USER MOD reduce.3.24.130724 H: found=0, std=0, add=885, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 884 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 79 LYS NZ :NH3+ 154:sc= 2 (180deg=0) USER MOD Set 1.2: A 81 THR OG1 : rot 111:sc= 0.797 USER MOD Set 1.3: A 94 SER OG : rot -170:sc= 0.885 USER MOD Set 2.1: A 67 MET CE :methyl 157:sc= 0 (180deg=-0.767) USER MOD Set 2.2: A 90 SER OG : rot -160:sc= 0 USER MOD Set 3.1: A 38 TYR OH : rot -164:sc= 0.488 USER MOD Set 3.2: A 52 GLN :FLIP amide:sc= 0.437 F(o=0.21,f=0.88) USER MOD Set 3.3: A 58 GLN : amide:sc= -0.0489 K(o=0.88,f=-0.2) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0.26) USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0943 USER MOD Single : A 45 TYR OH : rot 43:sc= 1.16 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -53:sc= 0.363 USER MOD Single : A 51 GLN :FLIP amide:sc= 0.311 F(o=-0.25!,f=0.31) USER MOD Single : A 53 MET CE :methyl -158:sc= 0 (180deg=-0.068) USER MOD Single : A 65 MET CE :methyl -161:sc= -0.0274 (180deg=-0.423) USER MOD Single : A 70 SER OG : rot -150:sc= -0.0702 USER MOD Single : A 72 GLN : amide:sc= -1.04 X(o=-1,f=-1.1) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 84:sc= 0.19 USER MOD Single : A 95 TYR OH : rot 81:sc= 0.00121 USER MOD Single : A 107 GLN : amide:sc= -0.86 K(o=-0.86,f=-3.8!) USER MOD Single : A 112 GLN : amide:sc= 1.42 K(o=1.4,f=-6.8!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -1.98! C(o=-2!,f=-2!) USER MOD Single : A 120 HIS : no HE2:sc= -0.914 K(o=-0.91,f=-4.9!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 HIS : no HE2:sc= -0.816 X(o=-0.82,f=-1.1) USER MOD Single : A 133 ASN : amide:sc= -0.074 K(o=-0.074,f=-1.6!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 58:sc= 0.201 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 MET CE :methyl 163:sc= -0.0265 (180deg=-0.278) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 30 -3.240 -21.297 -6.607 1.00 0.00 N ATOM 2 CA LEU A 30 -2.209 -22.009 -5.848 1.00 0.00 C ATOM 3 C LEU A 30 -0.860 -21.718 -6.478 1.00 0.00 C ATOM 4 O LEU A 30 -0.476 -22.398 -7.430 1.00 0.00 O ATOM 5 CB LEU A 30 -2.449 -23.521 -5.765 1.00 0.00 C ATOM 6 CG LEU A 30 -3.728 -23.911 -5.006 1.00 0.00 C ATOM 7 CD1 LEU A 30 -4.925 -24.113 -5.944 1.00 0.00 C ATOM 8 CD2 LEU A 30 -3.491 -25.189 -4.206 1.00 0.00 C ATOM 0 HA LEU A 30 -2.243 -21.648 -4.820 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.501 -23.926 -6.776 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.593 -23.988 -5.278 1.00 0.00 H new ATOM 0 HG LEU A 30 -3.967 -23.085 -4.336 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.803 -24.387 -5.359 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -5.124 -23.188 -6.485 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.700 -24.908 -6.655 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.402 -25.458 -3.672 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.216 -25.997 -4.884 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -2.685 -25.026 -3.490 1.00 0.00 H new ATOM 20 N ARG A 31 -0.177 -20.690 -5.974 1.00 0.00 N ATOM 21 CA ARG A 31 1.211 -20.300 -6.216 1.00 0.00 C ATOM 22 C ARG A 31 1.657 -19.455 -5.019 1.00 0.00 C ATOM 23 O ARG A 31 0.828 -19.088 -4.178 1.00 0.00 O ATOM 24 CB ARG A 31 1.349 -19.559 -7.555 1.00 0.00 C ATOM 25 CG ARG A 31 1.822 -20.508 -8.677 1.00 0.00 C ATOM 26 CD ARG A 31 1.258 -20.086 -10.027 1.00 0.00 C ATOM 27 NE ARG A 31 1.846 -18.826 -10.494 1.00 0.00 N ATOM 28 CZ ARG A 31 1.276 -17.972 -11.342 1.00 0.00 C ATOM 29 NH1 ARG A 31 0.060 -18.203 -11.833 1.00 0.00 N ATOM 30 NH2 ARG A 31 1.934 -16.879 -11.693 1.00 0.00 N ATOM 0 H ARG A 31 -0.627 -20.047 -5.322 1.00 0.00 H new ATOM 0 HA ARG A 31 1.858 -21.173 -6.302 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.391 -19.118 -7.829 1.00 0.00 H new ATOM 0 HB3 ARG A 31 2.058 -18.738 -7.447 1.00 0.00 H new ATOM 0 HG2 ARG A 31 2.911 -20.511 -8.720 1.00 0.00 H new ATOM 0 HG3 ARG A 31 1.509 -21.527 -8.451 1.00 0.00 H new ATOM 0 HD2 ARG A 31 1.447 -20.869 -10.761 1.00 0.00 H new ATOM 0 HD3 ARG A 31 0.176 -19.976 -9.950 1.00 0.00 H new ATOM 0 HE ARG A 31 2.771 -18.583 -10.139 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.449 -19.044 -11.560 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -0.363 -17.539 -12.482 1.00 0.00 H new ATOM 0 HH21 ARG A 31 2.864 -16.700 -11.315 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.511 -16.215 -12.342 1.00 0.00 H new ATOM 44 N SER A 32 2.951 -19.162 -4.912 1.00 0.00 N ATOM 45 CA SER A 32 3.550 -18.517 -3.748 1.00 0.00 C ATOM 46 C SER A 32 4.766 -17.696 -4.198 1.00 0.00 C ATOM 47 O SER A 32 4.977 -17.533 -5.400 1.00 0.00 O ATOM 48 CB SER A 32 3.901 -19.614 -2.727 1.00 0.00 C ATOM 49 OG SER A 32 3.881 -19.116 -1.407 1.00 0.00 O ATOM 0 H SER A 32 3.626 -19.371 -5.648 1.00 0.00 H new ATOM 0 HA SER A 32 2.864 -17.820 -3.267 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.192 -20.437 -2.817 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.889 -20.018 -2.950 1.00 0.00 H new ATOM 0 HG SER A 32 4.106 -19.837 -0.782 1.00 0.00 H new ATOM 55 N ASN A 33 5.526 -17.140 -3.255 1.00 0.00 N ATOM 56 CA ASN A 33 6.847 -16.503 -3.381 1.00 0.00 C ATOM 57 C ASN A 33 7.229 -16.009 -1.980 1.00 0.00 C ATOM 58 O ASN A 33 6.447 -16.193 -1.039 1.00 0.00 O ATOM 59 CB ASN A 33 6.863 -15.344 -4.408 1.00 0.00 C ATOM 60 CG ASN A 33 7.755 -15.686 -5.591 1.00 0.00 C ATOM 61 OD1 ASN A 33 7.289 -16.214 -6.594 1.00 0.00 O ATOM 62 ND2 ASN A 33 9.043 -15.420 -5.528 1.00 0.00 N ATOM 0 H ASN A 33 5.205 -17.120 -2.287 1.00 0.00 H new ATOM 0 HA ASN A 33 7.570 -17.225 -3.761 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.849 -15.146 -4.756 1.00 0.00 H new ATOM 0 HB3 ASN A 33 7.220 -14.432 -3.929 1.00 0.00 H new ATOM 0 HD21 ASN A 33 9.651 -15.653 -6.313 1.00 0.00 H new ATOM 0 HD22 ASN A 33 9.433 -14.981 -4.694 1.00 0.00 H new ATOM 69 N ILE A 34 8.390 -15.370 -1.808 1.00 0.00 N ATOM 70 CA ILE A 34 8.569 -14.456 -0.678 1.00 0.00 C ATOM 71 C ILE A 34 7.523 -13.345 -0.851 1.00 0.00 C ATOM 72 O ILE A 34 7.208 -12.948 -1.975 1.00 0.00 O ATOM 73 CB ILE A 34 10.007 -13.881 -0.623 1.00 0.00 C ATOM 74 CG1 ILE A 34 11.089 -14.974 -0.486 1.00 0.00 C ATOM 75 CG2 ILE A 34 10.202 -12.888 0.540 1.00 0.00 C ATOM 76 CD1 ILE A 34 12.387 -14.546 -1.182 1.00 0.00 C ATOM 0 H ILE A 34 9.201 -15.465 -2.420 1.00 0.00 H new ATOM 0 HA ILE A 34 8.430 -14.980 0.268 1.00 0.00 H new ATOM 0 HB ILE A 34 10.126 -13.367 -1.577 1.00 0.00 H new ATOM 0 HG12 ILE A 34 11.284 -15.169 0.569 1.00 0.00 H new ATOM 0 HG13 ILE A 34 10.728 -15.906 -0.921 1.00 0.00 H new ATOM 0 HG21 ILE A 34 11.226 -12.515 0.532 1.00 0.00 H new ATOM 0 HG22 ILE A 34 9.511 -12.053 0.425 1.00 0.00 H new ATOM 0 HG23 ILE A 34 10.007 -13.393 1.486 1.00 0.00 H new ATOM 0 HD11 ILE A 34 13.135 -15.331 -1.072 1.00 0.00 H new ATOM 0 HD12 ILE A 34 12.193 -14.375 -2.241 1.00 0.00 H new ATOM 0 HD13 ILE A 34 12.757 -13.627 -0.728 1.00 0.00 H new ATOM 88 N ASP A 35 7.052 -12.810 0.271 1.00 0.00 N ATOM 89 CA ASP A 35 6.154 -11.678 0.418 1.00 0.00 C ATOM 90 C ASP A 35 4.733 -11.920 -0.068 1.00 0.00 C ATOM 91 O ASP A 35 4.467 -12.548 -1.098 1.00 0.00 O ATOM 92 CB ASP A 35 6.738 -10.384 -0.152 1.00 0.00 C ATOM 93 CG ASP A 35 7.844 -9.788 0.711 1.00 0.00 C ATOM 94 OD1 ASP A 35 7.775 -9.929 1.953 1.00 0.00 O ATOM 95 OD2 ASP A 35 8.751 -9.134 0.150 1.00 0.00 O ATOM 0 H ASP A 35 7.315 -13.194 1.179 1.00 0.00 H new ATOM 0 HA ASP A 35 6.064 -11.552 1.497 1.00 0.00 H new ATOM 0 HB2 ASP A 35 7.131 -10.580 -1.150 1.00 0.00 H new ATOM 0 HB3 ASP A 35 5.939 -9.651 -0.263 1.00 0.00 H new ATOM 100 N LEU A 36 3.784 -11.409 0.714 1.00 0.00 N ATOM 101 CA LEU A 36 2.392 -11.267 0.349 1.00 0.00 C ATOM 102 C LEU A 36 2.188 -9.899 -0.288 1.00 0.00 C ATOM 103 O LEU A 36 3.101 -9.080 -0.364 1.00 0.00 O ATOM 104 CB LEU A 36 1.512 -11.483 1.591 1.00 0.00 C ATOM 105 CG LEU A 36 1.837 -10.564 2.786 1.00 0.00 C ATOM 106 CD1 LEU A 36 1.494 -9.091 2.557 1.00 0.00 C ATOM 107 CD2 LEU A 36 1.123 -11.091 4.028 1.00 0.00 C ATOM 0 H LEU A 36 3.981 -11.071 1.656 1.00 0.00 H new ATOM 0 HA LEU A 36 2.100 -12.020 -0.383 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.470 -11.334 1.310 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.610 -12.520 1.912 1.00 0.00 H new ATOM 0 HG LEU A 36 2.919 -10.590 2.919 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.754 -8.515 3.445 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.057 -8.715 1.703 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.427 -8.992 2.360 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.348 -10.447 4.878 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.047 -11.099 3.853 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.464 -12.104 4.241 1.00 0.00 H new ATOM 119 N PHE A 37 0.958 -9.677 -0.727 1.00 0.00 N ATOM 120 CA PHE A 37 0.462 -8.474 -1.378 1.00 0.00 C ATOM 121 C PHE A 37 -1.040 -8.678 -1.555 1.00 0.00 C ATOM 122 O PHE A 37 -1.435 -9.777 -1.961 1.00 0.00 O ATOM 123 CB PHE A 37 1.138 -8.302 -2.748 1.00 0.00 C ATOM 124 CG PHE A 37 0.915 -6.938 -3.350 1.00 0.00 C ATOM 125 CD1 PHE A 37 -0.295 -6.650 -4.006 1.00 0.00 C ATOM 126 CD2 PHE A 37 1.898 -5.940 -3.228 1.00 0.00 C ATOM 127 CE1 PHE A 37 -0.528 -5.368 -4.519 1.00 0.00 C ATOM 128 CE2 PHE A 37 1.666 -4.662 -3.742 1.00 0.00 C ATOM 129 CZ PHE A 37 0.444 -4.371 -4.358 1.00 0.00 C ATOM 0 H PHE A 37 0.229 -10.383 -0.631 1.00 0.00 H new ATOM 0 HA PHE A 37 0.676 -7.582 -0.790 1.00 0.00 H new ATOM 0 HB2 PHE A 37 2.209 -8.475 -2.642 1.00 0.00 H new ATOM 0 HB3 PHE A 37 0.758 -9.061 -3.432 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.046 -7.419 -4.114 1.00 0.00 H new ATOM 0 HD2 PHE A 37 2.834 -6.162 -2.736 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -1.451 -5.149 -5.035 1.00 0.00 H new ATOM 0 HE2 PHE A 37 2.428 -3.901 -3.664 1.00 0.00 H new ATOM 0 HZ PHE A 37 0.248 -3.370 -4.712 1.00 0.00 H new ATOM 139 N TYR A 38 -1.860 -7.671 -1.254 1.00 0.00 N ATOM 140 CA TYR A 38 -3.318 -7.697 -1.375 1.00 0.00 C ATOM 141 C TYR A 38 -3.772 -6.523 -2.247 1.00 0.00 C ATOM 142 O TYR A 38 -2.964 -5.674 -2.630 1.00 0.00 O ATOM 143 CB TYR A 38 -3.978 -7.613 0.015 1.00 0.00 C ATOM 144 CG TYR A 38 -3.612 -8.683 1.031 1.00 0.00 C ATOM 145 CD1 TYR A 38 -2.399 -8.592 1.741 1.00 0.00 C ATOM 146 CD2 TYR A 38 -4.503 -9.739 1.317 1.00 0.00 C ATOM 147 CE1 TYR A 38 -2.054 -9.565 2.696 1.00 0.00 C ATOM 148 CE2 TYR A 38 -4.185 -10.685 2.298 1.00 0.00 C ATOM 149 CZ TYR A 38 -2.949 -10.623 2.974 1.00 0.00 C ATOM 150 OH TYR A 38 -2.646 -11.569 3.903 1.00 0.00 O ATOM 0 H TYR A 38 -1.512 -6.778 -0.905 1.00 0.00 H new ATOM 0 HA TYR A 38 -3.622 -8.635 -1.839 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -3.733 -6.642 0.446 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -5.059 -7.636 -0.124 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -1.728 -7.768 1.550 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -5.435 -9.818 0.776 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -1.109 -9.504 3.215 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -4.890 -11.467 2.539 1.00 0.00 H new ATOM 0 HH TYR A 38 -3.237 -12.342 3.787 1.00 0.00 H new ATOM 160 N THR A 39 -5.067 -6.429 -2.520 1.00 0.00 N ATOM 161 CA THR A 39 -5.711 -5.319 -3.211 1.00 0.00 C ATOM 162 C THR A 39 -7.016 -4.967 -2.465 1.00 0.00 C ATOM 163 O THR A 39 -7.327 -5.644 -1.478 1.00 0.00 O ATOM 164 CB THR A 39 -5.860 -5.703 -4.701 1.00 0.00 C ATOM 165 OG1 THR A 39 -6.583 -6.905 -4.794 1.00 0.00 O ATOM 166 CG2 THR A 39 -4.513 -5.906 -5.410 1.00 0.00 C ATOM 0 H THR A 39 -5.728 -7.159 -2.253 1.00 0.00 H new ATOM 0 HA THR A 39 -5.124 -4.401 -3.203 1.00 0.00 H new ATOM 0 HB THR A 39 -6.374 -4.875 -5.189 1.00 0.00 H new ATOM 0 HG1 THR A 39 -6.683 -7.154 -5.736 1.00 0.00 H new ATOM 0 HG21 THR A 39 -4.687 -6.174 -6.452 1.00 0.00 H new ATOM 0 HG22 THR A 39 -3.935 -4.983 -5.364 1.00 0.00 H new ATOM 0 HG23 THR A 39 -3.960 -6.706 -4.918 1.00 0.00 H new ATOM 174 N PRO A 40 -7.755 -3.894 -2.815 1.00 0.00 N ATOM 175 CA PRO A 40 -8.819 -3.388 -1.962 1.00 0.00 C ATOM 176 C PRO A 40 -10.065 -4.257 -2.021 1.00 0.00 C ATOM 177 O PRO A 40 -10.918 -4.097 -1.166 1.00 0.00 O ATOM 178 CB PRO A 40 -9.149 -1.987 -2.459 1.00 0.00 C ATOM 179 CG PRO A 40 -8.806 -2.056 -3.934 1.00 0.00 C ATOM 180 CD PRO A 40 -7.708 -3.111 -4.037 1.00 0.00 C ATOM 0 HA PRO A 40 -8.486 -3.389 -0.924 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -10.199 -1.740 -2.300 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.561 -1.227 -1.943 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -9.676 -2.333 -4.529 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -8.461 -1.091 -4.304 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -7.865 -3.747 -4.908 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -6.732 -2.641 -4.157 1.00 0.00 H new ATOM 188 N GLY A 41 -10.184 -5.171 -2.980 1.00 0.00 N ATOM 189 CA GLY A 41 -11.138 -6.253 -2.871 1.00 0.00 C ATOM 190 C GLY A 41 -10.559 -7.358 -1.998 1.00 0.00 C ATOM 191 O GLY A 41 -11.254 -7.811 -1.099 1.00 0.00 O ATOM 0 H GLY A 41 -9.630 -5.178 -3.836 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -12.071 -5.887 -2.441 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -11.375 -6.644 -3.861 1.00 0.00 H new ATOM 195 N GLU A 42 -9.297 -7.775 -2.181 1.00 0.00 N ATOM 196 CA GLU A 42 -8.788 -8.991 -1.542 1.00 0.00 C ATOM 197 C GLU A 42 -8.847 -8.934 -0.012 1.00 0.00 C ATOM 198 O GLU A 42 -8.952 -9.974 0.636 1.00 0.00 O ATOM 199 CB GLU A 42 -7.326 -9.277 -1.931 1.00 0.00 C ATOM 200 CG GLU A 42 -7.092 -9.900 -3.313 1.00 0.00 C ATOM 201 CD GLU A 42 -5.643 -10.394 -3.413 1.00 0.00 C ATOM 202 OE1 GLU A 42 -4.696 -9.687 -3.810 1.00 0.00 O ATOM 203 OE2 GLU A 42 -5.393 -11.557 -3.034 1.00 0.00 O ATOM 0 H GLU A 42 -8.616 -7.289 -2.764 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.444 -9.784 -1.902 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.771 -8.340 -1.881 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.898 -9.942 -1.181 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.782 -10.729 -3.471 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.292 -9.166 -4.093 1.00 0.00 H new ATOM 210 N ILE A 43 -8.749 -7.740 0.573 1.00 0.00 N ATOM 211 CA ILE A 43 -8.761 -7.566 2.022 1.00 0.00 C ATOM 212 C ILE A 43 -10.171 -7.780 2.604 1.00 0.00 C ATOM 213 O ILE A 43 -10.277 -8.106 3.785 1.00 0.00 O ATOM 214 CB ILE A 43 -8.119 -6.191 2.356 1.00 0.00 C ATOM 215 CG1 ILE A 43 -6.618 -6.263 1.955 1.00 0.00 C ATOM 216 CG2 ILE A 43 -8.326 -5.781 3.834 1.00 0.00 C ATOM 217 CD1 ILE A 43 -5.660 -5.353 2.726 1.00 0.00 C ATOM 0 H ILE A 43 -8.659 -6.867 0.053 1.00 0.00 H new ATOM 0 HA ILE A 43 -8.158 -8.331 2.510 1.00 0.00 H new ATOM 0 HB ILE A 43 -8.613 -5.404 1.786 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.282 -7.293 2.076 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -6.536 -6.024 0.895 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -7.858 -4.813 4.012 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -9.393 -5.712 4.047 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -7.874 -6.528 4.486 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -4.645 -5.495 2.355 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.955 -4.313 2.587 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -5.696 -5.602 3.787 1.00 0.00 H new ATOM 229 N LEU A 44 -11.235 -7.638 1.807 1.00 0.00 N ATOM 230 CA LEU A 44 -12.625 -7.600 2.276 1.00 0.00 C ATOM 231 C LEU A 44 -13.458 -8.721 1.651 1.00 0.00 C ATOM 232 O LEU A 44 -14.353 -9.236 2.317 1.00 0.00 O ATOM 233 CB LEU A 44 -13.306 -6.228 2.025 1.00 0.00 C ATOM 234 CG LEU A 44 -12.560 -5.184 1.178 1.00 0.00 C ATOM 235 CD1 LEU A 44 -13.542 -4.184 0.563 1.00 0.00 C ATOM 236 CD2 LEU A 44 -11.534 -4.407 2.002 1.00 0.00 C ATOM 0 H LEU A 44 -11.152 -7.544 0.795 1.00 0.00 H new ATOM 0 HA LEU A 44 -12.581 -7.752 3.354 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -14.267 -6.417 1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -13.516 -5.779 2.996 1.00 0.00 H new ATOM 0 HG LEU A 44 -12.041 -5.734 0.393 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -12.993 -3.454 -0.032 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -14.249 -4.714 -0.075 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -14.084 -3.671 1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -11.030 -3.680 1.364 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -12.039 -3.887 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.799 -5.099 2.414 1.00 0.00 H new ATOM 248 N TYR A 45 -13.185 -9.063 0.391 1.00 0.00 N ATOM 249 CA TYR A 45 -13.810 -10.118 -0.397 1.00 0.00 C ATOM 250 C TYR A 45 -13.069 -11.450 -0.198 1.00 0.00 C ATOM 251 O TYR A 45 -13.692 -12.513 -0.246 1.00 0.00 O ATOM 252 CB TYR A 45 -13.771 -9.736 -1.893 1.00 0.00 C ATOM 253 CG TYR A 45 -14.680 -8.598 -2.355 1.00 0.00 C ATOM 254 CD1 TYR A 45 -14.629 -7.319 -1.765 1.00 0.00 C ATOM 255 CD2 TYR A 45 -15.581 -8.819 -3.414 1.00 0.00 C ATOM 256 CE1 TYR A 45 -15.529 -6.313 -2.171 1.00 0.00 C ATOM 257 CE2 TYR A 45 -16.489 -7.823 -3.821 1.00 0.00 C ATOM 258 CZ TYR A 45 -16.489 -6.568 -3.179 1.00 0.00 C ATOM 259 OH TYR A 45 -17.388 -5.613 -3.560 1.00 0.00 O ATOM 0 H TYR A 45 -12.468 -8.571 -0.142 1.00 0.00 H new ATOM 0 HA TYR A 45 -14.843 -10.233 -0.068 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -12.745 -9.470 -2.145 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -14.022 -10.624 -2.473 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -13.897 -7.109 -0.999 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -15.576 -9.771 -3.924 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -15.486 -5.338 -1.708 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -17.184 -8.020 -4.624 1.00 0.00 H new ATOM 0 HH TYR A 45 -16.932 -4.749 -3.643 1.00 0.00 H new ATOM 269 N GLY A 46 -11.750 -11.408 0.044 1.00 0.00 N ATOM 270 CA GLY A 46 -10.901 -12.571 0.296 1.00 0.00 C ATOM 271 C GLY A 46 -9.703 -12.619 -0.655 1.00 0.00 C ATOM 272 O GLY A 46 -9.785 -12.189 -1.807 1.00 0.00 O ATOM 0 H GLY A 46 -11.232 -10.530 0.069 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -10.546 -12.545 1.326 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -11.490 -13.481 0.185 1.00 0.00 H new ATOM 276 N LYS A 47 -8.583 -13.183 -0.186 1.00 0.00 N ATOM 277 CA LYS A 47 -7.356 -13.290 -0.974 1.00 0.00 C ATOM 278 C LYS A 47 -7.580 -14.137 -2.204 1.00 0.00 C ATOM 279 O LYS A 47 -7.973 -15.296 -2.065 1.00 0.00 O ATOM 280 CB LYS A 47 -6.270 -13.915 -0.114 1.00 0.00 C ATOM 281 CG LYS A 47 -4.882 -13.984 -0.762 1.00 0.00 C ATOM 282 CD LYS A 47 -3.868 -13.822 0.366 1.00 0.00 C ATOM 283 CE LYS A 47 -2.397 -13.801 -0.002 1.00 0.00 C ATOM 284 NZ LYS A 47 -1.910 -15.085 -0.540 1.00 0.00 N ATOM 0 H LYS A 47 -8.505 -13.577 0.752 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.053 -12.293 -1.296 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.192 -13.348 0.814 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.578 -14.925 0.155 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.741 -14.935 -1.277 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.762 -13.197 -1.507 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.095 -12.893 0.890 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.024 -14.635 1.076 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -2.226 -13.018 -0.740 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -1.813 -13.540 0.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -0.899 -15.004 -0.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.043 -15.832 0.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.443 -15.326 -1.400 1.00 0.00 H new ATOM 298 N ARG A 48 -7.122 -13.683 -3.368 1.00 0.00 N ATOM 299 CA ARG A 48 -7.840 -13.717 -4.644 1.00 0.00 C ATOM 300 C ARG A 48 -9.005 -14.697 -4.710 1.00 0.00 C ATOM 301 O ARG A 48 -10.148 -14.281 -4.854 1.00 0.00 O ATOM 302 CB ARG A 48 -6.843 -13.990 -5.781 1.00 0.00 C ATOM 303 CG ARG A 48 -6.108 -12.723 -6.221 1.00 0.00 C ATOM 304 CD ARG A 48 -5.099 -13.035 -7.330 1.00 0.00 C ATOM 305 NE ARG A 48 -3.833 -13.531 -6.766 1.00 0.00 N ATOM 306 CZ ARG A 48 -2.865 -14.155 -7.444 1.00 0.00 C ATOM 307 NH1 ARG A 48 -3.032 -14.451 -8.731 1.00 0.00 N ATOM 308 NH2 ARG A 48 -1.731 -14.481 -6.827 1.00 0.00 N ATOM 0 H ARG A 48 -6.197 -13.261 -3.454 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.301 -12.735 -4.752 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -6.117 -14.734 -5.454 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.374 -14.415 -6.633 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.827 -11.985 -6.575 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -5.592 -12.282 -5.368 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.516 -13.780 -8.007 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -4.912 -12.138 -7.920 1.00 0.00 H new ATOM 0 HE ARG A 48 -3.681 -13.385 -5.768 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -3.901 -14.201 -9.203 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -2.291 -14.927 -9.245 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -1.604 -14.254 -5.841 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -0.990 -14.957 -7.341 1.00 0.00 H new ATOM 322 N GLU A 49 -8.703 -15.990 -4.680 1.00 0.00 N ATOM 323 CA GLU A 49 -9.695 -17.044 -4.848 1.00 0.00 C ATOM 324 C GLU A 49 -10.563 -17.097 -3.604 1.00 0.00 C ATOM 325 O GLU A 49 -11.776 -16.941 -3.702 1.00 0.00 O ATOM 326 CB GLU A 49 -8.999 -18.392 -5.069 1.00 0.00 C ATOM 327 CG GLU A 49 -8.530 -18.567 -6.515 1.00 0.00 C ATOM 328 CD GLU A 49 -7.474 -17.533 -6.911 1.00 0.00 C ATOM 329 OE1 GLU A 49 -6.422 -17.453 -6.225 1.00 0.00 O ATOM 330 OE2 GLU A 49 -7.669 -16.811 -7.912 1.00 0.00 O ATOM 0 H GLU A 49 -7.755 -16.338 -4.537 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.315 -16.834 -5.719 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -8.143 -18.472 -4.399 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -9.683 -19.200 -4.810 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -8.120 -19.569 -6.643 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -9.386 -18.484 -7.185 1.00 0.00 H new ATOM 337 N THR A 50 -9.907 -17.324 -2.459 1.00 0.00 N ATOM 338 CA THR A 50 -10.359 -17.116 -1.085 1.00 0.00 C ATOM 339 C THR A 50 -9.351 -17.733 -0.089 1.00 0.00 C ATOM 340 O THR A 50 -9.698 -18.277 0.957 1.00 0.00 O ATOM 341 CB THR A 50 -11.811 -17.605 -0.894 1.00 0.00 C ATOM 342 OG1 THR A 50 -12.270 -17.296 0.391 1.00 0.00 O ATOM 343 CG2 THR A 50 -11.996 -19.102 -1.196 1.00 0.00 C ATOM 0 H THR A 50 -8.956 -17.693 -2.478 1.00 0.00 H new ATOM 0 HA THR A 50 -10.385 -16.048 -0.871 1.00 0.00 H new ATOM 0 HB THR A 50 -12.414 -17.071 -1.628 1.00 0.00 H new ATOM 0 HG1 THR A 50 -11.640 -17.644 1.056 1.00 0.00 H new ATOM 0 HG21 THR A 50 -13.039 -19.378 -1.042 1.00 0.00 H new ATOM 0 HG22 THR A 50 -11.717 -19.302 -2.231 1.00 0.00 H new ATOM 0 HG23 THR A 50 -11.363 -19.688 -0.530 1.00 0.00 H new ATOM 351 N GLN A 51 -8.060 -17.704 -0.418 1.00 0.00 N ATOM 352 CA GLN A 51 -7.067 -18.581 0.194 1.00 0.00 C ATOM 353 C GLN A 51 -6.572 -18.097 1.569 1.00 0.00 C ATOM 354 O GLN A 51 -5.543 -18.597 2.028 1.00 0.00 O ATOM 355 CB GLN A 51 -5.959 -18.882 -0.831 1.00 0.00 C ATOM 356 CG GLN A 51 -5.180 -17.659 -1.333 1.00 0.00 C ATOM 357 CD GLN A 51 -5.156 -17.588 -2.865 1.00 0.00 C ATOM 358 OE1 GLN A 51 -6.018 -16.784 -3.472 1.00 0.00 O flip ATOM 359 NE2 GLN A 51 -4.359 -18.251 -3.524 1.00 0.00 N flip ATOM 0 H GLN A 51 -7.674 -17.070 -1.118 1.00 0.00 H new ATOM 0 HA GLN A 51 -7.542 -19.529 0.447 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -5.254 -19.583 -0.384 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -6.407 -19.384 -1.689 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -5.633 -16.751 -0.934 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -4.158 -17.699 -0.955 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -3.697 -18.868 -3.053 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -4.359 -18.184 -4.542 1.00 0.00 H new ATOM 368 N GLN A 52 -7.280 -17.139 2.192 1.00 0.00 N ATOM 369 CA GLN A 52 -7.227 -16.545 3.539 1.00 0.00 C ATOM 370 C GLN A 52 -7.624 -15.062 3.464 1.00 0.00 C ATOM 371 O GLN A 52 -7.709 -14.500 2.373 1.00 0.00 O ATOM 372 CB GLN A 52 -5.894 -16.768 4.287 1.00 0.00 C ATOM 373 CG GLN A 52 -4.632 -16.248 3.581 1.00 0.00 C ATOM 374 CD GLN A 52 -4.176 -14.888 4.082 1.00 0.00 C ATOM 375 OE1 GLN A 52 -4.570 -13.812 3.424 1.00 0.00 O flip ATOM 376 NE2 GLN A 52 -3.414 -14.795 5.034 1.00 0.00 N flip ATOM 0 H GLN A 52 -8.031 -16.689 1.668 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.954 -17.078 4.151 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -5.964 -16.289 5.264 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -5.773 -17.837 4.464 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.825 -16.967 3.720 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.823 -16.187 2.510 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -3.117 -15.633 5.534 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -3.075 -13.879 5.328 1.00 0.00 H new ATOM 385 N MET A 53 -7.797 -14.404 4.608 1.00 0.00 N ATOM 386 CA MET A 53 -7.930 -12.950 4.738 1.00 0.00 C ATOM 387 C MET A 53 -6.701 -12.448 5.518 1.00 0.00 C ATOM 388 O MET A 53 -6.071 -13.256 6.209 1.00 0.00 O ATOM 389 CB MET A 53 -9.250 -12.624 5.454 1.00 0.00 C ATOM 390 CG MET A 53 -10.454 -13.222 4.708 1.00 0.00 C ATOM 391 SD MET A 53 -12.042 -12.452 5.104 1.00 0.00 S ATOM 392 CE MET A 53 -11.925 -10.997 4.024 1.00 0.00 C ATOM 0 H MET A 53 -7.851 -14.885 5.506 1.00 0.00 H new ATOM 0 HA MET A 53 -7.963 -12.452 3.769 1.00 0.00 H new ATOM 0 HB2 MET A 53 -9.220 -13.014 6.471 1.00 0.00 H new ATOM 0 HB3 MET A 53 -9.367 -11.543 5.530 1.00 0.00 H new ATOM 0 HG2 MET A 53 -10.280 -13.135 3.635 1.00 0.00 H new ATOM 0 HG3 MET A 53 -10.514 -14.286 4.936 1.00 0.00 H new ATOM 0 HE1 MET A 53 -12.591 -10.216 4.392 1.00 0.00 H new ATOM 0 HE2 MET A 53 -10.899 -10.628 4.021 1.00 0.00 H new ATOM 0 HE3 MET A 53 -12.215 -11.272 3.010 1.00 0.00 H new ATOM 402 N PRO A 54 -6.304 -11.165 5.451 1.00 0.00 N ATOM 403 CA PRO A 54 -5.233 -10.662 6.306 1.00 0.00 C ATOM 404 C PRO A 54 -5.695 -10.635 7.768 1.00 0.00 C ATOM 405 O PRO A 54 -6.891 -10.543 8.043 1.00 0.00 O ATOM 406 CB PRO A 54 -4.928 -9.252 5.792 1.00 0.00 C ATOM 407 CG PRO A 54 -6.258 -8.800 5.195 1.00 0.00 C ATOM 408 CD PRO A 54 -6.888 -10.089 4.667 1.00 0.00 C ATOM 0 HA PRO A 54 -4.345 -11.293 6.272 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.603 -8.592 6.597 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -4.134 -9.259 5.045 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -6.891 -8.325 5.945 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -6.110 -8.073 4.397 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -7.972 -10.068 4.778 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -6.679 -10.220 3.605 1.00 0.00 H new ATOM 416 N GLU A 55 -4.751 -10.642 8.704 1.00 0.00 N ATOM 417 CA GLU A 55 -5.017 -10.304 10.097 1.00 0.00 C ATOM 418 C GLU A 55 -5.067 -8.774 10.174 1.00 0.00 C ATOM 419 O GLU A 55 -4.310 -8.088 9.489 1.00 0.00 O ATOM 420 CB GLU A 55 -3.883 -10.843 10.991 1.00 0.00 C ATOM 421 CG GLU A 55 -4.197 -12.171 11.684 1.00 0.00 C ATOM 422 CD GLU A 55 -3.043 -12.569 12.611 1.00 0.00 C ATOM 423 OE1 GLU A 55 -1.889 -12.655 12.134 1.00 0.00 O ATOM 424 OE2 GLU A 55 -3.275 -12.771 13.826 1.00 0.00 O ATOM 0 H GLU A 55 -3.778 -10.883 8.517 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.953 -10.744 10.441 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.987 -10.968 10.383 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.651 -10.097 11.751 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -5.120 -12.081 12.257 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.359 -12.949 10.938 1.00 0.00 H new ATOM 431 N VAL A 56 -5.927 -8.228 11.028 1.00 0.00 N ATOM 432 CA VAL A 56 -5.997 -6.791 11.301 1.00 0.00 C ATOM 433 C VAL A 56 -4.951 -6.362 12.338 1.00 0.00 C ATOM 434 O VAL A 56 -4.707 -5.179 12.535 1.00 0.00 O ATOM 435 CB VAL A 56 -7.458 -6.442 11.629 1.00 0.00 C ATOM 436 CG1 VAL A 56 -7.999 -7.225 12.829 1.00 0.00 C ATOM 437 CG2 VAL A 56 -7.700 -4.955 11.849 1.00 0.00 C ATOM 0 H VAL A 56 -6.605 -8.776 11.558 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.723 -6.201 10.427 1.00 0.00 H new ATOM 0 HB VAL A 56 -8.006 -6.740 10.735 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -9.034 -6.938 13.014 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.951 -8.293 12.618 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -7.397 -7.002 13.710 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.753 -4.787 12.076 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -7.090 -4.606 12.682 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -7.431 -4.405 10.947 1.00 0.00 H new ATOM 447 N GLY A 57 -4.257 -7.322 12.938 1.00 0.00 N ATOM 448 CA GLY A 57 -3.048 -7.109 13.709 1.00 0.00 C ATOM 449 C GLY A 57 -1.825 -7.572 12.924 1.00 0.00 C ATOM 450 O GLY A 57 -0.975 -8.252 13.505 1.00 0.00 O ATOM 0 H GLY A 57 -4.534 -8.303 12.897 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.949 -6.052 13.957 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -3.110 -7.653 14.651 1.00 0.00 H new ATOM 454 N GLN A 58 -1.712 -7.280 11.620 1.00 0.00 N ATOM 455 CA GLN A 58 -0.468 -7.581 10.914 1.00 0.00 C ATOM 456 C GLN A 58 -0.081 -6.508 9.903 1.00 0.00 C ATOM 457 O GLN A 58 -0.881 -5.655 9.515 1.00 0.00 O ATOM 458 CB GLN A 58 -0.522 -8.975 10.260 1.00 0.00 C ATOM 459 CG GLN A 58 -1.372 -9.023 8.982 1.00 0.00 C ATOM 460 CD GLN A 58 -0.849 -9.932 7.887 1.00 0.00 C ATOM 461 OE1 GLN A 58 0.101 -10.686 8.047 1.00 0.00 O ATOM 462 NE2 GLN A 58 -1.493 -9.904 6.739 1.00 0.00 N ATOM 0 H GLN A 58 -2.442 -6.850 11.052 1.00 0.00 H new ATOM 0 HA GLN A 58 0.320 -7.587 11.667 1.00 0.00 H new ATOM 0 HB2 GLN A 58 0.493 -9.296 10.024 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.922 -9.689 10.979 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -2.379 -9.345 9.248 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.455 -8.012 8.583 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -2.284 -9.273 6.613 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.201 -10.514 5.975 1.00 0.00 H new ATOM 471 N ARG A 59 1.148 -6.649 9.418 1.00 0.00 N ATOM 472 CA ARG A 59 1.797 -5.864 8.384 1.00 0.00 C ATOM 473 C ARG A 59 1.473 -6.476 7.038 1.00 0.00 C ATOM 474 O ARG A 59 1.437 -7.700 6.898 1.00 0.00 O ATOM 475 CB ARG A 59 3.313 -5.822 8.630 1.00 0.00 C ATOM 476 CG ARG A 59 3.932 -7.226 8.680 1.00 0.00 C ATOM 477 CD ARG A 59 5.389 -7.192 9.104 1.00 0.00 C ATOM 478 NE ARG A 59 5.834 -8.570 9.341 1.00 0.00 N ATOM 479 CZ ARG A 59 7.023 -9.115 9.084 1.00 0.00 C ATOM 480 NH1 ARG A 59 8.076 -8.402 8.703 1.00 0.00 N ATOM 481 NH2 ARG A 59 7.131 -10.425 9.200 1.00 0.00 N ATOM 0 H ARG A 59 1.765 -7.380 9.772 1.00 0.00 H new ATOM 0 HA ARG A 59 1.433 -4.837 8.403 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.792 -5.244 7.840 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.513 -5.305 9.569 1.00 0.00 H new ATOM 0 HG2 ARG A 59 3.367 -7.847 9.375 1.00 0.00 H new ATOM 0 HG3 ARG A 59 3.851 -7.693 7.698 1.00 0.00 H new ATOM 0 HD2 ARG A 59 5.998 -6.724 8.331 1.00 0.00 H new ATOM 0 HD3 ARG A 59 5.507 -6.594 10.008 1.00 0.00 H new ATOM 0 HE ARG A 59 5.142 -9.193 9.757 1.00 0.00 H new ATOM 0 HH11 ARG A 59 7.995 -7.391 8.595 1.00 0.00 H new ATOM 0 HH12 ARG A 59 8.966 -8.865 8.518 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.322 -10.981 9.477 1.00 0.00 H new ATOM 0 HH22 ARG A 59 8.024 -10.882 9.012 1.00 0.00 H new ATOM 495 N LEU A 60 1.230 -5.648 6.031 1.00 0.00 N ATOM 496 CA LEU A 60 0.965 -6.090 4.682 1.00 0.00 C ATOM 497 C LEU A 60 1.326 -5.001 3.680 1.00 0.00 C ATOM 498 O LEU A 60 1.925 -3.990 4.041 1.00 0.00 O ATOM 499 CB LEU A 60 -0.455 -6.695 4.522 1.00 0.00 C ATOM 500 CG LEU A 60 -1.750 -6.087 5.104 1.00 0.00 C ATOM 501 CD1 LEU A 60 -1.712 -5.906 6.604 1.00 0.00 C ATOM 502 CD2 LEU A 60 -2.245 -4.781 4.503 1.00 0.00 C ATOM 0 H LEU A 60 1.213 -4.634 6.138 1.00 0.00 H new ATOM 0 HA LEU A 60 1.622 -6.929 4.452 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.623 -6.784 3.449 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.395 -7.708 4.920 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.461 -6.860 4.813 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.654 -5.475 6.942 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.563 -6.873 7.084 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.892 -5.239 6.869 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.161 -4.472 5.007 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.484 -4.011 4.629 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.446 -4.922 3.441 1.00 0.00 H new ATOM 514 N ARG A 61 1.021 -5.249 2.406 1.00 0.00 N ATOM 515 CA ARG A 61 1.070 -4.295 1.312 1.00 0.00 C ATOM 516 C ARG A 61 -0.207 -4.452 0.514 1.00 0.00 C ATOM 517 O ARG A 61 -0.747 -5.558 0.418 1.00 0.00 O ATOM 518 CB ARG A 61 2.333 -4.427 0.431 1.00 0.00 C ATOM 519 CG ARG A 61 3.058 -5.776 0.478 1.00 0.00 C ATOM 520 CD ARG A 61 4.312 -5.779 -0.413 1.00 0.00 C ATOM 521 NE ARG A 61 5.530 -5.908 0.390 1.00 0.00 N ATOM 522 CZ ARG A 61 6.625 -6.619 0.141 1.00 0.00 C ATOM 523 NH1 ARG A 61 6.761 -7.305 -0.986 1.00 0.00 N ATOM 524 NH2 ARG A 61 7.600 -6.661 1.044 1.00 0.00 N ATOM 0 H ARG A 61 0.717 -6.173 2.099 1.00 0.00 H new ATOM 0 HA ARG A 61 1.141 -3.287 1.722 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.051 -4.226 -0.603 1.00 0.00 H new ATOM 0 HB3 ARG A 61 3.038 -3.650 0.726 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.341 -6.001 1.506 1.00 0.00 H new ATOM 0 HG3 ARG A 61 2.380 -6.565 0.154 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.254 -6.602 -1.125 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.351 -4.857 -0.993 1.00 0.00 H new ATOM 0 HE ARG A 61 5.539 -5.378 1.262 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.016 -7.294 -1.683 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.610 -7.844 -1.156 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.505 -6.150 1.921 1.00 0.00 H new ATOM 0 HH22 ARG A 61 8.443 -7.205 0.859 1.00 0.00 H new ATOM 538 N VAL A 62 -0.674 -3.343 -0.040 1.00 0.00 N ATOM 539 CA VAL A 62 -1.923 -3.207 -0.756 1.00 0.00 C ATOM 540 C VAL A 62 -1.610 -2.447 -2.028 1.00 0.00 C ATOM 541 O VAL A 62 -0.986 -1.393 -1.962 1.00 0.00 O ATOM 542 CB VAL A 62 -2.946 -2.448 0.107 1.00 0.00 C ATOM 543 CG1 VAL A 62 -4.250 -2.190 -0.646 1.00 0.00 C ATOM 544 CG2 VAL A 62 -3.282 -3.261 1.347 1.00 0.00 C ATOM 0 H VAL A 62 -0.157 -2.465 0.004 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.360 -4.178 -0.989 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.491 -1.494 0.372 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.943 -1.652 0.001 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.045 -1.593 -1.535 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.693 -3.141 -0.942 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.007 -2.717 1.953 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.705 -4.221 1.049 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.376 -3.429 1.929 1.00 0.00 H new ATOM 554 N GLY A 63 -2.054 -2.940 -3.176 1.00 0.00 N ATOM 555 CA GLY A 63 -2.123 -2.140 -4.380 1.00 0.00 C ATOM 556 C GLY A 63 -3.547 -1.653 -4.537 1.00 0.00 C ATOM 557 O GLY A 63 -4.478 -2.269 -4.012 1.00 0.00 O ATOM 0 H GLY A 63 -2.374 -3.901 -3.294 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.436 -1.296 -4.316 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -1.824 -2.729 -5.247 1.00 0.00 H new ATOM 561 N GLY A 64 -3.728 -0.566 -5.268 1.00 0.00 N ATOM 562 CA GLY A 64 -5.038 -0.094 -5.684 1.00 0.00 C ATOM 563 C GLY A 64 -4.913 1.212 -6.438 1.00 0.00 C ATOM 564 O GLY A 64 -3.824 1.793 -6.506 1.00 0.00 O ATOM 0 H GLY A 64 -2.960 0.021 -5.593 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -5.517 -0.842 -6.316 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -5.677 0.042 -4.811 1.00 0.00 H new ATOM 568 N MET A 65 -6.026 1.670 -7.002 1.00 0.00 N ATOM 569 CA MET A 65 -6.081 2.884 -7.790 1.00 0.00 C ATOM 570 C MET A 65 -6.607 4.005 -6.910 1.00 0.00 C ATOM 571 O MET A 65 -7.630 3.829 -6.260 1.00 0.00 O ATOM 572 CB MET A 65 -6.960 2.646 -9.019 1.00 0.00 C ATOM 573 CG MET A 65 -6.475 3.533 -10.164 1.00 0.00 C ATOM 574 SD MET A 65 -7.253 3.204 -11.757 1.00 0.00 S ATOM 575 CE MET A 65 -6.530 1.573 -12.089 1.00 0.00 C ATOM 0 H MET A 65 -6.926 1.197 -6.920 1.00 0.00 H new ATOM 0 HA MET A 65 -5.092 3.171 -8.148 1.00 0.00 H new ATOM 0 HB2 MET A 65 -6.918 1.597 -9.313 1.00 0.00 H new ATOM 0 HB3 MET A 65 -8.001 2.870 -8.785 1.00 0.00 H new ATOM 0 HG2 MET A 65 -6.652 4.575 -9.898 1.00 0.00 H new ATOM 0 HG3 MET A 65 -5.397 3.409 -10.269 1.00 0.00 H new ATOM 0 HE1 MET A 65 -6.612 1.348 -13.152 1.00 0.00 H new ATOM 0 HE2 MET A 65 -5.479 1.575 -11.798 1.00 0.00 H new ATOM 0 HE3 MET A 65 -7.064 0.815 -11.516 1.00 0.00 H new ATOM 585 N VAL A 66 -5.888 5.120 -6.792 1.00 0.00 N ATOM 586 CA VAL A 66 -6.258 6.238 -5.933 1.00 0.00 C ATOM 587 C VAL A 66 -7.624 6.745 -6.386 1.00 0.00 C ATOM 588 O VAL A 66 -7.794 7.126 -7.550 1.00 0.00 O ATOM 589 CB VAL A 66 -5.187 7.338 -6.039 1.00 0.00 C ATOM 590 CG1 VAL A 66 -5.514 8.567 -5.181 1.00 0.00 C ATOM 591 CG2 VAL A 66 -3.821 6.795 -5.613 1.00 0.00 C ATOM 0 H VAL A 66 -5.017 5.272 -7.301 1.00 0.00 H new ATOM 0 HA VAL A 66 -6.318 5.932 -4.889 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.168 7.647 -7.084 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.725 9.310 -5.294 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -6.464 8.994 -5.504 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.586 8.271 -4.134 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.074 7.585 -5.694 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.873 6.449 -4.581 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.542 5.964 -6.261 1.00 0.00 H new ATOM 601 N MET A 67 -8.603 6.731 -5.485 1.00 0.00 N ATOM 602 CA MET A 67 -9.888 7.357 -5.703 1.00 0.00 C ATOM 603 C MET A 67 -9.658 8.863 -5.836 1.00 0.00 C ATOM 604 O MET A 67 -9.024 9.474 -4.967 1.00 0.00 O ATOM 605 CB MET A 67 -10.831 7.044 -4.528 1.00 0.00 C ATOM 606 CG MET A 67 -12.201 6.609 -5.037 1.00 0.00 C ATOM 607 SD MET A 67 -13.508 6.602 -3.787 1.00 0.00 S ATOM 608 CE MET A 67 -13.383 4.917 -3.133 1.00 0.00 C ATOM 0 H MET A 67 -8.517 6.278 -4.575 1.00 0.00 H new ATOM 0 HA MET A 67 -10.356 6.975 -6.610 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.400 6.256 -3.910 1.00 0.00 H new ATOM 0 HB3 MET A 67 -10.936 7.925 -3.895 1.00 0.00 H new ATOM 0 HG2 MET A 67 -12.498 7.272 -5.849 1.00 0.00 H new ATOM 0 HG3 MET A 67 -12.115 5.607 -5.458 1.00 0.00 H new ATOM 0 HE1 MET A 67 -13.807 4.884 -2.129 1.00 0.00 H new ATOM 0 HE2 MET A 67 -13.932 4.234 -3.781 1.00 0.00 H new ATOM 0 HE3 MET A 67 -12.335 4.618 -3.095 1.00 0.00 H new ATOM 618 N PRO A 68 -10.152 9.474 -6.920 1.00 0.00 N ATOM 619 CA PRO A 68 -10.131 10.912 -7.073 1.00 0.00 C ATOM 620 C PRO A 68 -11.026 11.524 -5.996 1.00 0.00 C ATOM 621 O PRO A 68 -11.956 10.878 -5.497 1.00 0.00 O ATOM 622 CB PRO A 68 -10.609 11.183 -8.504 1.00 0.00 C ATOM 623 CG PRO A 68 -11.451 9.954 -8.851 1.00 0.00 C ATOM 624 CD PRO A 68 -10.908 8.845 -7.984 1.00 0.00 C ATOM 0 HA PRO A 68 -9.147 11.362 -6.940 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.197 12.099 -8.562 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -9.770 11.299 -9.190 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -12.507 10.131 -8.649 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -11.366 9.704 -9.909 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -11.719 8.241 -7.577 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -10.273 8.176 -8.565 1.00 0.00 H new ATOM 632 N GLY A 69 -10.748 12.771 -5.629 1.00 0.00 N ATOM 633 CA GLY A 69 -11.458 13.467 -4.570 1.00 0.00 C ATOM 634 C GLY A 69 -11.452 12.697 -3.247 1.00 0.00 C ATOM 635 O GLY A 69 -12.498 12.617 -2.601 1.00 0.00 O ATOM 0 H GLY A 69 -10.015 13.330 -6.065 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -11.004 14.446 -4.417 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -12.489 13.638 -4.881 1.00 0.00 H new ATOM 639 N SER A 70 -10.310 12.141 -2.828 1.00 0.00 N ATOM 640 CA SER A 70 -10.120 11.580 -1.490 1.00 0.00 C ATOM 641 C SER A 70 -8.816 12.029 -0.827 1.00 0.00 C ATOM 642 O SER A 70 -8.825 12.250 0.381 1.00 0.00 O ATOM 643 CB SER A 70 -10.169 10.053 -1.538 1.00 0.00 C ATOM 644 OG SER A 70 -11.370 9.624 -2.138 1.00 0.00 O ATOM 0 H SER A 70 -9.482 12.068 -3.419 1.00 0.00 H new ATOM 0 HA SER A 70 -10.939 11.962 -0.882 1.00 0.00 H new ATOM 0 HB2 SER A 70 -9.317 9.672 -2.100 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.093 9.647 -0.529 1.00 0.00 H new ATOM 0 HG SER A 70 -11.629 8.755 -1.766 1.00 0.00 H new ATOM 650 N VAL A 71 -7.705 12.149 -1.567 1.00 0.00 N ATOM 651 CA VAL A 71 -6.380 12.412 -1.016 1.00 0.00 C ATOM 652 C VAL A 71 -6.299 13.793 -0.338 1.00 0.00 C ATOM 653 O VAL A 71 -6.012 14.812 -0.965 1.00 0.00 O ATOM 654 CB VAL A 71 -5.270 12.068 -2.040 1.00 0.00 C ATOM 655 CG1 VAL A 71 -5.527 12.532 -3.471 1.00 0.00 C ATOM 656 CG2 VAL A 71 -3.882 12.497 -1.558 1.00 0.00 C ATOM 0 H VAL A 71 -7.708 12.063 -2.583 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.188 11.729 -0.188 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.299 10.980 -2.092 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.689 12.240 -4.104 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.442 12.071 -3.844 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.634 13.617 -3.488 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.138 12.234 -2.310 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.870 13.575 -1.397 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -3.648 11.988 -0.623 1.00 0.00 H new ATOM 666 N GLN A 72 -6.550 13.801 0.971 1.00 0.00 N ATOM 667 CA GLN A 72 -6.394 14.900 1.899 1.00 0.00 C ATOM 668 C GLN A 72 -4.923 14.956 2.310 1.00 0.00 C ATOM 669 O GLN A 72 -4.511 14.337 3.291 1.00 0.00 O ATOM 670 CB GLN A 72 -7.343 14.723 3.103 1.00 0.00 C ATOM 671 CG GLN A 72 -7.341 13.364 3.787 1.00 0.00 C ATOM 672 CD GLN A 72 -7.722 13.475 5.253 1.00 0.00 C ATOM 673 OE1 GLN A 72 -7.002 14.053 6.069 1.00 0.00 O ATOM 674 NE2 GLN A 72 -8.856 12.915 5.619 1.00 0.00 N ATOM 0 H GLN A 72 -6.896 12.964 1.440 1.00 0.00 H new ATOM 0 HA GLN A 72 -6.666 15.849 1.437 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -7.091 15.478 3.848 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.359 14.933 2.768 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -8.039 12.699 3.278 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -6.352 12.914 3.701 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -9.437 12.441 4.928 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -9.153 12.955 6.594 1.00 0.00 H new ATOM 683 N ARG A 73 -4.085 15.645 1.542 1.00 0.00 N ATOM 684 CA ARG A 73 -2.734 15.948 2.018 1.00 0.00 C ATOM 685 C ARG A 73 -2.865 17.083 3.012 1.00 0.00 C ATOM 686 O ARG A 73 -3.639 18.003 2.741 1.00 0.00 O ATOM 687 CB ARG A 73 -1.765 16.344 0.897 1.00 0.00 C ATOM 688 CG ARG A 73 -2.189 15.961 -0.532 1.00 0.00 C ATOM 689 CD ARG A 73 -1.230 16.593 -1.533 1.00 0.00 C ATOM 690 NE ARG A 73 -1.304 18.065 -1.473 1.00 0.00 N ATOM 691 CZ ARG A 73 -0.265 18.904 -1.433 1.00 0.00 C ATOM 692 NH1 ARG A 73 0.974 18.450 -1.580 1.00 0.00 N ATOM 693 NH2 ARG A 73 -0.476 20.201 -1.233 1.00 0.00 N ATOM 0 H ARG A 73 -4.306 15.998 0.611 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.310 15.049 2.466 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -1.621 17.424 0.934 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -0.798 15.886 1.102 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -2.187 14.877 -0.645 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -3.207 16.300 -0.724 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -0.211 16.267 -1.323 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -1.472 16.253 -2.540 1.00 0.00 H new ATOM 0 HE ARG A 73 -2.235 18.481 -1.461 1.00 0.00 H new ATOM 0 HH11 ARG A 73 1.138 17.454 -1.725 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.762 19.097 -1.548 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -1.427 20.550 -1.111 1.00 0.00 H new ATOM 0 HH22 ARG A 73 0.313 20.847 -1.201 1.00 0.00 H new ATOM 707 N ASP A 74 -2.087 17.077 4.087 1.00 0.00 N ATOM 708 CA ASP A 74 -1.991 18.241 4.951 1.00 0.00 C ATOM 709 C ASP A 74 -1.098 19.220 4.189 1.00 0.00 C ATOM 710 O ASP A 74 0.086 18.925 4.042 1.00 0.00 O ATOM 711 CB ASP A 74 -1.390 17.863 6.318 1.00 0.00 C ATOM 712 CG ASP A 74 -1.912 18.780 7.420 1.00 0.00 C ATOM 713 OD1 ASP A 74 -1.392 19.910 7.567 1.00 0.00 O ATOM 714 OD2 ASP A 74 -2.821 18.342 8.169 1.00 0.00 O ATOM 0 H ASP A 74 -1.517 16.283 4.378 1.00 0.00 H new ATOM 0 HA ASP A 74 -2.965 18.677 5.172 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.638 16.828 6.554 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.303 17.928 6.271 1.00 0.00 H new ATOM 719 N PRO A 75 -1.581 20.346 3.629 1.00 0.00 N ATOM 720 CA PRO A 75 -0.704 21.247 2.889 1.00 0.00 C ATOM 721 C PRO A 75 0.294 21.946 3.826 1.00 0.00 C ATOM 722 O PRO A 75 1.182 22.654 3.346 1.00 0.00 O ATOM 723 CB PRO A 75 -1.641 22.229 2.184 1.00 0.00 C ATOM 724 CG PRO A 75 -2.831 22.317 3.136 1.00 0.00 C ATOM 725 CD PRO A 75 -2.915 20.916 3.741 1.00 0.00 C ATOM 0 HA PRO A 75 -0.082 20.719 2.166 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.170 23.201 2.037 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.938 21.867 1.200 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -2.675 23.076 3.903 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -3.747 22.581 2.608 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.234 20.960 4.782 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.645 20.306 3.210 1.00 0.00 H new ATOM 733 N ASN A 76 0.167 21.742 5.142 1.00 0.00 N ATOM 734 CA ASN A 76 0.983 22.296 6.208 1.00 0.00 C ATOM 735 C ASN A 76 1.655 21.173 7.009 1.00 0.00 C ATOM 736 O ASN A 76 2.095 21.431 8.133 1.00 0.00 O ATOM 737 CB ASN A 76 0.099 23.158 7.127 1.00 0.00 C ATOM 738 CG ASN A 76 -0.543 24.323 6.399 1.00 0.00 C ATOM 739 OD1 ASN A 76 0.129 25.271 6.006 1.00 0.00 O ATOM 740 ND2 ASN A 76 -1.853 24.300 6.212 1.00 0.00 N ATOM 0 H ASN A 76 -0.568 21.137 5.509 1.00 0.00 H new ATOM 0 HA ASN A 76 1.767 22.917 5.776 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -0.681 22.534 7.564 1.00 0.00 H new ATOM 0 HB3 ASN A 76 0.702 23.538 7.952 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -2.314 25.076 5.737 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -2.402 23.506 6.543 1.00 0.00 H new ATOM 747 N SER A 77 1.674 19.925 6.527 1.00 0.00 N ATOM 748 CA SER A 77 2.354 18.818 7.184 1.00 0.00 C ATOM 749 C SER A 77 2.695 17.759 6.132 1.00 0.00 C ATOM 750 O SER A 77 2.789 18.060 4.942 1.00 0.00 O ATOM 751 CB SER A 77 1.496 18.282 8.345 1.00 0.00 C ATOM 752 OG SER A 77 2.250 18.235 9.540 1.00 0.00 O ATOM 0 H SER A 77 1.210 19.659 5.659 1.00 0.00 H new ATOM 0 HA SER A 77 3.292 19.145 7.634 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.623 18.920 8.484 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.127 17.286 8.102 1.00 0.00 H new ATOM 0 HG SER A 77 1.689 17.894 10.268 1.00 0.00 H new ATOM 758 N LEU A 78 2.939 16.524 6.569 1.00 0.00 N ATOM 759 CA LEU A 78 3.246 15.402 5.688 1.00 0.00 C ATOM 760 C LEU A 78 2.260 14.264 5.896 1.00 0.00 C ATOM 761 O LEU A 78 2.268 13.312 5.123 1.00 0.00 O ATOM 762 CB LEU A 78 4.690 14.902 5.873 1.00 0.00 C ATOM 763 CG LEU A 78 5.765 15.907 5.413 1.00 0.00 C ATOM 764 CD1 LEU A 78 6.281 16.776 6.567 1.00 0.00 C ATOM 765 CD2 LEU A 78 6.958 15.169 4.797 1.00 0.00 C ATOM 0 H LEU A 78 2.928 16.273 7.558 1.00 0.00 H new ATOM 0 HA LEU A 78 3.152 15.764 4.664 1.00 0.00 H new ATOM 0 HB2 LEU A 78 4.851 14.670 6.926 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.816 13.972 5.318 1.00 0.00 H new ATOM 0 HG LEU A 78 5.289 16.553 4.675 1.00 0.00 H new ATOM 0 HD11 LEU A 78 7.036 17.467 6.193 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.453 17.340 6.996 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.721 16.139 7.334 1.00 0.00 H new ATOM 0 HD21 LEU A 78 7.708 15.893 4.477 1.00 0.00 H new ATOM 0 HD22 LEU A 78 7.393 14.499 5.538 1.00 0.00 H new ATOM 0 HD23 LEU A 78 6.623 14.590 3.937 1.00 0.00 H new ATOM 777 N LYS A 79 1.388 14.339 6.905 1.00 0.00 N ATOM 778 CA LYS A 79 0.225 13.479 6.972 1.00 0.00 C ATOM 779 C LYS A 79 -0.547 13.682 5.681 1.00 0.00 C ATOM 780 O LYS A 79 -0.767 14.816 5.253 1.00 0.00 O ATOM 781 CB LYS A 79 -0.613 13.795 8.217 1.00 0.00 C ATOM 782 CG LYS A 79 -0.584 12.631 9.218 1.00 0.00 C ATOM 783 CD LYS A 79 -1.566 11.508 8.846 1.00 0.00 C ATOM 784 CE LYS A 79 -2.970 11.801 9.400 1.00 0.00 C ATOM 785 NZ LYS A 79 -3.934 10.718 9.113 1.00 0.00 N ATOM 0 H LYS A 79 1.474 14.992 7.684 1.00 0.00 H new ATOM 0 HA LYS A 79 0.508 12.431 7.067 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -0.233 14.698 8.695 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -1.643 13.999 7.923 1.00 0.00 H new ATOM 0 HG2 LYS A 79 0.426 12.224 9.267 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -0.826 13.006 10.213 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -1.613 11.405 7.762 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -1.205 10.558 9.241 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -2.907 11.950 10.478 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.338 12.733 8.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -4.686 10.724 9.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.352 10.866 8.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -3.443 9.802 9.134 1.00 0.00 H new ATOM 799 N VAL A 80 -0.912 12.590 5.038 1.00 0.00 N ATOM 800 CA VAL A 80 -1.742 12.610 3.864 1.00 0.00 C ATOM 801 C VAL A 80 -2.557 11.346 3.928 1.00 0.00 C ATOM 802 O VAL A 80 -2.021 10.258 4.124 1.00 0.00 O ATOM 803 CB VAL A 80 -0.917 12.743 2.576 1.00 0.00 C ATOM 804 CG1 VAL A 80 0.258 11.772 2.474 1.00 0.00 C ATOM 805 CG2 VAL A 80 -1.833 12.538 1.363 1.00 0.00 C ATOM 0 H VAL A 80 -0.632 11.652 5.326 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.394 13.483 3.841 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.489 13.745 2.598 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.785 11.936 1.534 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.941 11.939 3.307 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.113 10.748 2.509 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.250 12.632 0.447 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.280 11.545 1.408 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.621 13.291 1.371 1.00 0.00 H new ATOM 815 N THR A 81 -3.853 11.492 3.760 1.00 0.00 N ATOM 816 CA THR A 81 -4.776 10.409 3.965 1.00 0.00 C ATOM 817 C THR A 81 -5.593 10.318 2.673 1.00 0.00 C ATOM 818 O THR A 81 -5.911 11.338 2.069 1.00 0.00 O ATOM 819 CB THR A 81 -5.499 10.734 5.278 1.00 0.00 C ATOM 820 OG1 THR A 81 -4.582 10.835 6.353 1.00 0.00 O ATOM 821 CG2 THR A 81 -6.594 9.756 5.606 1.00 0.00 C ATOM 0 H THR A 81 -4.292 12.368 3.477 1.00 0.00 H new ATOM 0 HA THR A 81 -4.374 9.406 4.109 1.00 0.00 H new ATOM 0 HB THR A 81 -5.978 11.702 5.130 1.00 0.00 H new ATOM 0 HG1 THR A 81 -4.527 11.768 6.649 1.00 0.00 H new ATOM 0 HG21 THR A 81 -7.067 10.041 6.546 1.00 0.00 H new ATOM 0 HG22 THR A 81 -7.338 9.762 4.809 1.00 0.00 H new ATOM 0 HG23 THR A 81 -6.172 8.755 5.701 1.00 0.00 H new ATOM 829 N PHE A 82 -5.803 9.127 2.129 1.00 0.00 N ATOM 830 CA PHE A 82 -6.458 8.927 0.839 1.00 0.00 C ATOM 831 C PHE A 82 -7.204 7.605 0.825 1.00 0.00 C ATOM 832 O PHE A 82 -7.128 6.814 1.765 1.00 0.00 O ATOM 833 CB PHE A 82 -5.418 9.000 -0.296 1.00 0.00 C ATOM 834 CG PHE A 82 -4.322 7.949 -0.321 1.00 0.00 C ATOM 835 CD1 PHE A 82 -3.193 8.121 0.503 1.00 0.00 C ATOM 836 CD2 PHE A 82 -4.373 6.864 -1.224 1.00 0.00 C ATOM 837 CE1 PHE A 82 -2.131 7.204 0.447 1.00 0.00 C ATOM 838 CE2 PHE A 82 -3.310 5.944 -1.270 1.00 0.00 C ATOM 839 CZ PHE A 82 -2.186 6.117 -0.443 1.00 0.00 C ATOM 0 H PHE A 82 -5.519 8.256 2.578 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.188 9.720 0.680 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -5.953 8.949 -1.244 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.942 9.979 -0.251 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.144 8.961 1.180 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.225 6.741 -1.877 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -1.271 7.334 1.088 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.357 5.101 -1.943 1.00 0.00 H new ATOM 0 HZ PHE A 82 -1.366 5.416 -0.491 1.00 0.00 H new ATOM 849 N THR A 83 -7.899 7.359 -0.279 1.00 0.00 N ATOM 850 CA THR A 83 -8.647 6.132 -0.496 1.00 0.00 C ATOM 851 C THR A 83 -8.114 5.519 -1.786 1.00 0.00 C ATOM 852 O THR A 83 -7.737 6.245 -2.715 1.00 0.00 O ATOM 853 CB THR A 83 -10.151 6.450 -0.549 1.00 0.00 C ATOM 854 OG1 THR A 83 -10.507 7.276 0.544 1.00 0.00 O ATOM 855 CG2 THR A 83 -11.015 5.190 -0.499 1.00 0.00 C ATOM 0 H THR A 83 -7.958 8.016 -1.057 1.00 0.00 H new ATOM 0 HA THR A 83 -8.521 5.413 0.314 1.00 0.00 H new ATOM 0 HB THR A 83 -10.333 6.956 -1.497 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.465 7.477 0.504 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.068 5.469 -0.539 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.776 4.551 -1.349 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.818 4.650 0.427 1.00 0.00 H new ATOM 863 N ILE A 84 -8.075 4.194 -1.856 1.00 0.00 N ATOM 864 CA ILE A 84 -7.673 3.437 -3.027 1.00 0.00 C ATOM 865 C ILE A 84 -8.766 2.393 -3.237 1.00 0.00 C ATOM 866 O ILE A 84 -9.347 1.891 -2.272 1.00 0.00 O ATOM 867 CB ILE A 84 -6.254 2.827 -2.864 1.00 0.00 C ATOM 868 CG1 ILE A 84 -5.749 2.756 -1.418 1.00 0.00 C ATOM 869 CG2 ILE A 84 -5.213 3.600 -3.687 1.00 0.00 C ATOM 870 CD1 ILE A 84 -4.454 1.939 -1.270 1.00 0.00 C ATOM 0 H ILE A 84 -8.332 3.599 -1.068 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.582 4.070 -3.910 1.00 0.00 H new ATOM 0 HB ILE A 84 -6.366 1.805 -3.227 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.577 3.767 -1.049 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.523 2.315 -0.790 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -4.231 3.147 -3.550 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.485 3.565 -4.742 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.183 4.637 -3.354 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.149 1.927 -0.224 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.627 0.918 -1.609 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -3.667 2.393 -1.872 1.00 0.00 H new ATOM 882 N TYR A 85 -9.097 2.122 -4.495 1.00 0.00 N ATOM 883 CA TYR A 85 -10.209 1.277 -4.892 1.00 0.00 C ATOM 884 C TYR A 85 -9.779 0.378 -6.044 1.00 0.00 C ATOM 885 O TYR A 85 -8.691 0.533 -6.608 1.00 0.00 O ATOM 886 CB TYR A 85 -11.424 2.144 -5.279 1.00 0.00 C ATOM 887 CG TYR A 85 -11.283 2.803 -6.636 1.00 0.00 C ATOM 888 CD1 TYR A 85 -10.504 3.961 -6.772 1.00 0.00 C ATOM 889 CD2 TYR A 85 -11.796 2.170 -7.782 1.00 0.00 C ATOM 890 CE1 TYR A 85 -10.200 4.472 -8.042 1.00 0.00 C ATOM 891 CE2 TYR A 85 -11.480 2.656 -9.059 1.00 0.00 C ATOM 892 CZ TYR A 85 -10.678 3.811 -9.197 1.00 0.00 C ATOM 893 OH TYR A 85 -10.361 4.285 -10.431 1.00 0.00 O ATOM 0 H TYR A 85 -8.580 2.498 -5.289 1.00 0.00 H new ATOM 0 HA TYR A 85 -10.506 0.645 -4.055 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.320 1.523 -5.276 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.567 2.915 -4.522 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -10.135 4.464 -5.890 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.436 1.306 -7.678 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -9.603 5.367 -8.138 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.850 2.147 -9.937 1.00 0.00 H new ATOM 0 HH TYR A 85 -9.482 3.943 -10.697 1.00 0.00 H new ATOM 903 N ASP A 86 -10.661 -0.554 -6.381 1.00 0.00 N ATOM 904 CA ASP A 86 -10.602 -1.374 -7.586 1.00 0.00 C ATOM 905 C ASP A 86 -12.045 -1.740 -7.963 1.00 0.00 C ATOM 906 O ASP A 86 -12.994 -1.187 -7.397 1.00 0.00 O ATOM 907 CB ASP A 86 -9.704 -2.603 -7.348 1.00 0.00 C ATOM 908 CG ASP A 86 -8.978 -3.062 -8.610 1.00 0.00 C ATOM 909 OD1 ASP A 86 -9.617 -3.330 -9.652 1.00 0.00 O ATOM 910 OD2 ASP A 86 -7.735 -3.175 -8.591 1.00 0.00 O ATOM 0 H ASP A 86 -11.471 -0.769 -5.799 1.00 0.00 H new ATOM 0 HA ASP A 86 -10.151 -0.836 -8.420 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.969 -2.366 -6.578 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -10.313 -3.423 -6.967 1.00 0.00 H new ATOM 915 N ALA A 87 -12.240 -2.664 -8.899 1.00 0.00 N ATOM 916 CA ALA A 87 -13.541 -3.097 -9.410 1.00 0.00 C ATOM 917 C ALA A 87 -14.395 -3.881 -8.395 1.00 0.00 C ATOM 918 O ALA A 87 -15.404 -4.481 -8.778 1.00 0.00 O ATOM 919 CB ALA A 87 -13.297 -3.951 -10.657 1.00 0.00 C ATOM 0 H ALA A 87 -11.463 -3.154 -9.343 1.00 0.00 H new ATOM 0 HA ALA A 87 -14.117 -2.199 -9.635 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -14.252 -4.288 -11.060 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -12.776 -3.358 -11.408 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.689 -4.816 -10.392 1.00 0.00 H new ATOM 925 N GLU A 88 -14.011 -3.934 -7.119 1.00 0.00 N ATOM 926 CA GLU A 88 -14.674 -4.711 -6.077 1.00 0.00 C ATOM 927 C GLU A 88 -14.945 -3.819 -4.872 1.00 0.00 C ATOM 928 O GLU A 88 -16.104 -3.569 -4.552 1.00 0.00 O ATOM 929 CB GLU A 88 -13.914 -5.992 -5.689 1.00 0.00 C ATOM 930 CG GLU A 88 -12.597 -6.264 -6.417 1.00 0.00 C ATOM 931 CD GLU A 88 -12.719 -6.704 -7.880 1.00 0.00 C ATOM 932 OE1 GLU A 88 -13.741 -7.307 -8.288 1.00 0.00 O ATOM 933 OE2 GLU A 88 -11.758 -6.463 -8.644 1.00 0.00 O ATOM 0 H GLU A 88 -13.202 -3.419 -6.773 1.00 0.00 H new ATOM 0 HA GLU A 88 -15.623 -5.063 -6.482 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -13.708 -5.953 -4.619 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -14.575 -6.842 -5.856 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -11.990 -5.359 -6.379 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -12.054 -7.035 -5.870 1.00 0.00 H new ATOM 940 N GLY A 89 -13.899 -3.368 -4.183 1.00 0.00 N ATOM 941 CA GLY A 89 -14.018 -2.606 -2.953 1.00 0.00 C ATOM 942 C GLY A 89 -13.023 -1.458 -2.930 1.00 0.00 C ATOM 943 O GLY A 89 -12.308 -1.207 -3.907 1.00 0.00 O ATOM 0 H GLY A 89 -12.934 -3.527 -4.472 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.032 -2.216 -2.858 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -13.846 -3.259 -2.097 1.00 0.00 H new ATOM 947 N SER A 90 -12.988 -0.756 -1.804 1.00 0.00 N ATOM 948 CA SER A 90 -12.066 0.335 -1.549 1.00 0.00 C ATOM 949 C SER A 90 -11.634 0.322 -0.081 1.00 0.00 C ATOM 950 O SER A 90 -12.309 -0.276 0.771 1.00 0.00 O ATOM 951 CB SER A 90 -12.697 1.648 -2.020 1.00 0.00 C ATOM 952 OG SER A 90 -13.977 1.916 -1.472 1.00 0.00 O ATOM 0 H SER A 90 -13.619 -0.938 -1.024 1.00 0.00 H new ATOM 0 HA SER A 90 -11.146 0.218 -2.121 1.00 0.00 H new ATOM 0 HB2 SER A 90 -12.028 2.470 -1.765 1.00 0.00 H new ATOM 0 HB3 SER A 90 -12.778 1.628 -3.107 1.00 0.00 H new ATOM 0 HG SER A 90 -14.443 2.571 -2.033 1.00 0.00 H new ATOM 958 N VAL A 91 -10.487 0.943 0.200 1.00 0.00 N ATOM 959 CA VAL A 91 -9.814 0.893 1.489 1.00 0.00 C ATOM 960 C VAL A 91 -9.220 2.259 1.812 1.00 0.00 C ATOM 961 O VAL A 91 -8.831 3.008 0.909 1.00 0.00 O ATOM 962 CB VAL A 91 -8.744 -0.221 1.492 1.00 0.00 C ATOM 963 CG1 VAL A 91 -9.394 -1.590 1.267 1.00 0.00 C ATOM 964 CG2 VAL A 91 -7.625 -0.041 0.456 1.00 0.00 C ATOM 0 H VAL A 91 -9.990 1.510 -0.487 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.534 0.650 2.270 1.00 0.00 H new ATOM 0 HB VAL A 91 -8.280 -0.155 2.476 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.625 -2.363 1.272 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -10.112 -1.787 2.063 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -9.908 -1.595 0.306 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -6.921 -0.870 0.533 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -8.056 -0.022 -0.545 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -7.102 0.897 0.644 1.00 0.00 H new ATOM 974 N ASP A 92 -9.164 2.560 3.107 1.00 0.00 N ATOM 975 CA ASP A 92 -8.651 3.810 3.653 1.00 0.00 C ATOM 976 C ASP A 92 -7.141 3.675 3.791 1.00 0.00 C ATOM 977 O ASP A 92 -6.642 2.582 4.090 1.00 0.00 O ATOM 978 CB ASP A 92 -9.279 4.074 5.035 1.00 0.00 C ATOM 979 CG ASP A 92 -10.793 4.252 4.929 1.00 0.00 C ATOM 980 OD1 ASP A 92 -11.249 5.142 4.177 1.00 0.00 O ATOM 981 OD2 ASP A 92 -11.524 3.454 5.564 1.00 0.00 O ATOM 0 H ASP A 92 -9.487 1.916 3.829 1.00 0.00 H new ATOM 0 HA ASP A 92 -8.900 4.642 2.995 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -9.054 3.244 5.704 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -8.835 4.967 5.475 1.00 0.00 H new ATOM 986 N VAL A 93 -6.406 4.774 3.632 1.00 0.00 N ATOM 987 CA VAL A 93 -4.970 4.829 3.835 1.00 0.00 C ATOM 988 C VAL A 93 -4.628 6.117 4.575 1.00 0.00 C ATOM 989 O VAL A 93 -4.838 7.199 4.029 1.00 0.00 O ATOM 990 CB VAL A 93 -4.215 4.767 2.496 1.00 0.00 C ATOM 991 CG1 VAL A 93 -2.710 4.647 2.775 1.00 0.00 C ATOM 992 CG2 VAL A 93 -4.627 3.592 1.602 1.00 0.00 C ATOM 0 H VAL A 93 -6.807 5.669 3.352 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.661 3.966 4.425 1.00 0.00 H new ATOM 0 HB VAL A 93 -4.466 5.683 1.962 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -2.167 4.602 1.831 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -2.375 5.514 3.345 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -2.517 3.740 3.347 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -4.050 3.618 0.678 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.435 2.654 2.123 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -5.689 3.667 1.369 1.00 0.00 H new ATOM 1002 N SER A 94 -4.043 6.011 5.765 1.00 0.00 N ATOM 1003 CA SER A 94 -3.289 7.093 6.377 1.00 0.00 C ATOM 1004 C SER A 94 -1.848 6.883 5.946 1.00 0.00 C ATOM 1005 O SER A 94 -1.316 5.782 6.074 1.00 0.00 O ATOM 1006 CB SER A 94 -3.422 7.032 7.900 1.00 0.00 C ATOM 1007 OG SER A 94 -2.863 8.156 8.558 1.00 0.00 O ATOM 0 H SER A 94 -4.081 5.165 6.333 1.00 0.00 H new ATOM 0 HA SER A 94 -3.654 8.073 6.068 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.477 6.954 8.163 1.00 0.00 H new ATOM 0 HB3 SER A 94 -2.935 6.127 8.264 1.00 0.00 H new ATOM 0 HG SER A 94 -2.835 7.990 9.523 1.00 0.00 H new ATOM 1013 N TYR A 95 -1.216 7.924 5.431 1.00 0.00 N ATOM 1014 CA TYR A 95 0.219 8.003 5.234 1.00 0.00 C ATOM 1015 C TYR A 95 0.745 9.242 5.952 1.00 0.00 C ATOM 1016 O TYR A 95 0.002 10.167 6.284 1.00 0.00 O ATOM 1017 CB TYR A 95 0.542 8.008 3.730 1.00 0.00 C ATOM 1018 CG TYR A 95 2.017 8.138 3.371 1.00 0.00 C ATOM 1019 CD1 TYR A 95 2.981 7.345 4.017 1.00 0.00 C ATOM 1020 CD2 TYR A 95 2.433 9.082 2.413 1.00 0.00 C ATOM 1021 CE1 TYR A 95 4.345 7.518 3.716 1.00 0.00 C ATOM 1022 CE2 TYR A 95 3.778 9.198 2.025 1.00 0.00 C ATOM 1023 CZ TYR A 95 4.741 8.422 2.702 1.00 0.00 C ATOM 1024 OH TYR A 95 6.053 8.575 2.388 1.00 0.00 O ATOM 0 H TYR A 95 -1.706 8.766 5.129 1.00 0.00 H new ATOM 0 HA TYR A 95 0.717 7.131 5.659 1.00 0.00 H new ATOM 0 HB2 TYR A 95 0.160 7.086 3.292 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -0.000 8.830 3.263 1.00 0.00 H new ATOM 0 HD1 TYR A 95 2.676 6.605 4.742 1.00 0.00 H new ATOM 0 HD2 TYR A 95 1.698 9.734 1.964 1.00 0.00 H new ATOM 0 HE1 TYR A 95 5.092 6.959 4.261 1.00 0.00 H new ATOM 0 HE2 TYR A 95 4.068 9.866 1.227 1.00 0.00 H new ATOM 0 HH TYR A 95 6.334 7.849 1.792 1.00 0.00 H new ATOM 1034 N GLU A 96 2.055 9.285 6.155 1.00 0.00 N ATOM 1035 CA GLU A 96 2.764 10.439 6.651 1.00 0.00 C ATOM 1036 C GLU A 96 4.114 10.433 5.943 1.00 0.00 C ATOM 1037 O GLU A 96 5.011 9.664 6.300 1.00 0.00 O ATOM 1038 CB GLU A 96 2.848 10.431 8.185 1.00 0.00 C ATOM 1039 CG GLU A 96 3.593 11.678 8.683 1.00 0.00 C ATOM 1040 CD GLU A 96 3.594 11.803 10.206 1.00 0.00 C ATOM 1041 OE1 GLU A 96 3.874 10.804 10.911 1.00 0.00 O ATOM 1042 OE2 GLU A 96 3.395 12.932 10.713 1.00 0.00 O ATOM 0 H GLU A 96 2.665 8.489 5.971 1.00 0.00 H new ATOM 0 HA GLU A 96 2.246 11.373 6.432 1.00 0.00 H new ATOM 0 HB2 GLU A 96 1.845 10.404 8.611 1.00 0.00 H new ATOM 0 HB3 GLU A 96 3.363 9.532 8.523 1.00 0.00 H new ATOM 0 HG2 GLU A 96 4.622 11.647 8.326 1.00 0.00 H new ATOM 0 HG3 GLU A 96 3.133 12.567 8.251 1.00 0.00 H new ATOM 1049 N GLY A 97 4.239 11.254 4.908 1.00 0.00 N ATOM 1050 CA GLY A 97 5.458 11.460 4.148 1.00 0.00 C ATOM 1051 C GLY A 97 5.140 12.316 2.929 1.00 0.00 C ATOM 1052 O GLY A 97 4.007 12.766 2.756 1.00 0.00 O ATOM 0 H GLY A 97 3.460 11.816 4.564 1.00 0.00 H new ATOM 0 HA2 GLY A 97 6.210 11.950 4.767 1.00 0.00 H new ATOM 0 HA3 GLY A 97 5.875 10.502 3.838 1.00 0.00 H new ATOM 1056 N ILE A 98 6.146 12.598 2.104 1.00 0.00 N ATOM 1057 CA ILE A 98 6.066 13.739 1.189 1.00 0.00 C ATOM 1058 C ILE A 98 5.074 13.489 0.054 1.00 0.00 C ATOM 1059 O ILE A 98 4.509 14.430 -0.503 1.00 0.00 O ATOM 1060 CB ILE A 98 7.478 14.140 0.693 1.00 0.00 C ATOM 1061 CG1 ILE A 98 7.536 15.522 0.008 1.00 0.00 C ATOM 1062 CG2 ILE A 98 8.067 13.091 -0.273 1.00 0.00 C ATOM 1063 CD1 ILE A 98 7.105 16.685 0.906 1.00 0.00 C ATOM 0 H ILE A 98 7.013 12.064 2.048 1.00 0.00 H new ATOM 0 HA ILE A 98 5.670 14.594 1.737 1.00 0.00 H new ATOM 0 HB ILE A 98 8.075 14.193 1.603 1.00 0.00 H new ATOM 0 HG12 ILE A 98 8.554 15.702 -0.337 1.00 0.00 H new ATOM 0 HG13 ILE A 98 6.898 15.504 -0.876 1.00 0.00 H new ATOM 0 HG21 ILE A 98 9.057 13.410 -0.597 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.144 12.130 0.236 1.00 0.00 H new ATOM 0 HG23 ILE A 98 7.416 12.990 -1.141 1.00 0.00 H new ATOM 0 HD11 ILE A 98 7.175 17.620 0.349 1.00 0.00 H new ATOM 0 HD12 ILE A 98 6.076 16.532 1.231 1.00 0.00 H new ATOM 0 HD13 ILE A 98 7.757 16.733 1.778 1.00 0.00 H new ATOM 1075 N LEU A 99 4.840 12.212 -0.242 1.00 0.00 N ATOM 1076 CA LEU A 99 4.176 11.658 -1.399 1.00 0.00 C ATOM 1077 C LEU A 99 4.990 11.940 -2.680 1.00 0.00 C ATOM 1078 O LEU A 99 5.437 13.069 -2.887 1.00 0.00 O ATOM 1079 CB LEU A 99 2.716 12.115 -1.413 1.00 0.00 C ATOM 1080 CG LEU A 99 1.708 11.089 -1.952 1.00 0.00 C ATOM 1081 CD1 LEU A 99 1.725 9.732 -1.226 1.00 0.00 C ATOM 1082 CD2 LEU A 99 0.337 11.709 -1.712 1.00 0.00 C ATOM 0 H LEU A 99 5.145 11.474 0.392 1.00 0.00 H new ATOM 0 HA LEU A 99 4.135 10.570 -1.351 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.427 12.383 -0.397 1.00 0.00 H new ATOM 0 HB3 LEU A 99 2.643 13.021 -2.014 1.00 0.00 H new ATOM 0 HG LEU A 99 1.955 10.884 -2.994 1.00 0.00 H new ATOM 0 HD11 LEU A 99 0.982 9.071 -1.673 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.714 9.282 -1.319 1.00 0.00 H new ATOM 0 HD13 LEU A 99 1.491 9.880 -0.172 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.437 11.031 -2.073 1.00 0.00 H new ATOM 0 HD22 LEU A 99 0.198 11.883 -0.645 1.00 0.00 H new ATOM 0 HD23 LEU A 99 0.268 12.656 -2.246 1.00 0.00 H new ATOM 1094 N PRO A 100 5.274 10.921 -3.512 1.00 0.00 N ATOM 1095 CA PRO A 100 6.229 11.001 -4.613 1.00 0.00 C ATOM 1096 C PRO A 100 5.739 11.967 -5.680 1.00 0.00 C ATOM 1097 O PRO A 100 4.561 12.331 -5.729 1.00 0.00 O ATOM 1098 CB PRO A 100 6.355 9.596 -5.228 1.00 0.00 C ATOM 1099 CG PRO A 100 5.446 8.718 -4.400 1.00 0.00 C ATOM 1100 CD PRO A 100 4.670 9.619 -3.457 1.00 0.00 C ATOM 0 HA PRO A 100 7.189 11.358 -4.240 1.00 0.00 H new ATOM 0 HB2 PRO A 100 6.055 9.596 -6.276 1.00 0.00 H new ATOM 0 HB3 PRO A 100 7.385 9.241 -5.192 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.765 8.159 -5.042 1.00 0.00 H new ATOM 0 HG3 PRO A 100 6.028 7.987 -3.839 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.622 9.670 -3.751 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.698 9.226 -2.441 1.00 0.00 H new ATOM 1108 N ASP A 101 6.625 12.291 -6.615 1.00 0.00 N ATOM 1109 CA ASP A 101 6.288 13.125 -7.760 1.00 0.00 C ATOM 1110 C ASP A 101 5.189 12.479 -8.603 1.00 0.00 C ATOM 1111 O ASP A 101 4.330 13.185 -9.135 1.00 0.00 O ATOM 1112 CB ASP A 101 7.527 13.361 -8.626 1.00 0.00 C ATOM 1113 CG ASP A 101 8.602 14.206 -7.949 1.00 0.00 C ATOM 1114 OD1 ASP A 101 8.288 14.945 -6.984 1.00 0.00 O ATOM 1115 OD2 ASP A 101 9.767 14.153 -8.389 1.00 0.00 O ATOM 0 H ASP A 101 7.597 11.982 -6.600 1.00 0.00 H new ATOM 0 HA ASP A 101 5.922 14.080 -7.384 1.00 0.00 H new ATOM 0 HB2 ASP A 101 7.956 12.397 -8.900 1.00 0.00 H new ATOM 0 HB3 ASP A 101 7.224 13.850 -9.552 1.00 0.00 H new ATOM 1120 N LEU A 102 5.247 11.148 -8.689 1.00 0.00 N ATOM 1121 CA LEU A 102 4.466 10.258 -9.537 1.00 0.00 C ATOM 1122 C LEU A 102 3.022 10.084 -9.054 1.00 0.00 C ATOM 1123 O LEU A 102 2.148 9.899 -9.890 1.00 0.00 O ATOM 1124 CB LEU A 102 5.151 8.872 -9.533 1.00 0.00 C ATOM 1125 CG LEU A 102 6.362 8.640 -10.472 1.00 0.00 C ATOM 1126 CD1 LEU A 102 5.920 8.072 -11.827 1.00 0.00 C ATOM 1127 CD2 LEU A 102 7.280 9.851 -10.666 1.00 0.00 C ATOM 0 H LEU A 102 5.904 10.622 -8.112 1.00 0.00 H new ATOM 0 HA LEU A 102 4.425 10.699 -10.533 1.00 0.00 H new ATOM 0 HB2 LEU A 102 5.479 8.668 -8.514 1.00 0.00 H new ATOM 0 HB3 LEU A 102 4.394 8.128 -9.780 1.00 0.00 H new ATOM 0 HG LEU A 102 6.971 7.902 -9.949 1.00 0.00 H new ATOM 0 HD11 LEU A 102 6.794 7.921 -12.461 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.414 7.119 -11.674 1.00 0.00 H new ATOM 0 HD13 LEU A 102 5.238 8.772 -12.310 1.00 0.00 H new ATOM 0 HD21 LEU A 102 8.095 9.585 -11.339 1.00 0.00 H new ATOM 0 HD22 LEU A 102 6.710 10.675 -11.095 1.00 0.00 H new ATOM 0 HD23 LEU A 102 7.689 10.155 -9.703 1.00 0.00 H new ATOM 1139 N PHE A 103 2.764 10.069 -7.739 1.00 0.00 N ATOM 1140 CA PHE A 103 1.466 9.687 -7.190 1.00 0.00 C ATOM 1141 C PHE A 103 0.410 10.692 -7.656 1.00 0.00 C ATOM 1142 O PHE A 103 0.628 11.902 -7.533 1.00 0.00 O ATOM 1143 CB PHE A 103 1.589 9.618 -5.665 1.00 0.00 C ATOM 1144 CG PHE A 103 0.306 9.311 -4.916 1.00 0.00 C ATOM 1145 CD1 PHE A 103 -0.647 10.336 -4.773 1.00 0.00 C ATOM 1146 CD2 PHE A 103 0.064 8.046 -4.335 1.00 0.00 C ATOM 1147 CE1 PHE A 103 -1.854 10.105 -4.094 1.00 0.00 C ATOM 1148 CE2 PHE A 103 -1.114 7.847 -3.592 1.00 0.00 C ATOM 1149 CZ PHE A 103 -2.076 8.866 -3.473 1.00 0.00 C ATOM 0 H PHE A 103 3.453 10.322 -7.030 1.00 0.00 H new ATOM 0 HA PHE A 103 1.152 8.705 -7.544 1.00 0.00 H new ATOM 0 HB2 PHE A 103 2.327 8.857 -5.412 1.00 0.00 H new ATOM 0 HB3 PHE A 103 1.978 10.571 -5.307 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.448 11.312 -5.190 1.00 0.00 H new ATOM 0 HD2 PHE A 103 0.774 7.242 -4.460 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -2.608 10.877 -4.050 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -1.282 6.897 -3.106 1.00 0.00 H new ATOM 0 HZ PHE A 103 -2.980 8.696 -2.907 1.00 0.00 H new ATOM 1159 N ARG A 104 -0.740 10.232 -8.165 1.00 0.00 N ATOM 1160 CA ARG A 104 -1.843 11.090 -8.591 1.00 0.00 C ATOM 1161 C ARG A 104 -3.183 10.464 -8.269 1.00 0.00 C ATOM 1162 O ARG A 104 -3.303 9.247 -8.137 1.00 0.00 O ATOM 1163 CB ARG A 104 -1.769 11.374 -10.094 1.00 0.00 C ATOM 1164 CG ARG A 104 -0.583 12.283 -10.347 1.00 0.00 C ATOM 1165 CD ARG A 104 -0.590 12.827 -11.767 1.00 0.00 C ATOM 1166 NE ARG A 104 0.108 14.121 -11.870 1.00 0.00 N ATOM 1167 CZ ARG A 104 1.283 14.461 -11.325 1.00 0.00 C ATOM 1168 NH1 ARG A 104 2.153 13.538 -10.925 1.00 0.00 N ATOM 1169 NH2 ARG A 104 1.555 15.751 -11.169 1.00 0.00 N ATOM 0 H ARG A 104 -0.929 9.238 -8.293 1.00 0.00 H new ATOM 0 HA ARG A 104 -1.749 12.027 -8.043 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -1.661 10.444 -10.652 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -2.690 11.846 -10.437 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -0.601 13.111 -9.639 1.00 0.00 H new ATOM 0 HG3 ARG A 104 0.342 11.733 -10.171 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -0.116 12.106 -12.433 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -1.620 12.943 -12.105 1.00 0.00 H new ATOM 0 HE ARG A 104 -0.358 14.842 -12.421 1.00 0.00 H new ATOM 0 HH11 ARG A 104 1.931 12.548 -11.031 1.00 0.00 H new ATOM 0 HH12 ARG A 104 3.042 13.820 -10.513 1.00 0.00 H new ATOM 0 HH21 ARG A 104 0.877 16.454 -11.461 1.00 0.00 H new ATOM 0 HH22 ARG A 104 2.442 16.039 -10.757 1.00 0.00 H new ATOM 1183 N GLU A 105 -4.208 11.308 -8.250 1.00 0.00 N ATOM 1184 CA GLU A 105 -5.589 10.889 -8.400 1.00 0.00 C ATOM 1185 C GLU A 105 -5.709 10.301 -9.810 1.00 0.00 C ATOM 1186 O GLU A 105 -5.475 11.019 -10.790 1.00 0.00 O ATOM 1187 CB GLU A 105 -6.513 12.105 -8.240 1.00 0.00 C ATOM 1188 CG GLU A 105 -6.535 12.603 -6.790 1.00 0.00 C ATOM 1189 CD GLU A 105 -7.113 14.012 -6.690 1.00 0.00 C ATOM 1190 OE1 GLU A 105 -8.346 14.150 -6.500 1.00 0.00 O ATOM 1191 OE2 GLU A 105 -6.321 14.986 -6.720 1.00 0.00 O ATOM 0 H GLU A 105 -4.098 12.315 -8.128 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.876 10.154 -7.648 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.178 12.908 -8.897 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.524 11.840 -8.551 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.127 11.922 -6.179 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.523 12.595 -6.386 1.00 0.00 H new ATOM 1198 N GLY A 106 -6.037 9.013 -9.913 1.00 0.00 N ATOM 1199 CA GLY A 106 -6.338 8.358 -11.182 1.00 0.00 C ATOM 1200 C GLY A 106 -5.374 7.233 -11.573 1.00 0.00 C ATOM 1201 O GLY A 106 -5.481 6.714 -12.691 1.00 0.00 O ATOM 0 H GLY A 106 -6.101 8.390 -9.108 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -7.348 7.951 -11.133 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -6.335 9.110 -11.972 1.00 0.00 H new ATOM 1205 N GLN A 107 -4.418 6.870 -10.709 1.00 0.00 N ATOM 1206 CA GLN A 107 -3.395 5.872 -11.021 1.00 0.00 C ATOM 1207 C GLN A 107 -3.248 4.834 -9.914 1.00 0.00 C ATOM 1208 O GLN A 107 -3.771 5.010 -8.810 1.00 0.00 O ATOM 1209 CB GLN A 107 -2.052 6.545 -11.329 1.00 0.00 C ATOM 1210 CG GLN A 107 -1.513 7.394 -10.170 1.00 0.00 C ATOM 1211 CD GLN A 107 -0.001 7.494 -10.242 1.00 0.00 C ATOM 1212 OE1 GLN A 107 0.681 7.220 -9.266 1.00 0.00 O ATOM 1213 NE2 GLN A 107 0.531 7.872 -11.391 1.00 0.00 N ATOM 0 H GLN A 107 -4.334 7.263 -9.772 1.00 0.00 H new ATOM 0 HA GLN A 107 -3.725 5.340 -11.913 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.319 5.778 -11.579 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -2.165 7.177 -12.210 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -1.951 8.391 -10.208 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -1.809 6.951 -9.219 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -0.072 8.093 -12.184 1.00 0.00 H new ATOM 0 HE22 GLN A 107 1.544 7.943 -11.485 1.00 0.00 H new ATOM 1222 N GLY A 108 -2.539 3.754 -10.241 1.00 0.00 N ATOM 1223 CA GLY A 108 -2.247 2.638 -9.367 1.00 0.00 C ATOM 1224 C GLY A 108 -1.017 2.942 -8.531 1.00 0.00 C ATOM 1225 O GLY A 108 -0.020 3.466 -9.033 1.00 0.00 O ATOM 0 H GLY A 108 -2.137 3.636 -11.171 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -3.100 2.442 -8.717 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.082 1.737 -9.957 1.00 0.00 H new ATOM 1229 N VAL A 109 -1.096 2.598 -7.254 1.00 0.00 N ATOM 1230 CA VAL A 109 -0.047 2.802 -6.262 1.00 0.00 C ATOM 1231 C VAL A 109 0.051 1.499 -5.443 1.00 0.00 C ATOM 1232 O VAL A 109 -0.836 0.643 -5.515 1.00 0.00 O ATOM 1233 CB VAL A 109 -0.316 4.081 -5.438 1.00 0.00 C ATOM 1234 CG1 VAL A 109 -0.707 5.273 -6.333 1.00 0.00 C ATOM 1235 CG2 VAL A 109 -1.348 3.842 -4.341 1.00 0.00 C ATOM 0 H VAL A 109 -1.926 2.151 -6.863 1.00 0.00 H new ATOM 0 HA VAL A 109 0.928 2.986 -6.713 1.00 0.00 H new ATOM 0 HB VAL A 109 0.622 4.343 -4.948 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.887 6.151 -5.712 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.102 5.483 -7.033 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.613 5.029 -6.888 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.508 4.766 -3.785 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.288 3.520 -4.790 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.986 3.069 -3.663 1.00 0.00 H new ATOM 1245 N VAL A 110 1.092 1.359 -4.631 1.00 0.00 N ATOM 1246 CA VAL A 110 1.358 0.270 -3.712 1.00 0.00 C ATOM 1247 C VAL A 110 1.578 0.899 -2.349 1.00 0.00 C ATOM 1248 O VAL A 110 2.578 1.581 -2.131 1.00 0.00 O ATOM 1249 CB VAL A 110 2.579 -0.522 -4.214 1.00 0.00 C ATOM 1250 CG1 VAL A 110 3.251 -1.389 -3.147 1.00 0.00 C ATOM 1251 CG2 VAL A 110 2.189 -1.357 -5.440 1.00 0.00 C ATOM 0 H VAL A 110 1.829 2.064 -4.599 1.00 0.00 H new ATOM 0 HA VAL A 110 0.534 -0.441 -3.645 1.00 0.00 H new ATOM 0 HB VAL A 110 3.332 0.216 -4.491 1.00 0.00 H new ATOM 0 HG11 VAL A 110 4.101 -1.912 -3.585 1.00 0.00 H new ATOM 0 HG12 VAL A 110 3.596 -0.757 -2.329 1.00 0.00 H new ATOM 0 HG13 VAL A 110 2.535 -2.117 -2.766 1.00 0.00 H new ATOM 0 HG21 VAL A 110 3.057 -1.915 -5.791 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.395 -2.053 -5.169 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.837 -0.697 -6.233 1.00 0.00 H new ATOM 1261 N VAL A 111 0.645 0.730 -1.429 1.00 0.00 N ATOM 1262 CA VAL A 111 0.843 0.925 -0.009 1.00 0.00 C ATOM 1263 C VAL A 111 1.526 -0.316 0.574 1.00 0.00 C ATOM 1264 O VAL A 111 1.440 -1.417 0.030 1.00 0.00 O ATOM 1265 CB VAL A 111 -0.554 1.189 0.572 1.00 0.00 C ATOM 1266 CG1 VAL A 111 -0.744 0.845 2.039 1.00 0.00 C ATOM 1267 CG2 VAL A 111 -0.903 2.659 0.389 1.00 0.00 C ATOM 0 H VAL A 111 -0.306 0.443 -1.662 1.00 0.00 H new ATOM 0 HA VAL A 111 1.495 1.764 0.233 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.211 0.518 0.019 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.767 1.073 2.337 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.550 -0.217 2.192 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.051 1.431 2.643 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.894 2.852 0.800 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.169 3.275 0.909 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.896 2.905 -0.673 1.00 0.00 H new ATOM 1277 N GLN A 112 2.161 -0.117 1.719 1.00 0.00 N ATOM 1278 CA GLN A 112 2.783 -1.081 2.608 1.00 0.00 C ATOM 1279 C GLN A 112 2.820 -0.417 3.974 1.00 0.00 C ATOM 1280 O GLN A 112 2.973 0.804 4.029 1.00 0.00 O ATOM 1281 CB GLN A 112 4.203 -1.386 2.114 1.00 0.00 C ATOM 1282 CG GLN A 112 4.968 -2.316 3.069 1.00 0.00 C ATOM 1283 CD GLN A 112 5.968 -3.206 2.350 1.00 0.00 C ATOM 1284 OE1 GLN A 112 6.012 -4.407 2.594 1.00 0.00 O ATOM 1285 NE2 GLN A 112 6.767 -2.672 1.443 1.00 0.00 N ATOM 0 H GLN A 112 2.263 0.829 2.086 1.00 0.00 H new ATOM 0 HA GLN A 112 2.238 -2.024 2.645 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.151 -1.846 1.127 1.00 0.00 H new ATOM 0 HB3 GLN A 112 4.754 -0.452 2.001 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.492 -1.715 3.812 1.00 0.00 H new ATOM 0 HG3 GLN A 112 4.256 -2.940 3.609 1.00 0.00 H new ATOM 0 HE21 GLN A 112 6.721 -1.672 1.249 1.00 0.00 H new ATOM 0 HE22 GLN A 112 7.429 -3.260 0.937 1.00 0.00 H new ATOM 1294 N GLY A 113 2.696 -1.185 5.053 1.00 0.00 N ATOM 1295 CA GLY A 113 2.702 -0.698 6.418 1.00 0.00 C ATOM 1296 C GLY A 113 1.941 -1.697 7.275 1.00 0.00 C ATOM 1297 O GLY A 113 2.433 -2.818 7.423 1.00 0.00 O ATOM 0 H GLY A 113 2.585 -2.197 4.993 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.725 -0.587 6.779 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.236 0.286 6.474 1.00 0.00 H new ATOM 1301 N GLU A 114 0.771 -1.348 7.819 1.00 0.00 N ATOM 1302 CA GLU A 114 0.054 -2.208 8.753 1.00 0.00 C ATOM 1303 C GLU A 114 -1.450 -2.022 8.599 1.00 0.00 C ATOM 1304 O GLU A 114 -1.898 -1.035 8.021 1.00 0.00 O ATOM 1305 CB GLU A 114 0.553 -1.905 10.174 1.00 0.00 C ATOM 1306 CG GLU A 114 0.221 -3.014 11.175 1.00 0.00 C ATOM 1307 CD GLU A 114 1.195 -3.060 12.345 1.00 0.00 C ATOM 1308 OE1 GLU A 114 1.121 -2.165 13.215 1.00 0.00 O ATOM 1309 OE2 GLU A 114 2.045 -3.986 12.353 1.00 0.00 O ATOM 0 H GLU A 114 0.300 -0.465 7.623 1.00 0.00 H new ATOM 0 HA GLU A 114 0.251 -3.259 8.541 1.00 0.00 H new ATOM 0 HB2 GLU A 114 1.633 -1.757 10.150 1.00 0.00 H new ATOM 0 HB3 GLU A 114 0.110 -0.970 10.517 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -0.790 -2.865 11.555 1.00 0.00 H new ATOM 0 HG3 GLU A 114 0.230 -3.976 10.662 1.00 0.00 H new ATOM 1316 N LEU A 115 -2.233 -2.997 9.049 1.00 0.00 N ATOM 1317 CA LEU A 115 -3.688 -2.913 9.116 1.00 0.00 C ATOM 1318 C LEU A 115 -4.079 -2.247 10.442 1.00 0.00 C ATOM 1319 O LEU A 115 -3.421 -2.465 11.461 1.00 0.00 O ATOM 1320 CB LEU A 115 -4.273 -4.316 8.940 1.00 0.00 C ATOM 1321 CG LEU A 115 -5.380 -4.437 7.861 1.00 0.00 C ATOM 1322 CD1 LEU A 115 -5.992 -5.838 7.807 1.00 0.00 C ATOM 1323 CD2 LEU A 115 -6.511 -3.422 7.933 1.00 0.00 C ATOM 0 H LEU A 115 -1.866 -3.887 9.385 1.00 0.00 H new ATOM 0 HA LEU A 115 -4.098 -2.298 8.315 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -3.464 -5.001 8.686 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -4.681 -4.645 9.896 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.826 -4.217 6.948 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -6.761 -5.869 7.036 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.215 -6.566 7.574 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -6.436 -6.078 8.773 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -7.221 -3.610 7.127 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -7.020 -3.512 8.893 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -6.104 -2.416 7.831 1.00 0.00 H new ATOM 1335 N GLU A 116 -5.122 -1.420 10.412 1.00 0.00 N ATOM 1336 CA GLU A 116 -5.596 -0.646 11.552 1.00 0.00 C ATOM 1337 C GLU A 116 -6.862 -1.321 12.096 1.00 0.00 C ATOM 1338 O GLU A 116 -6.780 -2.139 13.008 1.00 0.00 O ATOM 1339 CB GLU A 116 -5.821 0.810 11.089 1.00 0.00 C ATOM 1340 CG GLU A 116 -5.943 1.887 12.176 1.00 0.00 C ATOM 1341 CD GLU A 116 -5.947 1.387 13.618 1.00 0.00 C ATOM 1342 OE1 GLU A 116 -7.043 1.060 14.119 1.00 0.00 O ATOM 1343 OE2 GLU A 116 -4.865 1.393 14.250 1.00 0.00 O ATOM 0 H GLU A 116 -5.675 -1.267 9.569 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.873 -0.614 12.367 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.996 1.086 10.433 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -6.729 0.835 10.487 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -5.117 2.589 12.058 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -6.863 2.446 12.004 1.00 0.00 H new ATOM 1350 N LYS A 117 -8.022 -1.014 11.505 1.00 0.00 N ATOM 1351 CA LYS A 117 -9.342 -1.596 11.719 1.00 0.00 C ATOM 1352 C LYS A 117 -10.221 -1.118 10.575 1.00 0.00 C ATOM 1353 O LYS A 117 -9.997 -0.021 10.066 1.00 0.00 O ATOM 1354 CB LYS A 117 -9.956 -1.077 13.034 1.00 0.00 C ATOM 1355 CG LYS A 117 -9.984 -2.102 14.171 1.00 0.00 C ATOM 1356 CD LYS A 117 -10.894 -3.316 13.928 1.00 0.00 C ATOM 1357 CE LYS A 117 -12.317 -2.948 13.500 1.00 0.00 C ATOM 1358 NZ LYS A 117 -13.210 -4.121 13.498 1.00 0.00 N ATOM 0 H LYS A 117 -8.058 -0.280 10.797 1.00 0.00 H new ATOM 0 HA LYS A 117 -9.268 -2.682 11.767 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.393 -0.204 13.363 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -10.975 -0.744 12.837 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -8.968 -2.457 14.345 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -10.307 -1.601 15.084 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -10.445 -3.946 13.160 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -10.942 -3.911 14.840 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -12.715 -2.190 14.175 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -12.294 -2.507 12.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.164 -3.831 13.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -12.845 -4.834 12.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -13.252 -4.527 14.455 1.00 0.00 H new ATOM 1372 N GLY A 118 -11.269 -1.863 10.229 1.00 0.00 N ATOM 1373 CA GLY A 118 -12.271 -1.405 9.274 1.00 0.00 C ATOM 1374 C GLY A 118 -11.651 -1.149 7.908 1.00 0.00 C ATOM 1375 O GLY A 118 -11.951 -0.142 7.276 1.00 0.00 O ATOM 0 H GLY A 118 -11.445 -2.796 10.602 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -13.060 -2.152 9.184 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.737 -0.491 9.642 1.00 0.00 H new ATOM 1379 N ASN A 119 -10.775 -2.056 7.469 1.00 0.00 N ATOM 1380 CA ASN A 119 -10.078 -2.001 6.181 1.00 0.00 C ATOM 1381 C ASN A 119 -9.293 -0.689 6.008 1.00 0.00 C ATOM 1382 O ASN A 119 -9.254 -0.132 4.907 1.00 0.00 O ATOM 1383 CB ASN A 119 -11.028 -2.227 4.984 1.00 0.00 C ATOM 1384 CG ASN A 119 -12.095 -3.289 5.144 1.00 0.00 C ATOM 1385 OD1 ASN A 119 -13.271 -3.001 4.934 1.00 0.00 O ATOM 1386 ND2 ASN A 119 -11.732 -4.524 5.443 1.00 0.00 N ATOM 0 H ASN A 119 -10.523 -2.877 8.019 1.00 0.00 H new ATOM 0 HA ASN A 119 -9.364 -2.824 6.191 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -11.522 -1.281 4.761 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -10.422 -2.484 4.115 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -12.434 -5.261 5.503 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -10.750 -4.740 5.613 1.00 0.00 H new ATOM 1393 N HIS A 120 -8.628 -0.213 7.061 1.00 0.00 N ATOM 1394 CA HIS A 120 -7.805 0.990 7.029 1.00 0.00 C ATOM 1395 C HIS A 120 -6.365 0.545 7.149 1.00 0.00 C ATOM 1396 O HIS A 120 -6.021 -0.185 8.073 1.00 0.00 O ATOM 1397 CB HIS A 120 -8.188 1.961 8.154 1.00 0.00 C ATOM 1398 CG HIS A 120 -7.296 3.172 8.313 1.00 0.00 C ATOM 1399 ND1 HIS A 120 -7.227 3.980 9.426 1.00 0.00 N ATOM 1400 CD2 HIS A 120 -6.417 3.681 7.396 1.00 0.00 C ATOM 1401 CE1 HIS A 120 -6.314 4.933 9.172 1.00 0.00 C ATOM 1402 NE2 HIS A 120 -5.783 4.776 7.959 1.00 0.00 N ATOM 0 H HIS A 120 -8.649 -0.663 7.976 1.00 0.00 H new ATOM 0 HA HIS A 120 -7.960 1.534 6.097 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -9.207 2.305 7.979 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.194 1.412 9.096 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -7.768 3.875 10.284 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.247 3.294 6.402 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -6.046 5.722 9.859 1.00 0.00 H new ATOM 1410 N ILE A 121 -5.545 0.943 6.189 1.00 0.00 N ATOM 1411 CA ILE A 121 -4.127 0.688 6.163 1.00 0.00 C ATOM 1412 C ILE A 121 -3.401 1.908 6.726 1.00 0.00 C ATOM 1413 O ILE A 121 -3.583 3.025 6.243 1.00 0.00 O ATOM 1414 CB ILE A 121 -3.706 0.409 4.708 1.00 0.00 C ATOM 1415 CG1 ILE A 121 -4.610 -0.583 3.935 1.00 0.00 C ATOM 1416 CG2 ILE A 121 -2.278 -0.132 4.742 1.00 0.00 C ATOM 1417 CD1 ILE A 121 -4.569 -2.004 4.506 1.00 0.00 C ATOM 0 H ILE A 121 -5.869 1.472 5.379 1.00 0.00 H new ATOM 0 HA ILE A 121 -3.870 -0.179 6.772 1.00 0.00 H new ATOM 0 HB ILE A 121 -3.796 1.351 4.166 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -5.637 -0.220 3.954 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -4.301 -0.609 2.890 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -1.944 -0.342 3.726 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -1.619 0.609 5.195 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -2.250 -1.049 5.330 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -5.223 -2.650 3.921 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -3.549 -2.385 4.462 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -4.906 -1.990 5.542 1.00 0.00 H new ATOM 1429 N LEU A 122 -2.482 1.675 7.655 1.00 0.00 N ATOM 1430 CA LEU A 122 -1.387 2.596 7.877 1.00 0.00 C ATOM 1431 C LEU A 122 -0.414 2.286 6.765 1.00 0.00 C ATOM 1432 O LEU A 122 0.129 1.181 6.691 1.00 0.00 O ATOM 1433 CB LEU A 122 -0.659 2.332 9.196 1.00 0.00 C ATOM 1434 CG LEU A 122 -1.298 2.924 10.447 1.00 0.00 C ATOM 1435 CD1 LEU A 122 -1.462 4.449 10.401 1.00 0.00 C ATOM 1436 CD2 LEU A 122 -2.662 2.326 10.751 1.00 0.00 C ATOM 0 H LEU A 122 -2.478 0.856 8.263 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.755 3.622 7.905 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -0.575 1.254 9.331 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.355 2.722 9.112 1.00 0.00 H new ATOM 0 HG LEU A 122 -0.590 2.667 11.235 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.923 4.793 11.327 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -0.484 4.917 10.287 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.095 4.722 9.557 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.068 2.786 11.652 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.335 2.511 9.914 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.562 1.252 10.905 1.00 0.00 H new ATOM 1448 N ALA A 123 -0.219 3.234 5.869 1.00 0.00 N ATOM 1449 CA ALA A 123 0.938 3.222 5.013 1.00 0.00 C ATOM 1450 C ALA A 123 2.156 3.641 5.826 1.00 0.00 C ATOM 1451 O ALA A 123 2.081 4.478 6.723 1.00 0.00 O ATOM 1452 CB ALA A 123 0.720 4.176 3.853 1.00 0.00 C ATOM 0 H ALA A 123 -0.851 4.021 5.719 1.00 0.00 H new ATOM 0 HA ALA A 123 1.100 2.221 4.613 1.00 0.00 H new ATOM 0 HB1 ALA A 123 1.596 4.167 3.205 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.155 3.863 3.284 1.00 0.00 H new ATOM 0 HB3 ALA A 123 0.562 5.184 4.236 1.00 0.00 H new ATOM 1458 N LYS A 124 3.304 3.104 5.440 1.00 0.00 N ATOM 1459 CA LYS A 124 4.613 3.457 5.990 1.00 0.00 C ATOM 1460 C LYS A 124 5.470 4.175 4.954 1.00 0.00 C ATOM 1461 O LYS A 124 6.394 4.887 5.338 1.00 0.00 O ATOM 1462 CB LYS A 124 5.274 2.216 6.632 1.00 0.00 C ATOM 1463 CG LYS A 124 6.252 1.397 5.764 1.00 0.00 C ATOM 1464 CD LYS A 124 7.702 1.820 6.052 1.00 0.00 C ATOM 1465 CE LYS A 124 8.727 1.105 5.166 1.00 0.00 C ATOM 1466 NZ LYS A 124 10.099 1.271 5.685 1.00 0.00 N ATOM 0 H LYS A 124 3.356 2.389 4.714 1.00 0.00 H new ATOM 0 HA LYS A 124 4.493 4.180 6.797 1.00 0.00 H new ATOM 0 HB2 LYS A 124 5.810 2.544 7.523 1.00 0.00 H new ATOM 0 HB3 LYS A 124 4.480 1.547 6.965 1.00 0.00 H new ATOM 0 HG2 LYS A 124 6.128 0.334 5.969 1.00 0.00 H new ATOM 0 HG3 LYS A 124 6.025 1.546 4.708 1.00 0.00 H new ATOM 0 HD2 LYS A 124 7.795 2.896 5.908 1.00 0.00 H new ATOM 0 HD3 LYS A 124 7.932 1.617 7.098 1.00 0.00 H new ATOM 0 HE2 LYS A 124 8.484 0.044 5.110 1.00 0.00 H new ATOM 0 HE3 LYS A 124 8.670 1.499 4.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 10.768 0.775 5.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 10.339 2.283 5.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 10.158 0.873 6.644 1.00 0.00 H new ATOM 1480 N GLU A 125 5.176 4.005 3.661 1.00 0.00 N ATOM 1481 CA GLU A 125 6.008 4.529 2.590 1.00 0.00 C ATOM 1482 C GLU A 125 5.190 4.955 1.382 1.00 0.00 C ATOM 1483 O GLU A 125 5.397 6.071 0.915 1.00 0.00 O ATOM 1484 CB GLU A 125 7.122 3.515 2.266 1.00 0.00 C ATOM 1485 CG GLU A 125 6.650 2.153 1.720 1.00 0.00 C ATOM 1486 CD GLU A 125 7.660 1.029 1.968 1.00 0.00 C ATOM 1487 OE1 GLU A 125 8.874 1.243 1.765 1.00 0.00 O ATOM 1488 OE2 GLU A 125 7.262 -0.080 2.395 1.00 0.00 O ATOM 0 H GLU A 125 4.353 3.499 3.335 1.00 0.00 H new ATOM 0 HA GLU A 125 6.490 5.448 2.924 1.00 0.00 H new ATOM 0 HB2 GLU A 125 7.795 3.964 1.536 1.00 0.00 H new ATOM 0 HB3 GLU A 125 7.703 3.341 3.171 1.00 0.00 H new ATOM 0 HG2 GLU A 125 5.700 1.890 2.185 1.00 0.00 H new ATOM 0 HG3 GLU A 125 6.467 2.240 0.649 1.00 0.00 H new ATOM 1495 N VAL A 126 4.246 4.125 0.914 1.00 0.00 N ATOM 1496 CA VAL A 126 3.549 4.244 -0.360 1.00 0.00 C ATOM 1497 C VAL A 126 4.579 4.206 -1.514 1.00 0.00 C ATOM 1498 O VAL A 126 5.712 4.665 -1.385 1.00 0.00 O ATOM 1499 CB VAL A 126 2.647 5.495 -0.318 1.00 0.00 C ATOM 1500 CG1 VAL A 126 1.798 5.670 -1.582 1.00 0.00 C ATOM 1501 CG2 VAL A 126 1.654 5.516 0.836 1.00 0.00 C ATOM 0 H VAL A 126 3.937 3.312 1.448 1.00 0.00 H new ATOM 0 HA VAL A 126 2.881 3.403 -0.546 1.00 0.00 H new ATOM 0 HB VAL A 126 3.377 6.297 -0.208 1.00 0.00 H new ATOM 0 HG11 VAL A 126 1.187 6.568 -1.488 1.00 0.00 H new ATOM 0 HG12 VAL A 126 2.452 5.765 -2.449 1.00 0.00 H new ATOM 0 HG13 VAL A 126 1.151 4.802 -1.709 1.00 0.00 H new ATOM 0 HG21 VAL A 126 1.061 6.429 0.789 1.00 0.00 H new ATOM 0 HG22 VAL A 126 0.994 4.651 0.764 1.00 0.00 H new ATOM 0 HG23 VAL A 126 2.195 5.482 1.782 1.00 0.00 H new ATOM 1511 N LEU A 127 4.211 3.708 -2.691 1.00 0.00 N ATOM 1512 CA LEU A 127 5.007 3.733 -3.913 1.00 0.00 C ATOM 1513 C LEU A 127 4.032 3.838 -5.079 1.00 0.00 C ATOM 1514 O LEU A 127 2.928 3.316 -4.967 1.00 0.00 O ATOM 1515 CB LEU A 127 5.779 2.414 -4.027 1.00 0.00 C ATOM 1516 CG LEU A 127 6.802 2.144 -2.895 1.00 0.00 C ATOM 1517 CD1 LEU A 127 7.186 0.669 -2.777 1.00 0.00 C ATOM 1518 CD2 LEU A 127 8.050 3.022 -3.029 1.00 0.00 C ATOM 0 H LEU A 127 3.307 3.255 -2.824 1.00 0.00 H new ATOM 0 HA LEU A 127 5.710 4.566 -3.911 1.00 0.00 H new ATOM 0 HB2 LEU A 127 5.062 1.593 -4.049 1.00 0.00 H new ATOM 0 HB3 LEU A 127 6.306 2.402 -4.981 1.00 0.00 H new ATOM 0 HG LEU A 127 6.295 2.416 -1.969 1.00 0.00 H new ATOM 0 HD11 LEU A 127 7.905 0.544 -1.967 1.00 0.00 H new ATOM 0 HD12 LEU A 127 6.295 0.077 -2.566 1.00 0.00 H new ATOM 0 HD13 LEU A 127 7.632 0.333 -3.713 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.740 2.800 -2.215 1.00 0.00 H new ATOM 0 HD22 LEU A 127 8.537 2.819 -3.983 1.00 0.00 H new ATOM 0 HD23 LEU A 127 7.762 4.072 -2.984 1.00 0.00 H new ATOM 1530 N ALA A 128 4.416 4.429 -6.208 1.00 0.00 N ATOM 1531 CA ALA A 128 3.480 4.660 -7.322 1.00 0.00 C ATOM 1532 C ALA A 128 3.735 3.719 -8.518 1.00 0.00 C ATOM 1533 O ALA A 128 3.583 4.115 -9.680 1.00 0.00 O ATOM 1534 CB ALA A 128 3.449 6.157 -7.668 1.00 0.00 C ATOM 0 H ALA A 128 5.365 4.759 -6.382 1.00 0.00 H new ATOM 0 HA ALA A 128 2.472 4.392 -7.007 1.00 0.00 H new ATOM 0 HB1 ALA A 128 2.756 6.326 -8.492 1.00 0.00 H new ATOM 0 HB2 ALA A 128 3.122 6.725 -6.797 1.00 0.00 H new ATOM 0 HB3 ALA A 128 4.447 6.484 -7.960 1.00 0.00 H new ATOM 1540 N LYS A 129 4.166 2.476 -8.277 1.00 0.00 N ATOM 1541 CA LYS A 129 4.537 1.518 -9.340 1.00 0.00 C ATOM 1542 C LYS A 129 5.594 2.024 -10.344 1.00 0.00 C ATOM 1543 O LYS A 129 5.587 1.585 -11.494 1.00 0.00 O ATOM 1544 CB LYS A 129 3.262 0.979 -10.053 1.00 0.00 C ATOM 1545 CG LYS A 129 2.209 0.281 -9.164 1.00 0.00 C ATOM 1546 CD LYS A 129 2.365 -1.247 -9.069 1.00 0.00 C ATOM 1547 CE LYS A 129 2.050 -1.956 -10.394 1.00 0.00 C ATOM 1548 NZ LYS A 129 2.112 -3.430 -10.294 1.00 0.00 N ATOM 0 H LYS A 129 4.270 2.098 -7.335 1.00 0.00 H new ATOM 0 HA LYS A 129 5.040 0.695 -8.831 1.00 0.00 H new ATOM 0 HB2 LYS A 129 2.778 1.813 -10.561 1.00 0.00 H new ATOM 0 HB3 LYS A 129 3.576 0.275 -10.824 1.00 0.00 H new ATOM 0 HG2 LYS A 129 2.263 0.702 -8.160 1.00 0.00 H new ATOM 0 HG3 LYS A 129 1.216 0.509 -9.552 1.00 0.00 H new ATOM 0 HD2 LYS A 129 3.384 -1.486 -8.767 1.00 0.00 H new ATOM 0 HD3 LYS A 129 1.704 -1.628 -8.291 1.00 0.00 H new ATOM 0 HE2 LYS A 129 1.055 -1.662 -10.728 1.00 0.00 H new ATOM 0 HE3 LYS A 129 2.754 -1.620 -11.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 1.890 -3.850 -11.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 3.068 -3.718 -10.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.422 -3.760 -9.590 1.00 0.00 H new ATOM 1562 N HIS A 130 6.535 2.903 -9.982 1.00 0.00 N ATOM 1563 CA HIS A 130 7.768 3.183 -10.712 1.00 0.00 C ATOM 1564 C HIS A 130 8.755 2.005 -10.629 1.00 0.00 C ATOM 1565 O HIS A 130 9.946 2.212 -10.411 1.00 0.00 O ATOM 1566 CB HIS A 130 8.381 4.500 -10.189 1.00 0.00 C ATOM 1567 CG HIS A 130 8.341 4.671 -8.689 1.00 0.00 C ATOM 1568 ND1 HIS A 130 7.751 5.704 -7.999 1.00 0.00 N ATOM 1569 CD2 HIS A 130 8.813 3.786 -7.767 1.00 0.00 C ATOM 1570 CE1 HIS A 130 7.884 5.462 -6.687 1.00 0.00 C ATOM 1571 NE2 HIS A 130 8.533 4.304 -6.502 1.00 0.00 N ATOM 0 H HIS A 130 6.450 3.462 -9.133 1.00 0.00 H new ATOM 0 HA HIS A 130 7.538 3.307 -11.770 1.00 0.00 H new ATOM 0 HB2 HIS A 130 9.418 4.556 -10.519 1.00 0.00 H new ATOM 0 HB3 HIS A 130 7.855 5.336 -10.649 1.00 0.00 H new ATOM 0 HD1 HIS A 130 7.291 6.515 -8.414 1.00 0.00 H new ATOM 0 HD2 HIS A 130 9.313 2.852 -7.977 1.00 0.00 H new ATOM 0 HE1 HIS A 130 7.522 6.104 -5.897 1.00 0.00 H new ATOM 1579 N ASP A 131 8.285 0.772 -10.833 1.00 0.00 N ATOM 1580 CA ASP A 131 9.129 -0.398 -11.086 1.00 0.00 C ATOM 1581 C ASP A 131 10.180 -0.610 -9.994 1.00 0.00 C ATOM 1582 O ASP A 131 11.377 -0.730 -10.257 1.00 0.00 O ATOM 1583 CB ASP A 131 9.764 -0.231 -12.469 1.00 0.00 C ATOM 1584 CG ASP A 131 10.296 -1.548 -13.043 1.00 0.00 C ATOM 1585 OD1 ASP A 131 9.854 -2.636 -12.610 1.00 0.00 O ATOM 1586 OD2 ASP A 131 11.056 -1.499 -14.037 1.00 0.00 O ATOM 0 H ASP A 131 7.288 0.555 -10.827 1.00 0.00 H new ATOM 0 HA ASP A 131 8.514 -1.298 -11.066 1.00 0.00 H new ATOM 0 HB2 ASP A 131 9.026 0.186 -13.154 1.00 0.00 H new ATOM 0 HB3 ASP A 131 10.581 0.488 -12.404 1.00 0.00 H new ATOM 1591 N GLU A 132 9.732 -0.527 -8.746 1.00 0.00 N ATOM 1592 CA GLU A 132 10.592 -0.445 -7.575 1.00 0.00 C ATOM 1593 C GLU A 132 10.926 -1.844 -7.042 1.00 0.00 C ATOM 1594 O GLU A 132 12.100 -2.201 -6.919 1.00 0.00 O ATOM 1595 CB GLU A 132 9.966 0.491 -6.511 1.00 0.00 C ATOM 1596 CG GLU A 132 8.432 0.632 -6.450 1.00 0.00 C ATOM 1597 CD GLU A 132 7.649 -0.674 -6.444 1.00 0.00 C ATOM 1598 OE1 GLU A 132 7.543 -1.389 -5.424 1.00 0.00 O ATOM 1599 OE2 GLU A 132 7.093 -1.003 -7.515 1.00 0.00 O ATOM 0 H GLU A 132 8.738 -0.515 -8.517 1.00 0.00 H new ATOM 0 HA GLU A 132 11.546 0.002 -7.857 1.00 0.00 H new ATOM 0 HB2 GLU A 132 10.304 0.150 -5.533 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.382 1.487 -6.663 1.00 0.00 H new ATOM 0 HG2 GLU A 132 8.173 1.194 -5.553 1.00 0.00 H new ATOM 0 HG3 GLU A 132 8.106 1.226 -7.304 1.00 0.00 H new ATOM 1606 N ASN A 133 9.879 -2.623 -6.747 1.00 0.00 N ATOM 1607 CA ASN A 133 9.839 -3.817 -5.907 1.00 0.00 C ATOM 1608 C ASN A 133 10.720 -3.717 -4.648 1.00 0.00 C ATOM 1609 O ASN A 133 11.027 -2.621 -4.165 1.00 0.00 O ATOM 1610 CB ASN A 133 10.001 -5.092 -6.760 1.00 0.00 C ATOM 1611 CG ASN A 133 8.736 -5.452 -7.530 1.00 0.00 C ATOM 1612 OD1 ASN A 133 7.636 -5.005 -7.215 1.00 0.00 O ATOM 1613 ND2 ASN A 133 8.852 -6.299 -8.532 1.00 0.00 N ATOM 0 H ASN A 133 8.956 -2.411 -7.127 1.00 0.00 H new ATOM 0 HA ASN A 133 8.844 -3.896 -5.468 1.00 0.00 H new ATOM 0 HB2 ASN A 133 10.821 -4.951 -7.464 1.00 0.00 H new ATOM 0 HB3 ASN A 133 10.276 -5.924 -6.112 1.00 0.00 H new ATOM 0 HD21 ASN A 133 8.025 -6.589 -9.053 1.00 0.00 H new ATOM 0 HD22 ASN A 133 9.769 -6.665 -8.787 1.00 0.00 H new ATOM 1620 N TYR A 134 10.969 -4.852 -3.988 1.00 0.00 N ATOM 1621 CA TYR A 134 11.629 -4.891 -2.695 1.00 0.00 C ATOM 1622 C TYR A 134 13.016 -4.272 -2.824 1.00 0.00 C ATOM 1623 O TYR A 134 13.785 -4.661 -3.701 1.00 0.00 O ATOM 1624 CB TYR A 134 11.714 -6.333 -2.187 1.00 0.00 C ATOM 1625 CG TYR A 134 12.089 -6.419 -0.720 1.00 0.00 C ATOM 1626 CD1 TYR A 134 13.419 -6.235 -0.294 1.00 0.00 C ATOM 1627 CD2 TYR A 134 11.089 -6.683 0.231 1.00 0.00 C ATOM 1628 CE1 TYR A 134 13.747 -6.313 1.071 1.00 0.00 C ATOM 1629 CE2 TYR A 134 11.409 -6.776 1.596 1.00 0.00 C ATOM 1630 CZ TYR A 134 12.741 -6.588 2.023 1.00 0.00 C ATOM 1631 OH TYR A 134 13.039 -6.689 3.345 1.00 0.00 O ATOM 0 H TYR A 134 10.713 -5.773 -4.345 1.00 0.00 H new ATOM 0 HA TYR A 134 11.053 -4.317 -1.969 1.00 0.00 H new ATOM 0 HB2 TYR A 134 10.753 -6.825 -2.341 1.00 0.00 H new ATOM 0 HB3 TYR A 134 12.450 -6.879 -2.778 1.00 0.00 H new ATOM 0 HD1 TYR A 134 14.192 -6.033 -1.021 1.00 0.00 H new ATOM 0 HD2 TYR A 134 10.066 -6.815 -0.090 1.00 0.00 H new ATOM 0 HE1 TYR A 134 14.767 -6.163 1.391 1.00 0.00 H new ATOM 0 HE2 TYR A 134 10.636 -6.991 2.318 1.00 0.00 H new ATOM 0 HH TYR A 134 12.222 -6.881 3.851 1.00 0.00 H new ATOM 1641 N THR A 135 13.328 -3.334 -1.935 1.00 0.00 N ATOM 1642 CA THR A 135 14.578 -2.599 -1.935 1.00 0.00 C ATOM 1643 C THR A 135 15.191 -2.732 -0.521 1.00 0.00 C ATOM 1644 O THR A 135 14.448 -2.601 0.463 1.00 0.00 O ATOM 1645 CB THR A 135 14.274 -1.146 -2.351 1.00 0.00 C ATOM 1646 OG1 THR A 135 13.506 -1.062 -3.544 1.00 0.00 O ATOM 1647 CG2 THR A 135 15.553 -0.352 -2.601 1.00 0.00 C ATOM 0 H THR A 135 12.700 -3.061 -1.179 1.00 0.00 H new ATOM 0 HA THR A 135 15.309 -2.985 -2.646 1.00 0.00 H new ATOM 0 HB THR A 135 13.710 -0.732 -1.515 1.00 0.00 H new ATOM 0 HG1 THR A 135 12.667 -1.555 -3.428 1.00 0.00 H new ATOM 0 HG21 THR A 135 15.298 0.667 -2.892 1.00 0.00 H new ATOM 0 HG22 THR A 135 16.152 -0.330 -1.690 1.00 0.00 H new ATOM 0 HG23 THR A 135 16.125 -0.825 -3.399 1.00 0.00 H new ATOM 1655 N PRO A 136 16.505 -3.014 -0.386 1.00 0.00 N ATOM 1656 CA PRO A 136 17.191 -3.140 0.908 1.00 0.00 C ATOM 1657 C PRO A 136 17.247 -1.788 1.645 1.00 0.00 C ATOM 1658 O PRO A 136 16.812 -0.779 1.091 1.00 0.00 O ATOM 1659 CB PRO A 136 18.597 -3.655 0.564 1.00 0.00 C ATOM 1660 CG PRO A 136 18.840 -3.122 -0.839 1.00 0.00 C ATOM 1661 CD PRO A 136 17.458 -3.195 -1.475 1.00 0.00 C ATOM 0 HA PRO A 136 16.668 -3.817 1.583 1.00 0.00 H new ATOM 0 HB2 PRO A 136 19.343 -3.285 1.268 1.00 0.00 H new ATOM 0 HB3 PRO A 136 18.643 -4.744 0.593 1.00 0.00 H new ATOM 0 HG2 PRO A 136 19.224 -2.102 -0.823 1.00 0.00 H new ATOM 0 HG3 PRO A 136 19.567 -3.727 -1.381 1.00 0.00 H new ATOM 0 HD2 PRO A 136 17.336 -2.421 -2.233 1.00 0.00 H new ATOM 0 HD3 PRO A 136 17.307 -4.154 -1.971 1.00 0.00 H new ATOM 1669 N PRO A 137 17.772 -1.712 2.881 1.00 0.00 N ATOM 1670 CA PRO A 137 18.156 -0.446 3.493 1.00 0.00 C ATOM 1671 C PRO A 137 19.489 0.063 2.911 1.00 0.00 C ATOM 1672 O PRO A 137 20.059 -0.520 1.978 1.00 0.00 O ATOM 1673 CB PRO A 137 18.202 -0.744 4.994 1.00 0.00 C ATOM 1674 CG PRO A 137 18.692 -2.185 5.039 1.00 0.00 C ATOM 1675 CD PRO A 137 18.106 -2.815 3.774 1.00 0.00 C ATOM 0 HA PRO A 137 17.457 0.365 3.291 1.00 0.00 H new ATOM 0 HB2 PRO A 137 18.879 -0.070 5.519 1.00 0.00 H new ATOM 0 HB3 PRO A 137 17.222 -0.636 5.458 1.00 0.00 H new ATOM 0 HG2 PRO A 137 19.781 -2.236 5.043 1.00 0.00 H new ATOM 0 HG3 PRO A 137 18.346 -2.697 5.937 1.00 0.00 H new ATOM 0 HD2 PRO A 137 18.825 -3.489 3.307 1.00 0.00 H new ATOM 0 HD3 PRO A 137 17.221 -3.406 4.009 1.00 0.00 H new ATOM 1683 N GLU A 138 19.999 1.150 3.493 1.00 0.00 N ATOM 1684 CA GLU A 138 21.206 1.870 3.078 1.00 0.00 C ATOM 1685 C GLU A 138 21.068 2.431 1.649 1.00 0.00 C ATOM 1686 O GLU A 138 22.049 2.459 0.906 1.00 0.00 O ATOM 1687 CB GLU A 138 22.479 1.002 3.266 1.00 0.00 C ATOM 1688 CG GLU A 138 22.597 0.223 4.589 1.00 0.00 C ATOM 1689 CD GLU A 138 22.619 1.110 5.830 1.00 0.00 C ATOM 1690 OE1 GLU A 138 21.534 1.421 6.377 1.00 0.00 O ATOM 1691 OE2 GLU A 138 23.721 1.477 6.298 1.00 0.00 O ATOM 0 H GLU A 138 19.559 1.575 4.309 1.00 0.00 H new ATOM 0 HA GLU A 138 21.323 2.732 3.735 1.00 0.00 H new ATOM 0 HB2 GLU A 138 22.527 0.287 2.445 1.00 0.00 H new ATOM 0 HB3 GLU A 138 23.350 1.651 3.175 1.00 0.00 H new ATOM 0 HG2 GLU A 138 21.760 -0.472 4.666 1.00 0.00 H new ATOM 0 HG3 GLU A 138 23.507 -0.376 4.566 1.00 0.00 H new ATOM 1698 N VAL A 139 19.863 2.830 1.219 1.00 0.00 N ATOM 1699 CA VAL A 139 19.596 3.230 -0.155 1.00 0.00 C ATOM 1700 C VAL A 139 18.522 4.326 -0.110 1.00 0.00 C ATOM 1701 O VAL A 139 18.511 5.154 0.804 1.00 0.00 O ATOM 1702 CB VAL A 139 19.282 1.960 -0.990 1.00 0.00 C ATOM 1703 CG1 VAL A 139 17.932 1.343 -0.646 1.00 0.00 C ATOM 1704 CG2 VAL A 139 19.454 2.126 -2.510 1.00 0.00 C ATOM 0 H VAL A 139 19.045 2.882 1.826 1.00 0.00 H new ATOM 0 HA VAL A 139 20.446 3.678 -0.670 1.00 0.00 H new ATOM 0 HB VAL A 139 20.056 1.255 -0.687 1.00 0.00 H new ATOM 0 HG11 VAL A 139 17.769 0.459 -1.262 1.00 0.00 H new ATOM 0 HG12 VAL A 139 17.919 1.060 0.406 1.00 0.00 H new ATOM 0 HG13 VAL A 139 17.141 2.069 -0.836 1.00 0.00 H new ATOM 0 HG21 VAL A 139 19.212 1.187 -3.008 1.00 0.00 H new ATOM 0 HG22 VAL A 139 18.786 2.909 -2.868 1.00 0.00 H new ATOM 0 HG23 VAL A 139 20.486 2.399 -2.732 1.00 0.00 H new ATOM 1714 N GLU A 140 17.615 4.324 -1.082 1.00 0.00 N ATOM 1715 CA GLU A 140 16.483 5.190 -1.281 1.00 0.00 C ATOM 1716 C GLU A 140 16.928 6.568 -1.725 1.00 0.00 C ATOM 1717 O GLU A 140 16.730 6.908 -2.891 1.00 0.00 O ATOM 1718 CB GLU A 140 15.572 5.166 -0.050 1.00 0.00 C ATOM 1719 CG GLU A 140 14.244 5.915 -0.114 1.00 0.00 C ATOM 1720 CD GLU A 140 13.657 6.233 -1.498 1.00 0.00 C ATOM 1721 OE1 GLU A 140 13.489 5.294 -2.311 1.00 0.00 O ATOM 1722 OE2 GLU A 140 13.320 7.416 -1.759 1.00 0.00 O ATOM 0 H GLU A 140 17.673 3.632 -1.829 1.00 0.00 H new ATOM 0 HA GLU A 140 15.869 4.820 -2.102 1.00 0.00 H new ATOM 0 HB2 GLU A 140 15.354 4.123 0.181 1.00 0.00 H new ATOM 0 HB3 GLU A 140 16.139 5.567 0.790 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.505 5.331 0.435 1.00 0.00 H new ATOM 0 HG3 GLU A 140 14.367 6.857 0.420 1.00 0.00 H new ATOM 1729 N LYS A 141 17.485 7.343 -0.795 1.00 0.00 N ATOM 1730 CA LYS A 141 17.741 8.764 -0.955 1.00 0.00 C ATOM 1731 C LYS A 141 18.724 9.280 0.086 1.00 0.00 C ATOM 1732 O LYS A 141 19.533 10.157 -0.220 1.00 0.00 O ATOM 1733 CB LYS A 141 16.391 9.491 -0.829 1.00 0.00 C ATOM 1734 CG LYS A 141 16.525 10.998 -1.081 1.00 0.00 C ATOM 1735 CD LYS A 141 16.630 11.803 0.225 1.00 0.00 C ATOM 1736 CE LYS A 141 17.216 13.178 -0.098 1.00 0.00 C ATOM 1737 NZ LYS A 141 16.598 14.276 0.667 1.00 0.00 N ATOM 0 H LYS A 141 17.777 6.984 0.114 1.00 0.00 H new ATOM 0 HA LYS A 141 18.194 8.949 -1.929 1.00 0.00 H new ATOM 0 HB2 LYS A 141 15.682 9.066 -1.540 1.00 0.00 H new ATOM 0 HB3 LYS A 141 15.981 9.325 0.167 1.00 0.00 H new ATOM 0 HG2 LYS A 141 17.408 11.184 -1.692 1.00 0.00 H new ATOM 0 HG3 LYS A 141 15.664 11.346 -1.651 1.00 0.00 H new ATOM 0 HD2 LYS A 141 15.647 11.909 0.685 1.00 0.00 H new ATOM 0 HD3 LYS A 141 17.263 11.280 0.942 1.00 0.00 H new ATOM 0 HE2 LYS A 141 18.287 13.164 0.103 1.00 0.00 H new ATOM 0 HE3 LYS A 141 17.094 13.375 -1.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 17.041 15.178 0.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 15.580 14.315 0.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 16.736 14.111 1.684 1.00 0.00 H new ATOM 1751 N ALA A 142 18.615 8.800 1.327 1.00 0.00 N ATOM 1752 CA ALA A 142 19.484 9.165 2.436 1.00 0.00 C ATOM 1753 C ALA A 142 20.842 8.462 2.261 1.00 0.00 C ATOM 1754 O ALA A 142 21.189 7.549 3.012 1.00 0.00 O ATOM 1755 CB ALA A 142 18.761 8.801 3.739 1.00 0.00 C ATOM 0 H ALA A 142 17.896 8.126 1.590 1.00 0.00 H new ATOM 0 HA ALA A 142 19.695 10.234 2.466 1.00 0.00 H new ATOM 0 HB1 ALA A 142 19.390 9.064 4.590 1.00 0.00 H new ATOM 0 HB2 ALA A 142 17.821 9.350 3.799 1.00 0.00 H new ATOM 0 HB3 ALA A 142 18.558 7.730 3.755 1.00 0.00 H new ATOM 1761 N MET A 143 21.577 8.854 1.220 1.00 0.00 N ATOM 1762 CA MET A 143 22.699 8.135 0.624 1.00 0.00 C ATOM 1763 C MET A 143 23.831 9.104 0.342 1.00 0.00 C ATOM 1764 O MET A 143 24.924 8.646 -0.058 1.00 0.00 O ATOM 1765 CB MET A 143 22.257 7.518 -0.713 1.00 0.00 C ATOM 1766 CG MET A 143 21.136 6.488 -0.589 1.00 0.00 C ATOM 1767 SD MET A 143 20.461 5.963 -2.189 1.00 0.00 S ATOM 1768 CE MET A 143 21.827 4.950 -2.798 1.00 0.00 C ATOM 0 H MET A 143 21.392 9.736 0.743 1.00 0.00 H new ATOM 0 HA MET A 143 23.029 7.358 1.313 1.00 0.00 H new ATOM 0 HB2 MET A 143 21.929 8.317 -1.378 1.00 0.00 H new ATOM 0 HB3 MET A 143 23.119 7.045 -1.184 1.00 0.00 H new ATOM 0 HG2 MET A 143 21.513 5.614 -0.057 1.00 0.00 H new ATOM 0 HG3 MET A 143 20.332 6.907 0.016 1.00 0.00 H new ATOM 0 HE1 MET A 143 21.475 4.315 -3.611 1.00 0.00 H new ATOM 0 HE2 MET A 143 22.625 5.597 -3.162 1.00 0.00 H new ATOM 0 HE3 MET A 143 22.206 4.326 -1.989 1.00 0.00 H new TER 1778 MET A 143