H new ATOM 0 HB2 ASN A 28 11.001 -5.300 -21.132 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.518 -3.615 -21.132 1.00 0.00 H new ATOM 0 HD21 ASN A 28 13.483 -2.462 -19.575 1.00 0.00 H new ATOM 0 HD22 ASN A 28 11.934 -2.063 -20.327 1.00 0.00 H new ATOM 501 N ARG A 29 10.476 -5.657 -17.208 1.00 0.00 N ATOM 502 CA ARG A 29 10.723 -6.638 -16.138 1.00 0.00 C ATOM 503 C ARG A 29 9.526 -6.712 -15.187 1.00 0.00 C ATOM 504 O ARG A 29 8.932 -7.779 -15.026 1.00 0.00 O ATOM 505 CB ARG A 29 12.000 -6.292 -15.362 1.00 0.00 C ATOM 506 CG ARG A 29 13.180 -5.937 -16.270 1.00 0.00 C ATOM 507 CD ARG A 29 14.391 -5.698 -15.380 1.00 0.00 C ATOM 508 NE ARG A 29 15.568 -5.300 -16.174 1.00 0.00 N ATOM 509 CZ ARG A 29 16.760 -4.960 -15.716 1.00 0.00 C ATOM 510 NH1 ARG A 29 17.713 -4.637 -16.542 1.00 0.00 N ATOM 511 NH2 ARG A 29 17.033 -4.932 -14.442 1.00 0.00 N ATOM 0 H ARG A 29 10.507 -4.699 -16.859 1.00 0.00 H new ATOM 0 HA ARG A 29 10.859 -7.615 -16.602 1.00 0.00 H new ATOM 0 HB2 ARG A 29 11.797 -5.453 -14.696 1.00 0.00 H new ATOM 0 HB3 ARG A 29 12.276 -7.138 -14.733 1.00 0.00 H new ATOM 0 HG2 ARG A 29 13.377 -6.744 -16.975 1.00 0.00 H new ATOM 0 HG3 ARG A 29 12.956 -5.047 -16.859 1.00 0.00 H new ATOM 0 HD2 ARG A 29 14.162 -4.921 -14.651 1.00 0.00 H new ATOM 0 HD3 ARG A 29 14.618 -6.605 -14.819 1.00 0.00 H new ATOM 0 HE ARG A 29 15.449 -5.286 -17.187 1.00 0.00 H new ATOM 0 HH11 ARG A 29 17.541 -4.646 -17.547 1.00 0.00 H new ATOM 0 HH12 ARG A 29 18.631 -4.375 -16.184 1.00 0.00 H new ATOM 0 HH21 ARG A 29 16.315 -5.178 -13.761 1.00 0.00 H new ATOM 0 HH22 ARG A 29 17.965 -4.664 -14.126 1.00 0.00 H new ATOM 525 N GLY A 30 9.168 -5.571 -14.586 1.00 0.00 N ATOM 526 CA GLY A 30 8.146 -5.443 -13.564 1.00 0.00 C ATOM 527 C GLY A 30 8.591 -5.997 -12.213 1.00 0.00 C ATOM 528 O GLY A 30 9.521 -6.801 -12.108 1.00 0.00 O ATOM 0 H GLY A 30 9.607 -4.679 -14.815 1.00 0.00 H new ATOM 0 HA2 GLY A 30 7.880 -4.392 -13.451 1.00 0.00 H new ATOM 0 HA3 GLY A 30 7.246 -5.966 -13.888 1.00 0.00 H new ATOM 532 N TYR A 31 7.919 -5.550 -11.158 1.00 0.00 N ATOM 533 CA TYR A 31 8.028 -6.135 -9.830 1.00 0.00 C ATOM 534 C TYR A 31 7.332 -7.500 -9.805 1.00 0.00 C ATOM 535 O TYR A 31 6.228 -7.632 -10.319 1.00 0.00 O ATOM 536 CB TYR A 31 7.374 -5.201 -8.815 1.00 0.00 C ATOM 537 CG TYR A 31 7.862 -3.767 -8.818 1.00 0.00 C ATOM 538 CD1 TYR A 31 9.195 -3.443 -9.147 1.00 0.00 C ATOM 539 CD2 TYR A 31 6.960 -2.752 -8.454 1.00 0.00 C ATOM 540 CE1 TYR A 31 9.649 -2.121 -9.002 1.00 0.00 C ATOM 541 CE2 TYR A 31 7.395 -1.417 -8.381 1.00 0.00 C ATOM 542 CZ TYR A 31 8.746 -1.099 -8.626 1.00 0.00 C ATOM 543 OH TYR A 31 9.155 0.191 -8.495 1.00 0.00 O ATOM 0 H TYR A 31 7.275 -4.760 -11.203 1.00 0.00 H new ATOM 0 HA TYR A 31 9.079 -6.270 -9.576 1.00 0.00 H new ATOM 0 HB2 TYR A 31 6.299 -5.198 -8.995 1.00 0.00 H new ATOM 0 HB3 TYR A 31 7.530 -5.614 -7.818 1.00 0.00 H new ATOM 0 HD1 TYR A 31 9.865 -4.209 -9.509 1.00 0.00 H new ATOM 0 HD2 TYR A 31 5.932 -2.998 -8.230 1.00 0.00 H new ATOM 0 HE1 TYR A 31 10.688 -1.885 -9.178 1.00 0.00 H new ATOM 0 HE2 TYR A 31 6.693 -0.634 -8.137 1.00 0.00 H new ATOM 0 HH TYR A 31 8.395 0.750 -8.231 1.00 0.00 H new ATOM 553 N ARG A 32 7.935 -8.511 -9.182 1.00 0.00 N ATOM 554 CA ARG A 32 7.456 -9.915 -9.225 1.00 0.00 C ATOM 555 C ARG A 32 7.308 -10.578 -7.866 1.00 0.00 C ATOM 556 O ARG A 32 7.250 -11.799 -7.788 1.00 0.00 O ATOM 557 CB ARG A 32 8.250 -10.769 -10.237 1.00 0.00 C ATOM 558 CG ARG A 32 9.781 -10.753 -10.086 1.00 0.00 C ATOM 559 CD ARG A 32 10.410 -9.577 -10.845 1.00 0.00 C ATOM 560 NE ARG A 32 11.873 -9.553 -10.707 1.00 0.00 N ATOM 561 CZ ARG A 32 12.687 -8.600 -11.121 1.00 0.00 C ATOM 562 NH1 ARG A 32 13.959 -8.664 -10.861 1.00 0.00 N ATOM 563 NH2 ARG A 32 12.257 -7.557 -11.775 1.00 0.00 N ATOM 0 H ARG A 32 8.780 -8.390 -8.624 1.00 0.00 H new ATOM 0 HA ARG A 32 6.433 -9.855 -9.596 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.909 -11.801 -10.157 1.00 0.00 H new ATOM 0 HB3 ARG A 32 8.001 -10.428 -11.242 1.00 0.00 H new ATOM 0 HG2 ARG A 32 10.043 -10.687 -9.030 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.194 -11.690 -10.459 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.146 -9.644 -11.901 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.995 -8.641 -10.472 1.00 0.00 H new ATOM 0 HE ARG A 32 12.303 -10.354 -10.244 1.00 0.00 H new ATOM 0 HH11 ARG A 32 14.333 -9.454 -10.335 1.00 0.00 H new ATOM 0 HH12 ARG A 32 14.583 -7.925 -11.183 1.00 0.00 H new ATOM 0 HH21 ARG A 32 11.263 -7.459 -11.982 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.915 -6.839 -12.080 1.00 0.00 H new ATOM 577 N ALA A 33 7.225 -9.764 -6.813 1.00 0.00 N ATOM 578 CA ALA A 33 7.211 -10.121 -5.394 1.00 0.00 C ATOM 579 C ALA A 33 8.420 -10.948 -4.893 1.00 0.00 C ATOM 580 O ALA A 33 9.036 -10.589 -3.894 1.00 0.00 O ATOM 581 CB ALA A 33 5.857 -10.769 -5.112 1.00 0.00 C ATOM 0 H ALA A 33 7.160 -8.754 -6.942 1.00 0.00 H new ATOM 0 HA ALA A 33 7.333 -9.211 -4.806 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.801 -11.053 -4.061 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.060 -10.061 -5.339 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.742 -11.657 -5.734 1.00 0.00 H new ATOM 587 N SER A 34 8.818 -12.006 -5.601 1.00 0.00 N ATOM 588 CA SER A 34 9.906 -12.927 -5.243 1.00 0.00 C ATOM 589 C SER A 34 11.301 -12.287 -5.215 1.00 0.00 C ATOM 590 O SER A 34 12.211 -12.835 -4.593 1.00 0.00 O ATOM 591 CB SER A 34 9.922 -14.116 -6.211 1.00 0.00 C ATOM 592 OG SER A 34 8.685 -14.811 -6.169 1.00 0.00 O ATOM 0 H SER A 34 8.371 -12.259 -6.482 1.00 0.00 H new ATOM 0 HA SER A 34 9.693 -13.246 -4.223 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.113 -13.764 -7.225 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.735 -14.793 -5.950 1.00 0.00 H new ATOM 0 HG SER A 34 8.712 -15.565 -6.794 1.00 0.00 H new ATOM 598 N ASP A 35 11.481 -11.124 -5.852 1.00 0.00 N ATOM 599 CA ASP A 35 12.727 -10.341 -5.773 1.00 0.00 C ATOM 600 C ASP A 35 12.780 -9.404 -4.546 1.00 0.00 C ATOM 601 O ASP A 35 13.814 -8.781 -4.290 1.00 0.00 O ATOM 602 CB ASP A 35 12.944 -9.578 -7.087 1.00 0.00 C ATOM 603 CG ASP A 35 13.510 -10.480 -8.193 1.00 0.00 C ATOM 604 OD1 ASP A 35 12.776 -11.352 -8.711 1.00 0.00 O ATOM 605 OD2 ASP A 35 14.653 -10.244 -8.647 1.00 0.00 O ATOM 0 H ASP A 35 10.766 -10.695 -6.440 1.00 0.00 H new ATOM 0 HA ASP A 35 13.549 -11.043 -5.631 1.00 0.00 H new ATOM 0 HB2 ASP A 35 11.998 -9.150 -7.418 1.00 0.00 H new ATOM 0 HB3 ASP A 35 13.627 -8.746 -6.914 1.00 0.00 H new ATOM 610 N TRP A 36 11.693 -9.301 -3.772 1.00 0.00 N ATOM 611 CA TRP A 36 11.623 -8.553 -2.522 1.00 0.00 C ATOM 612 C TRP A 36 12.025 -9.444 -1.329 1.00 0.00 C ATOM 613 O TRP A 36 12.185 -10.662 -1.447 1.00 0.00 O ATOM 614 CB TRP A 36 10.205 -7.987 -2.339 1.00 0.00 C ATOM 615 CG TRP A 36 9.549 -7.227 -3.464 1.00 0.00 C ATOM 616 CD1 TRP A 36 10.106 -6.793 -4.623 1.00 0.00 C ATOM 617 CD2 TRP A 36 8.163 -6.768 -3.508 1.00 0.00 C ATOM 618 NE1 TRP A 36 9.167 -6.102 -5.370 1.00 0.00 N ATOM 619 CE2 TRP A 36 7.970 -6.006 -4.698 1.00 0.00 C ATOM 620 CE3 TRP A 36 7.051 -6.910 -2.651 1.00 0.00 C ATOM 621 CZ2 TRP A 36 6.762 -5.361 -4.987 1.00 0.00 C ATOM 622 CZ3 TRP A 36 5.834 -6.257 -2.923 1.00 0.00 C ATOM 623 CH2 TRP A 36 5.691 -5.481 -4.086 1.00 0.00 C ATOM 0 H TRP A 36 10.811 -9.753 -4.011 1.00 0.00 H new ATOM 0 HA TRP A 36 12.328 -7.723 -2.563 1.00 0.00 H new ATOM 0 HB2 TRP A 36 9.552 -8.822 -2.087 1.00 0.00 H new ATOM 0 HB3 TRP A 36 10.228 -7.328 -1.471 1.00 0.00 H new ATOM 0 HD1 TRP A 36 11.131 -6.962 -4.919 1.00 0.00 H new ATOM 0 HE1 TRP A 36 9.340 -5.715 -6.298 1.00 0.00 H new ATOM 0 HE3 TRP A 36 7.135 -7.531 -1.771 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 6.655 -4.779 -5.890 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 5.007 -6.353 -2.235 1.00 0.00 H new ATOM 0 HH2 TRP A 36 4.757 -4.977 -4.287 1.00 0.00 H new ATOM 634 N LYS A 37 12.162 -8.836 -0.147 1.00 0.00 N ATOM 635 CA LYS A 37 12.609 -9.490 1.100 1.00 0.00 C ATOM 636 C LYS A 37 11.513 -10.293 1.821 1.00 0.00 C ATOM 637 O LYS A 37 11.285 -10.111 3.016 1.00 0.00 O ATOM 638 CB LYS A 37 13.264 -8.460 2.030 1.00 0.00 C ATOM 639 CG LYS A 37 14.554 -7.855 1.464 1.00 0.00 C ATOM 640 CD LYS A 37 15.426 -7.236 2.566 1.00 0.00 C ATOM 641 CE LYS A 37 14.649 -6.280 3.481 1.00 0.00 C ATOM 642 NZ LYS A 37 15.507 -5.764 4.580 1.00 0.00 N ATOM 0 H LYS A 37 11.960 -7.844 -0.021 1.00 0.00 H new ATOM 0 HA LYS A 37 13.350 -10.235 0.810 1.00 0.00 H new ATOM 0 HB2 LYS A 37 12.553 -7.658 2.228 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.484 -8.935 2.986 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.120 -8.628 0.944 1.00 0.00 H new ATOM 0 HG3 LYS A 37 14.304 -7.092 0.727 1.00 0.00 H new ATOM 0 HD2 LYS A 37 15.860 -8.034 3.169 1.00 0.00 H new ATOM 0 HD3 LYS A 37 16.254 -6.697 2.106 1.00 0.00 H new ATOM 0 HE2 LYS A 37 14.264 -5.445 2.895 1.00 0.00 H new ATOM 0 HE3 LYS A 37 13.787 -6.797 3.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 14.953 -5.121 5.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 15.854 -6.560 5.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.316 -5.250 4.177 1.00 0.00 H new ATOM 656 N LEU A 38 10.848 -11.204 1.114 1.00 0.00 N ATOM 657 CA LEU A 38 9.664 -11.935 1.605 1.00 0.00 C ATOM 658 C LEU A 38 9.894 -12.782 2.875 1.00 0.00 C ATOM 659 O LEU A 38 8.932 -13.123 3.562 1.00 0.00 O ATOM 660 CB LEU A 38 9.109 -12.825 0.483 1.00 0.00 C ATOM 661 CG LEU A 38 8.746 -12.092 -0.820 1.00 0.00 C ATOM 662 CD1 LEU A 38 8.073 -13.091 -1.765 1.00 0.00 C ATOM 663 CD2 LEU A 38 7.801 -10.913 -0.595 1.00 0.00 C ATOM 0 H LEU A 38 11.116 -11.465 0.165 1.00 0.00 H new ATOM 0 HA LEU A 38 8.948 -11.167 1.897 1.00 0.00 H new ATOM 0 HB2 LEU A 38 9.846 -13.595 0.254 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.220 -13.335 0.853 1.00 0.00 H new ATOM 0 HG LEU A 38 9.668 -11.692 -1.243 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.808 -12.590 -2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.760 -13.910 -1.977 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.172 -13.485 -1.296 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.581 -10.436 -1.550 1.00 0.00 H new ATOM 0 HD22 LEU A 38 6.874 -11.270 -0.146 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.272 -10.191 0.072 1.00 0.00 H new ATOM 675 N ASP A 39 11.150 -13.100 3.204 1.00 0.00 N ATOM 676 CA ASP A 39 11.537 -13.859 4.405 1.00 0.00 C ATOM 677 C ASP A 39 12.172 -12.977 5.503 1.00 0.00 C ATOM 678 O ASP A 39 12.424 -13.454 6.613 1.00 0.00 O ATOM 679 CB ASP A 39 12.459 -15.018 3.994 1.00 0.00 C ATOM 680 CG ASP A 39 11.712 -16.096 3.193 1.00 0.00 C ATOM 681 OD1 ASP A 39 11.912 -16.189 1.957 1.00 0.00 O ATOM 682 OD2 ASP A 39 10.937 -16.876 3.802 1.00 0.00 O ATOM 0 H ASP A 39 11.949 -12.831 2.630 1.00 0.00 H new ATOM 0 HA ASP A 39 10.630 -14.262 4.856 1.00 0.00 H new ATOM 0 HB2 ASP A 39 13.284 -14.630 3.397 1.00 0.00 H new ATOM 0 HB3 ASP A 39 12.895 -15.467 4.886 1.00 0.00 H new ATOM 687 N GLN A 40 12.414 -11.691 5.213 1.00 0.00 N ATOM 688 CA GLN A 40 13.015 -10.719 6.139 1.00 0.00 C ATOM 689 C GLN A 40 12.499 -9.279 5.887 1.00 0.00 C ATOM 690 O GLN A 40 13.269 -8.421 5.440 1.00 0.00 O ATOM 691 CB GLN A 40 14.562 -10.832 6.148 1.00 0.00 C ATOM 692 CG GLN A 40 15.296 -10.889 4.793 1.00 0.00 C ATOM 693 CD GLN A 40 15.240 -12.249 4.092 1.00 0.00 C ATOM 694 OE1 GLN A 40 15.356 -13.309 4.692 1.00 0.00 O ATOM 695 NE2 GLN A 40 15.088 -12.277 2.784 1.00 0.00 N ATOM 0 H GLN A 40 12.191 -11.287 4.303 1.00 0.00 H new ATOM 0 HA GLN A 40 12.687 -10.969 7.148 1.00 0.00 H new ATOM 0 HB2 GLN A 40 14.955 -9.981 6.704 1.00 0.00 H new ATOM 0 HB3 GLN A 40 14.827 -11.729 6.708 1.00 0.00 H new ATOM 0 HG2 GLN A 40 14.868 -10.136 4.131 1.00 0.00 H new ATOM 0 HG3 GLN A 40 16.340 -10.619 4.949 1.00 0.00 H new ATOM 0 HE21 GLN A 40 14.989 -11.406 2.263 1.00 0.00 H new ATOM 0 HE22 GLN A 40 15.069 -13.170 2.292 1.00 0.00 H new ATOM 704 N PRO A 41 11.206 -8.985 6.153 1.00 0.00 N ATOM 705 CA PRO A 41 10.632 -7.643 6.003 1.00 0.00 C ATOM 706 C PRO A 41 11.402 -6.570 6.785 1.00 0.00 C ATOM 707 O PRO A 41 11.910 -6.803 7.885 1.00 0.00 O ATOM 708 CB PRO A 41 9.165 -7.735 6.456 1.00 0.00 C ATOM 709 CG PRO A 41 9.134 -8.999 7.314 1.00 0.00 C ATOM 710 CD PRO A 41 10.193 -9.892 6.673 1.00 0.00 C ATOM 0 HA PRO A 41 10.702 -7.327 4.962 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.865 -6.856 7.026 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.487 -7.810 5.606 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.369 -8.782 8.356 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.151 -9.469 7.300 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.620 -10.580 7.403 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.764 -10.499 5.876 1.00 0.00 H new ATOM 718 N ASP A 42 11.456 -5.367 6.212 1.00 0.00 N ATOM 719 CA ASP A 42 12.063 -4.181 6.828 1.00 0.00 C ATOM 720 C ASP A 42 11.220 -3.658 8.007 1.00 0.00 C ATOM 721 O ASP A 42 11.757 -3.110 8.971 1.00 0.00 O ATOM 722 CB ASP A 42 12.223 -3.113 5.737 1.00 0.00 C ATOM 723 CG ASP A 42 13.015 -1.884 6.210 1.00 0.00 C ATOM 724 OD1 ASP A 42 14.179 -2.053 6.645 1.00 0.00 O ATOM 725 OD2 ASP A 42 12.500 -0.748 6.078 1.00 0.00 O ATOM 0 H ASP A 42 11.071 -5.183 5.286 1.00 0.00 H new ATOM 0 HA ASP A 42 13.037 -4.439 7.243 1.00 0.00 H new ATOM 0 HB2 ASP A 42 12.727 -3.553 4.876 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.236 -2.795 5.401 1.00 0.00 H new ATOM 730 N TRP A 43 9.901 -3.877 7.943 1.00 0.00 N ATOM 731 CA TRP A 43 8.934 -3.594 9.012 1.00 0.00 C ATOM 732 C TRP A 43 7.668 -4.455 8.851 1.00 0.00 C ATOM 733 O TRP A 43 7.323 -4.841 7.733 1.00 0.00 O ATOM 734 CB TRP A 43 8.595 -2.095 8.978 1.00 0.00 C ATOM 735 CG TRP A 43 7.452 -1.652 9.835 1.00 0.00 C ATOM 736 CD1 TRP A 43 7.534 -1.140 11.084 1.00 0.00 C ATOM 737 CD2 TRP A 43 6.033 -1.657 9.496 1.00 0.00 C ATOM 738 NE1 TRP A 43 6.268 -0.806 11.529 1.00 0.00 N ATOM 739 CE2 TRP A 43 5.308 -1.075 10.575 1.00 0.00 C ATOM 740 CE3 TRP A 43 5.290 -2.104 8.383 1.00 0.00 C ATOM 741 CZ2 TRP A 43 3.921 -0.887 10.522 1.00 0.00 C ATOM 742 CZ3 TRP A 43 3.898 -1.905 8.318 1.00 0.00 C ATOM 743 CH2 TRP A 43 3.212 -1.294 9.381 1.00 0.00 C ATOM 0 H TRP A 43 9.460 -4.272 7.112 1.00 0.00 H new ATOM 0 HA TRP A 43 9.369 -3.847 9.979 1.00 0.00 H new ATOM 0 HB2 TRP A 43 9.482 -1.537 9.277 1.00 0.00 H new ATOM 0 HB3 TRP A 43 8.376 -1.817 7.947 1.00 0.00 H new ATOM 0 HD1 TRP A 43 8.447 -1.012 11.647 1.00 0.00 H new ATOM 0 HE1 TRP A 43 6.069 -0.410 12.448 1.00 0.00 H new ATOM 0 HE3 TRP A 43 5.796 -2.605 7.571 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 3.401 -0.432 11.352 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 3.352 -2.225 7.443 1.00 0.00 H new ATOM 0 HH2 TRP A 43 2.145 -1.138 9.321 1.00 0.00 H new ATOM 754 N THR A 44 6.946 -4.732 9.941 1.00 0.00 N ATOM 755 CA THR A 44 5.624 -5.391 9.917 1.00 0.00 C ATOM 756 C THR A 44 4.619 -4.713 10.852 1.00 0.00 C ATOM 757 O THR A 44 4.986 -4.148 11.886 1.00 0.00 O ATOM 758 CB THR A 44 5.703 -6.887 10.262 1.00 0.00 C ATOM 759 OG1 THR A 44 6.259 -7.098 11.544 1.00 0.00 O ATOM 760 CG2 THR A 44 6.536 -7.674 9.260 1.00 0.00 C ATOM 0 H THR A 44 7.263 -4.503 10.883 1.00 0.00 H new ATOM 0 HA THR A 44 5.274 -5.289 8.890 1.00 0.00 H new ATOM 0 HB THR A 44 4.673 -7.242 10.234 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.293 -8.059 11.732 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.559 -8.724 9.551 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.094 -7.582 8.268 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.552 -7.280 9.243 1.00 0.00 H new ATOM 768 N GLY A 45 3.332 -4.783 10.499 1.00 0.00 N ATOM 769 CA GLY A 45 2.256 -4.129 11.250 1.00 0.00 C ATOM 770 C GLY A 45 0.864 -4.331 10.647 1.00 0.00 C ATOM 771 O GLY A 45 0.549 -5.418 10.161 1.00 0.00 O ATOM 0 H GLY A 45 3.006 -5.297 9.681 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.257 -4.509 12.272 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.464 -3.061 11.307 1.00 0.00 H new ATOM 775 N ARG A 46 0.032 -3.284 10.703 1.00 0.00 N ATOM 776 CA ARG A 46 -1.355 -3.224 10.208 1.00 0.00 C ATOM 777 C ARG A 46 -1.489 -2.302 8.996 1.00 0.00 C ATOM 778 O ARG A 46 -0.779 -1.302 8.877 1.00 0.00 O ATOM 779 CB ARG A 46 -2.327 -2.724 11.297 1.00 0.00 C ATOM 780 CG ARG A 46 -2.152 -3.376 12.672 1.00 0.00 C ATOM 781 CD ARG A 46 -3.291 -3.021 13.640 1.00 0.00 C ATOM 782 NE ARG A 46 -3.293 -1.587 14.011 1.00 0.00 N ATOM 783 CZ ARG A 46 -3.378 -1.064 15.223 1.00 0.00 C ATOM 784 NH1 ARG A 46 -3.435 0.226 15.365 1.00 0.00 N ATOM 785 NH2 ARG A 46 -3.426 -1.788 16.307 1.00 0.00 N ATOM 0 H ARG A 46 0.324 -2.400 11.120 1.00 0.00 H new ATOM 0 HA ARG A 46 -1.612 -4.244 9.922 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -2.204 -1.646 11.405 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.348 -2.896 10.958 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.104 -4.459 12.554 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -1.202 -3.060 13.102 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -4.246 -3.276 13.181 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -3.199 -3.626 14.542 1.00 0.00 H new ATOM 0 HE ARG A 46 -3.220 -0.924 13.240 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -3.414 0.831 14.544 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -3.501 0.634 16.298 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -3.398 -2.806 16.242 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -3.491 -1.337 17.219 1.00 0.00 H new ATOM 799 N LEU A 47 -2.472 -2.604 8.157 1.00 0.00 N ATOM 800 CA LEU A 47 -2.996 -1.742 7.099 1.00 0.00 C ATOM 801 C LEU A 47 -4.150 -0.883 7.638 1.00 0.00 C ATOM 802 O LEU A 47 -5.033 -1.407 8.319 1.00 0.00 O ATOM 803 CB LEU A 47 -3.504 -2.661 5.972 1.00 0.00 C ATOM 804 CG LEU A 47 -4.168 -1.940 4.786 1.00 0.00 C ATOM 805 CD1 LEU A 47 -3.139 -1.214 3.922 1.00 0.00 C ATOM 806 CD2 LEU A 47 -4.910 -2.964 3.936 1.00 0.00 C ATOM 0 H LEU A 47 -2.952 -3.503 8.196 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.221 -1.069 6.731 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.665 -3.246 5.597 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.220 -3.366 6.395 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.860 -1.196 5.181 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.645 -0.717 3.094 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.615 -0.473 4.526 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.421 -1.934 3.529 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.384 -2.462 3.093 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.205 -3.709 3.566 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.672 -3.455 4.541 1.00 0.00 H new ATOM 818 N ARG A 48 -4.208 0.392 7.240 1.00 0.00 N ATOM 819 CA ARG A 48 -5.387 1.263 7.364 1.00 0.00 C ATOM 820 C ARG A 48 -5.540 2.131 6.109 1.00 0.00 C ATOM 821 O ARG A 48 -4.903 3.174 5.971 1.00 0.00 O ATOM 822 CB ARG A 48 -5.282 2.098 8.657 1.00 0.00 C ATOM 823 CG ARG A 48 -6.542 2.953 8.885 1.00 0.00 C ATOM 824 CD ARG A 48 -6.440 3.897 10.092 1.00 0.00 C ATOM 825 NE ARG A 48 -6.139 3.192 11.348 1.00 0.00 N ATOM 826 CZ ARG A 48 -6.929 2.449 12.095 1.00 0.00 C ATOM 827 NH1 ARG A 48 -6.426 1.830 13.119 1.00 0.00 N ATOM 828 NH2 ARG A 48 -8.200 2.299 11.847 1.00 0.00 N ATOM 0 H ARG A 48 -3.413 0.863 6.809 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.291 0.658 7.440 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.134 1.434 9.508 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.407 2.746 8.602 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.736 3.543 7.989 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.398 2.292 9.023 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.663 4.638 9.902 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.379 4.440 10.202 1.00 0.00 H new ATOM 0 HE ARG A 48 -5.183 3.293 11.688 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -5.433 1.923 13.334 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -7.023 1.250 13.708 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -8.622 2.768 11.045 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.772 1.713 12.455 1.00 0.00 H new ATOM 842 N ILE A 49 -6.416 1.712 5.199 1.00 0.00 N ATOM 843 CA ILE A 49 -6.832 2.531 4.053 1.00 0.00 C ATOM 844 C ILE A 49 -7.886 3.531 4.530 1.00 0.00 C ATOM 845 O ILE A 49 -8.858 3.155 5.189 1.00 0.00 O ATOM 846 CB ILE A 49 -7.348 1.690 2.866 1.00 0.00 C ATOM 847 CG1 ILE A 49 -6.384 0.531 2.539 1.00 0.00 C ATOM 848 CG2 ILE A 49 -7.535 2.608 1.643 1.00 0.00 C ATOM 849 CD1 ILE A 49 -6.830 -0.311 1.342 1.00 0.00 C ATOM 0 H ILE A 49 -6.861 0.795 5.231 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.959 3.060 3.672 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.306 1.245 3.137 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -5.393 0.938 2.338 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.293 -0.113 3.413 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.899 2.021 0.800 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.258 3.389 1.881 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.580 3.065 1.382 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.107 -1.108 1.168 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.808 -0.747 1.548 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.894 0.321 0.456 1.00 0.00 H new ATOM 861 N THR A 50 -7.687 4.798 4.187 1.00 0.00 N ATOM 862 CA THR A 50 -8.520 5.950 4.565 1.00 0.00 C ATOM 863 C THR A 50 -8.716 6.878 3.356 1.00 0.00 C ATOM 864 O THR A 50 -7.944 6.806 2.404 1.00 0.00 O ATOM 865 CB THR A 50 -7.881 6.702 5.752 1.00 0.00 C ATOM 866 OG1 THR A 50 -6.488 6.842 5.641 1.00 0.00 O ATOM 867 CG2 THR A 50 -8.142 6.024 7.096 1.00 0.00 C ATOM 0 H THR A 50 -6.896 5.072 3.604 1.00 0.00 H new ATOM 0 HA THR A 50 -9.501 5.596 4.881 1.00 0.00 H new ATOM 0 HB THR A 50 -8.360 7.680 5.715 1.00 0.00 H new ATOM 0 HG1 THR A 50 -6.185 6.440 4.800 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.668 6.599 7.892 1.00 0.00 H new ATOM 0 HG22 THR A 50 -9.216 5.973 7.275 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.728 5.016 7.081 1.00 0.00 H new ATOM 875 N SER A 51 -9.741 7.738 3.335 1.00 0.00 N ATOM 876 CA SER A 51 -9.915 8.758 2.280 1.00 0.00 C ATOM 877 C SER A 51 -10.755 9.946 2.721 1.00 0.00 C ATOM 878 O SER A 51 -11.820 9.777 3.315 1.00 0.00 O ATOM 879 CB SER A 51 -10.539 8.142 1.025 1.00 0.00 C ATOM 880 OG SER A 51 -10.515 9.069 -0.043 1.00 0.00 O ATOM 0 H SER A 51 -10.474 7.751 4.044 1.00 0.00 H new ATOM 0 HA SER A 51 -8.913 9.128 2.061 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.994 7.241 0.745 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.566 7.842 1.232 1.00 0.00 H new ATOM 0 HG SER A 51 -10.608 8.591 -0.893 1.00 0.00 H new ATOM 886 N LYS A 52 -10.272 11.153 2.412 1.00 0.00 N ATOM 887 CA LYS A 52 -10.923 12.440 2.679 1.00 0.00 C ATOM 888 C LYS A 52 -10.606 13.445 1.567 1.00 0.00 C ATOM 889 O LYS A 52 -9.449 13.676 1.224 1.00 0.00 O ATOM 890 CB LYS A 52 -10.491 12.990 4.046 1.00 0.00 C ATOM 891 CG LYS A 52 -11.174 12.353 5.267 1.00 0.00 C ATOM 892 CD LYS A 52 -12.679 12.624 5.381 1.00 0.00 C ATOM 893 CE LYS A 52 -13.080 12.508 6.859 1.00 0.00 C ATOM 894 NZ LYS A 52 -14.554 12.524 7.033 1.00 0.00 N ATOM 0 H LYS A 52 -9.372 11.265 1.946 1.00 0.00 H new ATOM 0 HA LYS A 52 -12.001 12.282 2.699 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -9.414 12.859 4.146 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -10.684 14.063 4.063 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -11.016 11.275 5.232 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -10.685 12.718 6.170 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -12.916 13.618 5.000 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -13.240 11.910 4.778 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -12.675 11.585 7.274 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -12.639 13.331 7.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -14.790 12.943 7.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -14.987 13.089 6.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -14.919 11.551 6.992 1.00 0.00 H new ATOM 908 N GLY A 53 -11.653 14.057 1.022 1.00 0.00 N ATOM 909 CA GLY A 53 -11.562 15.210 0.109 1.00 0.00 C ATOM 910 C GLY A 53 -11.076 14.877 -1.309 1.00 0.00 C ATOM 911 O GLY A 53 -10.332 15.657 -1.903 1.00 0.00 O ATOM 0 H GLY A 53 -12.613 13.765 1.202 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -12.544 15.678 0.040 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.887 15.947 0.545 1.00 0.00 H new ATOM 915 N LYS A 54 -11.482 13.713 -1.843 1.00 0.00 N ATOM 916 CA LYS A 54 -10.989 13.101 -3.098 1.00 0.00 C ATOM 917 C LYS A 54 -9.488 12.758 -3.065 1.00 0.00 C ATOM 918 O LYS A 54 -8.830 12.694 -4.104 1.00 0.00 O ATOM 919 CB LYS A 54 -11.407 13.882 -4.368 1.00 0.00 C ATOM 920 CG LYS A 54 -12.914 14.141 -4.558 1.00 0.00 C ATOM 921 CD LYS A 54 -13.497 15.387 -3.866 1.00 0.00 C ATOM 922 CE LYS A 54 -12.773 16.681 -4.267 1.00 0.00 C ATOM 923 NZ LYS A 54 -13.445 17.885 -3.713 1.00 0.00 N ATOM 0 H LYS A 54 -12.197 13.142 -1.393 1.00 0.00 H new ATOM 0 HA LYS A 54 -11.502 12.142 -3.165 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.895 14.844 -4.359 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -11.044 13.335 -5.238 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -13.113 14.222 -5.627 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -13.457 13.267 -4.198 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -14.554 15.475 -4.116 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -13.434 15.260 -2.785 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -11.743 16.645 -3.914 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -12.735 16.754 -5.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -12.926 18.738 -4.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -14.421 17.933 -4.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -13.459 17.828 -2.675 1.00 0.00 H new ATOM 937 N THR A 55 -8.964 12.491 -1.869 1.00 0.00 N ATOM 938 CA THR A 55 -7.601 12.003 -1.633 1.00 0.00 C ATOM 939 C THR A 55 -7.653 10.820 -0.671 1.00 0.00 C ATOM 940 O THR A 55 -8.071 10.963 0.479 1.00 0.00 O ATOM 941 CB THR A 55 -6.699 13.108 -1.060 1.00 0.00 C ATOM 942 OG1 THR A 55 -6.711 14.249 -1.897 1.00 0.00 O ATOM 943 CG2 THR A 55 -5.246 12.651 -0.963 1.00 0.00 C ATOM 0 H THR A 55 -9.494 12.612 -1.006 1.00 0.00 H new ATOM 0 HA THR A 55 -7.175 11.691 -2.586 1.00 0.00 H new ATOM 0 HB THR A 55 -7.091 13.341 -0.070 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.133 14.941 -1.514 1.00 0.00 H new ATOM 0 HG21 THR A 55 -4.637 13.457 -0.554 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.181 11.781 -0.310 1.00 0.00 H new ATOM 0 HG23 THR A 55 -4.880 12.388 -1.956 1.00 0.00 H new ATOM 951 N ALA A 56 -7.214 9.654 -1.142 1.00 0.00 N ATOM 952 CA ALA A 56 -7.041 8.463 -0.321 1.00 0.00 C ATOM 953 C ALA A 56 -5.660 8.455 0.345 1.00 0.00 C ATOM 954 O ALA A 56 -4.724 9.088 -0.140 1.00 0.00 O ATOM 955 CB ALA A 56 -7.303 7.214 -1.164 1.00 0.00 C ATOM 0 H ALA A 56 -6.965 9.511 -2.121 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.769 8.468 0.490 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.173 6.325 -0.547 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -8.322 7.242 -1.549 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.601 7.184 -1.997 1.00 0.00 H new ATOM 961 N TYR A 57 -5.525 7.718 1.442 1.00 0.00 N ATOM 962 CA TYR A 57 -4.293 7.542 2.199 1.00 0.00 C ATOM 963 C TYR A 57 -4.169 6.071 2.612 1.00 0.00 C ATOM 964 O TYR A 57 -4.987 5.558 3.380 1.00 0.00 O ATOM 965 CB TYR A 57 -4.275 8.470 3.428 1.00 0.00 C ATOM 966 CG TYR A 57 -4.625 9.922 3.161 1.00 0.00 C ATOM 967 CD1 TYR A 57 -3.627 10.821 2.749 1.00 0.00 C ATOM 968 CD2 TYR A 57 -5.953 10.369 3.323 1.00 0.00 C ATOM 969 CE1 TYR A 57 -3.949 12.168 2.492 1.00 0.00 C ATOM 970 CE2 TYR A 57 -6.280 11.715 3.070 1.00 0.00 C ATOM 971 CZ TYR A 57 -5.277 12.621 2.659 1.00 0.00 C ATOM 972 OH TYR A 57 -5.594 13.926 2.430 1.00 0.00 O ATOM 0 H TYR A 57 -6.308 7.204 1.845 1.00 0.00 H new ATOM 0 HA TYR A 57 -3.439 7.810 1.578 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -4.973 8.077 4.167 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.282 8.431 3.875 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -2.610 10.478 2.629 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -6.720 9.678 3.641 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -3.181 12.854 2.167 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.298 12.055 3.190 1.00 0.00 H new ATOM 0 HH TYR A 57 -6.551 14.063 2.592 1.00 0.00 H new ATOM 982 N ILE A 58 -3.139 5.379 2.125 1.00 0.00 N ATOM 983 CA ILE A 58 -2.766 4.053 2.636 1.00 0.00 C ATOM 984 C ILE A 58 -1.847 4.291 3.832 1.00 0.00 C ATOM 985 O ILE A 58 -0.643 4.499 3.660 1.00 0.00 O ATOM 986 CB ILE A 58 -2.141 3.156 1.538 1.00 0.00 C ATOM 987 CG1 ILE A 58 -3.094 2.816 0.368 1.00 0.00 C ATOM 988 CG2 ILE A 58 -1.672 1.824 2.151 1.00 0.00 C ATOM 989 CD1 ILE A 58 -3.298 3.943 -0.651 1.00 0.00 C ATOM 0 H ILE A 58 -2.541 5.716 1.370 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.644 3.492 2.955 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.315 3.741 1.133 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.706 1.941 -0.154 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.065 2.538 0.779 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.234 1.199 1.372 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.926 2.021 2.921 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.524 1.308 2.594 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.981 3.608 -1.432 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.719 4.815 -0.150 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.339 4.208 -1.097 1.00 0.00 H new ATOM 1001 N LYS A 59 -2.419 4.328 5.041 1.00 0.00 N ATOM 1002 CA LYS A 59 -1.659 4.440 6.296 1.00 0.00 C ATOM 1003 C LYS A 59 -1.252 3.059 6.825 1.00 0.00 C ATOM 1004 O LYS A 59 -2.032 2.107 6.778 1.00 0.00 O ATOM 1005 CB LYS A 59 -2.446 5.266 7.331 1.00 0.00 C ATOM 1006 CG LYS A 59 -2.912 6.619 6.764 1.00 0.00 C ATOM 1007 CD LYS A 59 -3.438 7.547 7.865 1.00 0.00 C ATOM 1008 CE LYS A 59 -4.049 8.811 7.247 1.00 0.00 C ATOM 1009 NZ LYS A 59 -4.464 9.773 8.298 1.00 0.00 N ATOM 0 H LYS A 59 -3.428 4.281 5.179 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.731 4.976 6.096 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.313 4.696 7.664 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.821 5.437 8.207 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -2.082 7.102 6.247 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.695 6.453 6.024 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -4.187 7.027 8.462 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -2.626 7.819 8.539 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -3.324 9.283 6.584 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.910 8.541 6.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -5.093 10.490 7.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.968 9.266 9.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -3.623 10.238 8.695 1.00 0.00 H new ATOM 1023 N LEU A 60 -0.028 2.949 7.334 1.00 0.00 N ATOM 1024 CA LEU A 60 0.554 1.753 7.954 1.00 0.00 C ATOM 1025 C LEU A 60 0.807 1.988 9.451 1.00 0.00 C ATOM 1026 O LEU A 60 1.386 3.008 9.828 1.00 0.00 O ATOM 1027 CB LEU A 60 1.853 1.387 7.212 1.00 0.00 C ATOM 1028 CG LEU A 60 1.702 0.266 6.172 1.00 0.00 C ATOM 1029 CD1 LEU A 60 0.651 0.542 5.095 1.00 0.00 C ATOM 1030 CD2 LEU A 60 3.039 0.063 5.464 1.00 0.00 C ATOM 0 H LEU A 60 0.624 3.733 7.327 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.144 0.920 7.874 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.234 2.278 6.713 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.602 1.086 7.945 1.00 0.00 H new ATOM 0 HG LEU A 60 1.377 -0.614 6.728 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.610 -0.299 4.403 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.324 0.674 5.564 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.918 1.448 4.550 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.942 -0.731 4.724 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.332 0.988 4.968 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.799 -0.213 6.195 1.00 0.00 H new ATOM 1042 N GLU A 61 0.405 1.043 10.303 1.00 0.00 N ATOM 1043 CA GLU A 61 0.418 1.198 11.769 1.00 0.00 C ATOM 1044 C GLU A 61 1.108 0.049 12.508 1.00 0.00 C ATOM 1045 O GLU A 61 1.024 -1.102 12.088 1.00 0.00 O ATOM 1046 CB GLU A 61 -1.007 1.333 12.315 1.00 0.00 C ATOM 1047 CG GLU A 61 -1.718 2.612 11.867 1.00 0.00 C ATOM 1048 CD GLU A 61 -3.092 2.759 12.541 1.00 0.00 C ATOM 1049 OE1 GLU A 61 -3.644 1.772 13.090 1.00 0.00 O ATOM 1050 OE2 GLU A 61 -3.672 3.864 12.489 1.00 0.00 O ATOM 0 H GLU A 61 0.056 0.135 9.996 1.00 0.00 H new ATOM 0 HA GLU A 61 0.995 2.105 11.952 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.593 0.471 11.995 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.973 1.309 13.404 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -1.099 3.477 12.107 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -1.842 2.600 10.784 1.00 0.00 H new ATOM 1057 N ASP A 62 1.748 0.324 13.645 1.00 0.00 N ATOM 1058 CA ASP A 62 2.274 -0.723 14.519 1.00 0.00 C ATOM 1059 C ASP A 62 1.115 -1.418 15.241 1.00 0.00 C ATOM 1060 O ASP A 62 0.284 -0.758 15.875 1.00 0.00 O ATOM 1061 CB ASP A 62 3.241 -0.107 15.527 1.00 0.00 C ATOM 1062 CG ASP A 62 3.908 -1.178 16.394 1.00 0.00 C ATOM 1063 OD1 ASP A 62 5.089 -1.517 16.151 1.00 0.00 O ATOM 1064 OD2 ASP A 62 3.221 -1.685 17.308 1.00 0.00 O ATOM 0 H ASP A 62 1.915 1.272 13.984 1.00 0.00 H new ATOM 0 HA ASP A 62 2.811 -1.463 13.926 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.006 0.462 14.998 1.00 0.00 H new ATOM 0 HB3 ASP A 62 2.704 0.596 16.164 1.00 0.00 H new ATOM 1069 N LYS A 63 1.059 -2.751 15.178 1.00 0.00 N ATOM 1070 CA LYS A 63 -0.087 -3.506 15.703 1.00 0.00 C ATOM 1071 C LYS A 63 -0.153 -3.629 17.222 1.00 0.00 C ATOM 1072 O LYS A 63 -1.163 -4.105 17.744 1.00 0.00 O ATOM 1073 CB LYS A 63 -0.192 -4.872 15.000 1.00 0.00 C ATOM 1074 CG LYS A 63 0.848 -5.878 15.510 1.00 0.00 C ATOM 1075 CD LYS A 63 0.717 -7.236 14.818 1.00 0.00 C ATOM 1076 CE LYS A 63 1.267 -7.197 13.387 1.00 0.00 C ATOM 1077 NZ LYS A 63 0.666 -8.279 12.569 1.00 0.00 N ATOM 0 H LYS A 63 1.792 -3.331 14.770 1.00 0.00 H new ATOM 0 HA LYS A 63 -0.967 -2.909 15.464 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.192 -5.279 15.152 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.064 -4.735 13.926 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.849 -5.481 15.343 1.00 0.00 H new ATOM 0 HG3 LYS A 63 0.731 -6.006 16.586 1.00 0.00 H new ATOM 0 HD2 LYS A 63 1.252 -7.991 15.393 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.331 -7.535 14.797 1.00 0.00 H new ATOM 0 HE2 LYS A 63 1.052 -6.229 12.935 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.351 -7.306 13.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.292 -8.497 11.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.544 -9.130 13.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.260 -7.970 12.211 1.00 0.00 H new ATOM 1091 N VAL A 64 0.902 -3.216 17.920 1.00 0.00 N ATOM 1092 CA VAL A 64 1.068 -3.420 19.360 1.00 0.00 C ATOM 1093 C VAL A 64 1.002 -2.089 20.108 1.00 0.00 C ATOM 1094 O VAL A 64 0.402 -2.022 21.184 1.00 0.00 O ATOM 1095 CB VAL A 64 2.397 -4.155 19.634 1.00 0.00 C ATOM 1096 CG1 VAL A 64 2.575 -4.478 21.122 1.00 0.00 C ATOM 1097 CG2 VAL A 64 2.506 -5.472 18.848 1.00 0.00 C ATOM 0 H VAL A 64 1.683 -2.719 17.492 1.00 0.00 H new ATOM 0 HA VAL A 64 0.250 -4.040 19.728 1.00 0.00 H new ATOM 0 HB VAL A 64 3.179 -3.470 19.307 1.00 0.00 H new ATOM 0 HG11 VAL A 64 3.523 -4.995 21.271 1.00 0.00 H new ATOM 0 HG12 VAL A 64 2.572 -3.553 21.698 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.757 -5.116 21.456 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.458 -5.953 19.074 1.00 0.00 H new ATOM 0 HG22 VAL A 64 1.689 -6.134 19.133 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.449 -5.264 17.780 1.00 0.00 H new ATOM 1107 N SER A 65 1.550 -1.021 19.519 1.00 0.00 N ATOM 1108 CA SER A 65 1.610 0.313 20.129 1.00 0.00 C ATOM 1109 C SER A 65 0.701 1.343 19.445 1.00 0.00 C ATOM 1110 O SER A 65 0.427 2.395 20.027 1.00 0.00 O ATOM 1111 CB SER A 65 3.062 0.805 20.154 1.00 0.00 C ATOM 1112 OG SER A 65 3.847 -0.009 21.016 1.00 0.00 O ATOM 0 H SER A 65 1.971 -1.059 18.591 1.00 0.00 H new ATOM 0 HA SER A 65 1.232 0.213 21.146 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.477 0.784 19.146 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.096 1.841 20.491 1.00 0.00 H new ATOM 0 HG SER A 65 4.772 0.316 21.020 1.00 0.00 H new ATOM 1118 N GLY A 66 0.207 1.065 18.229 1.00 0.00 N ATOM 1119 CA GLY A 66 -0.668 1.980 17.484 1.00 0.00 C ATOM 1120 C GLY A 66 0.069 3.182 16.878 1.00 0.00 C ATOM 1121 O GLY A 66 -0.550 4.201 16.571 1.00 0.00 O ATOM 0 H GLY A 66 0.405 0.196 17.734 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.161 1.427 16.685 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.451 2.343 18.150 1.00 0.00 H new ATOM 1125 N GLU A 67 1.392 3.077 16.725 1.00 0.00 N ATOM 1126 CA GLU A 67 2.234 4.068 16.048 1.00 0.00 C ATOM 1127 C GLU A 67 1.866 4.197 14.566 1.00 0.00 C ATOM 1128 O GLU A 67 1.345 3.255 13.971 1.00 0.00 O ATOM 1129 CB GLU A 67 3.715 3.662 16.122 1.00 0.00 C ATOM 1130 CG GLU A 67 4.240 3.403 17.534 1.00 0.00 C ATOM 1131 CD GLU A 67 4.118 4.627 18.468 1.00 0.00 C ATOM 1132 OE1 GLU A 67 3.697 4.461 19.637 1.00 0.00 O ATOM 1133 OE2 GLU A 67 4.464 5.760 18.050 1.00 0.00 O ATOM 0 H GLU A 67 1.921 2.280 17.078 1.00 0.00 H new ATOM 0 HA GLU A 67 2.069 5.018 16.556 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.860 2.762 15.525 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.316 4.448 15.665 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.693 2.567 17.969 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.286 3.103 17.475 1.00 0.00 H new ATOM 1140 N LEU A 68 2.228 5.323 13.949 1.00 0.00 N ATOM 1141 CA LEU A 68 2.203 5.501 12.492 1.00 0.00 C ATOM 1142 C LEU A 68 3.598 5.201 11.920 1.00 0.00 C ATOM 1143 O LEU A 68 4.570 5.876 12.268 1.00 0.00 O ATOM 1144 CB LEU A 68 1.717 6.926 12.156 1.00 0.00 C ATOM 1145 CG LEU A 68 1.583 7.217 10.646 1.00 0.00 C ATOM 1146 CD1 LEU A 68 0.415 6.465 10.005 1.00 0.00 C ATOM 1147 CD2 LEU A 68 1.344 8.711 10.420 1.00 0.00 C ATOM 0 H LEU A 68 2.551 6.149 14.452 1.00 0.00 H new ATOM 0 HA LEU A 68 1.504 4.804 12.030 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.750 7.088 12.632 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.411 7.645 12.592 1.00 0.00 H new ATOM 0 HG LEU A 68 2.514 6.886 10.186 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.366 6.706 8.943 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.562 5.392 10.128 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.517 6.761 10.487 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.251 8.907 9.352 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.427 9.013 10.926 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.184 9.279 10.821 1.00 0.00 H new ATOM 1159 N PHE A 69 3.701 4.207 11.036 1.00 0.00 N ATOM 1160 CA PHE A 69 4.944 3.871 10.333 1.00 0.00 C ATOM 1161 C PHE A 69 5.132 4.745 9.085 1.00 0.00 C ATOM 1162 O PHE A 69 6.150 5.427 8.947 1.00 0.00 O ATOM 1163 CB PHE A 69 4.954 2.375 9.984 1.00 0.00 C ATOM 1164 CG PHE A 69 6.070 1.974 9.034 1.00 0.00 C ATOM 1165 CD1 PHE A 69 7.400 1.917 9.491 1.00 0.00 C ATOM 1166 CD2 PHE A 69 5.789 1.710 7.679 1.00 0.00 C ATOM 1167 CE1 PHE A 69 8.442 1.594 8.602 1.00 0.00 C ATOM 1168 CE2 PHE A 69 6.834 1.409 6.787 1.00 0.00 C ATOM 1169 CZ PHE A 69 8.160 1.344 7.249 1.00 0.00 C ATOM 0 H PHE A 69 2.917 3.605 10.784 1.00 0.00 H new ATOM 0 HA PHE A 69 5.788 4.077 10.992 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.048 1.798 10.904 1.00 0.00 H new ATOM 0 HB3 PHE A 69 3.996 2.109 9.537 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.622 2.122 10.528 1.00 0.00 H new ATOM 0 HD2 PHE A 69 4.769 1.739 7.324 1.00 0.00 H new ATOM 0 HE1 PHE A 69 9.459 1.538 8.960 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.617 1.227 5.745 1.00 0.00 H new ATOM 0 HZ PHE A 69 8.960 1.102 6.565 1.00 0.00 H new ATOM 1179 N ALA A 70 4.138 4.739 8.192 1.00 0.00 N ATOM 1180 CA ALA A 70 4.143 5.485 6.937 1.00 0.00 C ATOM 1181 C ALA A 70 2.713 5.771 6.444 1.00 0.00 C ATOM 1182 O ALA A 70 1.747 5.161 6.908 1.00 0.00 O ATOM 1183 CB ALA A 70 4.933 4.675 5.898 1.00 0.00 C ATOM 0 H ALA A 70 3.284 4.198 8.329 1.00 0.00 H new ATOM 0 HA ALA A 70 4.618 6.454 7.093 1.00 0.00 H new ATOM 0 HB1 ALA A 70 4.949 5.215 4.951 1.00 0.00 H new ATOM 0 HB2 ALA A 70 5.954 4.529 6.250 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.457 3.705 5.754 1.00 0.00 H new ATOM 1189 N GLN A 71 2.582 6.681 5.479 1.00 0.00 N ATOM 1190 CA GLN A 71 1.319 7.018 4.814 1.00 0.00 C ATOM 1191 C GLN A 71 1.547 7.345 3.331 1.00 0.00 C ATOM 1192 O GLN A 71 2.460 8.098 3.003 1.00 0.00 O ATOM 1193 CB GLN A 71 0.623 8.189 5.535 1.00 0.00 C ATOM 1194 CG GLN A 71 1.552 9.379 5.848 1.00 0.00 C ATOM 1195 CD GLN A 71 0.837 10.725 5.815 1.00 0.00 C ATOM 1196 OE1 GLN A 71 -0.232 10.919 6.381 1.00 0.00 O ATOM 1197 NE2 GLN A 71 1.401 11.704 5.140 1.00 0.00 N ATOM 0 H GLN A 71 3.373 7.221 5.127 1.00 0.00 H new ATOM 0 HA GLN A 71 0.665 6.147 4.866 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.204 8.541 4.919 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.193 7.823 6.467 1.00 0.00 H new ATOM 0 HG2 GLN A 71 1.996 9.235 6.833 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.370 9.392 5.128 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.291 11.550 4.666 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.948 12.617 5.091 1.00 0.00 H new ATOM 1206 N ALA A 72 0.710 6.820 2.433 1.00 0.00 N ATOM 1207 CA ALA A 72 0.746 7.122 0.998 1.00 0.00 C ATOM 1208 C ALA A 72 -0.535 7.840 0.528 1.00 0.00 C ATOM 1209 O ALA A 72 -1.534 7.171 0.258 1.00 0.00 O ATOM 1210 CB ALA A 72 1.021 5.827 0.224 1.00 0.00 C ATOM 0 H ALA A 72 -0.026 6.161 2.686 1.00 0.00 H new ATOM 0 HA ALA A 72 1.556 7.823 0.796 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.050 6.041 -0.844 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.979 5.413 0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.230 5.106 0.429 1.00 0.00 H new ATOM 1216 N PRO A 73 -0.516 9.186 0.426 1.00 0.00 N ATOM 1217 CA PRO A 73 -1.527 9.975 -0.277 1.00 0.00 C ATOM 1218 C PRO A 73 -1.678 9.583 -1.755 1.00 0.00 C ATOM 1219 O PRO A 73 -0.681 9.421 -2.463 1.00 0.00 O ATOM 1220 CB PRO A 73 -1.083 11.439 -0.167 1.00 0.00 C ATOM 1221 CG PRO A 73 -0.166 11.464 1.051 1.00 0.00 C ATOM 1222 CD PRO A 73 0.445 10.065 1.074 1.00 0.00 C ATOM 0 HA PRO A 73 -2.503 9.798 0.176 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -0.559 11.764 -1.066 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.936 12.105 -0.036 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.600 12.234 0.959 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -0.721 11.674 1.966 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.400 10.050 0.549 1.00 0.00 H new ATOM 0 HD3 PRO A 73 0.638 9.742 2.097 1.00 0.00 H new ATOM 1230 N VAL A 74 -2.924 9.496 -2.227 1.00 0.00 N ATOM 1231 CA VAL A 74 -3.316 9.123 -3.597 1.00 0.00 C ATOM 1232 C VAL A 74 -4.471 10.015 -4.066 1.00 0.00 C ATOM 1233 O VAL A 74 -5.483 10.114 -3.374 1.00 0.00 O ATOM 1234 CB VAL A 74 -3.788 7.650 -3.681 1.00 0.00 C ATOM 1235 CG1 VAL A 74 -3.741 7.146 -5.125 1.00 0.00 C ATOM 1236 CG2 VAL A 74 -3.011 6.666 -2.804 1.00 0.00 C ATOM 0 H VAL A 74 -3.732 9.693 -1.637 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.437 9.251 -4.229 1.00 0.00 H new ATOM 0 HB VAL A 74 -4.808 7.676 -3.298 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.077 6.110 -5.160 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.393 7.760 -5.746 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.719 7.209 -5.499 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.418 5.663 -2.934 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -1.960 6.672 -3.094 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.101 6.961 -1.759 1.00 0.00 H new ATOM 1246 N GLU A 75 -4.373 10.638 -5.243 1.00 0.00 N ATOM 1247 CA GLU A 75 -5.439 11.521 -5.766 1.00 0.00 C ATOM 1248 C GLU A 75 -6.489 10.785 -6.626 1.00 0.00 C ATOM 1249 O GLU A 75 -7.610 11.266 -6.787 1.00 0.00 O ATOM 1250 CB GLU A 75 -4.812 12.680 -6.559 1.00 0.00 C ATOM 1251 CG GLU A 75 -3.968 13.610 -5.677 1.00 0.00 C ATOM 1252 CD GLU A 75 -3.434 14.803 -6.491 1.00 0.00 C ATOM 1253 OE1 GLU A 75 -2.362 14.675 -7.132 1.00 0.00 O ATOM 1254 OE2 GLU A 75 -4.079 15.881 -6.497 1.00 0.00 O ATOM 0 H GLU A 75 -3.566 10.552 -5.860 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.978 11.906 -4.900 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.187 12.275 -7.355 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.603 13.258 -7.037 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -4.570 13.973 -4.844 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.134 13.054 -5.249 1.00 0.00 H new ATOM 1261 N GLN A 76 -6.127 9.631 -7.199 1.00 0.00 N ATOM 1262 CA GLN A 76 -7.009 8.735 -7.962 1.00 0.00 C ATOM 1263 C GLN A 76 -6.391 7.331 -8.095 1.00 0.00 C ATOM 1264 O GLN A 76 -5.169 7.183 -8.091 1.00 0.00 O ATOM 1265 CB GLN A 76 -7.366 9.317 -9.352 1.00 0.00 C ATOM 1266 CG GLN A 76 -6.339 10.236 -10.045 1.00 0.00 C ATOM 1267 CD GLN A 76 -4.969 9.600 -10.273 1.00 0.00 C ATOM 1268 OE1 GLN A 76 -4.798 8.689 -11.069 1.00 0.00 O ATOM 1269 NE2 GLN A 76 -3.932 10.073 -9.609 1.00 0.00 N ATOM 0 H GLN A 76 -5.171 9.280 -7.142 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.939 8.647 -7.401 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -7.568 8.480 -10.021 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.296 9.876 -9.250 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -6.744 10.551 -11.007 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.212 11.136 -9.443 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.058 10.833 -8.941 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.004 9.678 -9.764 1.00 0.00 H new ATOM 1278 N TYR A 77 -7.235 6.302 -8.227 1.00 0.00 N ATOM 1279 CA TYR A 77 -6.832 4.897 -8.348 1.00 0.00 C ATOM 1280 C TYR A 77 -7.533 4.193 -9.534 1.00 0.00 C ATOM 1281 O TYR A 77 -8.754 4.339 -9.668 1.00 0.00 O ATOM 1282 CB TYR A 77 -7.143 4.170 -7.035 1.00 0.00 C ATOM 1283 CG TYR A 77 -6.658 2.737 -7.023 1.00 0.00 C ATOM 1284 CD1 TYR A 77 -5.285 2.474 -6.877 1.00 0.00 C ATOM 1285 CD2 TYR A 77 -7.566 1.679 -7.220 1.00 0.00 C ATOM 1286 CE1 TYR A 77 -4.814 1.151 -6.966 1.00 0.00 C ATOM 1287 CE2 TYR A 77 -7.099 0.351 -7.271 1.00 0.00 C ATOM 1288 CZ TYR A 77 -5.719 0.084 -7.153 1.00 0.00 C ATOM 1289 OH TYR A 77 -5.265 -1.195 -7.236 1.00 0.00 O ATOM 0 H TYR A 77 -8.247 6.428 -8.253 1.00 0.00 H new ATOM 0 HA TYR A 77 -5.761 4.864 -8.547 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.682 4.711 -6.209 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.219 4.185 -6.864 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.594 3.284 -6.697 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -8.620 1.886 -7.332 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -3.755 0.951 -6.891 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -7.797 -0.463 -7.400 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.447 -1.287 -6.705 1.00 0.00 H new ATOM 1299 N PRO A 78 -6.821 3.397 -10.360 1.00 0.00 N ATOM 1300 CA PRO A 78 -5.361 3.236 -10.401 1.00 0.00 C ATOM 1301 C PRO A 78 -4.617 4.539 -10.743 1.00 0.00 C ATOM 1302 O PRO A 78 -5.109 5.356 -11.525 1.00 0.00 O ATOM 1303 CB PRO A 78 -5.086 2.142 -11.442 1.00 0.00 C ATOM 1304 CG PRO A 78 -6.397 1.358 -11.486 1.00 0.00 C ATOM 1305 CD PRO A 78 -7.434 2.459 -11.287 1.00 0.00 C ATOM 0 HA PRO A 78 -4.987 2.961 -9.415 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -4.839 2.566 -12.415 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -4.249 1.509 -11.148 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -6.530 0.839 -12.435 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -6.447 0.604 -10.701 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -7.680 2.943 -12.232 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -8.363 2.057 -10.883 1.00 0.00 H new ATOM 1313 N GLY A 79 -3.436 4.733 -10.148 1.00 0.00 N ATOM 1314 CA GLY A 79 -2.636 5.963 -10.254 1.00 0.00 C ATOM 1315 C GLY A 79 -1.140 5.762 -9.968 1.00 0.00 C ATOM 1316 O GLY A 79 -0.609 4.663 -10.124 1.00 0.00 O ATOM 0 H GLY A 79 -2.996 4.022 -9.564 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -2.752 6.374 -11.257 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -3.032 6.703 -9.559 1.00 0.00 H new ATOM 1320 N ILE A 80 -0.451 6.834 -9.555 1.00 0.00 N ATOM 1321 CA ILE A 80 1.013 6.859 -9.348 1.00 0.00 C ATOM 1322 C ILE A 80 1.452 6.323 -7.976 1.00 0.00 C ATOM 1323 O ILE A 80 2.449 5.609 -7.882 1.00 0.00 O ATOM 1324 CB ILE A 80 1.571 8.275 -9.649 1.00 0.00 C ATOM 1325 CG1 ILE A 80 3.100 8.393 -9.417 1.00 0.00 C ATOM 1326 CG2 ILE A 80 0.794 9.414 -8.954 1.00 0.00 C ATOM 1327 CD1 ILE A 80 3.571 8.883 -8.041 1.00 0.00 C ATOM 0 H ILE A 80 -0.899 7.727 -9.350 1.00 0.00 H new ATOM 0 HA ILE A 80 1.453 6.161 -10.061 1.00 0.00 H new ATOM 0 HB ILE A 80 1.405 8.408 -10.718 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.544 7.414 -9.596 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.504 9.069 -10.171 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.244 10.372 -9.213 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.245 9.400 -9.284 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.833 9.275 -7.874 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.660 8.917 -8.020 1.00 0.00 H new ATOM 0 HD12 ILE A 80 3.173 9.881 -7.854 1.00 0.00 H new ATOM 0 HD13 ILE A 80 3.214 8.200 -7.270 1.00 0.00 H new ATOM 1339 N ALA A 81 0.708 6.626 -6.911 1.00 0.00 N ATOM 1340 CA ALA A 81 1.084 6.306 -5.528 1.00 0.00 C ATOM 1341 C ALA A 81 0.686 4.891 -5.082 1.00 0.00 C ATOM 1342 O ALA A 81 0.823 4.575 -3.902 1.00 0.00 O ATOM 1343 CB ALA A 81 0.551 7.418 -4.618 1.00 0.00 C ATOM 0 H ALA A 81 -0.188 7.108 -6.984 1.00 0.00 H new ATOM 0 HA ALA A 81 2.171 6.278 -5.455 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.819 7.201 -3.584 1.00 0.00 H new ATOM 0 HB2 ALA A 81 0.988 8.371 -4.914 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.534 7.473 -4.708 1.00 0.00 H new ATOM 1349 N VAL A 82 0.229 4.041 -6.008 1.00 0.00 N ATOM 1350 CA VAL A 82 -0.164 2.642 -5.774 1.00 0.00 C ATOM 1351 C VAL A 82 0.102 1.805 -7.036 1.00 0.00 C ATOM 1352 O VAL A 82 -0.261 2.208 -8.141 1.00 0.00 O ATOM 1353 CB VAL A 82 -1.654 2.519 -5.392 1.00 0.00 C ATOM 1354 CG1 VAL A 82 -1.968 1.099 -4.900 1.00 0.00 C ATOM 1355 CG2 VAL A 82 -2.143 3.493 -4.312 1.00 0.00 C ATOM 0 H VAL A 82 0.117 4.318 -6.983 1.00 0.00 H new ATOM 0 HA VAL A 82 0.434 2.271 -4.941 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.179 2.769 -6.314 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -3.023 1.031 -4.635 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.745 0.382 -5.691 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.359 0.874 -4.025 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.202 3.321 -4.120 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.577 3.333 -3.394 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.998 4.518 -4.654 1.00 0.00 H new ATOM 1365 N GLU A 83 0.722 0.637 -6.882 1.00 0.00 N ATOM 1366 CA GLU A 83 1.165 -0.263 -7.961 1.00 0.00 C ATOM 1367 C GLU A 83 1.073 -1.749 -7.566 1.00 0.00 C ATOM 1368 O GLU A 83 0.976 -2.084 -6.387 1.00 0.00 O ATOM 1369 CB GLU A 83 2.614 0.097 -8.361 1.00 0.00 C ATOM 1370 CG GLU A 83 2.697 0.689 -9.771 1.00 0.00 C ATOM 1371 CD GLU A 83 2.656 -0.398 -10.859 1.00 0.00 C ATOM 1372 OE1 GLU A 83 3.676 -0.571 -11.572 1.00 0.00 O ATOM 1373 OE2 GLU A 83 1.609 -1.070 -11.004 1.00 0.00 O ATOM 0 H GLU A 83 0.943 0.268 -5.957 1.00 0.00 H new ATOM 0 HA GLU A 83 0.495 -0.123 -8.809 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.020 0.812 -7.645 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.236 -0.796 -8.307 1.00 0.00 H new ATOM 0 HG2 GLU A 83 1.870 1.383 -9.921 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.618 1.264 -9.868 1.00 0.00 H new ATOM 1380 N THR A 84 1.130 -2.650 -8.548 1.00 0.00 N ATOM 1381 CA THR A 84 1.021 -4.117 -8.394 1.00 0.00 C ATOM 1382 C THR A 84 2.308 -4.833 -8.825 1.00 0.00 C ATOM 1383 O THR A 84 3.148 -4.280 -9.541 1.00 0.00 O ATOM 1384 CB THR A 84 -0.164 -4.666 -9.216 1.00 0.00 C ATOM 1385 OG1 THR A 84 0.019 -4.442 -10.598 1.00 0.00 O ATOM 1386 CG2 THR A 84 -1.494 -4.015 -8.832 1.00 0.00 C ATOM 0 H THR A 84 1.259 -2.373 -9.521 1.00 0.00 H new ATOM 0 HA THR A 84 0.854 -4.313 -7.335 1.00 0.00 H new ATOM 0 HB THR A 84 -0.196 -5.733 -8.995 1.00 0.00 H new ATOM 0 HG1 THR A 84 -0.747 -4.802 -11.092 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.294 -4.437 -9.440 1.00 0.00 H new ATOM 0 HG22 THR A 84 -1.701 -4.203 -7.778 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.436 -2.940 -9.004 1.00 0.00 H new ATOM 1394 N VAL A 85 2.466 -6.090 -8.398 1.00 0.00 N ATOM 1395 CA VAL A 85 3.455 -7.034 -8.945 1.00 0.00 C ATOM 1396 C VAL A 85 2.864 -7.835 -10.123 1.00 0.00 C ATOM 1397 O VAL A 85 1.666 -7.759 -10.409 1.00 0.00 O ATOM 1398 CB VAL A 85 3.967 -7.986 -7.852 1.00 0.00 C ATOM 1399 CG1 VAL A 85 4.551 -7.206 -6.673 1.00 0.00 C ATOM 1400 CG2 VAL A 85 2.866 -8.918 -7.356 1.00 0.00 C ATOM 0 H VAL A 85 1.901 -6.490 -7.649 1.00 0.00 H new ATOM 0 HA VAL A 85 4.298 -6.453 -9.317 1.00 0.00 H new ATOM 0 HB VAL A 85 4.754 -8.592 -8.302 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.906 -7.904 -5.915 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.383 -6.593 -7.019 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.781 -6.565 -6.244 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.266 -9.576 -6.584 1.00 0.00 H new ATOM 0 HG22 VAL A 85 2.049 -8.328 -6.942 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.495 -9.518 -8.187 1.00 0.00 H new ATOM 1410 N THR A 86 3.683 -8.662 -10.773 1.00 0.00 N ATOM 1411 CA THR A 86 3.300 -9.517 -11.913 1.00 0.00 C ATOM 1412 C THR A 86 2.942 -10.949 -11.507 1.00 0.00 C ATOM 1413 O THR A 86 2.111 -11.585 -12.159 1.00 0.00 O ATOM 1414 CB THR A 86 4.439 -9.573 -12.945 1.00 0.00 C ATOM 1415 OG1 THR A 86 5.585 -10.174 -12.381 1.00 0.00 O ATOM 1416 CG2 THR A 86 4.849 -8.179 -13.411 1.00 0.00 C ATOM 0 H THR A 86 4.665 -8.764 -10.517 1.00 0.00 H new ATOM 0 HA THR A 86 2.407 -9.060 -12.340 1.00 0.00 H new ATOM 0 HB THR A 86 4.064 -10.151 -13.789 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.301 -10.204 -13.049 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.656 -8.261 -14.139 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.994 -7.683 -13.871 1.00 0.00 H new ATOM 0 HG23 THR A 86 5.190 -7.595 -12.556 1.00 0.00 H new ATOM 1424 N ASP A 87 3.560 -11.470 -10.441 1.00 0.00 N ATOM 1425 CA ASP A 87 3.523 -12.899 -10.103 1.00 0.00 C ATOM 1426 C ASP A 87 2.354 -13.282 -9.184 1.00 0.00 C ATOM 1427 O ASP A 87 1.693 -14.295 -9.426 1.00 0.00 O ATOM 1428 CB ASP A 87 4.861 -13.301 -9.473 1.00 0.00 C ATOM 1429 CG ASP A 87 4.948 -14.822 -9.264 1.00 0.00 C ATOM 1430 OD1 ASP A 87 4.705 -15.297 -8.129 1.00 0.00 O ATOM 1431 OD2 ASP A 87 5.255 -15.549 -10.240 1.00 0.00 O ATOM 0 H ASP A 87 4.103 -10.910 -9.784 1.00 0.00 H new ATOM 0 HA ASP A 87 3.360 -13.448 -11.031 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.680 -12.973 -10.113 1.00 0.00 H new ATOM 0 HB3 ASP A 87 4.982 -12.793 -8.516 1.00 0.00 H new ATOM 1436 N SER A 88 2.089 -12.478 -8.145 1.00 0.00 N ATOM 1437 CA SER A 88 1.034 -12.786 -7.152 1.00 0.00 C ATOM 1438 C SER A 88 0.272 -11.562 -6.638 1.00 0.00 C ATOM 1439 O SER A 88 0.865 -10.616 -6.129 1.00 0.00 O ATOM 1440 CB SER A 88 1.628 -13.575 -5.981 1.00 0.00 C ATOM 1441 OG SER A 88 0.608 -13.893 -5.047 1.00 0.00 O ATOM 0 H SER A 88 2.588 -11.607 -7.965 1.00 0.00 H new ATOM 0 HA SER A 88 0.295 -13.390 -7.679 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.096 -14.489 -6.347 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.409 -12.990 -5.495 1.00 0.00 H new ATOM 0 HG SER A 88 0.993 -14.399 -4.301 1.00 0.00 H new ATOM 1447 N SER A 89 -1.064 -11.591 -6.700 1.00 0.00 N ATOM 1448 CA SER A 89 -1.931 -10.441 -6.373 1.00 0.00 C ATOM 1449 C SER A 89 -1.929 -10.025 -4.892 1.00 0.00 C ATOM 1450 O SER A 89 -2.570 -9.032 -4.545 1.00 0.00 O ATOM 1451 CB SER A 89 -3.382 -10.692 -6.815 1.00 0.00 C ATOM 1452 OG SER A 89 -3.455 -11.465 -8.006 1.00 0.00 O ATOM 0 H SER A 89 -1.585 -12.421 -6.982 1.00 0.00 H new ATOM 0 HA SER A 89 -1.493 -9.614 -6.932 1.00 0.00 H new ATOM 0 HB2 SER A 89 -3.919 -11.205 -6.017 1.00 0.00 H new ATOM 0 HB3 SER A 89 -3.882 -9.737 -6.973 1.00 0.00 H new ATOM 0 HG SER A 89 -3.918 -10.952 -8.701 1.00 0.00 H new ATOM 1458 N ARG A 90 -1.220 -10.747 -4.006 1.00 0.00 N ATOM 1459 CA ARG A 90 -1.098 -10.428 -2.574 1.00 0.00 C ATOM 1460 C ARG A 90 0.007 -9.409 -2.240 1.00 0.00 C ATOM 1461 O ARG A 90 0.374 -9.275 -1.072 1.00 0.00 O ATOM 1462 CB ARG A 90 -1.126 -11.712 -1.721 1.00 0.00 C ATOM 1463 CG ARG A 90 0.224 -12.419 -1.608 1.00 0.00 C ATOM 1464 CD ARG A 90 0.127 -13.740 -0.838 1.00 0.00 C ATOM 1465 NE ARG A 90 1.471 -14.315 -0.649 1.00 0.00 N ATOM 1466 CZ ARG A 90 1.803 -15.577 -0.463 1.00 0.00 C ATOM 1467 NH1 ARG A 90 3.060 -15.891 -0.358 1.00 0.00 N ATOM 1468 NH2 ARG A 90 0.923 -16.535 -0.385 1.00 0.00 N ATOM 0 H ARG A 90 -0.705 -11.586 -4.272 1.00 0.00 H new ATOM 0 HA ARG A 90 -1.987 -9.869 -2.282 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.477 -11.462 -0.720 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.851 -12.404 -2.150 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.615 -12.611 -2.607 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.935 -11.761 -1.108 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.345 -13.572 0.130 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.504 -14.442 -1.383 1.00 0.00 H new ATOM 0 HE ARG A 90 2.244 -13.650 -0.664 1.00 0.00 H new ATOM 0 HH11 ARG A 90 3.774 -15.165 -0.420 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.332 -16.863 -0.214 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.071 -16.322 -0.469 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.228 -17.497 -0.240 1.00 0.00 H new ATOM 1482 N TYR A 91 0.530 -8.693 -3.241 1.00 0.00 N ATOM 1483 CA TYR A 91 1.662 -7.783 -3.109 1.00 0.00 C ATOM 1484 C TYR A 91 1.437 -6.498 -3.921 1.00 0.00 C ATOM 1485 O TYR A 91 1.048 -6.548 -5.092 1.00 0.00 O ATOM 1486 CB TYR A 91 2.937 -8.498 -3.573 1.00 0.00 C ATOM 1487 CG TYR A 91 3.309 -9.737 -2.782 1.00 0.00 C ATOM 1488 CD1 TYR A 91 3.976 -9.602 -1.553 1.00 0.00 C ATOM 1489 CD2 TYR A 91 2.990 -11.020 -3.273 1.00 0.00 C ATOM 1490 CE1 TYR A 91 4.295 -10.743 -0.791 1.00 0.00 C ATOM 1491 CE2 TYR A 91 3.355 -12.165 -2.539 1.00 0.00 C ATOM 1492 CZ TYR A 91 3.991 -12.029 -1.288 1.00 0.00 C ATOM 1493 OH TYR A 91 4.271 -13.139 -0.548 1.00 0.00 O ATOM 0 H TYR A 91 0.163 -8.735 -4.192 1.00 0.00 H new ATOM 0 HA TYR A 91 1.766 -7.495 -2.063 1.00 0.00 H new ATOM 0 HB2 TYR A 91 2.817 -8.778 -4.620 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.767 -7.793 -3.525 1.00 0.00 H new ATOM 0 HD1 TYR A 91 4.245 -8.621 -1.191 1.00 0.00 H new ATOM 0 HD2 TYR A 91 2.466 -11.124 -4.212 1.00 0.00 H new ATOM 0 HE1 TYR A 91 4.771 -10.634 0.172 1.00 0.00 H new ATOM 0 HE2 TYR A 91 3.148 -13.148 -2.935 1.00 0.00 H new ATOM 0 HH TYR A 91 4.217 -12.919 0.405 1.00 0.00 H new ATOM 1503 N PHE A 92 1.715 -5.348 -3.304 1.00 0.00 N ATOM 1504 CA PHE A 92 1.559 -4.013 -3.891 1.00 0.00 C ATOM 1505 C PHE A 92 2.766 -3.129 -3.580 1.00 0.00 C ATOM 1506 O PHE A 92 3.508 -3.394 -2.641 1.00 0.00 O ATOM 1507 CB PHE A 92 0.279 -3.349 -3.360 1.00 0.00 C ATOM 1508 CG PHE A 92 -0.985 -4.116 -3.675 1.00 0.00 C ATOM 1509 CD1 PHE A 92 -1.577 -4.929 -2.694 1.00 0.00 C ATOM 1510 CD2 PHE A 92 -1.557 -4.041 -4.957 1.00 0.00 C ATOM 1511 CE1 PHE A 92 -2.736 -5.660 -2.992 1.00 0.00 C ATOM 1512 CE2 PHE A 92 -2.702 -4.797 -5.264 1.00 0.00 C ATOM 1513 CZ PHE A 92 -3.290 -5.608 -4.283 1.00 0.00 C ATOM 0 H PHE A 92 2.068 -5.318 -2.347 1.00 0.00 H new ATOM 0 HA PHE A 92 1.487 -4.127 -4.973 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.363 -3.234 -2.279 1.00 0.00 H new ATOM 0 HB3 PHE A 92 0.199 -2.347 -3.782 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.139 -4.991 -1.709 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -1.116 -3.402 -5.707 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.204 -6.264 -2.229 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.128 -4.753 -6.255 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.167 -6.192 -4.519 1.00 0.00 H new ATOM 1523 N VAL A 93 2.947 -2.052 -4.338 1.00 0.00 N ATOM 1524 CA VAL A 93 3.887 -0.964 -4.031 1.00 0.00 C ATOM 1525 C VAL A 93 3.100 0.320 -3.805 1.00 0.00 C ATOM 1526 O VAL A 93 2.105 0.538 -4.492 1.00 0.00 O ATOM 1527 CB VAL A 93 4.938 -0.822 -5.148 1.00 0.00 C ATOM 1528 CG1 VAL A 93 5.847 0.399 -4.987 1.00 0.00 C ATOM 1529 CG2 VAL A 93 5.815 -2.075 -5.181 1.00 0.00 C ATOM 0 H VAL A 93 2.434 -1.902 -5.207 1.00 0.00 H new ATOM 0 HA VAL A 93 4.438 -1.191 -3.118 1.00 0.00 H new ATOM 0 HB VAL A 93 4.382 -0.692 -6.076 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.561 0.432 -5.810 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.243 1.306 -4.994 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.386 0.329 -4.042 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.560 -1.977 -5.971 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.317 -2.193 -4.221 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.193 -2.949 -5.375 1.00 0.00 H new ATOM 1539 N ILE A 94 3.520 1.185 -2.879 1.00 0.00 N ATOM 1540 CA ILE A 94 2.906 2.507 -2.690 1.00 0.00 C ATOM 1541 C ILE A 94 3.951 3.615 -2.535 1.00 0.00 C ATOM 1542 O ILE A 94 5.034 3.384 -1.988 1.00 0.00 O ATOM 1543 CB ILE A 94 1.866 2.544 -1.544 1.00 0.00 C ATOM 1544 CG1 ILE A 94 2.416 2.249 -0.127 1.00 0.00 C ATOM 1545 CG2 ILE A 94 0.628 1.686 -1.842 1.00 0.00 C ATOM 1546 CD1 ILE A 94 2.615 0.774 0.254 1.00 0.00 C ATOM 0 H ILE A 94 4.292 0.993 -2.240 1.00 0.00 H new ATOM 0 HA ILE A 94 2.354 2.703 -3.609 1.00 0.00 H new ATOM 0 HB ILE A 94 1.567 3.592 -1.518 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.375 2.757 -0.024 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.738 2.697 0.599 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.068 1.749 -1.005 1.00 0.00 H new ATOM 0 HG22 ILE A 94 0.142 2.051 -2.747 1.00 0.00 H new ATOM 0 HG23 ILE A 94 0.930 0.649 -1.986 1.00 0.00 H new ATOM 0 HD11 ILE A 94 3.004 0.710 1.270 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.660 0.252 0.197 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.322 0.312 -0.435 1.00 0.00 H new ATOM 1558 N ARG A 95 3.615 4.830 -2.994 1.00 0.00 N ATOM 1559 CA ARG A 95 4.448 6.033 -2.796 1.00 0.00 C ATOM 1560 C ARG A 95 4.099 6.706 -1.468 1.00 0.00 C ATOM 1561 O ARG A 95 3.241 7.589 -1.418 1.00 0.00 O ATOM 1562 CB ARG A 95 4.366 7.008 -3.990 1.00 0.00 C ATOM 1563 CG ARG A 95 5.454 8.092 -3.880 1.00 0.00 C ATOM 1564 CD ARG A 95 5.347 9.098 -5.030 1.00 0.00 C ATOM 1565 NE ARG A 95 6.318 10.200 -4.883 1.00 0.00 N ATOM 1566 CZ ARG A 95 6.348 11.332 -5.561 1.00 0.00 C ATOM 1567 NH1 ARG A 95 7.267 12.210 -5.295 1.00 0.00 N ATOM 1568 NH2 ARG A 95 5.486 11.620 -6.494 1.00 0.00 N ATOM 0 H ARG A 95 2.756 5.010 -3.515 1.00 0.00 H new ATOM 0 HA ARG A 95 5.490 5.716 -2.748 1.00 0.00 H new ATOM 0 HB2 ARG A 95 4.485 6.459 -4.924 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.381 7.475 -4.018 1.00 0.00 H new ATOM 0 HG2 ARG A 95 5.358 8.613 -2.927 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.439 7.626 -3.891 1.00 0.00 H new ATOM 0 HD2 ARG A 95 5.517 8.587 -5.978 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.337 9.505 -5.064 1.00 0.00 H new ATOM 0 HE ARG A 95 7.046 10.073 -4.180 1.00 0.00 H new ATOM 0 HH11 ARG A 95 7.957 12.022 -4.568 1.00 0.00 H new ATOM 0 HH12 ARG A 95 7.299 13.088 -5.813 1.00 0.00 H new ATOM 0 HH21 ARG A 95 4.747 10.957 -6.728 1.00 0.00 H new ATOM 0 HH22 ARG A 95 5.550 12.509 -6.991 1.00 0.00 H new ATOM 1582 N ILE A 96 4.758 6.302 -0.386 1.00 0.00 N ATOM 1583 CA ILE A 96 4.603 6.960 0.920 1.00 0.00 C ATOM 1584 C ILE A 96 5.220 8.366 0.900 1.00 0.00 C ATOM 1585 O ILE A 96 6.247 8.579 0.258 1.00 0.00 O ATOM 1586 CB ILE A 96 5.066 6.089 2.110 1.00 0.00 C ATOM 1587 CG1 ILE A 96 6.585 5.805 2.167 1.00 0.00 C ATOM 1588 CG2 ILE A 96 4.286 4.767 2.136 1.00 0.00 C ATOM 1589 CD1 ILE A 96 7.338 6.761 3.097 1.00 0.00 C ATOM 0 H ILE A 96 5.410 5.518 -0.382 1.00 0.00 H new ATOM 0 HA ILE A 96 3.534 7.086 1.094 1.00 0.00 H new ATOM 0 HB ILE A 96 4.850 6.685 2.997 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.745 4.780 2.502 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.001 5.881 1.162 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.622 4.163 2.979 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.221 4.975 2.240 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.461 4.223 1.208 1.00 0.00 H new ATOM 0 HD11 ILE A 96 8.399 6.511 3.094 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.206 7.786 2.750 1.00 0.00 H new ATOM 0 HD13 ILE A 96 6.946 6.668 4.110 1.00 0.00 H new ATOM 1601 N GLN A 97 4.576 9.330 1.561 1.00 0.00 N ATOM 1602 CA GLN A 97 4.957 10.750 1.582 1.00 0.00 C ATOM 1603 C GLN A 97 4.885 11.333 2.999 1.00 0.00 C ATOM 1604 O GLN A 97 3.959 11.061 3.765 1.00 0.00 O ATOM 1605 CB GLN A 97 4.054 11.582 0.654 1.00 0.00 C ATOM 1606 CG GLN A 97 4.233 11.308 -0.850 1.00 0.00 C ATOM 1607 CD GLN A 97 2.905 11.361 -1.602 1.00 0.00 C ATOM 1608 OE1 GLN A 97 2.373 12.416 -1.918 1.00 0.00 O ATOM 1609 NE2 GLN A 97 2.312 10.222 -1.883 1.00 0.00 N ATOM 0 H GLN A 97 3.743 9.139 2.118 1.00 0.00 H new ATOM 0 HA GLN A 97 5.987 10.802 1.228 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.014 11.394 0.920 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.244 12.639 0.840 1.00 0.00 H new ATOM 0 HG2 GLN A 97 4.919 12.042 -1.273 1.00 0.00 H new ATOM 0 HG3 GLN A 97 4.689 10.328 -0.988 1.00 0.00 H new ATOM 0 HE21 GLN A 97 2.752 9.340 -1.621 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.412 10.220 -2.363 1.00 0.00 H new ATOM 1618 N ASP A 98 5.835 12.211 3.315 1.00 0.00 N ATOM 1619 CA ASP A 98 6.004 12.831 4.643 1.00 0.00 C ATOM 1620 C ASP A 98 5.320 14.214 4.771 1.00 0.00 C ATOM 1621 O ASP A 98 5.594 14.986 5.690 1.00 0.00 O ATOM 1622 CB ASP A 98 7.505 12.855 4.974 1.00 0.00 C ATOM 1623 CG ASP A 98 7.824 13.126 6.456 1.00 0.00 C ATOM 1624 OD1 ASP A 98 7.135 12.577 7.348 1.00 0.00 O ATOM 1625 OD2 ASP A 98 8.833 13.821 6.724 1.00 0.00 O ATOM 0 H ASP A 98 6.532 12.525 2.640 1.00 0.00 H new ATOM 0 HA ASP A 98 5.485 12.227 5.387 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.943 11.898 4.689 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.987 13.620 4.365 1.00 0.00 H new ATOM 1630 N GLY A 99 4.441 14.555 3.820 1.00 0.00 N ATOM 1631 CA GLY A 99 3.633 15.789 3.808 1.00 0.00 C ATOM 1632 C GLY A 99 4.384 17.067 3.399 1.00 0.00 C ATOM 1633 O GLY A 99 3.827 18.162 3.491 1.00 0.00 O ATOM 0 H GLY A 99 4.264 13.962 3.009 1.00 0.00 H new ATOM 0 HA2 GLY A 99 2.795 15.647 3.126 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.213 15.938 4.803 1.00 0.00 H new ATOM 1637 N THR A 100 5.640 16.939 2.956 1.00 0.00 N ATOM 1638 CA THR A 100 6.567 18.056 2.663 1.00 0.00 C ATOM 1639 C THR A 100 7.244 17.958 1.275 1.00 0.00 C ATOM 1640 O THR A 100 8.102 18.767 0.920 1.00 0.00 O ATOM 1641 CB THR A 100 7.566 18.177 3.835 1.00 0.00 C ATOM 1642 OG1 THR A 100 8.262 19.406 3.812 1.00 0.00 O ATOM 1643 CG2 THR A 100 8.583 17.033 3.883 1.00 0.00 C ATOM 0 H THR A 100 6.061 16.026 2.783 1.00 0.00 H new ATOM 0 HA THR A 100 5.994 18.980 2.589 1.00 0.00 H new ATOM 0 HB THR A 100 6.950 18.123 4.733 1.00 0.00 H new ATOM 0 HG1 THR A 100 8.396 19.689 2.883 1.00 0.00 H new ATOM 0 HG21 THR A 100 9.255 17.179 4.729 1.00 0.00 H new ATOM 0 HG22 THR A 100 8.058 16.084 3.995 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.161 17.021 2.959 1.00 0.00 H new ATOM 1651 N GLY A 101 6.864 16.959 0.465 1.00 0.00 N ATOM 1652 CA GLY A 101 7.462 16.652 -0.850 1.00 0.00 C ATOM 1653 C GLY A 101 8.563 15.581 -0.797 1.00 0.00 C ATOM 1654 O GLY A 101 9.046 15.121 -1.835 1.00 0.00 O ATOM 0 H GLY A 101 6.108 16.320 0.712 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.676 16.318 -1.527 1.00 0.00 H new ATOM 0 HA3 GLY A 101 7.878 17.567 -1.272 1.00 0.00 H new ATOM 1658 N ARG A 102 8.915 15.136 0.415 1.00 0.00 N ATOM 1659 CA ARG A 102 9.712 13.953 0.729 1.00 0.00 C ATOM 1660 C ARG A 102 8.829 12.719 0.568 1.00 0.00 C ATOM 1661 O ARG A 102 7.722 12.663 1.107 1.00 0.00 O ATOM 1662 CB ARG A 102 10.234 14.134 2.163 1.00 0.00 C ATOM 1663 CG ARG A 102 10.866 12.884 2.777 1.00 0.00 C ATOM 1664 CD ARG A 102 11.242 13.169 4.235 1.00 0.00 C ATOM 1665 NE ARG A 102 11.917 12.014 4.860 1.00 0.00 N ATOM 1666 CZ ARG A 102 11.880 11.653 6.132 1.00 0.00 C ATOM 1667 NH1 ARG A 102 12.625 10.669 6.547 1.00 0.00 N ATOM 1668 NH2 ARG A 102 11.124 12.234 7.020 1.00 0.00 N ATOM 0 H ARG A 102 8.628 15.631 1.259 1.00 0.00 H new ATOM 0 HA ARG A 102 10.565 13.824 0.063 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.971 14.937 2.168 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.408 14.456 2.798 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.169 12.048 2.726 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.752 12.595 2.211 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.896 14.040 4.279 1.00 0.00 H new ATOM 0 HD3 ARG A 102 10.344 13.416 4.801 1.00 0.00 H new ATOM 0 HE ARG A 102 12.476 11.428 4.240 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.235 10.179 5.892 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.599 10.388 7.527 1.00 0.00 H new ATOM 0 HH21 ARG A 102 10.520 13.009 6.747 1.00 0.00 H new ATOM 0 HH22 ARG A 102 11.136 11.913 7.988 1.00 0.00 H new ATOM 1682 N SER A 103 9.332 11.742 -0.173 1.00 0.00 N ATOM 1683 CA SER A 103 8.612 10.509 -0.526 1.00 0.00 C ATOM 1684 C SER A 103 9.529 9.309 -0.806 1.00 0.00 C ATOM 1685 O SER A 103 10.721 9.474 -1.080 1.00 0.00 O ATOM 1686 CB SER A 103 7.703 10.772 -1.732 1.00 0.00 C ATOM 1687 OG SER A 103 8.447 11.025 -2.914 1.00 0.00 O ATOM 0 H SER A 103 10.275 11.778 -0.559 1.00 0.00 H new ATOM 0 HA SER A 103 8.021 10.235 0.348 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.053 9.912 -1.890 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.058 11.625 -1.520 1.00 0.00 H new ATOM 0 HG SER A 103 8.889 11.897 -2.842 1.00 0.00 H new ATOM 1693 N ALA A 104 8.962 8.100 -0.755 1.00 0.00 N ATOM 1694 CA ALA A 104 9.612 6.843 -1.134 1.00 0.00 C ATOM 1695 C ALA A 104 8.602 5.837 -1.710 1.00 0.00 C ATOM 1696 O ALA A 104 7.439 5.822 -1.312 1.00 0.00 O ATOM 1697 CB ALA A 104 10.327 6.259 0.095 1.00 0.00 C ATOM 0 H ALA A 104 8.002 7.965 -0.437 1.00 0.00 H new ATOM 0 HA ALA A 104 10.341 7.045 -1.919 1.00 0.00 H new ATOM 0 HB1 ALA A 104 10.814 5.323 -0.178 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.076 6.967 0.451 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.599 6.073 0.885 1.00 0.00 H new ATOM 1703 N PHE A 105 9.051 4.960 -2.610 1.00 0.00 N ATOM 1704 CA PHE A 105 8.279 3.794 -3.051 1.00 0.00 C ATOM 1705 C PHE A 105 8.645 2.574 -2.194 1.00 0.00 C ATOM 1706 O PHE A 105 9.799 2.140 -2.186 1.00 0.00 O ATOM 1707 CB PHE A 105 8.501 3.534 -4.548 1.00 0.00 C ATOM 1708 CG PHE A 105 7.766 4.495 -5.467 1.00 0.00 C ATOM 1709 CD1 PHE A 105 6.449 4.207 -5.874 1.00 0.00 C ATOM 1710 CD2 PHE A 105 8.400 5.659 -5.944 1.00 0.00 C ATOM 1711 CE1 PHE A 105 5.779 5.053 -6.774 1.00 0.00 C ATOM 1712 CE2 PHE A 105 7.725 6.515 -6.836 1.00 0.00 C ATOM 1713 CZ PHE A 105 6.420 6.205 -7.259 1.00 0.00 C ATOM 0 H PHE A 105 9.965 5.038 -3.056 1.00 0.00 H new ATOM 0 HA PHE A 105 7.216 3.991 -2.915 1.00 0.00 H new ATOM 0 HB2 PHE A 105 9.569 3.592 -4.760 1.00 0.00 H new ATOM 0 HB3 PHE A 105 8.185 2.517 -4.779 1.00 0.00 H new ATOM 0 HD1 PHE A 105 5.950 3.329 -5.491 1.00 0.00 H new ATOM 0 HD2 PHE A 105 9.405 5.895 -5.625 1.00 0.00 H new ATOM 0 HE1 PHE A 105 4.774 4.818 -7.092 1.00 0.00 H new ATOM 0 HE2 PHE A 105 8.210 7.410 -7.196 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.911 6.853 -7.957 1.00 0.00 H new ATOM 1723 N ILE A 106 7.662 2.019 -1.478 1.00 0.00 N ATOM 1724 CA ILE A 106 7.814 0.820 -0.632 1.00 0.00 C ATOM 1725 C ILE A 106 6.883 -0.302 -1.096 1.00 0.00 C ATOM 1726 O ILE A 106 5.770 -0.034 -1.546 1.00 0.00 O ATOM 1727 CB ILE A 106 7.642 1.127 0.875 1.00 0.00 C ATOM 1728 CG1 ILE A 106 6.183 1.441 1.284 1.00 0.00 C ATOM 1729 CG2 ILE A 106 8.592 2.266 1.278 1.00 0.00 C ATOM 1730 CD1 ILE A 106 5.977 1.610 2.795 1.00 0.00 C ATOM 0 H ILE A 106 6.714 2.396 -1.467 1.00 0.00 H new ATOM 0 HA ILE A 106 8.840 0.473 -0.753 1.00 0.00 H new ATOM 0 HB ILE A 106 7.902 0.219 1.420 1.00 0.00 H new ATOM 0 HG12 ILE A 106 5.865 2.354 0.781 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.537 0.639 0.928 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.471 2.482 2.339 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.622 1.967 1.084 1.00 0.00 H new ATOM 0 HG23 ILE A 106 8.358 3.158 0.697 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.928 1.828 2.997 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.262 0.690 3.306 1.00 0.00 H new ATOM 0 HD13 ILE A 106 6.595 2.432 3.157 1.00 0.00 H new ATOM 1742 N GLY A 107 7.324 -1.552 -0.971 1.00 0.00 N ATOM 1743 CA GLY A 107 6.510 -2.736 -1.243 1.00 0.00 C ATOM 1744 C GLY A 107 5.805 -3.213 0.022 1.00 0.00 C ATOM 1745 O GLY A 107 6.381 -3.141 1.107 1.00 0.00 O ATOM 0 H GLY A 107 8.274 -1.775 -0.673 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.772 -2.506 -2.011 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.141 -3.534 -1.636 1.00 0.00 H new ATOM 1749 N ILE A 108 4.580 -3.718 -0.113 1.00 0.00 N ATOM 1750 CA ILE A 108 3.803 -4.370 0.943 1.00 0.00 C ATOM 1751 C ILE A 108 3.285 -5.740 0.493 1.00 0.00 C ATOM 1752 O ILE A 108 2.855 -5.911 -0.648 1.00 0.00 O ATOM 1753 CB ILE A 108 2.659 -3.490 1.494 1.00 0.00 C ATOM 1754 CG1 ILE A 108 1.649 -3.012 0.426 1.00 0.00 C ATOM 1755 CG2 ILE A 108 3.251 -2.317 2.285 1.00 0.00 C ATOM 1756 CD1 ILE A 108 0.385 -2.377 1.026 1.00 0.00 C ATOM 0 H ILE A 108 4.079 -3.683 -1.001 1.00 0.00 H new ATOM 0 HA ILE A 108 4.494 -4.522 1.773 1.00 0.00 H new ATOM 0 HB ILE A 108 2.068 -4.120 2.158 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.136 -2.288 -0.227 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.361 -3.859 -0.197 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.444 -1.696 2.674 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.845 -2.700 3.114 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.885 -1.720 1.630 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.281 -2.064 0.222 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.124 -3.106 1.656 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.663 -1.510 1.626 1.00 0.00 H new ATOM 1768 N GLY A 109 3.313 -6.711 1.405 1.00 0.00 N ATOM 1769 CA GLY A 109 2.814 -8.075 1.221 1.00 0.00 C ATOM 1770 C GLY A 109 1.774 -8.470 2.266 1.00 0.00 C ATOM 1771 O GLY A 109 1.873 -8.084 3.435 1.00 0.00 O ATOM 0 H GLY A 109 3.702 -6.562 2.336 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.376 -8.166 0.227 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.651 -8.772 1.266 1.00 0.00 H new ATOM 1775 N PHE A 110 0.774 -9.236 1.828 1.00 0.00 N ATOM 1776 CA PHE A 110 -0.390 -9.636 2.621 1.00 0.00 C ATOM 1777 C PHE A 110 -0.316 -11.102 3.074 1.00 0.00 C ATOM 1778 O PHE A 110 0.402 -11.923 2.498 1.00 0.00 O ATOM 1779 CB PHE A 110 -1.665 -9.374 1.805 1.00 0.00 C ATOM 1780 CG PHE A 110 -2.079 -7.915 1.721 1.00 0.00 C ATOM 1781 CD1 PHE A 110 -1.285 -6.977 1.033 1.00 0.00 C ATOM 1782 CD2 PHE A 110 -3.276 -7.494 2.336 1.00 0.00 C ATOM 1783 CE1 PHE A 110 -1.658 -5.624 1.001 1.00 0.00 C ATOM 1784 CE2 PHE A 110 -3.668 -6.147 2.267 1.00 0.00 C ATOM 1785 CZ PHE A 110 -2.849 -5.210 1.614 1.00 0.00 C ATOM 0 H PHE A 110 0.751 -9.608 0.879 1.00 0.00 H new ATOM 0 HA PHE A 110 -0.406 -9.038 3.532 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -1.517 -9.754 0.794 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -2.484 -9.945 2.243 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -0.386 -7.300 0.528 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.893 -8.209 2.861 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -1.027 -4.902 0.504 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -4.598 -5.831 2.716 1.00 0.00 H new ATOM 0 HZ PHE A 110 -3.137 -4.170 1.584 1.00 0.00 H new ATOM 1795 N THR A 111 -1.115 -11.439 4.090 1.00 0.00 N ATOM 1796 CA THR A 111 -1.228 -12.801 4.639 1.00 0.00 C ATOM 1797 C THR A 111 -1.927 -13.773 3.675 1.00 0.00 C ATOM 1798 O THR A 111 -1.633 -14.970 3.676 1.00 0.00 O ATOM 1799 CB THR A 111 -1.930 -12.751 6.008 1.00 0.00 C ATOM 1800 OG1 THR A 111 -1.844 -13.999 6.661 1.00 0.00 O ATOM 1801 CG2 THR A 111 -3.410 -12.351 5.951 1.00 0.00 C ATOM 0 H THR A 111 -1.714 -10.764 4.565 1.00 0.00 H new ATOM 0 HA THR A 111 -0.220 -13.194 4.773 1.00 0.00 H new ATOM 0 HB THR A 111 -1.399 -11.973 6.558 1.00 0.00 H new ATOM 0 HG1 THR A 111 -2.295 -13.945 7.530 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.824 -12.342 6.959 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.502 -11.357 5.512 1.00 0.00 H new ATOM 0 HG23 THR A 111 -3.958 -13.069 5.341 1.00 0.00 H new ATOM 1809 N ASP A 112 -2.817 -13.266 2.811 1.00 0.00 N ATOM 1810 CA ASP A 112 -3.572 -14.064 1.840 1.00 0.00 C ATOM 1811 C ASP A 112 -4.053 -13.213 0.650 1.00 0.00 C ATOM 1812 O ASP A 112 -4.326 -12.017 0.792 1.00 0.00 O ATOM 1813 CB ASP A 112 -4.769 -14.733 2.539 1.00 0.00 C ATOM 1814 CG ASP A 112 -5.430 -15.792 1.643 1.00 0.00 C ATOM 1815 OD1 ASP A 112 -4.943 -16.947 1.612 1.00 0.00 O ATOM 1816 OD2 ASP A 112 -6.406 -15.457 0.936 1.00 0.00 O ATOM 0 H ASP A 112 -3.035 -12.271 2.768 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.907 -14.830 1.442 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -4.436 -15.198 3.467 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.504 -13.974 2.809 1.00 0.00 H new ATOM 1821 N ARG A 113 -4.202 -13.837 -0.525 1.00 0.00 N ATOM 1822 CA ARG A 113 -4.686 -13.187 -1.753 1.00 0.00 C ATOM 1823 C ARG A 113 -6.119 -12.652 -1.627 1.00 0.00 C ATOM 1824 O ARG A 113 -6.408 -11.582 -2.156 1.00 0.00 O ATOM 1825 CB ARG A 113 -4.544 -14.190 -2.912 1.00 0.00 C ATOM 1826 CG ARG A 113 -4.705 -13.523 -4.284 1.00 0.00 C ATOM 1827 CD ARG A 113 -4.551 -14.560 -5.405 1.00 0.00 C ATOM 1828 NE ARG A 113 -4.603 -13.935 -6.742 1.00 0.00 N ATOM 1829 CZ ARG A 113 -5.069 -14.456 -7.862 1.00 0.00 C ATOM 1830 NH1 ARG A 113 -4.997 -13.761 -8.957 1.00 0.00 N ATOM 1831 NH2 ARG A 113 -5.596 -15.646 -7.926 1.00 0.00 N ATOM 0 H ARG A 113 -3.986 -14.826 -0.653 1.00 0.00 H new ATOM 0 HA ARG A 113 -4.078 -12.303 -1.947 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -3.567 -14.670 -2.856 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -5.291 -14.976 -2.803 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -5.684 -13.048 -4.352 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -3.960 -12.737 -4.403 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -3.603 -15.086 -5.286 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -5.342 -15.306 -5.321 1.00 0.00 H new ATOM 0 HE ARG A 113 -4.234 -12.986 -6.808 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -4.585 -12.828 -8.943 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -5.352 -14.148 -9.831 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -5.663 -16.220 -7.086 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -5.942 -16.003 -8.817 1.00 0.00 H new ATOM 1845 N GLY A 114 -6.991 -13.332 -0.883 1.00 0.00 N ATOM 1846 CA GLY A 114 -8.361 -12.880 -0.610 1.00 0.00 C ATOM 1847 C GLY A 114 -8.435 -11.650 0.307 1.00 0.00 C ATOM 1848 O GLY A 114 -9.370 -10.857 0.198 1.00 0.00 O ATOM 0 H GLY A 114 -6.765 -14.225 -0.445 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -8.852 -12.648 -1.555 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.919 -13.697 -0.153 1.00 0.00 H new ATOM 1852 N ASP A 115 -7.427 -11.444 1.160 1.00 0.00 N ATOM 1853 CA ASP A 115 -7.301 -10.253 2.013 1.00 0.00 C ATOM 1854 C ASP A 115 -6.627 -9.092 1.268 1.00 0.00 C ATOM 1855 O ASP A 115 -7.001 -7.935 1.464 1.00 0.00 O ATOM 1856 CB ASP A 115 -6.552 -10.603 3.308 1.00 0.00 C ATOM 1857 CG ASP A 115 -7.465 -11.339 4.299 1.00 0.00 C ATOM 1858 OD1 ASP A 115 -8.407 -10.695 4.819 1.00 0.00 O ATOM 1859 OD2 ASP A 115 -7.244 -12.544 4.568 1.00 0.00 O ATOM 0 H ASP A 115 -6.663 -12.109 1.281 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.303 -9.917 2.278 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -5.689 -11.226 3.074 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -6.172 -9.691 3.769 1.00 0.00 H new ATOM 1864 N ALA A 116 -5.700 -9.385 0.353 1.00 0.00 N ATOM 1865 CA ALA A 116 -5.171 -8.400 -0.585 1.00 0.00 C ATOM 1866 C ALA A 116 -6.205 -7.919 -1.615 1.00 0.00 C ATOM 1867 O ALA A 116 -6.181 -6.753 -2.000 1.00 0.00 O ATOM 1868 CB ALA A 116 -3.992 -9.034 -1.295 1.00 0.00 C ATOM 0 H ALA A 116 -5.296 -10.315 0.244 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.879 -7.514 -0.022 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.571 -8.324 -2.006 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.232 -9.310 -0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -4.324 -9.926 -1.827 1.00 0.00 H new ATOM 1874 N PHE A 117 -7.150 -8.768 -2.027 1.00 0.00 N ATOM 1875 CA PHE A 117 -8.254 -8.343 -2.899 1.00 0.00 C ATOM 1876 C PHE A 117 -9.088 -7.203 -2.284 1.00 0.00 C ATOM 1877 O PHE A 117 -9.558 -6.325 -3.007 1.00 0.00 O ATOM 1878 CB PHE A 117 -9.129 -9.545 -3.291 1.00 0.00 C ATOM 1879 CG PHE A 117 -9.028 -9.883 -4.766 1.00 0.00 C ATOM 1880 CD1 PHE A 117 -8.038 -10.774 -5.225 1.00 0.00 C ATOM 1881 CD2 PHE A 117 -9.898 -9.273 -5.690 1.00 0.00 C ATOM 1882 CE1 PHE A 117 -7.926 -11.062 -6.597 1.00 0.00 C ATOM 1883 CE2 PHE A 117 -9.786 -9.561 -7.063 1.00 0.00 C ATOM 1884 CZ PHE A 117 -8.801 -10.456 -7.517 1.00 0.00 C ATOM 0 H PHE A 117 -7.175 -9.755 -1.772 1.00 0.00 H new ATOM 0 HA PHE A 117 -7.811 -7.935 -3.808 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.833 -10.413 -2.702 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.168 -9.330 -3.042 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.363 -11.237 -4.521 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -10.653 -8.582 -5.344 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -7.168 -11.749 -6.944 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -10.457 -9.094 -7.769 1.00 0.00 H new ATOM 0 HZ PHE A 117 -8.716 -10.678 -8.571 1.00 0.00 H new ATOM 1894 N ASP A 118 -9.214 -7.149 -0.951 1.00 0.00 N ATOM 1895 CA ASP A 118 -9.881 -6.039 -0.261 1.00 0.00 C ATOM 1896 C ASP A 118 -9.099 -4.713 -0.357 1.00 0.00 C ATOM 1897 O ASP A 118 -9.723 -3.655 -0.359 1.00 0.00 O ATOM 1898 CB ASP A 118 -10.161 -6.407 1.207 1.00 0.00 C ATOM 1899 CG ASP A 118 -11.317 -7.409 1.380 1.00 0.00 C ATOM 1900 OD1 ASP A 118 -11.211 -8.274 2.282 1.00 0.00 O ATOM 1901 OD2 ASP A 118 -12.351 -7.300 0.679 1.00 0.00 O ATOM 0 H ASP A 118 -8.858 -7.870 -0.324 1.00 0.00 H new ATOM 0 HA ASP A 118 -10.829 -5.874 -0.773 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -9.257 -6.828 1.646 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -10.392 -5.498 1.763 1.00 0.00 H new ATOM 1906 N PHE A 119 -7.768 -4.734 -0.503 1.00 0.00 N ATOM 1907 CA PHE A 119 -6.946 -3.525 -0.675 1.00 0.00 C ATOM 1908 C PHE A 119 -7.286 -2.786 -1.980 1.00 0.00 C ATOM 1909 O PHE A 119 -7.664 -1.611 -1.953 1.00 0.00 O ATOM 1910 CB PHE A 119 -5.457 -3.898 -0.580 1.00 0.00 C ATOM 1911 CG PHE A 119 -4.480 -2.791 -0.917 1.00 0.00 C ATOM 1912 CD1 PHE A 119 -4.052 -2.608 -2.245 1.00 0.00 C ATOM 1913 CD2 PHE A 119 -3.963 -1.966 0.096 1.00 0.00 C ATOM 1914 CE1 PHE A 119 -3.145 -1.582 -2.562 1.00 0.00 C ATOM 1915 CE2 PHE A 119 -3.060 -0.942 -0.219 1.00 0.00 C ATOM 1916 CZ PHE A 119 -2.651 -0.744 -1.549 1.00 0.00 C ATOM 0 H PHE A 119 -7.225 -5.597 -0.505 1.00 0.00 H new ATOM 0 HA PHE A 119 -7.172 -2.825 0.129 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.252 -4.243 0.433 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.269 -4.739 -1.247 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.422 -3.258 -3.024 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -4.263 -2.122 1.122 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -2.828 -1.438 -3.584 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.677 -0.303 0.563 1.00 0.00 H new ATOM 0 HZ PHE A 119 -1.960 0.049 -1.791 1.00 0.00 H new ATOM 1926 N ASN A 120 -7.220 -3.476 -3.124 1.00 0.00 N ATOM 1927 CA ASN A 120 -7.474 -2.853 -4.428 1.00 0.00 C ATOM 1928 C ASN A 120 -8.965 -2.584 -4.700 1.00 0.00 C ATOM 1929 O ASN A 120 -9.292 -1.678 -5.472 1.00 0.00 O ATOM 1930 CB ASN A 120 -6.810 -3.682 -5.542 1.00 0.00 C ATOM 1931 CG ASN A 120 -7.337 -5.102 -5.671 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -6.787 -6.040 -5.121 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -8.410 -5.316 -6.399 1.00 0.00 N ATOM 0 H ASN A 120 -6.992 -4.469 -3.173 1.00 0.00 H new ATOM 0 HA ASN A 120 -7.017 -1.864 -4.413 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -6.951 -3.168 -6.493 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -5.737 -3.722 -5.357 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -8.777 -6.262 -6.501 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -8.876 -4.536 -6.862 1.00 0.00 H new ATOM 1940 N VAL A 121 -9.882 -3.329 -4.070 1.00 0.00 N ATOM 1941 CA VAL A 121 -11.326 -3.051 -4.151 1.00 0.00 C ATOM 1942 C VAL A 121 -11.707 -1.852 -3.275 1.00 0.00 C ATOM 1943 O VAL A 121 -12.462 -0.993 -3.727 1.00 0.00 O ATOM 1944 CB VAL A 121 -12.155 -4.308 -3.817 1.00 0.00 C ATOM 1945 CG1 VAL A 121 -13.656 -4.019 -3.672 1.00 0.00 C ATOM 1946 CG2 VAL A 121 -12.008 -5.349 -4.936 1.00 0.00 C ATOM 0 H VAL A 121 -9.649 -4.137 -3.493 1.00 0.00 H new ATOM 0 HA VAL A 121 -11.563 -2.780 -5.180 1.00 0.00 H new ATOM 0 HB VAL A 121 -11.770 -4.672 -2.865 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.184 -4.943 -3.437 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -13.812 -3.298 -2.869 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -14.040 -3.610 -4.607 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.597 -6.233 -4.691 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -12.363 -4.926 -5.876 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.959 -5.629 -5.037 1.00 0.00 H new ATOM 1956 N SER A 122 -11.147 -1.726 -2.067 1.00 0.00 N ATOM 1957 CA SER A 122 -11.416 -0.598 -1.161 1.00 0.00 C ATOM 1958 C SER A 122 -11.054 0.759 -1.782 1.00 0.00 C ATOM 1959 O SER A 122 -11.820 1.719 -1.663 1.00 0.00 O ATOM 1960 CB SER A 122 -10.638 -0.807 0.141 1.00 0.00 C ATOM 1961 OG SER A 122 -10.859 0.249 1.051 1.00 0.00 O ATOM 0 H SER A 122 -10.490 -2.407 -1.686 1.00 0.00 H new ATOM 0 HA SER A 122 -12.488 -0.576 -0.965 1.00 0.00 H new ATOM 0 HB2 SER A 122 -10.937 -1.751 0.597 1.00 0.00 H new ATOM 0 HB3 SER A 122 -9.573 -0.883 -0.078 1.00 0.00 H new ATOM 0 HG SER A 122 -10.065 0.368 1.613 1.00 0.00 H new ATOM 1967 N LEU A 123 -9.936 0.829 -2.516 1.00 0.00 N ATOM 1968 CA LEU A 123 -9.525 2.030 -3.247 1.00 0.00 C ATOM 1969 C LEU A 123 -10.472 2.341 -4.420 1.00 0.00 C ATOM 1970 O LEU A 123 -11.033 3.438 -4.486 1.00 0.00 O ATOM 1971 CB LEU A 123 -8.064 1.872 -3.713 1.00 0.00 C ATOM 1972 CG LEU A 123 -7.024 1.871 -2.575 1.00 0.00 C ATOM 1973 CD1 LEU A 123 -5.659 1.459 -3.126 1.00 0.00 C ATOM 1974 CD2 LEU A 123 -6.880 3.251 -1.927 1.00 0.00 C ATOM 0 H LEU A 123 -9.288 0.048 -2.619 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.587 2.886 -2.575 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -7.973 0.940 -4.271 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.827 2.682 -4.403 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.373 1.165 -1.821 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.926 1.459 -2.319 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.726 0.459 -3.555 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.350 2.164 -3.897 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.137 3.203 -1.131 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.561 3.974 -2.678 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.839 3.559 -1.511 1.00 0.00 H new ATOM 1986 N GLN A 124 -10.703 1.386 -5.329 1.00 0.00 N ATOM 1987 CA GLN A 124 -11.506 1.643 -6.537 1.00 0.00 C ATOM 1988 C GLN A 124 -12.989 1.918 -6.227 1.00 0.00 C ATOM 1989 O GLN A 124 -13.619 2.735 -6.897 1.00 0.00 O ATOM 1990 CB GLN A 124 -11.309 0.507 -7.559 1.00 0.00 C ATOM 1991 CG GLN A 124 -12.158 -0.743 -7.305 1.00 0.00 C ATOM 1992 CD GLN A 124 -11.734 -1.902 -8.202 1.00 0.00 C ATOM 1993 OE1 GLN A 124 -12.404 -2.271 -9.157 1.00 0.00 O ATOM 1994 NE2 GLN A 124 -10.596 -2.509 -7.939 1.00 0.00 N ATOM 0 H GLN A 124 -10.349 0.432 -5.255 1.00 0.00 H new ATOM 0 HA GLN A 124 -11.141 2.566 -6.988 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.539 0.889 -8.554 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.258 0.220 -7.563 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -12.067 -1.039 -6.260 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -13.209 -0.512 -7.481 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -10.030 -2.209 -7.145 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -10.280 -3.279 -8.529 1.00 0.00 H new ATOM 2003 N ASP A 125 -13.538 1.303 -5.174 1.00 0.00 N ATOM 2004 CA ASP A 125 -14.923 1.492 -4.735 1.00 0.00 C ATOM 2005 C ASP A 125 -15.094 2.718 -3.816 1.00 0.00 C ATOM 2006 O ASP A 125 -16.215 3.052 -3.429 1.00 0.00 O ATOM 2007 CB ASP A 125 -15.450 0.195 -4.099 1.00 0.00 C ATOM 2008 CG ASP A 125 -16.972 0.218 -3.864 1.00 0.00 C ATOM 2009 OD1 ASP A 125 -17.426 -0.209 -2.776 1.00 0.00 O ATOM 2010 OD2 ASP A 125 -17.724 0.637 -4.779 1.00 0.00 O ATOM 0 H ASP A 125 -13.020 0.646 -4.591 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.531 1.711 -5.613 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -15.200 -0.648 -4.744 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.943 0.030 -3.148 1.00 0.00 H new ATOM 2015 N HIS A 126 -14.007 3.442 -3.517 1.00 0.00 N ATOM 2016 CA HIS A 126 -14.095 4.822 -3.034 1.00 0.00 C ATOM 2017 C HIS A 126 -14.007 5.843 -4.173 1.00 0.00 C ATOM 2018 O HIS A 126 -14.749 6.821 -4.166 1.00 0.00 O ATOM 2019 CB HIS A 126 -13.059 5.101 -1.940 1.00 0.00 C ATOM 2020 CG HIS A 126 -13.349 6.412 -1.249 1.00 0.00 C ATOM 2021 ND1 HIS A 126 -12.816 7.658 -1.595 1.00 0.00 N ATOM 2022 CD2 HIS A 126 -14.295 6.593 -0.282 1.00 0.00 C ATOM 2023 CE1 HIS A 126 -13.458 8.559 -0.829 1.00 0.00 C ATOM 2024 NE2 HIS A 126 -14.339 7.945 -0.021 1.00 0.00 N ATOM 0 H HIS A 126 -13.053 3.091 -3.603 1.00 0.00 H new ATOM 0 HA HIS A 126 -15.082 4.939 -2.587 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -13.066 4.291 -1.211 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -12.061 5.128 -2.377 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -14.893 5.826 0.187 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -13.289 9.625 -0.859 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -14.937 8.402 0.667 1.00 0.00 H new ATOM 2032 N PHE A 127 -13.172 5.607 -5.191 1.00 0.00 N ATOM 2033 CA PHE A 127 -12.943 6.558 -6.289 1.00 0.00 C ATOM 2034 C PHE A 127 -13.946 6.483 -7.454 1.00 0.00 C ATOM 2035 O PHE A 127 -13.906 7.359 -8.319 1.00 0.00 O ATOM 2036 CB PHE A 127 -11.499 6.419 -6.791 1.00 0.00 C ATOM 2037 CG PHE A 127 -10.452 7.055 -5.896 1.00 0.00 C ATOM 2038 CD1 PHE A 127 -9.441 6.271 -5.311 1.00 0.00 C ATOM 2039 CD2 PHE A 127 -10.453 8.449 -5.693 1.00 0.00 C ATOM 2040 CE1 PHE A 127 -8.407 6.875 -4.576 1.00 0.00 C ATOM 2041 CE2 PHE A 127 -9.425 9.055 -4.951 1.00 0.00 C ATOM 2042 CZ PHE A 127 -8.394 8.270 -4.407 1.00 0.00 C ATOM 0 H PHE A 127 -12.632 4.746 -5.278 1.00 0.00 H new ATOM 0 HA PHE A 127 -13.111 7.548 -5.864 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -11.268 5.360 -6.901 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -11.429 6.866 -7.783 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -9.460 5.197 -5.428 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -11.246 9.053 -6.109 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -7.625 6.269 -4.142 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -9.427 10.124 -4.799 1.00 0.00 H new ATOM 0 HZ PHE A 127 -7.591 8.739 -3.858 1.00 0.00 H new ATOM 2052 N LYS A 128 -14.863 5.504 -7.503 1.00 0.00 N ATOM 2053 CA LYS A 128 -15.749 5.297 -8.673 1.00 0.00 C ATOM 2054 C LYS A 128 -16.570 6.520 -9.114 1.00 0.00 C ATOM 2055 O LYS A 128 -16.809 6.692 -10.308 1.00 0.00 O ATOM 2056 CB LYS A 128 -16.621 4.033 -8.538 1.00 0.00 C ATOM 2057 CG LYS A 128 -17.860 4.134 -7.632 1.00 0.00 C ATOM 2058 CD LYS A 128 -17.496 4.234 -6.150 1.00 0.00 C ATOM 2059 CE LYS A 128 -18.722 4.190 -5.236 1.00 0.00 C ATOM 2060 NZ LYS A 128 -19.362 2.848 -5.207 1.00 0.00 N ATOM 0 H LYS A 128 -15.015 4.838 -6.746 1.00 0.00 H new ATOM 0 HA LYS A 128 -15.051 5.137 -9.494 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -16.953 3.742 -9.535 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -15.992 3.226 -8.163 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -18.445 5.008 -7.919 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -18.493 3.261 -7.789 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.824 3.416 -5.889 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.951 5.162 -5.976 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.428 4.471 -4.225 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -19.449 4.929 -5.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -20.066 2.815 -4.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -19.832 2.668 -6.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.637 2.121 -5.042 1.00 0.00 H new ATOM 2074 N TRP A 129 -16.956 7.390 -8.178 1.00 0.00 N ATOM 2075 CA TRP A 129 -17.684 8.643 -8.445 1.00 0.00 C ATOM 2076 C TRP A 129 -16.762 9.797 -8.886 1.00 0.00 C ATOM 2077 O TRP A 129 -17.183 10.670 -9.647 1.00 0.00 O ATOM 2078 CB TRP A 129 -18.496 9.038 -7.202 1.00 0.00 C ATOM 2079 CG TRP A 129 -17.677 9.410 -6.003 1.00 0.00 C ATOM 2080 CD1 TRP A 129 -17.058 8.536 -5.182 1.00 0.00 C ATOM 2081 CD2 TRP A 129 -17.346 10.739 -5.480 1.00 0.00 C ATOM 2082 NE1 TRP A 129 -16.310 9.218 -4.248 1.00 0.00 N ATOM 2083 CE2 TRP A 129 -16.496 10.578 -4.343 1.00 0.00 C ATOM 2084 CE3 TRP A 129 -17.677 12.063 -5.847 1.00 0.00 C ATOM 2085 CZ2 TRP A 129 -16.015 11.664 -3.598 1.00 0.00 C ATOM 2086 CZ3 TRP A 129 -17.209 13.163 -5.099 1.00 0.00 C ATOM 2087 CH2 TRP A 129 -16.391 12.965 -3.972 1.00 0.00 C ATOM 0 H TRP A 129 -16.768 7.243 -7.186 1.00 0.00 H new ATOM 0 HA TRP A 129 -18.355 8.458 -9.284 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -19.140 9.879 -7.459 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -19.149 8.207 -6.934 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -17.137 7.461 -5.248 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -15.694 8.770 -3.569 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -18.298 12.235 -6.714 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 -15.366 11.503 -2.750 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -17.481 14.166 -5.394 1.00 0.00 H new ATOM 0 HH2 TRP A 129 -16.052 13.812 -3.395 1.00 0.00 H new ATOM 2098 N VAL A 130 -15.494 9.780 -8.459 1.00 0.00 N ATOM 2099 CA VAL A 130 -14.441 10.727 -8.878 1.00 0.00 C ATOM 2100 C VAL A 130 -13.962 10.413 -10.303 1.00 0.00 C ATOM 2101 O VAL A 130 -13.642 11.319 -11.072 1.00 0.00 O ATOM 2102 CB VAL A 130 -13.248 10.702 -7.892 1.00 0.00 C ATOM 2103 CG1 VAL A 130 -12.236 11.819 -8.181 1.00 0.00 C ATOM 2104 CG2 VAL A 130 -13.698 10.868 -6.434 1.00 0.00 C ATOM 0 H VAL A 130 -15.157 9.087 -7.791 1.00 0.00 H new ATOM 0 HA VAL A 130 -14.871 11.729 -8.870 1.00 0.00 H new ATOM 0 HB VAL A 130 -12.785 9.726 -8.035 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -11.417 11.762 -7.464 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -11.843 11.702 -9.191 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.728 12.788 -8.093 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -12.827 10.844 -5.779 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -14.213 11.822 -6.318 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -14.375 10.056 -6.167 1.00 0.00 H new ATOM 2114 N LYS A 131 -13.971 9.126 -10.682 1.00 0.00 N ATOM 2115 CA LYS A 131 -13.523 8.586 -11.975 1.00 0.00 C ATOM 2116 C LYS A 131 -14.695 8.249 -12.904 1.00 0.00 C ATOM 2117 O LYS A 131 -14.673 7.249 -13.623 1.00 0.00 O ATOM 2118 CB LYS A 131 -12.524 7.432 -11.734 1.00 0.00 C ATOM 2119 CG LYS A 131 -11.171 7.895 -11.149 1.00 0.00 C ATOM 2120 CD LYS A 131 -10.404 8.910 -12.020 1.00 0.00 C ATOM 2121 CE LYS A 131 -10.061 8.358 -13.413 1.00 0.00 C ATOM 2122 NZ LYS A 131 -9.786 9.445 -14.387 1.00 0.00 N ATOM 0 H LYS A 131 -14.310 8.393 -10.059 1.00 0.00 H new ATOM 0 HA LYS A 131 -12.981 9.355 -12.525 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -12.975 6.708 -11.055 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -12.345 6.915 -12.677 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -11.347 8.338 -10.169 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -10.540 7.020 -10.994 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -11.003 9.814 -12.130 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -9.484 9.197 -11.511 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -9.190 7.706 -13.341 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -10.888 7.747 -13.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -9.319 9.048 -15.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -10.681 9.894 -14.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -9.165 10.155 -13.949 1.00 0.00 H new ATOM 2136 N GLN A 132 -15.697 9.134 -12.930 1.00 0.00 N ATOM 2137 CA GLN A 132 -16.732 9.165 -13.976 1.00 0.00 C ATOM 2138 C GLN A 132 -16.283 9.877 -15.272 1.00 0.00 C ATOM 2139 O GLN A 132 -17.048 10.018 -16.229 1.00 0.00 O ATOM 2140 CB GLN A 132 -18.041 9.756 -13.417 1.00 0.00 C ATOM 2141 CG GLN A 132 -18.712 8.876 -12.352 1.00 0.00 C ATOM 2142 CD GLN A 132 -19.193 7.536 -12.912 1.00 0.00 C ATOM 2143 OE1 GLN A 132 -20.098 7.460 -13.734 1.00 0.00 O ATOM 2144 NE2 GLN A 132 -18.607 6.431 -12.505 1.00 0.00 N ATOM 0 H GLN A 132 -15.816 9.857 -12.220 1.00 0.00 H new ATOM 0 HA GLN A 132 -16.913 8.131 -14.271 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -17.832 10.736 -12.987 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -18.739 9.911 -14.239 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -18.008 8.694 -11.540 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -19.559 9.412 -11.925 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -17.852 6.476 -11.821 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -18.908 5.529 -12.873 1.00 0.00 H new ATOM 2153 N GLU A 133 -15.023 10.310 -15.295 1.00 0.00 N ATOM 2154 CA GLU A 133 -14.286 10.958 -16.396 1.00 0.00 C ATOM 2155 C GLU A 133 -12.771 10.682 -16.319 1.00 0.00 C ATOM 2156 O GLU A 133 -12.258 10.410 -15.208 1.00 0.00 O ATOM 2157 CB GLU A 133 -14.585 12.471 -16.422 1.00 0.00 C ATOM 2158 CG GLU A 133 -14.151 13.245 -15.164 1.00 0.00 C ATOM 2159 CD GLU A 133 -14.514 14.743 -15.283 1.00 0.00 C ATOM 2160 OE1 GLU A 133 -13.690 15.539 -15.801 1.00 0.00 O ATOM 2161 OE2 GLU A 133 -15.624 15.147 -14.853 1.00 0.00 O ATOM 2162 OXT GLU A 133 -12.105 10.708 -17.380 1.00 0.00 O ATOM 0 H GLU A 133 -14.431 10.210 -14.470 1.00 0.00 H new ATOM 0 HA GLU A 133 -14.633 10.522 -17.333 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -14.089 12.909 -17.288 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -15.657 12.611 -16.564 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -14.635 12.819 -14.285 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -13.076 13.138 -15.020 1.00 0.00 H new TER 2169 GLU A 133