USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1045 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 129 GLN : amide:sc= 0.222 K(o=0.75,f=-0.3) USER MOD Set 1.2: A 139 THR OG1 : rot 180:sc= 0.525 USER MOD Set 2.1: A 113 THR OG1 : rot 180:sc= 0.0079 USER MOD Set 2.2: A 114 HIS : no HD1:sc= -0.215 K(o=-0.21,f=-3.8!) USER MOD Set 3.1: A 74 TYR OH : rot -68:sc= 1.03 USER MOD Set 3.2: A 108 TYR OH : rot 30:sc= 0.876 USER MOD Set 4.1: A 72 ASN :FLIP amide:sc= -1.02 F(o=-2.6!,f=-1.4) USER MOD Set 4.2: A 95 MET CE :methyl -138:sc= -0.365 (180deg=-0.856) USER MOD Single : A 1 ILE N :NH3+ 150:sc=-0.00825 (180deg=-0.0492) USER MOD Single : A 3 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0369) USER MOD Single : A 4 HIS : no HD1:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.454 X(o=-0.45,f=-0.58) USER MOD Single : A 20 THR OG1 : rot 130:sc= -0.159 USER MOD Single : A 21 GLN : amide:sc=-0.00452 X(o=-0.0045,f=-0.41) USER MOD Single : A 26 THR OG1 : rot -63:sc= 0.189 USER MOD Single : A 27 SER OG : rot -150:sc= 0.216 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= -0.115 K(o=-0.11,f=-0.8) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0.108 USER MOD Single : A 48 GLN : amide:sc= -0.018 X(o=-0.018,f=-0.018) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0.11 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.0189 X(o=-0.019,f=-0.22) USER MOD Single : A 64 HIS : no HD1:sc= -0.0114 X(o=-0.011,f=-0.091) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 25:sc= 0.89 USER MOD Single : A 75 MET CE :methyl -115:sc= -0.04 (180deg=-1.48!) USER MOD Single : A 77 SER OG : rot 180:sc= 0.0116 USER MOD Single : A 78 TYR OH : rot 132:sc= 1.12 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= -0.0175 USER MOD Single : A 89 THR OG1 : rot 180:sc=0.000964 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.07 USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc=-0.00083 X(o=-0.00083,f=0) USER MOD Single : A 110 ASN : amide:sc= 0.273 X(o=0.27,f=0) USER MOD Single : A 118 THR OG1 : rot 3:sc= 0.465 USER MOD Single : A 121 GLN : amide:sc= -0.374 K(o=-0.37,f=-1.2) USER MOD Single : A 122 MET CE :methyl -116:sc= -0.015 (180deg=-0.166) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 127 GLN : amide:sc= 0.92 K(o=0.92,f=0) USER MOD Single : A 128 MET CE :methyl -171:sc= -0.546 (180deg=-0.596) USER MOD Single : A 134 ASN : amide:sc= 0.97 K(o=0.97,f=-0.038) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot -41:sc= 0.577 USER MOD Single : A 144 THR OG1 : rot 180:sc= -0.051 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 1 29.669 27.505 5.178 1.00 0.00 N ATOM 2 CA ILE A 1 29.483 26.473 4.143 1.00 0.00 C ATOM 3 C ILE A 1 30.813 26.200 3.428 1.00 0.00 C ATOM 4 O ILE A 1 31.126 26.876 2.454 1.00 0.00 O ATOM 5 CB ILE A 1 28.302 26.785 3.194 1.00 0.00 C ATOM 6 CG1 ILE A 1 28.279 28.241 2.664 1.00 0.00 C ATOM 7 CG2 ILE A 1 26.994 26.464 3.943 1.00 0.00 C ATOM 8 CD1 ILE A 1 27.290 28.448 1.511 1.00 0.00 C ATOM 0 H1 ILE A 1 28.785 28.040 5.297 1.00 0.00 H new ATOM 0 H2 ILE A 1 29.923 27.051 6.079 1.00 0.00 H new ATOM 0 H3 ILE A 1 30.430 28.153 4.890 1.00 0.00 H new ATOM 0 HA ILE A 1 29.188 25.542 4.628 1.00 0.00 H new ATOM 0 HB ILE A 1 28.419 26.164 2.306 1.00 0.00 H new ATOM 0 HG12 ILE A 1 28.020 28.914 3.481 1.00 0.00 H new ATOM 0 HG13 ILE A 1 29.280 28.515 2.330 1.00 0.00 H new ATOM 0 HG21 ILE A 1 26.143 26.675 3.296 1.00 0.00 H new ATOM 0 HG22 ILE A 1 26.984 25.411 4.223 1.00 0.00 H new ATOM 0 HG23 ILE A 1 26.929 27.079 4.841 1.00 0.00 H new ATOM 0 HD11 ILE A 1 27.323 29.488 1.186 1.00 0.00 H new ATOM 0 HD12 ILE A 1 27.561 27.799 0.678 1.00 0.00 H new ATOM 0 HD13 ILE A 1 26.282 28.205 1.848 1.00 0.00 H new ATOM 20 N PRO A 2 31.664 25.301 3.957 1.00 0.00 N ATOM 21 CA PRO A 2 32.794 24.771 3.195 1.00 0.00 C ATOM 22 C PRO A 2 32.281 23.903 2.029 1.00 0.00 C ATOM 23 O PRO A 2 31.073 23.769 1.833 1.00 0.00 O ATOM 24 CB PRO A 2 33.609 23.969 4.217 1.00 0.00 C ATOM 25 CG PRO A 2 32.532 23.417 5.150 1.00 0.00 C ATOM 26 CD PRO A 2 31.492 24.540 5.191 1.00 0.00 C ATOM 0 HA PRO A 2 33.408 25.545 2.734 1.00 0.00 H new ATOM 0 HB2 PRO A 2 34.181 23.171 3.742 1.00 0.00 H new ATOM 0 HB3 PRO A 2 34.322 24.599 4.750 1.00 0.00 H new ATOM 0 HG2 PRO A 2 32.107 22.489 4.769 1.00 0.00 H new ATOM 0 HG3 PRO A 2 32.931 23.201 6.141 1.00 0.00 H new ATOM 0 HD2 PRO A 2 30.483 24.134 5.260 1.00 0.00 H new ATOM 0 HD3 PRO A 2 31.640 25.176 6.064 1.00 0.00 H new ATOM 34 N LYS A 3 33.187 23.294 1.262 1.00 0.00 N ATOM 35 CA LYS A 3 32.879 22.189 0.356 1.00 0.00 C ATOM 36 C LYS A 3 34.018 21.174 0.442 1.00 0.00 C ATOM 37 O LYS A 3 35.043 21.473 1.056 1.00 0.00 O ATOM 38 CB LYS A 3 32.628 22.680 -1.084 1.00 0.00 C ATOM 39 CG LYS A 3 33.822 23.394 -1.754 1.00 0.00 C ATOM 40 CD LYS A 3 33.696 24.928 -1.790 1.00 0.00 C ATOM 41 CE LYS A 3 32.553 25.439 -2.685 1.00 0.00 C ATOM 42 NZ LYS A 3 32.701 25.043 -4.107 1.00 0.00 N ATOM 0 H LYS A 3 34.172 23.560 1.254 1.00 0.00 H new ATOM 0 HA LYS A 3 31.949 21.708 0.658 1.00 0.00 H new ATOM 0 HB2 LYS A 3 32.346 21.825 -1.698 1.00 0.00 H new ATOM 0 HB3 LYS A 3 31.777 23.361 -1.075 1.00 0.00 H new ATOM 0 HG2 LYS A 3 34.736 23.127 -1.223 1.00 0.00 H new ATOM 0 HG3 LYS A 3 33.927 23.025 -2.774 1.00 0.00 H new ATOM 0 HD2 LYS A 3 33.541 25.294 -0.775 1.00 0.00 H new ATOM 0 HD3 LYS A 3 34.637 25.352 -2.141 1.00 0.00 H new ATOM 0 HE2 LYS A 3 31.605 25.058 -2.305 1.00 0.00 H new ATOM 0 HE3 LYS A 3 32.508 26.526 -2.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 31.959 25.500 -4.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 33.635 25.340 -4.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 32.613 24.010 -4.191 1.00 0.00 H new ATOM 56 N HIS A 4 33.855 20.021 -0.195 1.00 0.00 N ATOM 57 CA HIS A 4 34.839 18.954 -0.306 1.00 0.00 C ATOM 58 C HIS A 4 34.786 18.420 -1.742 1.00 0.00 C ATOM 59 O HIS A 4 33.787 18.661 -2.427 1.00 0.00 O ATOM 60 CB HIS A 4 34.510 17.856 0.724 1.00 0.00 C ATOM 61 CG HIS A 4 33.063 17.419 0.708 1.00 0.00 C ATOM 62 ND1 HIS A 4 32.474 16.545 -0.182 1.00 0.00 N ATOM 63 CD2 HIS A 4 32.084 17.870 1.552 1.00 0.00 C ATOM 64 CE1 HIS A 4 31.166 16.476 0.125 1.00 0.00 C ATOM 65 NE2 HIS A 4 30.881 17.280 1.164 1.00 0.00 N ATOM 0 H HIS A 4 32.984 19.794 -0.674 1.00 0.00 H new ATOM 0 HA HIS A 4 35.847 19.312 -0.096 1.00 0.00 H new ATOM 0 HB2 HIS A 4 35.144 16.990 0.533 1.00 0.00 H new ATOM 0 HB3 HIS A 4 34.759 18.220 1.721 1.00 0.00 H new ATOM 0 HD2 HIS A 4 32.219 18.560 2.372 1.00 0.00 H new ATOM 0 HE1 HIS A 4 30.445 15.860 -0.392 1.00 0.00 H new ATOM 0 HE2 HIS A 4 29.964 17.429 1.586 1.00 0.00 H new ATOM 73 N PRO A 5 35.829 17.726 -2.221 1.00 0.00 N ATOM 74 CA PRO A 5 35.779 16.984 -3.464 1.00 0.00 C ATOM 75 C PRO A 5 34.994 15.688 -3.228 1.00 0.00 C ATOM 76 O PRO A 5 35.548 14.705 -2.743 1.00 0.00 O ATOM 77 CB PRO A 5 37.239 16.745 -3.856 1.00 0.00 C ATOM 78 CG PRO A 5 37.962 16.659 -2.511 1.00 0.00 C ATOM 79 CD PRO A 5 37.129 17.550 -1.586 1.00 0.00 C ATOM 0 HA PRO A 5 35.269 17.507 -4.273 1.00 0.00 H new ATOM 0 HB2 PRO A 5 37.354 15.827 -4.433 1.00 0.00 H new ATOM 0 HB3 PRO A 5 37.628 17.558 -4.469 1.00 0.00 H new ATOM 0 HG2 PRO A 5 38.004 15.633 -2.145 1.00 0.00 H new ATOM 0 HG3 PRO A 5 38.990 17.013 -2.587 1.00 0.00 H new ATOM 0 HD2 PRO A 5 37.019 17.090 -0.604 1.00 0.00 H new ATOM 0 HD3 PRO A 5 37.618 18.512 -1.435 1.00 0.00 H new ATOM 87 N ASP A 6 33.702 15.707 -3.527 1.00 0.00 N ATOM 88 CA ASP A 6 32.878 14.523 -3.777 1.00 0.00 C ATOM 89 C ASP A 6 32.060 14.805 -5.046 1.00 0.00 C ATOM 90 O ASP A 6 32.070 15.939 -5.533 1.00 0.00 O ATOM 91 CB ASP A 6 32.006 14.209 -2.547 1.00 0.00 C ATOM 92 CG ASP A 6 31.260 12.873 -2.630 1.00 0.00 C ATOM 93 OD1 ASP A 6 31.595 12.038 -3.498 1.00 0.00 O ATOM 94 OD2 ASP A 6 30.340 12.678 -1.805 1.00 0.00 O ATOM 0 H ASP A 6 33.176 16.577 -3.606 1.00 0.00 H new ATOM 0 HA ASP A 6 33.484 13.632 -3.939 1.00 0.00 H new ATOM 0 HB2 ASP A 6 32.638 14.205 -1.659 1.00 0.00 H new ATOM 0 HB3 ASP A 6 31.279 15.011 -2.417 1.00 0.00 H new ATOM 99 N SER A 7 31.390 13.798 -5.602 1.00 0.00 N ATOM 100 CA SER A 7 30.539 13.902 -6.784 1.00 0.00 C ATOM 101 C SER A 7 29.076 13.689 -6.386 1.00 0.00 C ATOM 102 O SER A 7 28.798 13.036 -5.381 1.00 0.00 O ATOM 103 CB SER A 7 30.959 12.835 -7.801 1.00 0.00 C ATOM 104 OG SER A 7 32.362 12.854 -7.987 1.00 0.00 O ATOM 0 H SER A 7 31.427 12.850 -5.226 1.00 0.00 H new ATOM 0 HA SER A 7 30.647 14.892 -7.227 1.00 0.00 H new ATOM 0 HB2 SER A 7 30.645 11.850 -7.455 1.00 0.00 H new ATOM 0 HB3 SER A 7 30.457 13.013 -8.752 1.00 0.00 H new ATOM 0 HG SER A 7 32.615 12.166 -8.638 1.00 0.00 H new ATOM 110 N GLU A 8 28.133 14.150 -7.208 1.00 0.00 N ATOM 111 CA GLU A 8 26.699 14.073 -6.923 1.00 0.00 C ATOM 112 C GLU A 8 25.998 12.970 -7.726 1.00 0.00 C ATOM 113 O GLU A 8 24.772 12.895 -7.797 1.00 0.00 O ATOM 114 CB GLU A 8 26.055 15.468 -7.108 1.00 0.00 C ATOM 115 CG GLU A 8 26.426 16.250 -8.385 1.00 0.00 C ATOM 116 CD GLU A 8 26.263 15.444 -9.677 1.00 0.00 C ATOM 117 OE1 GLU A 8 27.178 14.647 -9.991 1.00 0.00 O ATOM 118 OE2 GLU A 8 25.233 15.599 -10.379 1.00 0.00 O ATOM 0 H GLU A 8 28.346 14.593 -8.102 1.00 0.00 H new ATOM 0 HA GLU A 8 26.567 13.781 -5.881 1.00 0.00 H new ATOM 0 HB2 GLU A 8 24.972 15.346 -7.089 1.00 0.00 H new ATOM 0 HB3 GLU A 8 26.322 16.081 -6.247 1.00 0.00 H new ATOM 0 HG2 GLU A 8 25.805 17.144 -8.445 1.00 0.00 H new ATOM 0 HG3 GLU A 8 27.460 16.586 -8.306 1.00 0.00 H new ATOM 125 N ALA A 9 26.789 12.075 -8.310 1.00 0.00 N ATOM 126 CA ALA A 9 26.343 11.099 -9.299 1.00 0.00 C ATOM 127 C ALA A 9 25.815 9.816 -8.648 1.00 0.00 C ATOM 128 O ALA A 9 25.940 8.712 -9.190 1.00 0.00 O ATOM 129 CB ALA A 9 27.488 10.849 -10.294 1.00 0.00 C ATOM 0 H ALA A 9 27.785 12.007 -8.103 1.00 0.00 H new ATOM 0 HA ALA A 9 25.491 11.499 -9.849 1.00 0.00 H new ATOM 0 HB1 ALA A 9 27.169 10.121 -11.040 1.00 0.00 H new ATOM 0 HB2 ALA A 9 27.751 11.784 -10.789 1.00 0.00 H new ATOM 0 HB3 ALA A 9 28.357 10.464 -9.760 1.00 0.00 H new ATOM 135 N VAL A 10 25.180 9.969 -7.494 1.00 0.00 N ATOM 136 CA VAL A 10 24.729 8.917 -6.599 1.00 0.00 C ATOM 137 C VAL A 10 23.466 9.408 -5.881 1.00 0.00 C ATOM 138 O VAL A 10 23.261 10.612 -5.711 1.00 0.00 O ATOM 139 CB VAL A 10 25.892 8.518 -5.656 1.00 0.00 C ATOM 140 CG1 VAL A 10 26.476 9.686 -4.843 1.00 0.00 C ATOM 141 CG2 VAL A 10 25.492 7.376 -4.712 1.00 0.00 C ATOM 0 H VAL A 10 24.952 10.896 -7.136 1.00 0.00 H new ATOM 0 HA VAL A 10 24.454 8.007 -7.132 1.00 0.00 H new ATOM 0 HB VAL A 10 26.682 8.177 -6.325 1.00 0.00 H new ATOM 0 HG11 VAL A 10 27.284 9.320 -4.210 1.00 0.00 H new ATOM 0 HG12 VAL A 10 26.863 10.445 -5.523 1.00 0.00 H new ATOM 0 HG13 VAL A 10 25.695 10.122 -4.220 1.00 0.00 H new ATOM 0 HG21 VAL A 10 26.334 7.125 -4.067 1.00 0.00 H new ATOM 0 HG22 VAL A 10 24.647 7.689 -4.100 1.00 0.00 H new ATOM 0 HG23 VAL A 10 25.211 6.501 -5.298 1.00 0.00 H new ATOM 151 N ALA A 11 22.615 8.463 -5.489 1.00 0.00 N ATOM 152 CA ALA A 11 21.338 8.661 -4.821 1.00 0.00 C ATOM 153 C ALA A 11 21.183 7.564 -3.755 1.00 0.00 C ATOM 154 O ALA A 11 21.796 6.502 -3.903 1.00 0.00 O ATOM 155 CB ALA A 11 20.235 8.579 -5.890 1.00 0.00 C ATOM 0 H ALA A 11 22.816 7.475 -5.641 1.00 0.00 H new ATOM 0 HA ALA A 11 21.274 9.630 -4.326 1.00 0.00 H new ATOM 0 HB1 ALA A 11 19.262 8.724 -5.421 1.00 0.00 H new ATOM 0 HB2 ALA A 11 20.396 9.355 -6.639 1.00 0.00 H new ATOM 0 HB3 ALA A 11 20.265 7.600 -6.369 1.00 0.00 H new ATOM 161 N PRO A 12 20.358 7.776 -2.716 1.00 0.00 N ATOM 162 CA PRO A 12 20.190 6.831 -1.617 1.00 0.00 C ATOM 163 C PRO A 12 19.366 5.615 -2.059 1.00 0.00 C ATOM 164 O PRO A 12 18.829 5.587 -3.174 1.00 0.00 O ATOM 165 CB PRO A 12 19.497 7.632 -0.508 1.00 0.00 C ATOM 166 CG PRO A 12 18.675 8.662 -1.281 1.00 0.00 C ATOM 167 CD PRO A 12 19.536 8.955 -2.506 1.00 0.00 C ATOM 0 HA PRO A 12 21.139 6.421 -1.271 1.00 0.00 H new ATOM 0 HB2 PRO A 12 18.865 6.997 0.113 1.00 0.00 H new ATOM 0 HB3 PRO A 12 20.219 8.109 0.155 1.00 0.00 H new ATOM 0 HG2 PRO A 12 17.698 8.268 -1.561 1.00 0.00 H new ATOM 0 HG3 PRO A 12 18.498 9.561 -0.690 1.00 0.00 H new ATOM 0 HD2 PRO A 12 18.915 9.157 -3.379 1.00 0.00 H new ATOM 0 HD3 PRO A 12 20.155 9.837 -2.344 1.00 0.00 H new ATOM 175 N ASP A 13 19.251 4.611 -1.188 1.00 0.00 N ATOM 176 CA ASP A 13 18.429 3.417 -1.403 1.00 0.00 C ATOM 177 C ASP A 13 16.940 3.795 -1.510 1.00 0.00 C ATOM 178 O ASP A 13 16.546 4.895 -1.105 1.00 0.00 O ATOM 179 CB ASP A 13 18.682 2.382 -0.283 1.00 0.00 C ATOM 180 CG ASP A 13 19.345 1.116 -0.831 1.00 0.00 C ATOM 181 OD1 ASP A 13 20.445 1.236 -1.429 1.00 0.00 O ATOM 182 OD2 ASP A 13 18.787 0.006 -0.687 1.00 0.00 O ATOM 0 H ASP A 13 19.738 4.605 -0.292 1.00 0.00 H new ATOM 0 HA ASP A 13 18.715 2.956 -2.349 1.00 0.00 H new ATOM 0 HB2 ASP A 13 19.317 2.823 0.485 1.00 0.00 H new ATOM 0 HB3 ASP A 13 17.737 2.122 0.194 1.00 0.00 H new ATOM 187 N PRO A 14 16.096 2.931 -2.099 1.00 0.00 N ATOM 188 CA PRO A 14 14.692 3.223 -2.351 1.00 0.00 C ATOM 189 C PRO A 14 13.847 3.122 -1.074 1.00 0.00 C ATOM 190 O PRO A 14 14.315 2.698 -0.019 1.00 0.00 O ATOM 191 CB PRO A 14 14.268 2.202 -3.414 1.00 0.00 C ATOM 192 CG PRO A 14 15.167 1.001 -3.139 1.00 0.00 C ATOM 193 CD PRO A 14 16.452 1.622 -2.617 1.00 0.00 C ATOM 0 HA PRO A 14 14.541 4.247 -2.694 1.00 0.00 H new ATOM 0 HB2 PRO A 14 13.213 1.942 -3.322 1.00 0.00 H new ATOM 0 HB3 PRO A 14 14.414 2.589 -4.422 1.00 0.00 H new ATOM 0 HG2 PRO A 14 14.722 0.328 -2.407 1.00 0.00 H new ATOM 0 HG3 PRO A 14 15.343 0.418 -4.043 1.00 0.00 H new ATOM 0 HD2 PRO A 14 16.893 1.003 -1.836 1.00 0.00 H new ATOM 0 HD3 PRO A 14 17.193 1.708 -3.412 1.00 0.00 H new ATOM 201 N PHE A 15 12.555 3.455 -1.202 1.00 0.00 N ATOM 202 CA PHE A 15 11.551 3.318 -0.149 1.00 0.00 C ATOM 203 C PHE A 15 11.988 4.052 1.130 1.00 0.00 C ATOM 204 O PHE A 15 12.012 3.488 2.227 1.00 0.00 O ATOM 205 CB PHE A 15 11.207 1.830 0.054 1.00 0.00 C ATOM 206 CG PHE A 15 10.830 1.077 -1.212 1.00 0.00 C ATOM 207 CD1 PHE A 15 9.667 1.428 -1.929 1.00 0.00 C ATOM 208 CD2 PHE A 15 11.613 -0.010 -1.646 1.00 0.00 C ATOM 209 CE1 PHE A 15 9.266 0.667 -3.040 1.00 0.00 C ATOM 210 CE2 PHE A 15 11.203 -0.781 -2.748 1.00 0.00 C ATOM 211 CZ PHE A 15 10.013 -0.459 -3.422 1.00 0.00 C ATOM 0 H PHE A 15 12.173 3.837 -2.067 1.00 0.00 H new ATOM 0 HA PHE A 15 10.625 3.807 -0.450 1.00 0.00 H new ATOM 0 HB2 PHE A 15 12.063 1.334 0.512 1.00 0.00 H new ATOM 0 HB3 PHE A 15 10.381 1.757 0.761 1.00 0.00 H new ATOM 0 HD1 PHE A 15 9.083 2.284 -1.623 1.00 0.00 H new ATOM 0 HD2 PHE A 15 12.531 -0.252 -1.131 1.00 0.00 H new ATOM 0 HE1 PHE A 15 8.385 0.947 -3.599 1.00 0.00 H new ATOM 0 HE2 PHE A 15 11.801 -1.618 -3.075 1.00 0.00 H new ATOM 0 HZ PHE A 15 9.671 -1.080 -4.237 1.00 0.00 H new ATOM 221 N ASN A 16 12.307 5.340 0.995 1.00 0.00 N ATOM 222 CA ASN A 16 12.805 6.174 2.093 1.00 0.00 C ATOM 223 C ASN A 16 11.663 6.867 2.837 1.00 0.00 C ATOM 224 O ASN A 16 10.609 7.095 2.236 1.00 0.00 O ATOM 225 CB ASN A 16 13.794 7.214 1.540 1.00 0.00 C ATOM 226 CG ASN A 16 15.195 6.948 2.070 1.00 0.00 C ATOM 227 OD1 ASN A 16 15.700 5.835 2.019 1.00 0.00 O ATOM 228 ND2 ASN A 16 15.827 7.940 2.652 1.00 0.00 N ATOM 0 H ASN A 16 12.226 5.841 0.110 1.00 0.00 H new ATOM 0 HA ASN A 16 13.315 5.529 2.808 1.00 0.00 H new ATOM 0 HB2 ASN A 16 13.798 7.178 0.451 1.00 0.00 H new ATOM 0 HB3 ASN A 16 13.475 8.216 1.825 1.00 0.00 H new ATOM 0 HD21 ASN A 16 16.746 7.786 3.066 1.00 0.00 H new ATOM 0 HD22 ASN A 16 15.399 8.865 2.690 1.00 0.00 H new ATOM 235 N PRO A 17 11.856 7.275 4.107 1.00 0.00 N ATOM 236 CA PRO A 17 10.862 8.015 4.887 1.00 0.00 C ATOM 237 C PRO A 17 10.566 9.403 4.311 1.00 0.00 C ATOM 238 O PRO A 17 9.402 9.809 4.294 1.00 0.00 O ATOM 239 CB PRO A 17 11.414 8.120 6.315 1.00 0.00 C ATOM 240 CG PRO A 17 12.909 7.844 6.155 1.00 0.00 C ATOM 241 CD PRO A 17 12.997 6.930 4.941 1.00 0.00 C ATOM 0 HA PRO A 17 9.909 7.486 4.862 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.234 9.107 6.741 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.943 7.395 6.979 1.00 0.00 H new ATOM 0 HG2 PRO A 17 13.469 8.766 6.000 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.322 7.366 7.043 1.00 0.00 H new ATOM 0 HD2 PRO A 17 13.934 7.080 4.405 1.00 0.00 H new ATOM 0 HD3 PRO A 17 12.963 5.881 5.237 1.00 0.00 H new ATOM 249 N ALA A 18 11.595 10.095 3.798 1.00 0.00 N ATOM 250 CA ALA A 18 11.605 11.503 3.382 1.00 0.00 C ATOM 251 C ALA A 18 10.726 11.840 2.158 1.00 0.00 C ATOM 252 O ALA A 18 10.941 12.851 1.490 1.00 0.00 O ATOM 253 CB ALA A 18 13.055 11.923 3.129 1.00 0.00 C ATOM 0 H ALA A 18 12.503 9.654 3.654 1.00 0.00 H new ATOM 0 HA ALA A 18 11.155 12.068 4.199 1.00 0.00 H new ATOM 0 HB1 ALA A 18 13.082 12.968 2.819 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.634 11.801 4.044 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.483 11.300 2.344 1.00 0.00 H new ATOM 259 N ALA A 19 9.756 10.989 1.830 1.00 0.00 N ATOM 260 CA ALA A 19 8.972 11.037 0.613 1.00 0.00 C ATOM 261 C ALA A 19 7.480 10.744 0.840 1.00 0.00 C ATOM 262 O ALA A 19 6.686 10.962 -0.079 1.00 0.00 O ATOM 263 CB ALA A 19 9.636 10.062 -0.354 1.00 0.00 C ATOM 0 H ALA A 19 9.489 10.215 2.438 1.00 0.00 H new ATOM 0 HA ALA A 19 8.965 12.045 0.199 1.00 0.00 H new ATOM 0 HB1 ALA A 19 9.087 10.053 -1.296 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.665 10.374 -0.536 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.631 9.061 0.078 1.00 0.00 H new ATOM 269 N THR A 20 7.057 10.311 2.036 1.00 0.00 N ATOM 270 CA THR A 20 5.630 10.126 2.309 1.00 0.00 C ATOM 271 C THR A 20 4.912 11.439 2.626 1.00 0.00 C ATOM 272 O THR A 20 3.703 11.517 2.435 1.00 0.00 O ATOM 273 CB THR A 20 5.412 9.055 3.383 1.00 0.00 C ATOM 274 OG1 THR A 20 5.639 7.816 2.775 1.00 0.00 O ATOM 275 CG2 THR A 20 3.995 8.965 3.930 1.00 0.00 C ATOM 0 H THR A 20 7.674 10.086 2.817 1.00 0.00 H new ATOM 0 HA THR A 20 5.169 9.763 1.391 1.00 0.00 H new ATOM 0 HB THR A 20 6.077 9.316 4.206 1.00 0.00 H new ATOM 0 HG1 THR A 20 6.260 7.292 3.323 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.945 8.178 4.683 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.718 9.918 4.382 1.00 0.00 H new ATOM 0 HG23 THR A 20 3.305 8.734 3.118 1.00 0.00 H new ATOM 283 N GLN A 21 5.612 12.510 3.012 1.00 0.00 N ATOM 284 CA GLN A 21 4.958 13.800 3.246 1.00 0.00 C ATOM 285 C GLN A 21 4.184 14.326 2.035 1.00 0.00 C ATOM 286 O GLN A 21 3.316 15.176 2.199 1.00 0.00 O ATOM 287 CB GLN A 21 5.974 14.845 3.715 1.00 0.00 C ATOM 288 CG GLN A 21 7.267 14.955 2.874 1.00 0.00 C ATOM 289 CD GLN A 21 8.537 14.481 3.590 1.00 0.00 C ATOM 290 OE1 GLN A 21 8.514 13.582 4.432 1.00 0.00 O ATOM 291 NE2 GLN A 21 9.682 15.037 3.246 1.00 0.00 N ATOM 0 H GLN A 21 6.620 12.510 3.168 1.00 0.00 H new ATOM 0 HA GLN A 21 4.223 13.623 4.031 1.00 0.00 H new ATOM 0 HB2 GLN A 21 5.486 15.820 3.724 1.00 0.00 H new ATOM 0 HB3 GLN A 21 6.251 14.617 4.744 1.00 0.00 H new ATOM 0 HG2 GLN A 21 7.142 14.373 1.961 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.402 15.994 2.573 1.00 0.00 H new ATOM 0 HE21 GLN A 21 9.698 15.781 2.549 1.00 0.00 H new ATOM 0 HE22 GLN A 21 10.551 14.723 3.677 1.00 0.00 H new ATOM 300 N LEU A 22 4.469 13.834 0.830 1.00 0.00 N ATOM 301 CA LEU A 22 3.819 14.287 -0.390 1.00 0.00 C ATOM 302 C LEU A 22 2.558 13.458 -0.663 1.00 0.00 C ATOM 303 O LEU A 22 1.950 13.633 -1.718 1.00 0.00 O ATOM 304 CB LEU A 22 4.811 14.246 -1.576 1.00 0.00 C ATOM 305 CG LEU A 22 6.133 15.029 -1.421 1.00 0.00 C ATOM 306 CD1 LEU A 22 6.012 16.321 -0.602 1.00 0.00 C ATOM 307 CD2 LEU A 22 7.242 14.138 -0.852 1.00 0.00 C ATOM 0 H LEU A 22 5.164 13.104 0.676 1.00 0.00 H new ATOM 0 HA LEU A 22 3.505 15.323 -0.265 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.058 13.203 -1.773 1.00 0.00 H new ATOM 0 HB3 LEU A 22 4.296 14.624 -2.459 1.00 0.00 H new ATOM 0 HG LEU A 22 6.398 15.339 -2.432 1.00 0.00 H new ATOM 0 HD11 LEU A 22 6.986 16.807 -0.543 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.300 16.992 -1.083 1.00 0.00 H new ATOM 0 HD13 LEU A 22 5.664 16.083 0.403 1.00 0.00 H new ATOM 0 HD21 LEU A 22 8.160 14.717 -0.754 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.942 13.765 0.127 1.00 0.00 H new ATOM 0 HD23 LEU A 22 7.413 13.297 -1.524 1.00 0.00 H new ATOM 319 N LEU A 23 2.172 12.531 0.226 1.00 0.00 N ATOM 320 CA LEU A 23 1.031 11.640 0.000 1.00 0.00 C ATOM 321 C LEU A 23 -0.273 12.317 0.422 1.00 0.00 C ATOM 322 O LEU A 23 -0.933 11.885 1.362 1.00 0.00 O ATOM 323 CB LEU A 23 1.223 10.259 0.664 1.00 0.00 C ATOM 324 CG LEU A 23 2.388 9.423 0.108 1.00 0.00 C ATOM 325 CD1 LEU A 23 2.337 7.990 0.650 1.00 0.00 C ATOM 326 CD2 LEU A 23 2.385 9.312 -1.414 1.00 0.00 C ATOM 0 H LEU A 23 2.642 12.380 1.118 1.00 0.00 H new ATOM 0 HA LEU A 23 0.969 11.445 -1.071 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.379 10.406 1.733 1.00 0.00 H new ATOM 0 HB3 LEU A 23 0.301 9.688 0.552 1.00 0.00 H new ATOM 0 HG LEU A 23 3.287 9.949 0.428 1.00 0.00 H new ATOM 0 HD11 LEU A 23 3.170 7.417 0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.407 8.010 1.738 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.397 7.523 0.355 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.234 8.709 -1.737 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.459 8.840 -1.743 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.460 10.307 -1.852 1.00 0.00 H new ATOM 338 N ASP A 24 -0.650 13.377 -0.291 1.00 0.00 N ATOM 339 CA ASP A 24 -1.837 14.181 -0.001 1.00 0.00 C ATOM 340 C ASP A 24 -2.816 14.203 -1.152 1.00 0.00 C ATOM 341 O ASP A 24 -3.997 13.935 -0.930 1.00 0.00 O ATOM 342 CB ASP A 24 -1.476 15.596 0.479 1.00 0.00 C ATOM 343 CG ASP A 24 -0.432 16.374 -0.337 1.00 0.00 C ATOM 344 OD1 ASP A 24 -0.364 16.291 -1.585 1.00 0.00 O ATOM 345 OD2 ASP A 24 0.357 17.095 0.315 1.00 0.00 O ATOM 0 H ASP A 24 -0.129 13.708 -1.103 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.347 13.688 0.827 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -2.392 16.187 0.505 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.115 15.522 1.505 1.00 0.00 H new ATOM 350 N ASP A 25 -2.330 14.462 -2.357 1.00 0.00 N ATOM 351 CA ASP A 25 -3.120 14.554 -3.571 1.00 0.00 C ATOM 352 C ASP A 25 -2.448 13.622 -4.576 1.00 0.00 C ATOM 353 O ASP A 25 -1.956 14.047 -5.622 1.00 0.00 O ATOM 354 CB ASP A 25 -3.228 16.022 -4.017 1.00 0.00 C ATOM 355 CG ASP A 25 -4.101 16.840 -3.062 1.00 0.00 C ATOM 356 OD1 ASP A 25 -5.336 16.642 -3.063 1.00 0.00 O ATOM 357 OD2 ASP A 25 -3.562 17.733 -2.365 1.00 0.00 O ATOM 0 H ASP A 25 -1.335 14.620 -2.520 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.155 14.236 -3.444 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -2.232 16.462 -4.067 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -3.647 16.067 -5.022 1.00 0.00 H new ATOM 362 N THR A 26 -2.325 12.340 -4.216 1.00 0.00 N ATOM 363 CA THR A 26 -1.590 11.345 -4.991 1.00 0.00 C ATOM 364 C THR A 26 -2.333 10.012 -4.997 1.00 0.00 C ATOM 365 O THR A 26 -3.172 9.729 -4.146 1.00 0.00 O ATOM 366 CB THR A 26 -0.152 11.192 -4.463 1.00 0.00 C ATOM 367 OG1 THR A 26 -0.177 10.756 -3.122 1.00 0.00 O ATOM 368 CG2 THR A 26 0.674 12.479 -4.526 1.00 0.00 C ATOM 0 H THR A 26 -2.741 11.963 -3.365 1.00 0.00 H new ATOM 0 HA THR A 26 -1.523 11.690 -6.023 1.00 0.00 H new ATOM 0 HB THR A 26 0.324 10.463 -5.118 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.611 11.436 -2.565 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.674 12.289 -4.136 1.00 0.00 H new ATOM 0 HG22 THR A 26 0.745 12.815 -5.560 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.192 13.251 -3.926 1.00 0.00 H new ATOM 376 N SER A 27 -1.998 9.164 -5.955 1.00 0.00 N ATOM 377 CA SER A 27 -2.841 8.088 -6.414 1.00 0.00 C ATOM 378 C SER A 27 -1.980 6.887 -6.725 1.00 0.00 C ATOM 379 O SER A 27 -0.897 7.029 -7.308 1.00 0.00 O ATOM 380 CB SER A 27 -3.590 8.574 -7.646 1.00 0.00 C ATOM 381 OG SER A 27 -2.802 9.364 -8.530 1.00 0.00 O ATOM 0 H SER A 27 -1.105 9.212 -6.445 1.00 0.00 H new ATOM 0 HA SER A 27 -3.564 7.793 -5.653 1.00 0.00 H new ATOM 0 HB2 SER A 27 -3.972 7.710 -8.190 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.454 9.157 -7.327 1.00 0.00 H new ATOM 0 HG SER A 27 -3.377 10.007 -8.994 1.00 0.00 H new ATOM 387 N TRP A 28 -2.443 5.717 -6.298 1.00 0.00 N ATOM 388 CA TRP A 28 -1.634 4.521 -6.234 1.00 0.00 C ATOM 389 C TRP A 28 -2.513 3.286 -6.441 1.00 0.00 C ATOM 390 O TRP A 28 -3.741 3.357 -6.353 1.00 0.00 O ATOM 391 CB TRP A 28 -0.907 4.487 -4.876 1.00 0.00 C ATOM 392 CG TRP A 28 -0.151 5.731 -4.500 1.00 0.00 C ATOM 393 CD1 TRP A 28 -0.660 6.806 -3.850 1.00 0.00 C ATOM 394 CD2 TRP A 28 1.239 6.070 -4.793 1.00 0.00 C ATOM 395 NE1 TRP A 28 0.296 7.798 -3.775 1.00 0.00 N ATOM 396 CE2 TRP A 28 1.496 7.389 -4.318 1.00 0.00 C ATOM 397 CE3 TRP A 28 2.304 5.400 -5.431 1.00 0.00 C ATOM 398 CZ2 TRP A 28 2.753 7.998 -4.450 1.00 0.00 C ATOM 399 CZ3 TRP A 28 3.578 5.990 -5.546 1.00 0.00 C ATOM 400 CH2 TRP A 28 3.810 7.280 -5.034 1.00 0.00 C ATOM 0 H TRP A 28 -3.404 5.579 -5.984 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.886 4.523 -7.027 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.643 4.284 -4.098 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.209 3.650 -4.881 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -1.661 6.875 -3.451 1.00 0.00 H new ATOM 0 HE1 TRP A 28 0.135 8.720 -3.368 1.00 0.00 H new ATOM 0 HE3 TRP A 28 2.139 4.414 -5.840 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 2.907 9.010 -4.106 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.379 5.450 -6.029 1.00 0.00 H new ATOM 0 HH2 TRP A 28 4.796 7.716 -5.090 1.00 0.00 H new ATOM 411 N VAL A 29 -1.913 2.134 -6.711 1.00 0.00 N ATOM 412 CA VAL A 29 -2.619 0.860 -6.852 1.00 0.00 C ATOM 413 C VAL A 29 -1.749 -0.217 -6.230 1.00 0.00 C ATOM 414 O VAL A 29 -0.586 -0.343 -6.599 1.00 0.00 O ATOM 415 CB VAL A 29 -2.923 0.580 -8.334 1.00 0.00 C ATOM 416 CG1 VAL A 29 -3.519 -0.810 -8.597 1.00 0.00 C ATOM 417 CG2 VAL A 29 -3.837 1.644 -8.930 1.00 0.00 C ATOM 0 H VAL A 29 -0.905 2.054 -6.841 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.581 0.883 -6.340 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.951 0.611 -8.827 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.705 -0.930 -9.664 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -2.819 -1.575 -8.262 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.457 -0.913 -8.051 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -4.030 1.413 -9.978 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.780 1.662 -8.383 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.356 2.619 -8.856 1.00 0.00 H new ATOM 427 N LEU A 30 -2.298 -0.947 -5.261 1.00 0.00 N ATOM 428 CA LEU A 30 -1.655 -2.102 -4.660 1.00 0.00 C ATOM 429 C LEU A 30 -1.520 -3.148 -5.748 1.00 0.00 C ATOM 430 O LEU A 30 -2.504 -3.461 -6.418 1.00 0.00 O ATOM 431 CB LEU A 30 -2.549 -2.639 -3.541 1.00 0.00 C ATOM 432 CG LEU A 30 -2.019 -3.820 -2.709 1.00 0.00 C ATOM 433 CD1 LEU A 30 -2.156 -5.201 -3.357 1.00 0.00 C ATOM 434 CD2 LEU A 30 -0.603 -3.598 -2.201 1.00 0.00 C ATOM 0 H LEU A 30 -3.218 -0.745 -4.869 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.680 -1.846 -4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.763 -1.817 -2.858 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.498 -2.940 -3.985 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.694 -3.836 -1.854 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -1.752 -5.959 -2.686 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.208 -5.410 -3.549 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.605 -5.218 -4.297 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.284 -4.464 -1.621 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.070 -3.460 -3.047 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.578 -2.710 -1.570 1.00 0.00 H new ATOM 446 N SER A 31 -0.326 -3.709 -5.892 1.00 0.00 N ATOM 447 CA SER A 31 -0.065 -4.701 -6.922 1.00 0.00 C ATOM 448 C SER A 31 0.718 -5.909 -6.372 1.00 0.00 C ATOM 449 O SER A 31 0.892 -6.906 -7.080 1.00 0.00 O ATOM 450 CB SER A 31 0.678 -3.989 -8.075 1.00 0.00 C ATOM 451 OG SER A 31 0.212 -4.322 -9.372 1.00 0.00 O ATOM 0 H SER A 31 0.479 -3.491 -5.305 1.00 0.00 H new ATOM 0 HA SER A 31 -1.002 -5.117 -7.292 1.00 0.00 H new ATOM 0 HB2 SER A 31 0.589 -2.912 -7.937 1.00 0.00 H new ATOM 0 HB3 SER A 31 1.739 -4.232 -8.011 1.00 0.00 H new ATOM 0 HG SER A 31 0.731 -3.830 -10.042 1.00 0.00 H new ATOM 457 N ALA A 32 1.169 -5.871 -5.106 1.00 0.00 N ATOM 458 CA ALA A 32 1.726 -7.039 -4.424 1.00 0.00 C ATOM 459 C ALA A 32 1.669 -6.865 -2.917 1.00 0.00 C ATOM 460 O ALA A 32 1.568 -5.749 -2.411 1.00 0.00 O ATOM 461 CB ALA A 32 3.185 -7.277 -4.824 1.00 0.00 C ATOM 0 H ALA A 32 1.155 -5.028 -4.532 1.00 0.00 H new ATOM 0 HA ALA A 32 1.122 -7.895 -4.724 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.568 -8.152 -4.299 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.245 -7.444 -5.899 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.782 -6.405 -4.558 1.00 0.00 H new ATOM 467 N TRP A 33 1.795 -7.976 -2.198 1.00 0.00 N ATOM 468 CA TRP A 33 1.825 -8.010 -0.750 1.00 0.00 C ATOM 469 C TRP A 33 2.766 -9.130 -0.351 1.00 0.00 C ATOM 470 O TRP A 33 2.521 -10.291 -0.671 1.00 0.00 O ATOM 471 CB TRP A 33 0.398 -8.228 -0.242 1.00 0.00 C ATOM 472 CG TRP A 33 0.134 -8.184 1.232 1.00 0.00 C ATOM 473 CD1 TRP A 33 1.018 -8.102 2.256 1.00 0.00 C ATOM 474 CD2 TRP A 33 -1.182 -8.168 1.846 1.00 0.00 C ATOM 475 NE1 TRP A 33 0.332 -8.037 3.454 1.00 0.00 N ATOM 476 CE2 TRP A 33 -1.033 -8.059 3.257 1.00 0.00 C ATOM 477 CE3 TRP A 33 -2.489 -8.227 1.324 1.00 0.00 C ATOM 478 CZ2 TRP A 33 -2.142 -7.998 4.113 1.00 0.00 C ATOM 479 CZ3 TRP A 33 -3.607 -8.132 2.167 1.00 0.00 C ATOM 480 CH2 TRP A 33 -3.427 -8.015 3.554 1.00 0.00 C ATOM 0 H TRP A 33 1.881 -8.899 -2.623 1.00 0.00 H new ATOM 0 HA TRP A 33 2.186 -7.080 -0.311 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -0.236 -7.476 -0.712 1.00 0.00 H new ATOM 0 HB3 TRP A 33 0.064 -9.200 -0.607 1.00 0.00 H new ATOM 0 HD1 TRP A 33 2.093 -8.089 2.152 1.00 0.00 H new ATOM 0 HE1 TRP A 33 0.779 -7.980 4.369 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -2.633 -8.347 0.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -2.008 -7.939 5.183 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -4.603 -8.149 1.750 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -4.290 -7.937 4.199 1.00 0.00 H new ATOM 491 N LYS A 34 3.862 -8.801 0.319 1.00 0.00 N ATOM 492 CA LYS A 34 4.790 -9.768 0.869 1.00 0.00 C ATOM 493 C LYS A 34 4.520 -9.881 2.363 1.00 0.00 C ATOM 494 O LYS A 34 4.278 -8.862 3.008 1.00 0.00 O ATOM 495 CB LYS A 34 6.213 -9.272 0.595 1.00 0.00 C ATOM 496 CG LYS A 34 7.177 -10.452 0.448 1.00 0.00 C ATOM 497 CD LYS A 34 7.486 -10.736 -1.030 1.00 0.00 C ATOM 498 CE LYS A 34 8.720 -9.927 -1.442 1.00 0.00 C ATOM 499 NZ LYS A 34 9.316 -10.412 -2.703 1.00 0.00 N ATOM 0 H LYS A 34 4.132 -7.834 0.497 1.00 0.00 H new ATOM 0 HA LYS A 34 4.671 -10.752 0.415 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.225 -8.670 -0.314 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.542 -8.626 1.409 1.00 0.00 H new ATOM 0 HG2 LYS A 34 8.103 -10.237 0.981 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.743 -11.339 0.909 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.666 -11.801 -1.180 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.633 -10.466 -1.652 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.443 -8.879 -1.554 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.465 -9.977 -0.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.147 -9.833 -2.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 9.606 -11.404 -2.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.615 -10.340 -3.468 1.00 0.00 H new ATOM 513 N GLN A 35 4.541 -11.085 2.923 1.00 0.00 N ATOM 514 CA GLN A 35 4.555 -11.281 4.366 1.00 0.00 C ATOM 515 C GLN A 35 5.919 -10.872 4.919 1.00 0.00 C ATOM 516 O GLN A 35 6.877 -10.712 4.160 1.00 0.00 O ATOM 517 CB GLN A 35 4.247 -12.748 4.696 1.00 0.00 C ATOM 518 CG GLN A 35 2.842 -13.142 4.209 1.00 0.00 C ATOM 519 CD GLN A 35 2.182 -14.248 5.027 1.00 0.00 C ATOM 520 OE1 GLN A 35 0.961 -14.279 5.127 1.00 0.00 O ATOM 521 NE2 GLN A 35 2.937 -15.150 5.635 1.00 0.00 N ATOM 0 H GLN A 35 4.549 -11.953 2.388 1.00 0.00 H new ATOM 0 HA GLN A 35 3.789 -10.660 4.830 1.00 0.00 H new ATOM 0 HB2 GLN A 35 4.991 -13.393 4.229 1.00 0.00 H new ATOM 0 HB3 GLN A 35 4.320 -12.905 5.772 1.00 0.00 H new ATOM 0 HG2 GLN A 35 2.202 -12.260 4.230 1.00 0.00 H new ATOM 0 HG3 GLN A 35 2.907 -13.464 3.170 1.00 0.00 H new ATOM 0 HE21 GLN A 35 3.952 -15.111 5.542 1.00 0.00 H new ATOM 0 HE22 GLN A 35 2.504 -15.883 6.196 1.00 0.00 H new ATOM 530 N ALA A 36 6.024 -10.739 6.240 1.00 0.00 N ATOM 531 CA ALA A 36 7.238 -10.269 6.902 1.00 0.00 C ATOM 532 C ALA A 36 8.433 -11.190 6.650 1.00 0.00 C ATOM 533 O ALA A 36 9.569 -10.715 6.589 1.00 0.00 O ATOM 534 CB ALA A 36 6.992 -10.109 8.406 1.00 0.00 C ATOM 0 H ALA A 36 5.264 -10.956 6.885 1.00 0.00 H new ATOM 0 HA ALA A 36 7.487 -9.299 6.472 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.904 -9.758 8.889 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.194 -9.385 8.569 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.703 -11.070 8.832 1.00 0.00 H new ATOM 540 N ASP A 37 8.172 -12.486 6.462 1.00 0.00 N ATOM 541 CA ASP A 37 9.214 -13.462 6.162 1.00 0.00 C ATOM 542 C ASP A 37 9.666 -13.304 4.717 1.00 0.00 C ATOM 543 O ASP A 37 10.860 -13.273 4.442 1.00 0.00 O ATOM 544 CB ASP A 37 8.682 -14.876 6.386 1.00 0.00 C ATOM 545 CG ASP A 37 9.781 -15.922 6.208 1.00 0.00 C ATOM 546 OD1 ASP A 37 10.186 -16.215 5.064 1.00 0.00 O ATOM 547 OD2 ASP A 37 10.227 -16.490 7.226 1.00 0.00 O ATOM 0 H ASP A 37 7.234 -12.884 6.514 1.00 0.00 H new ATOM 0 HA ASP A 37 10.063 -13.292 6.824 1.00 0.00 H new ATOM 0 HB2 ASP A 37 8.263 -14.954 7.389 1.00 0.00 H new ATOM 0 HB3 ASP A 37 7.871 -15.076 5.686 1.00 0.00 H new ATOM 552 N GLY A 38 8.707 -13.165 3.798 1.00 0.00 N ATOM 553 CA GLY A 38 8.952 -13.168 2.368 1.00 0.00 C ATOM 554 C GLY A 38 7.912 -13.953 1.565 1.00 0.00 C ATOM 555 O GLY A 38 8.060 -14.073 0.349 1.00 0.00 O ATOM 0 H GLY A 38 7.723 -13.046 4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.972 -12.139 2.010 1.00 0.00 H new ATOM 0 HA3 GLY A 38 9.939 -13.591 2.179 1.00 0.00 H new ATOM 559 N THR A 39 6.854 -14.501 2.179 1.00 0.00 N ATOM 560 CA THR A 39 5.762 -15.120 1.437 1.00 0.00 C ATOM 561 C THR A 39 5.057 -14.033 0.618 1.00 0.00 C ATOM 562 O THR A 39 4.296 -13.237 1.166 1.00 0.00 O ATOM 563 CB THR A 39 4.791 -15.806 2.414 1.00 0.00 C ATOM 564 OG1 THR A 39 5.467 -16.634 3.343 1.00 0.00 O ATOM 565 CG2 THR A 39 3.674 -16.574 1.711 1.00 0.00 C ATOM 0 H THR A 39 6.737 -14.525 3.192 1.00 0.00 H new ATOM 0 HA THR A 39 6.142 -15.885 0.760 1.00 0.00 H new ATOM 0 HB THR A 39 4.316 -14.997 2.968 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.815 -17.049 3.946 1.00 0.00 H new ATOM 0 HG21 THR A 39 3.024 -17.034 2.456 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.092 -15.888 1.096 1.00 0.00 H new ATOM 0 HG23 THR A 39 4.107 -17.349 1.079 1.00 0.00 H new ATOM 573 N ALA A 40 5.323 -13.943 -0.681 1.00 0.00 N ATOM 574 CA ALA A 40 4.499 -13.174 -1.598 1.00 0.00 C ATOM 575 C ALA A 40 3.076 -13.743 -1.603 1.00 0.00 C ATOM 576 O ALA A 40 2.845 -14.844 -2.104 1.00 0.00 O ATOM 577 CB ALA A 40 5.150 -13.199 -2.975 1.00 0.00 C ATOM 0 H ALA A 40 6.118 -14.403 -1.125 1.00 0.00 H new ATOM 0 HA ALA A 40 4.424 -12.133 -1.284 1.00 0.00 H new ATOM 0 HB1 ALA A 40 4.543 -12.625 -3.675 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.146 -12.760 -2.915 1.00 0.00 H new ATOM 0 HB3 ALA A 40 5.228 -14.229 -3.322 1.00 0.00 H new ATOM 583 N ARG A 41 2.128 -13.011 -1.017 1.00 0.00 N ATOM 584 CA ARG A 41 0.715 -13.364 -1.004 1.00 0.00 C ATOM 585 C ARG A 41 0.136 -13.296 -2.413 1.00 0.00 C ATOM 586 O ARG A 41 0.674 -12.630 -3.312 1.00 0.00 O ATOM 587 CB ARG A 41 -0.064 -12.418 -0.070 1.00 0.00 C ATOM 588 CG ARG A 41 0.003 -12.799 1.416 1.00 0.00 C ATOM 589 CD ARG A 41 -0.487 -11.604 2.250 1.00 0.00 C ATOM 590 NE ARG A 41 -1.036 -11.981 3.568 1.00 0.00 N ATOM 591 CZ ARG A 41 -0.736 -11.428 4.752 1.00 0.00 C ATOM 592 NH1 ARG A 41 0.326 -10.642 4.873 1.00 0.00 N ATOM 593 NH2 ARG A 41 -1.521 -11.633 5.799 1.00 0.00 N ATOM 0 H ARG A 41 2.329 -12.138 -0.529 1.00 0.00 H new ATOM 0 HA ARG A 41 0.619 -14.385 -0.634 1.00 0.00 H new ATOM 0 HB2 ARG A 41 0.324 -11.407 -0.191 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.108 -12.398 -0.381 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.615 -13.675 1.610 1.00 0.00 H new ATOM 0 HG3 ARG A 41 1.024 -13.061 1.694 1.00 0.00 H new ATOM 0 HD2 ARG A 41 0.342 -10.911 2.397 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.253 -11.070 1.687 1.00 0.00 H new ATOM 0 HE ARG A 41 -1.715 -12.742 3.579 1.00 0.00 H new ATOM 0 HH11 ARG A 41 0.918 -10.456 4.063 1.00 0.00 H new ATOM 0 HH12 ARG A 41 0.550 -10.223 5.776 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.355 -12.212 5.705 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.291 -11.212 6.699 1.00 0.00 H new ATOM 607 N ALA A 42 -1.012 -13.944 -2.593 1.00 0.00 N ATOM 608 CA ALA A 42 -1.922 -13.629 -3.683 1.00 0.00 C ATOM 609 C ALA A 42 -2.672 -12.345 -3.340 1.00 0.00 C ATOM 610 O ALA A 42 -3.005 -12.116 -2.178 1.00 0.00 O ATOM 611 CB ALA A 42 -2.919 -14.773 -3.873 1.00 0.00 C ATOM 0 H ALA A 42 -1.334 -14.699 -1.988 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.359 -13.495 -4.607 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -3.598 -14.532 -4.691 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -2.380 -15.690 -4.108 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -3.491 -14.913 -2.956 1.00 0.00 H new ATOM 617 N VAL A 43 -2.958 -11.543 -4.361 1.00 0.00 N ATOM 618 CA VAL A 43 -3.854 -10.393 -4.334 1.00 0.00 C ATOM 619 C VAL A 43 -4.647 -10.389 -5.659 1.00 0.00 C ATOM 620 O VAL A 43 -4.289 -11.140 -6.581 1.00 0.00 O ATOM 621 CB VAL A 43 -3.063 -9.084 -4.075 1.00 0.00 C ATOM 622 CG1 VAL A 43 -2.366 -9.107 -2.704 1.00 0.00 C ATOM 623 CG2 VAL A 43 -2.007 -8.760 -5.143 1.00 0.00 C ATOM 0 H VAL A 43 -2.546 -11.687 -5.283 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.564 -10.460 -3.510 1.00 0.00 H new ATOM 0 HB VAL A 43 -3.823 -8.303 -4.110 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.822 -8.174 -2.557 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.113 -9.219 -1.918 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.669 -9.944 -2.664 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.501 -7.830 -4.884 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.277 -9.568 -5.190 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.492 -8.652 -6.113 1.00 0.00 H new ATOM 633 N PRO A 44 -5.744 -9.626 -5.796 1.00 0.00 N ATOM 634 CA PRO A 44 -6.420 -9.510 -7.080 1.00 0.00 C ATOM 635 C PRO A 44 -5.582 -8.692 -8.066 1.00 0.00 C ATOM 636 O PRO A 44 -5.172 -7.567 -7.779 1.00 0.00 O ATOM 637 CB PRO A 44 -7.764 -8.848 -6.805 1.00 0.00 C ATOM 638 CG PRO A 44 -7.533 -8.081 -5.503 1.00 0.00 C ATOM 639 CD PRO A 44 -6.476 -8.905 -4.763 1.00 0.00 C ATOM 0 HA PRO A 44 -6.562 -10.488 -7.540 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -8.055 -8.181 -7.616 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -8.559 -9.586 -6.699 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -7.184 -7.066 -5.695 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -8.451 -7.997 -4.922 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.810 -8.262 -4.188 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -6.940 -9.595 -4.058 1.00 0.00 H new ATOM 647 N SER A 45 -5.346 -9.256 -9.247 1.00 0.00 N ATOM 648 CA SER A 45 -4.876 -8.553 -10.417 1.00 0.00 C ATOM 649 C SER A 45 -5.900 -7.526 -10.921 1.00 0.00 C ATOM 650 O SER A 45 -7.097 -7.670 -10.663 1.00 0.00 O ATOM 651 CB SER A 45 -4.541 -9.624 -11.471 1.00 0.00 C ATOM 652 OG SER A 45 -4.180 -10.869 -10.876 1.00 0.00 O ATOM 0 H SER A 45 -5.485 -10.253 -9.412 1.00 0.00 H new ATOM 0 HA SER A 45 -3.988 -7.964 -10.185 1.00 0.00 H new ATOM 0 HB2 SER A 45 -5.401 -9.771 -12.124 1.00 0.00 H new ATOM 0 HB3 SER A 45 -3.722 -9.271 -12.098 1.00 0.00 H new ATOM 0 HG SER A 45 -3.977 -11.521 -11.579 1.00 0.00 H new ATOM 658 N ALA A 46 -5.475 -6.570 -11.753 1.00 0.00 N ATOM 659 CA ALA A 46 -6.400 -5.760 -12.545 1.00 0.00 C ATOM 660 C ALA A 46 -7.342 -6.655 -13.344 1.00 0.00 C ATOM 661 O ALA A 46 -8.532 -6.364 -13.477 1.00 0.00 O ATOM 662 CB ALA A 46 -5.625 -4.799 -13.454 1.00 0.00 C ATOM 0 H ALA A 46 -4.492 -6.339 -11.894 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.010 -5.158 -11.871 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -6.328 -4.203 -14.037 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -5.008 -4.139 -12.844 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -4.987 -5.371 -14.128 1.00 0.00 H new ATOM 668 N ASP A 47 -6.829 -7.778 -13.831 1.00 0.00 N ATOM 669 CA ASP A 47 -7.577 -8.730 -14.634 1.00 0.00 C ATOM 670 C ASP A 47 -8.568 -9.548 -13.816 1.00 0.00 C ATOM 671 O ASP A 47 -9.527 -10.088 -14.354 1.00 0.00 O ATOM 672 CB ASP A 47 -6.604 -9.697 -15.307 1.00 0.00 C ATOM 673 CG ASP A 47 -5.593 -8.983 -16.190 1.00 0.00 C ATOM 674 OD1 ASP A 47 -4.663 -8.353 -15.634 1.00 0.00 O ATOM 675 OD2 ASP A 47 -5.730 -9.045 -17.430 1.00 0.00 O ATOM 0 H ASP A 47 -5.860 -8.056 -13.674 1.00 0.00 H new ATOM 0 HA ASP A 47 -8.141 -8.151 -15.365 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -6.076 -10.267 -14.543 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -7.165 -10.413 -15.908 1.00 0.00 H new ATOM 680 N GLN A 48 -8.361 -9.641 -12.503 1.00 0.00 N ATOM 681 CA GLN A 48 -9.185 -10.472 -11.627 1.00 0.00 C ATOM 682 C GLN A 48 -10.596 -9.913 -11.447 1.00 0.00 C ATOM 683 O GLN A 48 -11.456 -10.620 -10.910 1.00 0.00 O ATOM 684 CB GLN A 48 -8.514 -10.628 -10.256 1.00 0.00 C ATOM 685 CG GLN A 48 -7.396 -11.676 -10.276 1.00 0.00 C ATOM 686 CD GLN A 48 -7.949 -13.090 -10.257 1.00 0.00 C ATOM 687 OE1 GLN A 48 -8.516 -13.524 -9.255 1.00 0.00 O ATOM 688 NE2 GLN A 48 -7.793 -13.827 -11.339 1.00 0.00 N ATOM 0 H GLN A 48 -7.616 -9.142 -12.016 1.00 0.00 H new ATOM 0 HA GLN A 48 -9.276 -11.445 -12.109 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.104 -9.668 -9.942 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.263 -10.912 -9.517 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -6.783 -11.537 -11.167 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.744 -11.529 -9.415 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.319 -13.441 -12.155 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -8.147 -14.784 -11.360 1.00 0.00 H new ATOM 697 N GLY A 49 -10.835 -8.674 -11.873 1.00 0.00 N ATOM 698 CA GLY A 49 -12.137 -8.037 -11.870 1.00 0.00 C ATOM 699 C GLY A 49 -12.291 -6.979 -10.782 1.00 0.00 C ATOM 700 O GLY A 49 -13.370 -6.383 -10.689 1.00 0.00 O ATOM 0 H GLY A 49 -10.099 -8.072 -12.241 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -12.310 -7.576 -12.842 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -12.906 -8.798 -11.737 1.00 0.00 H new ATOM 704 N ALA A 50 -11.266 -6.771 -9.946 1.00 0.00 N ATOM 705 CA ALA A 50 -11.251 -5.780 -8.877 1.00 0.00 C ATOM 706 C ALA A 50 -9.833 -5.629 -8.279 1.00 0.00 C ATOM 707 O ALA A 50 -9.529 -6.257 -7.268 1.00 0.00 O ATOM 708 CB ALA A 50 -12.294 -6.170 -7.819 1.00 0.00 C ATOM 0 H ALA A 50 -10.400 -7.307 -10.002 1.00 0.00 H new ATOM 0 HA ALA A 50 -11.517 -4.802 -9.277 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -12.290 -5.434 -7.015 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -13.283 -6.201 -8.277 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.051 -7.152 -7.413 1.00 0.00 H new ATOM 714 N PRO A 51 -8.937 -4.823 -8.876 1.00 0.00 N ATOM 715 CA PRO A 51 -7.660 -4.495 -8.255 1.00 0.00 C ATOM 716 C PRO A 51 -7.878 -3.611 -7.023 1.00 0.00 C ATOM 717 O PRO A 51 -8.865 -2.879 -6.927 1.00 0.00 O ATOM 718 CB PRO A 51 -6.863 -3.744 -9.324 1.00 0.00 C ATOM 719 CG PRO A 51 -7.955 -3.088 -10.172 1.00 0.00 C ATOM 720 CD PRO A 51 -9.115 -4.086 -10.109 1.00 0.00 C ATOM 0 HA PRO A 51 -7.133 -5.387 -7.916 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -6.195 -3.004 -8.883 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.245 -4.420 -9.915 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -8.242 -2.115 -9.772 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.622 -2.926 -11.197 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -10.075 -3.570 -10.121 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -9.102 -4.755 -10.969 1.00 0.00 H new ATOM 728 N ILE A 52 -6.911 -3.619 -6.109 1.00 0.00 N ATOM 729 CA ILE A 52 -6.932 -2.793 -4.909 1.00 0.00 C ATOM 730 C ILE A 52 -6.310 -1.433 -5.261 1.00 0.00 C ATOM 731 O ILE A 52 -5.114 -1.354 -5.536 1.00 0.00 O ATOM 732 CB ILE A 52 -6.252 -3.574 -3.761 1.00 0.00 C ATOM 733 CG1 ILE A 52 -7.206 -4.727 -3.360 1.00 0.00 C ATOM 734 CG2 ILE A 52 -5.969 -2.675 -2.540 1.00 0.00 C ATOM 735 CD1 ILE A 52 -6.760 -5.588 -2.175 1.00 0.00 C ATOM 0 H ILE A 52 -6.081 -4.207 -6.184 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.936 -2.575 -4.546 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.289 -3.954 -4.101 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -8.181 -4.300 -3.126 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -7.342 -5.377 -4.225 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.491 -3.264 -1.757 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.309 -1.859 -2.834 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.907 -2.266 -2.164 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.505 -6.361 -1.986 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -5.802 -6.055 -2.405 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.655 -4.962 -1.289 1.00 0.00 H new ATOM 747 N THR A 53 -7.097 -0.354 -5.281 1.00 0.00 N ATOM 748 CA THR A 53 -6.671 0.945 -5.810 1.00 0.00 C ATOM 749 C THR A 53 -6.844 2.001 -4.703 1.00 0.00 C ATOM 750 O THR A 53 -7.914 2.089 -4.086 1.00 0.00 O ATOM 751 CB THR A 53 -7.462 1.283 -7.093 1.00 0.00 C ATOM 752 OG1 THR A 53 -8.839 1.521 -6.869 1.00 0.00 O ATOM 753 CG2 THR A 53 -7.436 0.191 -8.158 1.00 0.00 C ATOM 0 H THR A 53 -8.054 -0.357 -4.928 1.00 0.00 H new ATOM 0 HA THR A 53 -5.620 0.924 -6.096 1.00 0.00 H new ATOM 0 HB THR A 53 -6.943 2.179 -7.433 1.00 0.00 H new ATOM 0 HG1 THR A 53 -9.278 1.730 -7.720 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.016 0.513 -9.023 1.00 0.00 H new ATOM 0 HG22 THR A 53 -6.406 0.003 -8.461 1.00 0.00 H new ATOM 0 HG23 THR A 53 -7.867 -0.724 -7.752 1.00 0.00 H new ATOM 761 N LEU A 54 -5.833 2.841 -4.462 1.00 0.00 N ATOM 762 CA LEU A 54 -5.851 3.912 -3.464 1.00 0.00 C ATOM 763 C LEU A 54 -5.848 5.257 -4.194 1.00 0.00 C ATOM 764 O LEU A 54 -5.038 5.473 -5.091 1.00 0.00 O ATOM 765 CB LEU A 54 -4.610 3.779 -2.559 1.00 0.00 C ATOM 766 CG LEU A 54 -4.397 4.960 -1.584 1.00 0.00 C ATOM 767 CD1 LEU A 54 -5.568 5.113 -0.607 1.00 0.00 C ATOM 768 CD2 LEU A 54 -3.109 4.749 -0.781 1.00 0.00 C ATOM 0 H LEU A 54 -4.952 2.792 -4.973 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.743 3.845 -2.841 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.694 2.858 -1.981 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.726 3.680 -3.189 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.328 5.867 -2.185 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.378 5.954 0.060 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.487 5.293 -1.165 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.673 4.201 -0.020 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.966 5.585 -0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.183 3.822 -0.212 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.261 4.689 -1.463 1.00 0.00 H new ATOM 780 N THR A 55 -6.693 6.196 -3.783 1.00 0.00 N ATOM 781 CA THR A 55 -6.616 7.586 -4.210 1.00 0.00 C ATOM 782 C THR A 55 -6.519 8.413 -2.937 1.00 0.00 C ATOM 783 O THR A 55 -7.194 8.093 -1.957 1.00 0.00 O ATOM 784 CB THR A 55 -7.860 7.943 -5.038 1.00 0.00 C ATOM 785 OG1 THR A 55 -8.035 7.010 -6.090 1.00 0.00 O ATOM 786 CG2 THR A 55 -7.769 9.323 -5.691 1.00 0.00 C ATOM 0 H THR A 55 -7.459 6.010 -3.136 1.00 0.00 H new ATOM 0 HA THR A 55 -5.754 7.779 -4.848 1.00 0.00 H new ATOM 0 HB THR A 55 -8.692 7.930 -4.334 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.832 7.248 -6.609 1.00 0.00 H new ATOM 0 HG21 THR A 55 -8.677 9.516 -6.261 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.657 10.084 -4.919 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.908 9.354 -6.359 1.00 0.00 H new ATOM 794 N LEU A 56 -5.698 9.459 -2.956 1.00 0.00 N ATOM 795 CA LEU A 56 -5.564 10.420 -1.858 1.00 0.00 C ATOM 796 C LEU A 56 -5.860 11.777 -2.459 1.00 0.00 C ATOM 797 O LEU A 56 -5.216 12.127 -3.447 1.00 0.00 O ATOM 798 CB LEU A 56 -4.153 10.417 -1.235 1.00 0.00 C ATOM 799 CG LEU A 56 -3.665 9.032 -0.779 1.00 0.00 C ATOM 800 CD1 LEU A 56 -2.193 9.086 -0.375 1.00 0.00 C ATOM 801 CD2 LEU A 56 -4.503 8.538 0.400 1.00 0.00 C ATOM 0 H LEU A 56 -5.093 9.669 -3.750 1.00 0.00 H new ATOM 0 HA LEU A 56 -6.247 10.160 -1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.447 10.817 -1.963 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -4.145 11.092 -0.379 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.776 8.340 -1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.867 8.096 -0.055 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.594 9.408 -1.226 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.067 9.792 0.446 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.147 7.556 0.713 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.412 9.239 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.548 8.466 0.099 1.00 0.00 H new ATOM 813 N SER A 57 -6.862 12.487 -1.939 1.00 0.00 N ATOM 814 CA SER A 57 -7.221 13.827 -2.388 1.00 0.00 C ATOM 815 C SER A 57 -8.295 14.385 -1.434 1.00 0.00 C ATOM 816 O SER A 57 -8.662 13.748 -0.439 1.00 0.00 O ATOM 817 CB SER A 57 -7.722 13.727 -3.852 1.00 0.00 C ATOM 818 OG SER A 57 -8.207 14.922 -4.424 1.00 0.00 O ATOM 0 H SER A 57 -7.453 12.140 -1.184 1.00 0.00 H new ATOM 0 HA SER A 57 -6.371 14.509 -2.369 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.904 13.358 -4.470 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.515 12.980 -3.893 1.00 0.00 H new ATOM 0 HG SER A 57 -8.495 14.751 -5.345 1.00 0.00 H new ATOM 824 N THR A 58 -8.847 15.560 -1.738 1.00 0.00 N ATOM 825 CA THR A 58 -9.742 16.315 -0.869 1.00 0.00 C ATOM 826 C THR A 58 -11.170 16.409 -1.432 1.00 0.00 C ATOM 827 O THR A 58 -11.855 17.409 -1.222 1.00 0.00 O ATOM 828 CB THR A 58 -9.105 17.664 -0.507 1.00 0.00 C ATOM 829 OG1 THR A 58 -8.922 18.483 -1.644 1.00 0.00 O ATOM 830 CG2 THR A 58 -7.743 17.489 0.181 1.00 0.00 C ATOM 0 H THR A 58 -8.675 16.026 -2.629 1.00 0.00 H new ATOM 0 HA THR A 58 -9.871 15.771 0.067 1.00 0.00 H new ATOM 0 HB THR A 58 -9.802 18.143 0.180 1.00 0.00 H new ATOM 0 HG1 THR A 58 -8.516 19.333 -1.373 1.00 0.00 H new ATOM 0 HG21 THR A 58 -7.328 18.468 0.420 1.00 0.00 H new ATOM 0 HG22 THR A 58 -7.870 16.915 1.099 1.00 0.00 H new ATOM 0 HG23 THR A 58 -7.063 16.960 -0.487 1.00 0.00 H new ATOM 838 N SER A 59 -11.662 15.355 -2.090 1.00 0.00 N ATOM 839 CA SER A 59 -13.056 15.186 -2.514 1.00 0.00 C ATOM 840 C SER A 59 -14.123 15.449 -1.431 1.00 0.00 C ATOM 841 O SER A 59 -15.306 15.504 -1.764 1.00 0.00 O ATOM 842 CB SER A 59 -13.244 13.735 -2.969 1.00 0.00 C ATOM 843 OG SER A 59 -12.934 13.495 -4.321 1.00 0.00 O ATOM 0 H SER A 59 -11.076 14.563 -2.353 1.00 0.00 H new ATOM 0 HA SER A 59 -13.209 15.930 -3.295 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.621 13.091 -2.348 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.279 13.445 -2.791 1.00 0.00 H new ATOM 0 HG SER A 59 -13.079 12.548 -4.527 1.00 0.00 H new ATOM 849 N THR A 60 -13.774 15.518 -0.145 1.00 0.00 N ATOM 850 CA THR A 60 -14.728 15.812 0.924 1.00 0.00 C ATOM 851 C THR A 60 -14.431 17.172 1.571 1.00 0.00 C ATOM 852 O THR A 60 -15.081 17.524 2.547 1.00 0.00 O ATOM 853 CB THR A 60 -14.781 14.611 1.895 1.00 0.00 C ATOM 854 OG1 THR A 60 -16.010 14.537 2.589 1.00 0.00 O ATOM 855 CG2 THR A 60 -13.645 14.562 2.917 1.00 0.00 C ATOM 0 H THR A 60 -12.820 15.371 0.184 1.00 0.00 H new ATOM 0 HA THR A 60 -15.737 15.927 0.527 1.00 0.00 H new ATOM 0 HB THR A 60 -14.666 13.751 1.235 1.00 0.00 H new ATOM 0 HG1 THR A 60 -16.000 13.763 3.190 1.00 0.00 H new ATOM 0 HG21 THR A 60 -13.766 13.686 3.554 1.00 0.00 H new ATOM 0 HG22 THR A 60 -12.689 14.502 2.396 1.00 0.00 H new ATOM 0 HG23 THR A 60 -13.668 15.463 3.530 1.00 0.00 H new ATOM 863 N GLY A 61 -13.447 17.935 1.093 1.00 0.00 N ATOM 864 CA GLY A 61 -13.018 19.190 1.702 1.00 0.00 C ATOM 865 C GLY A 61 -12.060 18.953 2.870 1.00 0.00 C ATOM 866 O GLY A 61 -11.353 19.871 3.289 1.00 0.00 O ATOM 0 H GLY A 61 -12.917 17.691 0.256 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.530 19.811 0.951 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.890 19.741 2.053 1.00 0.00 H new ATOM 870 N GLN A 62 -11.948 17.714 3.358 1.00 0.00 N ATOM 871 CA GLN A 62 -10.873 17.281 4.226 1.00 0.00 C ATOM 872 C GLN A 62 -9.999 16.244 3.517 1.00 0.00 C ATOM 873 O GLN A 62 -10.402 15.636 2.516 1.00 0.00 O ATOM 874 CB GLN A 62 -11.407 16.710 5.540 1.00 0.00 C ATOM 875 CG GLN A 62 -12.481 17.539 6.269 1.00 0.00 C ATOM 876 CD GLN A 62 -13.888 17.060 5.930 1.00 0.00 C ATOM 877 OE1 GLN A 62 -14.213 15.890 6.105 1.00 0.00 O ATOM 878 NE2 GLN A 62 -14.743 17.921 5.424 1.00 0.00 N ATOM 0 H GLN A 62 -12.621 16.976 3.150 1.00 0.00 H new ATOM 0 HA GLN A 62 -10.267 18.156 4.463 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.819 15.721 5.339 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.565 16.572 6.218 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -12.323 17.473 7.346 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -12.378 18.589 5.996 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -14.465 18.892 5.282 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -15.684 17.618 5.174 1.00 0.00 H new ATOM 887 N ARG A 63 -8.827 15.993 4.101 1.00 0.00 N ATOM 888 CA ARG A 63 -7.975 14.856 3.790 1.00 0.00 C ATOM 889 C ARG A 63 -8.759 13.553 3.954 1.00 0.00 C ATOM 890 O ARG A 63 -9.200 13.239 5.065 1.00 0.00 O ATOM 891 CB ARG A 63 -6.716 14.905 4.668 1.00 0.00 C ATOM 892 CG ARG A 63 -6.929 14.954 6.189 1.00 0.00 C ATOM 893 CD ARG A 63 -5.593 15.163 6.903 1.00 0.00 C ATOM 894 NE ARG A 63 -5.161 16.567 6.880 1.00 0.00 N ATOM 895 CZ ARG A 63 -5.362 17.441 7.877 1.00 0.00 C ATOM 896 NH1 ARG A 63 -6.193 17.172 8.885 1.00 0.00 N ATOM 897 NH2 ARG A 63 -4.709 18.589 7.862 1.00 0.00 N ATOM 0 H ARG A 63 -8.437 16.597 4.825 1.00 0.00 H new ATOM 0 HA ARG A 63 -7.651 14.901 2.750 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.109 14.029 4.439 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.135 15.781 4.379 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.615 15.763 6.442 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.390 14.027 6.529 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.680 14.829 7.937 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.831 14.543 6.431 1.00 0.00 H new ATOM 0 HE ARG A 63 -4.674 16.900 6.048 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.694 16.284 8.910 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -6.328 17.855 9.631 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.064 18.799 7.100 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.850 19.266 8.612 1.00 0.00 H new ATOM 911 N HIS A 64 -8.961 12.812 2.868 1.00 0.00 N ATOM 912 CA HIS A 64 -9.616 11.509 2.873 1.00 0.00 C ATOM 913 C HIS A 64 -8.948 10.627 1.810 1.00 0.00 C ATOM 914 O HIS A 64 -8.158 11.121 1.002 1.00 0.00 O ATOM 915 CB HIS A 64 -11.129 11.681 2.636 1.00 0.00 C ATOM 916 CG HIS A 64 -12.026 11.073 3.682 1.00 0.00 C ATOM 917 ND1 HIS A 64 -13.033 10.161 3.453 1.00 0.00 N ATOM 918 CD2 HIS A 64 -12.091 11.439 5.000 1.00 0.00 C ATOM 919 CE1 HIS A 64 -13.681 9.972 4.616 1.00 0.00 C ATOM 920 NE2 HIS A 64 -13.128 10.713 5.590 1.00 0.00 N ATOM 0 H HIS A 64 -8.666 13.109 1.938 1.00 0.00 H new ATOM 0 HA HIS A 64 -9.505 11.019 3.841 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -11.349 12.746 2.569 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -11.379 11.243 1.670 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.455 12.159 5.494 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.528 9.316 4.748 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -13.410 10.740 6.570 1.00 0.00 H new ATOM 928 N ALA A 65 -9.257 9.327 1.822 1.00 0.00 N ATOM 929 CA ALA A 65 -8.661 8.330 0.942 1.00 0.00 C ATOM 930 C ALA A 65 -9.753 7.401 0.429 1.00 0.00 C ATOM 931 O ALA A 65 -9.905 6.269 0.895 1.00 0.00 O ATOM 932 CB ALA A 65 -7.560 7.557 1.676 1.00 0.00 C ATOM 0 H ALA A 65 -9.947 8.934 2.462 1.00 0.00 H new ATOM 0 HA ALA A 65 -8.195 8.822 0.089 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.126 6.817 1.004 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -6.785 8.250 2.002 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.986 7.054 2.544 1.00 0.00 H new ATOM 938 N SER A 66 -10.571 7.900 -0.483 1.00 0.00 N ATOM 939 CA SER A 66 -11.633 7.112 -1.078 1.00 0.00 C ATOM 940 C SER A 66 -10.952 6.059 -1.951 1.00 0.00 C ATOM 941 O SER A 66 -10.258 6.399 -2.914 1.00 0.00 O ATOM 942 CB SER A 66 -12.560 8.028 -1.874 1.00 0.00 C ATOM 943 OG SER A 66 -13.878 7.515 -1.928 1.00 0.00 O ATOM 0 H SER A 66 -10.517 8.858 -0.829 1.00 0.00 H new ATOM 0 HA SER A 66 -12.256 6.616 -0.333 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.573 9.018 -1.419 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.174 8.147 -2.886 1.00 0.00 H new ATOM 0 HG SER A 66 -14.446 8.126 -2.443 1.00 0.00 H new ATOM 949 N GLY A 67 -11.115 4.784 -1.619 1.00 0.00 N ATOM 950 CA GLY A 67 -10.321 3.711 -2.198 1.00 0.00 C ATOM 951 C GLY A 67 -11.151 2.453 -2.345 1.00 0.00 C ATOM 952 O GLY A 67 -12.315 2.413 -1.943 1.00 0.00 O ATOM 0 H GLY A 67 -11.804 4.466 -0.938 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -9.940 4.018 -3.172 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -9.455 3.510 -1.567 1.00 0.00 H new ATOM 956 N PHE A 68 -10.553 1.429 -2.944 1.00 0.00 N ATOM 957 CA PHE A 68 -11.214 0.192 -3.311 1.00 0.00 C ATOM 958 C PHE A 68 -10.369 -0.959 -2.772 1.00 0.00 C ATOM 959 O PHE A 68 -9.259 -1.173 -3.260 1.00 0.00 O ATOM 960 CB PHE A 68 -11.425 0.195 -4.830 1.00 0.00 C ATOM 961 CG PHE A 68 -12.326 -0.901 -5.334 1.00 0.00 C ATOM 962 CD1 PHE A 68 -11.815 -2.191 -5.502 1.00 0.00 C ATOM 963 CD2 PHE A 68 -13.682 -0.642 -5.610 1.00 0.00 C ATOM 964 CE1 PHE A 68 -12.664 -3.230 -5.892 1.00 0.00 C ATOM 965 CE2 PHE A 68 -14.540 -1.693 -5.976 1.00 0.00 C ATOM 966 CZ PHE A 68 -14.029 -2.991 -6.121 1.00 0.00 C ATOM 0 H PHE A 68 -9.564 1.442 -3.193 1.00 0.00 H new ATOM 0 HA PHE A 68 -12.206 0.077 -2.874 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -11.844 1.157 -5.125 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.455 0.106 -5.320 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -10.766 -2.384 -5.331 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -14.063 0.366 -5.540 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -12.267 -4.226 -6.019 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -15.589 -1.502 -6.145 1.00 0.00 H new ATOM 0 HZ PHE A 68 -14.682 -3.802 -6.407 1.00 0.00 H new ATOM 976 N SER A 69 -10.846 -1.619 -1.713 1.00 0.00 N ATOM 977 CA SER A 69 -10.295 -2.880 -1.215 1.00 0.00 C ATOM 978 C SER A 69 -10.786 -4.022 -2.112 1.00 0.00 C ATOM 979 O SER A 69 -11.532 -3.780 -3.051 1.00 0.00 O ATOM 980 CB SER A 69 -10.737 -3.119 0.234 1.00 0.00 C ATOM 981 OG SER A 69 -10.422 -2.015 1.046 1.00 0.00 O ATOM 0 H SER A 69 -11.641 -1.285 -1.168 1.00 0.00 H new ATOM 0 HA SER A 69 -9.206 -2.837 -1.236 1.00 0.00 H new ATOM 0 HB2 SER A 69 -11.811 -3.303 0.265 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.249 -4.013 0.624 1.00 0.00 H new ATOM 0 HG SER A 69 -10.359 -1.209 0.492 1.00 0.00 H new ATOM 987 N GLY A 70 -10.436 -5.270 -1.785 1.00 0.00 N ATOM 988 CA GLY A 70 -10.500 -6.443 -2.656 1.00 0.00 C ATOM 989 C GLY A 70 -11.765 -6.620 -3.508 1.00 0.00 C ATOM 990 O GLY A 70 -11.671 -7.138 -4.619 1.00 0.00 O ATOM 0 H GLY A 70 -10.082 -5.499 -0.856 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -9.643 -6.411 -3.328 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -10.385 -7.331 -2.035 1.00 0.00 H new ATOM 994 N CYS A 71 -12.936 -6.159 -3.050 1.00 0.00 N ATOM 995 CA CYS A 71 -14.052 -5.819 -3.939 1.00 0.00 C ATOM 996 C CYS A 71 -14.930 -4.664 -3.444 1.00 0.00 C ATOM 997 O CYS A 71 -16.014 -4.408 -3.990 1.00 0.00 O ATOM 998 CB CYS A 71 -14.920 -7.052 -4.153 1.00 0.00 C ATOM 999 SG CYS A 71 -14.637 -7.837 -5.754 1.00 0.00 S ATOM 0 H CYS A 71 -13.135 -6.012 -2.060 1.00 0.00 H new ATOM 0 HA CYS A 71 -13.601 -5.479 -4.871 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -14.721 -7.773 -3.360 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -15.970 -6.770 -4.072 1.00 0.00 H new ATOM 1004 N ASN A 72 -14.524 -4.008 -2.363 1.00 0.00 N ATOM 1005 CA ASN A 72 -15.420 -3.194 -1.552 1.00 0.00 C ATOM 1006 C ASN A 72 -14.736 -1.876 -1.259 1.00 0.00 C ATOM 1007 O ASN A 72 -13.633 -1.838 -0.715 1.00 0.00 O ATOM 1008 CB ASN A 72 -15.809 -3.891 -0.251 1.00 0.00 C ATOM 1009 CG ASN A 72 -16.248 -5.327 -0.504 1.00 0.00 C ATOM 1010 OD1 ASN A 72 -17.450 -5.491 -1.021 1.00 0.00 O flip ATOM 1011 ND2 ASN A 72 -15.499 -6.287 -0.375 1.00 0.00 N flip ATOM 0 H ASN A 72 -13.562 -4.026 -2.024 1.00 0.00 H new ATOM 0 HA ASN A 72 -16.343 -3.030 -2.108 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -14.963 -3.883 0.436 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -16.617 -3.341 0.232 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -14.570 -6.159 0.025 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -15.804 -7.215 -0.668 1.00 0.00 H new ATOM 1018 N ARG A 73 -15.382 -0.787 -1.651 1.00 0.00 N ATOM 1019 CA ARG A 73 -14.852 0.552 -1.435 1.00 0.00 C ATOM 1020 C ARG A 73 -14.861 0.915 0.036 1.00 0.00 C ATOM 1021 O ARG A 73 -15.814 0.596 0.760 1.00 0.00 O ATOM 1022 CB ARG A 73 -15.566 1.658 -2.223 1.00 0.00 C ATOM 1023 CG ARG A 73 -16.268 1.191 -3.494 1.00 0.00 C ATOM 1024 CD ARG A 73 -16.711 2.438 -4.262 1.00 0.00 C ATOM 1025 NE ARG A 73 -17.618 2.124 -5.377 1.00 0.00 N ATOM 1026 CZ ARG A 73 -18.574 2.937 -5.842 1.00 0.00 C ATOM 1027 NH1 ARG A 73 -18.673 4.181 -5.382 1.00 0.00 N ATOM 1028 NH2 ARG A 73 -19.431 2.500 -6.755 1.00 0.00 N ATOM 0 H ARG A 73 -16.285 -0.806 -2.126 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.831 0.502 -1.813 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -16.301 2.131 -1.572 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.837 2.423 -2.489 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -15.596 0.585 -4.102 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -17.127 0.566 -3.250 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -17.208 3.125 -3.577 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -15.832 2.954 -4.648 1.00 0.00 H new ATOM 0 HE ARG A 73 -17.510 1.217 -5.831 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -18.020 4.516 -4.674 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -19.402 4.800 -5.737 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -19.362 1.544 -7.103 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -20.159 3.120 -7.109 1.00 0.00 H new ATOM 1042 N TYR A 74 -13.859 1.695 0.404 1.00 0.00 N ATOM 1043 CA TYR A 74 -13.614 2.205 1.743 1.00 0.00 C ATOM 1044 C TYR A 74 -13.369 3.707 1.676 1.00 0.00 C ATOM 1045 O TYR A 74 -13.165 4.279 0.597 1.00 0.00 O ATOM 1046 CB TYR A 74 -12.434 1.466 2.399 1.00 0.00 C ATOM 1047 CG TYR A 74 -11.082 1.709 1.747 1.00 0.00 C ATOM 1048 CD1 TYR A 74 -10.696 0.940 0.637 1.00 0.00 C ATOM 1049 CD2 TYR A 74 -10.208 2.695 2.245 1.00 0.00 C ATOM 1050 CE1 TYR A 74 -9.436 1.119 0.046 1.00 0.00 C ATOM 1051 CE2 TYR A 74 -8.963 2.917 1.623 1.00 0.00 C ATOM 1052 CZ TYR A 74 -8.569 2.114 0.532 1.00 0.00 C ATOM 1053 OH TYR A 74 -7.379 2.325 -0.085 1.00 0.00 O ATOM 0 H TYR A 74 -13.153 2.008 -0.263 1.00 0.00 H new ATOM 0 HA TYR A 74 -14.491 2.026 2.365 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -12.375 1.764 3.446 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -12.641 0.396 2.384 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -11.376 0.204 0.234 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -10.493 3.282 3.106 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -9.133 0.494 -0.781 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -8.312 3.701 1.981 1.00 0.00 H new ATOM 0 HH TYR A 74 -6.794 1.552 0.059 1.00 0.00 H new ATOM 1063 N MET A 75 -13.416 4.345 2.837 1.00 0.00 N ATOM 1064 CA MET A 75 -13.193 5.761 3.051 1.00 0.00 C ATOM 1065 C MET A 75 -12.722 5.954 4.491 1.00 0.00 C ATOM 1066 O MET A 75 -12.929 5.086 5.344 1.00 0.00 O ATOM 1067 CB MET A 75 -14.504 6.523 2.799 1.00 0.00 C ATOM 1068 CG MET A 75 -15.614 6.154 3.796 1.00 0.00 C ATOM 1069 SD MET A 75 -17.266 6.021 3.077 1.00 0.00 S ATOM 1070 CE MET A 75 -17.058 4.394 2.320 1.00 0.00 C ATOM 0 H MET A 75 -13.624 3.854 3.706 1.00 0.00 H new ATOM 0 HA MET A 75 -12.436 6.146 2.367 1.00 0.00 H new ATOM 0 HB2 MET A 75 -14.312 7.594 2.857 1.00 0.00 H new ATOM 0 HB3 MET A 75 -14.849 6.316 1.786 1.00 0.00 H new ATOM 0 HG2 MET A 75 -15.360 5.204 4.265 1.00 0.00 H new ATOM 0 HG3 MET A 75 -15.637 6.904 4.587 1.00 0.00 H new ATOM 0 HE1 MET A 75 -17.115 4.487 1.236 1.00 0.00 H new ATOM 0 HE2 MET A 75 -16.087 3.985 2.598 1.00 0.00 H new ATOM 0 HE3 MET A 75 -17.846 3.727 2.669 1.00 0.00 H new ATOM 1080 N GLY A 76 -12.146 7.119 4.760 1.00 0.00 N ATOM 1081 CA GLY A 76 -11.627 7.525 6.052 1.00 0.00 C ATOM 1082 C GLY A 76 -10.533 8.567 5.835 1.00 0.00 C ATOM 1083 O GLY A 76 -10.135 8.824 4.691 1.00 0.00 O ATOM 0 H GLY A 76 -12.024 7.838 4.047 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.426 7.939 6.667 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.227 6.663 6.586 1.00 0.00 H new ATOM 1087 N SER A 77 -10.044 9.183 6.909 1.00 0.00 N ATOM 1088 CA SER A 77 -9.139 10.329 6.882 1.00 0.00 C ATOM 1089 C SER A 77 -7.678 9.894 6.983 1.00 0.00 C ATOM 1090 O SER A 77 -7.406 8.866 7.603 1.00 0.00 O ATOM 1091 CB SER A 77 -9.511 11.247 8.049 1.00 0.00 C ATOM 1092 OG SER A 77 -9.519 10.556 9.286 1.00 0.00 O ATOM 0 H SER A 77 -10.276 8.886 7.857 1.00 0.00 H new ATOM 0 HA SER A 77 -9.244 10.855 5.933 1.00 0.00 H new ATOM 0 HB2 SER A 77 -8.802 12.074 8.100 1.00 0.00 H new ATOM 0 HB3 SER A 77 -10.495 11.681 7.870 1.00 0.00 H new ATOM 0 HG SER A 77 -9.759 11.176 10.006 1.00 0.00 H new ATOM 1098 N TYR A 78 -6.737 10.688 6.458 1.00 0.00 N ATOM 1099 CA TYR A 78 -5.305 10.386 6.528 1.00 0.00 C ATOM 1100 C TYR A 78 -4.598 11.337 7.489 1.00 0.00 C ATOM 1101 O TYR A 78 -5.153 12.351 7.916 1.00 0.00 O ATOM 1102 CB TYR A 78 -4.640 10.308 5.139 1.00 0.00 C ATOM 1103 CG TYR A 78 -4.651 11.532 4.240 1.00 0.00 C ATOM 1104 CD1 TYR A 78 -3.746 12.583 4.477 1.00 0.00 C ATOM 1105 CD2 TYR A 78 -5.466 11.566 3.090 1.00 0.00 C ATOM 1106 CE1 TYR A 78 -3.679 13.674 3.594 1.00 0.00 C ATOM 1107 CE2 TYR A 78 -5.399 12.651 2.197 1.00 0.00 C ATOM 1108 CZ TYR A 78 -4.514 13.721 2.454 1.00 0.00 C ATOM 1109 OH TYR A 78 -4.501 14.817 1.647 1.00 0.00 O ATOM 0 H TYR A 78 -6.949 11.559 5.972 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.198 9.382 6.939 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.599 10.022 5.290 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -5.118 9.495 4.592 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.100 12.551 5.342 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -6.148 10.752 2.893 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.987 14.480 3.787 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -6.024 12.666 1.316 1.00 0.00 H new ATOM 0 HH TYR A 78 -4.419 14.534 0.712 1.00 0.00 H new ATOM 1119 N ALA A 79 -3.364 11.001 7.860 1.00 0.00 N ATOM 1120 CA ALA A 79 -2.504 11.797 8.714 1.00 0.00 C ATOM 1121 C ALA A 79 -1.056 11.497 8.331 1.00 0.00 C ATOM 1122 O ALA A 79 -0.620 10.346 8.376 1.00 0.00 O ATOM 1123 CB ALA A 79 -2.775 11.471 10.186 1.00 0.00 C ATOM 0 H ALA A 79 -2.925 10.131 7.559 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.701 12.860 8.579 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -2.124 12.074 10.818 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.816 11.692 10.422 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -2.578 10.414 10.367 1.00 0.00 H new ATOM 1129 N LEU A 80 -0.326 12.542 7.954 1.00 0.00 N ATOM 1130 CA LEU A 80 1.026 12.480 7.404 1.00 0.00 C ATOM 1131 C LEU A 80 2.001 12.845 8.517 1.00 0.00 C ATOM 1132 O LEU A 80 1.935 13.939 9.079 1.00 0.00 O ATOM 1133 CB LEU A 80 1.130 13.419 6.186 1.00 0.00 C ATOM 1134 CG LEU A 80 0.194 12.993 5.034 1.00 0.00 C ATOM 1135 CD1 LEU A 80 0.025 14.121 4.012 1.00 0.00 C ATOM 1136 CD2 LEU A 80 0.692 11.712 4.354 1.00 0.00 C ATOM 0 H LEU A 80 -0.675 13.498 8.026 1.00 0.00 H new ATOM 0 HA LEU A 80 1.271 11.479 7.048 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.885 14.436 6.492 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.159 13.433 5.828 1.00 0.00 H new ATOM 0 HG LEU A 80 -0.783 12.782 5.468 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.639 13.792 3.213 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.403 14.995 4.502 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.997 14.380 3.592 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.011 11.440 3.548 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.688 11.881 3.946 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.731 10.904 5.084 1.00 0.00 H new ATOM 1148 N LYS A 81 2.793 11.874 8.966 1.00 0.00 N ATOM 1149 CA LYS A 81 3.723 11.971 10.080 1.00 0.00 C ATOM 1150 C LYS A 81 4.836 10.947 9.882 1.00 0.00 C ATOM 1151 O LYS A 81 4.623 9.976 9.175 1.00 0.00 O ATOM 1152 CB LYS A 81 2.965 11.683 11.386 1.00 0.00 C ATOM 1153 CG LYS A 81 2.203 10.339 11.397 1.00 0.00 C ATOM 1154 CD LYS A 81 1.649 10.003 12.784 1.00 0.00 C ATOM 1155 CE LYS A 81 0.478 10.907 13.188 1.00 0.00 C ATOM 1156 NZ LYS A 81 0.186 10.776 14.627 1.00 0.00 N ATOM 0 H LYS A 81 2.801 10.949 8.536 1.00 0.00 H new ATOM 0 HA LYS A 81 4.158 12.969 10.130 1.00 0.00 H new ATOM 0 HB2 LYS A 81 3.675 11.692 12.213 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.256 12.491 11.566 1.00 0.00 H new ATOM 0 HG2 LYS A 81 1.383 10.382 10.680 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.871 9.541 11.071 1.00 0.00 H new ATOM 0 HD2 LYS A 81 1.322 8.963 12.798 1.00 0.00 H new ATOM 0 HD3 LYS A 81 2.446 10.096 13.522 1.00 0.00 H new ATOM 0 HE2 LYS A 81 0.716 11.945 12.954 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -0.407 10.645 12.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -0.610 11.397 14.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -0.063 9.790 14.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 1.025 11.049 15.178 1.00 0.00 H new ATOM 1170 N ASP A 82 5.952 11.083 10.589 1.00 0.00 N ATOM 1171 CA ASP A 82 6.996 10.072 10.827 1.00 0.00 C ATOM 1172 C ASP A 82 7.522 9.311 9.599 1.00 0.00 C ATOM 1173 O ASP A 82 7.914 8.150 9.705 1.00 0.00 O ATOM 1174 CB ASP A 82 6.543 9.084 11.921 1.00 0.00 C ATOM 1175 CG ASP A 82 7.728 8.635 12.781 1.00 0.00 C ATOM 1176 OD1 ASP A 82 8.484 9.520 13.254 1.00 0.00 O ATOM 1177 OD2 ASP A 82 7.901 7.410 12.987 1.00 0.00 O ATOM 0 H ASP A 82 6.175 11.966 11.049 1.00 0.00 H new ATOM 0 HA ASP A 82 7.856 10.657 11.154 1.00 0.00 H new ATOM 0 HB2 ASP A 82 5.789 9.555 12.552 1.00 0.00 H new ATOM 0 HB3 ASP A 82 6.074 8.215 11.459 1.00 0.00 H new ATOM 1182 N GLY A 83 7.509 9.923 8.414 1.00 0.00 N ATOM 1183 CA GLY A 83 7.868 9.237 7.178 1.00 0.00 C ATOM 1184 C GLY A 83 6.820 8.212 6.729 1.00 0.00 C ATOM 1185 O GLY A 83 7.113 7.421 5.829 1.00 0.00 O ATOM 0 H GLY A 83 7.251 10.902 8.287 1.00 0.00 H new ATOM 0 HA2 GLY A 83 8.007 9.975 6.388 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.825 8.733 7.315 1.00 0.00 H new ATOM 1189 N LYS A 84 5.624 8.217 7.337 1.00 0.00 N ATOM 1190 CA LYS A 84 4.559 7.225 7.222 1.00 0.00 C ATOM 1191 C LYS A 84 3.203 7.864 6.909 1.00 0.00 C ATOM 1192 O LYS A 84 3.032 9.084 7.005 1.00 0.00 O ATOM 1193 CB LYS A 84 4.546 6.318 8.474 1.00 0.00 C ATOM 1194 CG LYS A 84 3.753 6.805 9.693 1.00 0.00 C ATOM 1195 CD LYS A 84 3.699 5.667 10.718 1.00 0.00 C ATOM 1196 CE LYS A 84 3.339 6.126 12.117 1.00 0.00 C ATOM 1197 NZ LYS A 84 3.614 5.083 13.122 1.00 0.00 N ATOM 0 H LYS A 84 5.362 8.974 7.968 1.00 0.00 H new ATOM 0 HA LYS A 84 4.765 6.585 6.364 1.00 0.00 H new ATOM 0 HB2 LYS A 84 4.149 5.346 8.181 1.00 0.00 H new ATOM 0 HB3 LYS A 84 5.578 6.160 8.786 1.00 0.00 H new ATOM 0 HG2 LYS A 84 4.227 7.685 10.127 1.00 0.00 H new ATOM 0 HG3 LYS A 84 2.746 7.098 9.398 1.00 0.00 H new ATOM 0 HD2 LYS A 84 2.970 4.927 10.389 1.00 0.00 H new ATOM 0 HD3 LYS A 84 4.668 5.169 10.746 1.00 0.00 H new ATOM 0 HE2 LYS A 84 3.905 7.025 12.362 1.00 0.00 H new ATOM 0 HE3 LYS A 84 2.283 6.395 12.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 3.355 5.434 14.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.055 4.234 12.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.626 4.845 13.107 1.00 0.00 H new ATOM 1211 N LEU A 85 2.239 7.039 6.496 1.00 0.00 N ATOM 1212 CA LEU A 85 0.918 7.467 6.039 1.00 0.00 C ATOM 1213 C LEU A 85 -0.115 6.765 6.916 1.00 0.00 C ATOM 1214 O LEU A 85 -0.503 5.626 6.646 1.00 0.00 O ATOM 1215 CB LEU A 85 0.744 7.135 4.545 1.00 0.00 C ATOM 1216 CG LEU A 85 -0.428 7.825 3.814 1.00 0.00 C ATOM 1217 CD1 LEU A 85 -0.846 6.968 2.621 1.00 0.00 C ATOM 1218 CD2 LEU A 85 -1.678 8.120 4.640 1.00 0.00 C ATOM 0 H LEU A 85 2.360 6.027 6.470 1.00 0.00 H new ATOM 0 HA LEU A 85 0.791 8.546 6.131 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.668 7.395 4.029 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.618 6.057 4.448 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.029 8.800 3.535 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.674 7.449 2.100 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -0.003 6.857 1.939 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.160 5.985 2.972 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.424 8.604 4.010 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.084 7.187 5.032 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.419 8.779 5.469 1.00 0.00 H new ATOM 1230 N SER A 86 -0.515 7.423 7.997 1.00 0.00 N ATOM 1231 CA SER A 86 -1.507 6.900 8.924 1.00 0.00 C ATOM 1232 C SER A 86 -2.896 7.278 8.425 1.00 0.00 C ATOM 1233 O SER A 86 -3.064 8.190 7.613 1.00 0.00 O ATOM 1234 CB SER A 86 -1.252 7.457 10.330 1.00 0.00 C ATOM 1235 OG SER A 86 -2.133 6.931 11.314 1.00 0.00 O ATOM 0 H SER A 86 -0.156 8.342 8.256 1.00 0.00 H new ATOM 0 HA SER A 86 -1.436 5.814 8.978 1.00 0.00 H new ATOM 0 HB2 SER A 86 -0.224 7.238 10.619 1.00 0.00 H new ATOM 0 HB3 SER A 86 -1.352 8.542 10.306 1.00 0.00 H new ATOM 0 HG SER A 86 -1.920 7.322 12.187 1.00 0.00 H new ATOM 1241 N PHE A 87 -3.903 6.645 9.021 1.00 0.00 N ATOM 1242 CA PHE A 87 -5.310 6.947 8.801 1.00 0.00 C ATOM 1243 C PHE A 87 -6.037 7.139 10.134 1.00 0.00 C ATOM 1244 O PHE A 87 -5.439 6.936 11.198 1.00 0.00 O ATOM 1245 CB PHE A 87 -5.947 5.860 7.926 1.00 0.00 C ATOM 1246 CG PHE A 87 -5.294 5.702 6.564 1.00 0.00 C ATOM 1247 CD1 PHE A 87 -5.563 6.617 5.527 1.00 0.00 C ATOM 1248 CD2 PHE A 87 -4.396 4.645 6.338 1.00 0.00 C ATOM 1249 CE1 PHE A 87 -4.923 6.483 4.279 1.00 0.00 C ATOM 1250 CE2 PHE A 87 -3.762 4.516 5.093 1.00 0.00 C ATOM 1251 CZ PHE A 87 -4.015 5.436 4.065 1.00 0.00 C ATOM 0 H PHE A 87 -3.756 5.888 9.688 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.401 7.890 8.262 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.897 4.908 8.454 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -7.003 6.093 7.787 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.262 7.424 5.689 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -4.194 3.932 7.123 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.132 7.187 3.487 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.073 3.701 4.925 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.513 5.339 3.114 1.00 0.00 H new ATOM 1261 N GLY A 88 -7.303 7.551 10.065 1.00 0.00 N ATOM 1262 CA GLY A 88 -8.278 7.624 11.145 1.00 0.00 C ATOM 1263 C GLY A 88 -9.294 6.496 10.973 1.00 0.00 C ATOM 1264 O GLY A 88 -8.884 5.371 10.667 1.00 0.00 O ATOM 0 H GLY A 88 -7.701 7.867 9.181 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.779 7.537 12.110 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.782 8.590 11.133 1.00 0.00 H new ATOM 1268 N THR A 89 -10.585 6.785 11.159 1.00 0.00 N ATOM 1269 CA THR A 89 -11.700 5.851 11.010 1.00 0.00 C ATOM 1270 C THR A 89 -11.841 5.366 9.555 1.00 0.00 C ATOM 1271 O THR A 89 -12.641 5.880 8.769 1.00 0.00 O ATOM 1272 CB THR A 89 -13.003 6.526 11.485 1.00 0.00 C ATOM 1273 OG1 THR A 89 -12.804 7.274 12.666 1.00 0.00 O ATOM 1274 CG2 THR A 89 -14.111 5.497 11.729 1.00 0.00 C ATOM 0 H THR A 89 -10.893 7.719 11.430 1.00 0.00 H new ATOM 0 HA THR A 89 -11.500 4.974 11.626 1.00 0.00 H new ATOM 0 HB THR A 89 -13.308 7.200 10.685 1.00 0.00 H new ATOM 0 HG1 THR A 89 -13.650 7.689 12.937 1.00 0.00 H new ATOM 0 HG21 THR A 89 -15.014 6.007 12.063 1.00 0.00 H new ATOM 0 HG22 THR A 89 -14.319 4.959 10.804 1.00 0.00 H new ATOM 0 HG23 THR A 89 -13.790 4.791 12.495 1.00 0.00 H new ATOM 1282 N LEU A 90 -11.071 4.349 9.177 1.00 0.00 N ATOM 1283 CA LEU A 90 -11.267 3.658 7.915 1.00 0.00 C ATOM 1284 C LEU A 90 -12.458 2.722 8.045 1.00 0.00 C ATOM 1285 O LEU A 90 -12.604 2.051 9.073 1.00 0.00 O ATOM 1286 CB LEU A 90 -10.036 2.825 7.549 1.00 0.00 C ATOM 1287 CG LEU A 90 -8.776 3.649 7.265 1.00 0.00 C ATOM 1288 CD1 LEU A 90 -7.616 2.681 7.097 1.00 0.00 C ATOM 1289 CD2 LEU A 90 -8.900 4.458 5.975 1.00 0.00 C ATOM 0 H LEU A 90 -10.299 3.986 9.736 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.436 4.402 7.137 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.826 2.132 8.364 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -10.268 2.223 6.670 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.625 4.342 8.092 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.703 3.240 6.893 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.490 2.101 8.012 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -7.822 2.007 6.266 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.984 5.027 5.813 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -9.060 3.782 5.135 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -9.744 5.143 6.055 1.00 0.00 H new ATOM 1301 N GLY A 91 -13.234 2.598 6.976 1.00 0.00 N ATOM 1302 CA GLY A 91 -14.255 1.575 6.836 1.00 0.00 C ATOM 1303 C GLY A 91 -15.060 1.805 5.567 1.00 0.00 C ATOM 1304 O GLY A 91 -14.740 2.700 4.778 1.00 0.00 O ATOM 0 H GLY A 91 -13.168 3.218 6.169 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -13.791 0.589 6.807 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -14.916 1.590 7.702 1.00 0.00 H new ATOM 1308 N GLY A 92 -16.083 0.987 5.331 1.00 0.00 N ATOM 1309 CA GLY A 92 -16.628 0.826 3.995 1.00 0.00 C ATOM 1310 C GLY A 92 -17.945 0.071 3.996 1.00 0.00 C ATOM 1311 O GLY A 92 -18.812 0.313 4.840 1.00 0.00 O ATOM 0 H GLY A 92 -16.547 0.429 6.048 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -16.775 1.808 3.545 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -15.908 0.295 3.373 1.00 0.00 H new ATOM 1315 N THR A 93 -18.136 -0.781 2.994 1.00 0.00 N ATOM 1316 CA THR A 93 -19.223 -1.754 2.923 1.00 0.00 C ATOM 1317 C THR A 93 -18.593 -3.148 2.956 1.00 0.00 C ATOM 1318 O THR A 93 -17.384 -3.305 2.777 1.00 0.00 O ATOM 1319 CB THR A 93 -20.203 -1.496 1.765 1.00 0.00 C ATOM 1320 OG1 THR A 93 -21.231 -2.472 1.679 1.00 0.00 O ATOM 1321 CG2 THR A 93 -19.404 -1.446 0.494 1.00 0.00 C ATOM 0 H THR A 93 -17.519 -0.815 2.182 1.00 0.00 H new ATOM 0 HA THR A 93 -19.880 -1.656 3.787 1.00 0.00 H new ATOM 0 HB THR A 93 -20.715 -0.550 1.942 1.00 0.00 H new ATOM 0 HG1 THR A 93 -21.824 -2.258 0.929 1.00 0.00 H new ATOM 0 HG21 THR A 93 -20.071 -1.264 -0.348 1.00 0.00 H new ATOM 0 HG22 THR A 93 -18.671 -0.642 0.556 1.00 0.00 H new ATOM 0 HG23 THR A 93 -18.889 -2.396 0.350 1.00 0.00 H new ATOM 1329 N ARG A 94 -19.431 -4.156 3.144 1.00 0.00 N ATOM 1330 CA ARG A 94 -19.135 -5.568 3.058 1.00 0.00 C ATOM 1331 C ARG A 94 -20.170 -6.091 2.087 1.00 0.00 C ATOM 1332 O ARG A 94 -21.317 -6.317 2.469 1.00 0.00 O ATOM 1333 CB ARG A 94 -19.205 -6.207 4.439 1.00 0.00 C ATOM 1334 CG ARG A 94 -17.877 -5.940 5.174 1.00 0.00 C ATOM 1335 CD ARG A 94 -17.719 -6.951 6.293 1.00 0.00 C ATOM 1336 NE ARG A 94 -18.716 -6.710 7.347 1.00 0.00 N ATOM 1337 CZ ARG A 94 -19.111 -7.530 8.323 1.00 0.00 C ATOM 1338 NH1 ARG A 94 -18.586 -8.741 8.468 1.00 0.00 N ATOM 1339 NH2 ARG A 94 -20.069 -7.102 9.131 1.00 0.00 N ATOM 0 H ARG A 94 -20.410 -3.989 3.378 1.00 0.00 H new ATOM 0 HA ARG A 94 -18.128 -5.796 2.709 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -20.040 -5.794 5.005 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -19.379 -7.279 4.351 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -17.041 -6.014 4.479 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -17.867 -4.927 5.577 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -17.835 -7.961 5.898 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -16.715 -6.885 6.712 1.00 0.00 H new ATOM 0 HE ARG A 94 -19.165 -5.794 7.330 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -17.863 -9.064 7.825 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -18.906 -9.348 9.223 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -20.476 -6.177 8.994 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -20.400 -7.698 9.890 1.00 0.00 H new ATOM 1353 N MET A 95 -19.812 -6.094 0.808 1.00 0.00 N ATOM 1354 CA MET A 95 -20.548 -6.755 -0.255 1.00 0.00 C ATOM 1355 C MET A 95 -19.771 -8.054 -0.563 1.00 0.00 C ATOM 1356 O MET A 95 -18.666 -8.232 -0.032 1.00 0.00 O ATOM 1357 CB MET A 95 -20.661 -5.791 -1.455 1.00 0.00 C ATOM 1358 CG MET A 95 -20.773 -4.288 -1.125 1.00 0.00 C ATOM 1359 SD MET A 95 -20.802 -3.191 -2.571 1.00 0.00 S ATOM 1360 CE MET A 95 -19.032 -2.832 -2.747 1.00 0.00 C ATOM 0 H MET A 95 -18.973 -5.619 0.475 1.00 0.00 H new ATOM 0 HA MET A 95 -21.572 -7.016 0.013 1.00 0.00 H new ATOM 0 HB2 MET A 95 -19.788 -5.936 -2.092 1.00 0.00 H new ATOM 0 HB3 MET A 95 -21.534 -6.077 -2.041 1.00 0.00 H new ATOM 0 HG2 MET A 95 -21.681 -4.125 -0.544 1.00 0.00 H new ATOM 0 HG3 MET A 95 -19.933 -4.006 -0.490 1.00 0.00 H new ATOM 0 HE1 MET A 95 -18.896 -1.774 -2.973 1.00 0.00 H new ATOM 0 HE2 MET A 95 -18.517 -3.074 -1.817 1.00 0.00 H new ATOM 0 HE3 MET A 95 -18.618 -3.432 -3.557 1.00 0.00 H new ATOM 1370 N ALA A 96 -20.274 -8.964 -1.407 1.00 0.00 N ATOM 1371 CA ALA A 96 -19.622 -10.256 -1.635 1.00 0.00 C ATOM 1372 C ALA A 96 -19.468 -10.558 -3.122 1.00 0.00 C ATOM 1373 O ALA A 96 -20.429 -10.935 -3.786 1.00 0.00 O ATOM 1374 CB ALA A 96 -20.368 -11.390 -0.934 1.00 0.00 C ATOM 0 H ALA A 96 -21.131 -8.827 -1.943 1.00 0.00 H new ATOM 0 HA ALA A 96 -18.624 -10.186 -1.203 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -19.857 -12.334 -1.124 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -20.393 -11.201 0.139 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -21.387 -11.446 -1.316 1.00 0.00 H new ATOM 1380 N CYS A 97 -18.235 -10.467 -3.619 1.00 0.00 N ATOM 1381 CA CYS A 97 -17.856 -10.900 -4.970 1.00 0.00 C ATOM 1382 C CYS A 97 -17.658 -12.411 -5.094 1.00 0.00 C ATOM 1383 O CYS A 97 -17.483 -12.917 -6.199 1.00 0.00 O ATOM 1384 CB CYS A 97 -16.583 -10.187 -5.408 1.00 0.00 C ATOM 1385 SG CYS A 97 -16.813 -8.531 -6.137 1.00 0.00 S ATOM 0 H CYS A 97 -17.454 -10.083 -3.086 1.00 0.00 H new ATOM 0 HA CYS A 97 -18.690 -10.634 -5.620 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -15.925 -10.095 -4.544 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -16.069 -10.815 -6.135 1.00 0.00 H new ATOM 1390 N MET A 98 -17.699 -13.132 -3.978 1.00 0.00 N ATOM 1391 CA MET A 98 -17.616 -14.585 -3.887 1.00 0.00 C ATOM 1392 C MET A 98 -16.249 -15.141 -4.310 1.00 0.00 C ATOM 1393 O MET A 98 -16.118 -16.332 -4.601 1.00 0.00 O ATOM 1394 CB MET A 98 -18.794 -15.283 -4.614 1.00 0.00 C ATOM 1395 CG MET A 98 -20.087 -14.468 -4.779 1.00 0.00 C ATOM 1396 SD MET A 98 -21.565 -15.492 -4.979 1.00 0.00 S ATOM 1397 CE MET A 98 -22.068 -15.433 -3.249 1.00 0.00 C ATOM 0 H MET A 98 -17.796 -12.693 -3.062 1.00 0.00 H new ATOM 0 HA MET A 98 -17.713 -14.826 -2.828 1.00 0.00 H new ATOM 0 HB2 MET A 98 -18.452 -15.582 -5.605 1.00 0.00 H new ATOM 0 HB3 MET A 98 -19.035 -16.197 -4.071 1.00 0.00 H new ATOM 0 HG2 MET A 98 -20.215 -13.825 -3.908 1.00 0.00 H new ATOM 0 HG3 MET A 98 -19.987 -13.815 -5.646 1.00 0.00 H new ATOM 0 HE1 MET A 98 -22.984 -16.009 -3.116 1.00 0.00 H new ATOM 0 HE2 MET A 98 -21.280 -15.856 -2.626 1.00 0.00 H new ATOM 0 HE3 MET A 98 -22.245 -14.398 -2.957 1.00 0.00 H new ATOM 1407 N THR A 99 -15.211 -14.313 -4.292 1.00 0.00 N ATOM 1408 CA THR A 99 -13.880 -14.587 -4.835 1.00 0.00 C ATOM 1409 C THR A 99 -12.793 -14.334 -3.780 1.00 0.00 C ATOM 1410 O THR A 99 -13.035 -13.599 -2.822 1.00 0.00 O ATOM 1411 CB THR A 99 -13.660 -13.679 -6.059 1.00 0.00 C ATOM 1412 OG1 THR A 99 -14.041 -12.350 -5.746 1.00 0.00 O ATOM 1413 CG2 THR A 99 -14.431 -14.197 -7.278 1.00 0.00 C ATOM 0 H THR A 99 -15.275 -13.383 -3.877 1.00 0.00 H new ATOM 0 HA THR A 99 -13.814 -15.635 -5.128 1.00 0.00 H new ATOM 0 HB THR A 99 -12.600 -13.690 -6.314 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.898 -11.776 -6.527 1.00 0.00 H new ATOM 0 HG21 THR A 99 -14.256 -13.536 -8.127 1.00 0.00 H new ATOM 0 HG22 THR A 99 -14.089 -15.202 -7.525 1.00 0.00 H new ATOM 0 HG23 THR A 99 -15.497 -14.222 -7.051 1.00 0.00 H new ATOM 1421 N PRO A 100 -11.575 -14.878 -3.953 1.00 0.00 N ATOM 1422 CA PRO A 100 -10.498 -14.701 -2.989 1.00 0.00 C ATOM 1423 C PRO A 100 -9.964 -13.273 -3.021 1.00 0.00 C ATOM 1424 O PRO A 100 -9.672 -12.714 -1.968 1.00 0.00 O ATOM 1425 CB PRO A 100 -9.425 -15.716 -3.383 1.00 0.00 C ATOM 1426 CG PRO A 100 -9.646 -15.920 -4.878 1.00 0.00 C ATOM 1427 CD PRO A 100 -11.159 -15.780 -5.013 1.00 0.00 C ATOM 0 HA PRO A 100 -10.838 -14.865 -1.966 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -8.423 -15.340 -3.175 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -9.536 -16.650 -2.831 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -9.115 -15.175 -5.471 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -9.298 -16.898 -5.209 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -11.428 -15.382 -5.991 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -11.650 -16.748 -4.916 1.00 0.00 H new ATOM 1435 N GLY A 101 -9.886 -12.666 -4.212 1.00 0.00 N ATOM 1436 CA GLY A 101 -9.517 -11.268 -4.329 1.00 0.00 C ATOM 1437 C GLY A 101 -10.604 -10.382 -3.737 1.00 0.00 C ATOM 1438 O GLY A 101 -10.268 -9.361 -3.160 1.00 0.00 O ATOM 0 H GLY A 101 -10.075 -13.129 -5.101 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.573 -11.090 -3.814 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.361 -11.013 -5.377 1.00 0.00 H new ATOM 1442 N GLY A 102 -11.877 -10.795 -3.781 1.00 0.00 N ATOM 1443 CA GLY A 102 -12.944 -10.166 -3.023 1.00 0.00 C ATOM 1444 C GLY A 102 -12.613 -10.201 -1.533 1.00 0.00 C ATOM 1445 O GLY A 102 -12.481 -9.166 -0.886 1.00 0.00 O ATOM 0 H GLY A 102 -12.188 -11.582 -4.351 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -13.076 -9.135 -3.351 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -13.886 -10.682 -3.207 1.00 0.00 H new ATOM 1449 N GLN A 103 -12.466 -11.408 -0.989 1.00 0.00 N ATOM 1450 CA GLN A 103 -12.467 -11.674 0.447 1.00 0.00 C ATOM 1451 C GLN A 103 -11.126 -11.413 1.137 1.00 0.00 C ATOM 1452 O GLN A 103 -10.994 -11.673 2.336 1.00 0.00 O ATOM 1453 CB GLN A 103 -12.943 -13.112 0.702 1.00 0.00 C ATOM 1454 CG GLN A 103 -14.409 -13.292 0.283 1.00 0.00 C ATOM 1455 CD GLN A 103 -15.083 -14.414 1.057 1.00 0.00 C ATOM 1456 OE1 GLN A 103 -15.464 -15.442 0.497 1.00 0.00 O ATOM 1457 NE2 GLN A 103 -15.295 -14.218 2.343 1.00 0.00 N ATOM 0 H GLN A 103 -12.340 -12.250 -1.551 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.160 -10.961 0.895 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.315 -13.810 0.148 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -12.832 -13.353 1.759 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -14.951 -12.361 0.447 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -14.458 -13.506 -0.785 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -14.971 -13.359 2.788 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -15.783 -14.925 2.893 1.00 0.00 H new ATOM 1466 N ILE A 104 -10.109 -10.945 0.417 1.00 0.00 N ATOM 1467 CA ILE A 104 -8.905 -10.399 1.035 1.00 0.00 C ATOM 1468 C ILE A 104 -9.155 -8.960 1.519 1.00 0.00 C ATOM 1469 O ILE A 104 -8.312 -8.412 2.224 1.00 0.00 O ATOM 1470 CB ILE A 104 -7.714 -10.533 0.069 1.00 0.00 C ATOM 1471 CG1 ILE A 104 -6.412 -10.545 0.888 1.00 0.00 C ATOM 1472 CG2 ILE A 104 -7.728 -9.449 -1.016 1.00 0.00 C ATOM 1473 CD1 ILE A 104 -5.170 -10.721 0.032 1.00 0.00 C ATOM 0 H ILE A 104 -10.096 -10.934 -0.603 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.646 -10.972 1.925 1.00 0.00 H new ATOM 0 HB ILE A 104 -7.790 -11.475 -0.474 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -6.332 -9.612 1.446 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -6.458 -11.351 1.620 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.870 -9.582 -1.675 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -8.647 -9.527 -1.597 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -7.677 -8.466 -0.549 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.286 -10.721 0.669 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.230 -11.667 -0.506 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.102 -9.901 -0.683 1.00 0.00 H new ATOM 1485 N GLU A 105 -10.306 -8.358 1.194 1.00 0.00 N ATOM 1486 CA GLU A 105 -10.690 -7.003 1.564 1.00 0.00 C ATOM 1487 C GLU A 105 -10.375 -6.702 3.035 1.00 0.00 C ATOM 1488 O GLU A 105 -9.565 -5.812 3.299 1.00 0.00 O ATOM 1489 CB GLU A 105 -12.167 -6.808 1.161 1.00 0.00 C ATOM 1490 CG GLU A 105 -12.958 -5.750 1.941 1.00 0.00 C ATOM 1491 CD GLU A 105 -13.739 -6.291 3.154 1.00 0.00 C ATOM 1492 OE1 GLU A 105 -13.688 -7.511 3.448 1.00 0.00 O ATOM 1493 OE2 GLU A 105 -14.402 -5.466 3.814 1.00 0.00 O ATOM 0 H GLU A 105 -11.022 -8.829 0.641 1.00 0.00 H new ATOM 0 HA GLU A 105 -10.097 -6.264 1.025 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -12.200 -6.547 0.103 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -12.679 -7.764 1.269 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -12.267 -4.981 2.285 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -13.660 -5.267 1.261 1.00 0.00 H new ATOM 1500 N GLY A 106 -10.940 -7.462 3.974 1.00 0.00 N ATOM 1501 CA GLY A 106 -10.797 -7.212 5.396 1.00 0.00 C ATOM 1502 C GLY A 106 -9.338 -7.261 5.819 1.00 0.00 C ATOM 1503 O GLY A 106 -8.927 -6.451 6.649 1.00 0.00 O ATOM 0 H GLY A 106 -11.515 -8.276 3.759 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -11.217 -6.236 5.640 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.366 -7.953 5.957 1.00 0.00 H new ATOM 1507 N ALA A 107 -8.531 -8.149 5.217 1.00 0.00 N ATOM 1508 CA ALA A 107 -7.135 -8.255 5.591 1.00 0.00 C ATOM 1509 C ALA A 107 -6.388 -6.993 5.178 1.00 0.00 C ATOM 1510 O ALA A 107 -5.519 -6.529 5.913 1.00 0.00 O ATOM 1511 CB ALA A 107 -6.497 -9.501 4.968 1.00 0.00 C ATOM 0 H ALA A 107 -8.827 -8.790 4.481 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.069 -8.357 6.674 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.449 -9.559 5.263 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -7.022 -10.391 5.316 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.565 -9.440 3.882 1.00 0.00 H new ATOM 1517 N TYR A 108 -6.693 -6.454 3.996 1.00 0.00 N ATOM 1518 CA TYR A 108 -6.090 -5.219 3.525 1.00 0.00 C ATOM 1519 C TYR A 108 -6.497 -4.058 4.437 1.00 0.00 C ATOM 1520 O TYR A 108 -5.621 -3.296 4.842 1.00 0.00 O ATOM 1521 CB TYR A 108 -6.444 -4.993 2.052 1.00 0.00 C ATOM 1522 CG TYR A 108 -6.153 -3.593 1.545 1.00 0.00 C ATOM 1523 CD1 TYR A 108 -4.855 -3.214 1.149 1.00 0.00 C ATOM 1524 CD2 TYR A 108 -7.195 -2.653 1.499 1.00 0.00 C ATOM 1525 CE1 TYR A 108 -4.608 -1.908 0.685 1.00 0.00 C ATOM 1526 CE2 TYR A 108 -6.959 -1.353 1.027 1.00 0.00 C ATOM 1527 CZ TYR A 108 -5.661 -0.965 0.623 1.00 0.00 C ATOM 1528 OH TYR A 108 -5.448 0.304 0.169 1.00 0.00 O ATOM 0 H TYR A 108 -7.363 -6.864 3.345 1.00 0.00 H new ATOM 0 HA TYR A 108 -5.003 -5.285 3.575 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -5.891 -5.709 1.444 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -7.504 -5.205 1.909 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -4.046 -3.928 1.202 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -8.185 -2.932 1.829 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -3.613 -1.625 0.376 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -7.773 -0.645 0.972 1.00 0.00 H new ATOM 0 HH TYR A 108 -4.722 0.298 -0.489 1.00 0.00 H new ATOM 1538 N LEU A 109 -7.771 -3.942 4.844 1.00 0.00 N ATOM 1539 CA LEU A 109 -8.140 -2.928 5.839 1.00 0.00 C ATOM 1540 C LEU A 109 -7.337 -3.141 7.128 1.00 0.00 C ATOM 1541 O LEU A 109 -6.891 -2.160 7.719 1.00 0.00 O ATOM 1542 CB LEU A 109 -9.654 -2.884 6.154 1.00 0.00 C ATOM 1543 CG LEU A 109 -10.592 -2.195 5.142 1.00 0.00 C ATOM 1544 CD1 LEU A 109 -10.040 -0.883 4.568 1.00 0.00 C ATOM 1545 CD2 LEU A 109 -11.016 -3.110 3.998 1.00 0.00 C ATOM 0 H LEU A 109 -8.542 -4.520 4.510 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.895 -1.962 5.397 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.997 -3.911 6.280 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.779 -2.386 7.116 1.00 0.00 H new ATOM 0 HG LEU A 109 -11.471 -1.951 5.738 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.759 -0.462 3.865 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.868 -0.175 5.379 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.100 -1.079 4.052 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -11.675 -2.565 3.321 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -10.133 -3.445 3.454 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.544 -3.975 4.400 1.00 0.00 H new ATOM 1557 N ASN A 110 -7.095 -4.392 7.537 1.00 0.00 N ATOM 1558 CA ASN A 110 -6.306 -4.734 8.731 1.00 0.00 C ATOM 1559 C ASN A 110 -4.839 -4.334 8.629 1.00 0.00 C ATOM 1560 O ASN A 110 -4.137 -4.301 9.634 1.00 0.00 O ATOM 1561 CB ASN A 110 -6.332 -6.249 8.975 1.00 0.00 C ATOM 1562 CG ASN A 110 -6.499 -6.554 10.454 1.00 0.00 C ATOM 1563 OD1 ASN A 110 -7.567 -6.989 10.873 1.00 0.00 O ATOM 1564 ND2 ASN A 110 -5.495 -6.290 11.267 1.00 0.00 N ATOM 0 H ASN A 110 -7.447 -5.210 7.040 1.00 0.00 H new ATOM 0 HA ASN A 110 -6.769 -4.177 9.545 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -7.150 -6.699 8.412 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -5.408 -6.697 8.609 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -5.596 -6.447 12.270 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -4.617 -5.929 10.893 1.00 0.00 H new ATOM 1571 N ALA A 111 -4.349 -4.109 7.415 1.00 0.00 N ATOM 1572 CA ALA A 111 -3.003 -3.629 7.167 1.00 0.00 C ATOM 1573 C ALA A 111 -2.961 -2.095 7.194 1.00 0.00 C ATOM 1574 O ALA A 111 -1.925 -1.514 7.521 1.00 0.00 O ATOM 1575 CB ALA A 111 -2.546 -4.204 5.821 1.00 0.00 C ATOM 0 H ALA A 111 -4.889 -4.259 6.563 1.00 0.00 H new ATOM 0 HA ALA A 111 -2.320 -3.962 7.948 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -1.534 -3.861 5.604 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -2.558 -5.293 5.868 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -3.220 -3.867 5.034 1.00 0.00 H new ATOM 1581 N LEU A 112 -4.083 -1.426 6.916 1.00 0.00 N ATOM 1582 CA LEU A 112 -4.233 0.031 6.995 1.00 0.00 C ATOM 1583 C LEU A 112 -4.476 0.535 8.423 1.00 0.00 C ATOM 1584 O LEU A 112 -4.801 1.706 8.626 1.00 0.00 O ATOM 1585 CB LEU A 112 -5.347 0.513 6.062 1.00 0.00 C ATOM 1586 CG LEU A 112 -5.178 0.208 4.568 1.00 0.00 C ATOM 1587 CD1 LEU A 112 -6.344 0.880 3.830 1.00 0.00 C ATOM 1588 CD2 LEU A 112 -3.828 0.703 4.036 1.00 0.00 C ATOM 0 H LEU A 112 -4.938 -1.897 6.621 1.00 0.00 H new ATOM 0 HA LEU A 112 -3.283 0.455 6.670 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.285 0.069 6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -5.445 1.592 6.179 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.190 -0.870 4.404 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.259 0.685 2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.288 0.478 4.198 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -6.315 1.955 4.006 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -3.747 0.468 2.975 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -3.755 1.782 4.176 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -3.021 0.212 4.579 1.00 0.00 H new ATOM 1600 N THR A 113 -4.291 -0.319 9.419 1.00 0.00 N ATOM 1601 CA THR A 113 -4.148 0.034 10.825 1.00 0.00 C ATOM 1602 C THR A 113 -2.711 -0.200 11.316 1.00 0.00 C ATOM 1603 O THR A 113 -2.376 0.200 12.430 1.00 0.00 O ATOM 1604 CB THR A 113 -5.193 -0.758 11.638 1.00 0.00 C ATOM 1605 OG1 THR A 113 -5.594 -1.934 10.957 1.00 0.00 O ATOM 1606 CG2 THR A 113 -6.441 0.093 11.818 1.00 0.00 C ATOM 0 H THR A 113 -4.234 -1.325 9.262 1.00 0.00 H new ATOM 0 HA THR A 113 -4.335 1.099 10.964 1.00 0.00 H new ATOM 0 HB THR A 113 -4.736 -1.019 12.592 1.00 0.00 H new ATOM 0 HG1 THR A 113 -6.255 -2.416 11.497 1.00 0.00 H new ATOM 0 HG21 THR A 113 -7.181 -0.464 12.392 1.00 0.00 H new ATOM 0 HG22 THR A 113 -6.183 1.009 12.350 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.854 0.345 10.841 1.00 0.00 H new ATOM 1614 N HIS A 114 -1.834 -0.786 10.490 1.00 0.00 N ATOM 1615 CA HIS A 114 -0.490 -1.203 10.868 1.00 0.00 C ATOM 1616 C HIS A 114 0.505 -0.577 9.886 1.00 0.00 C ATOM 1617 O HIS A 114 1.132 -1.275 9.094 1.00 0.00 O ATOM 1618 CB HIS A 114 -0.414 -2.736 10.952 1.00 0.00 C ATOM 1619 CG HIS A 114 -1.226 -3.341 12.070 1.00 0.00 C ATOM 1620 ND1 HIS A 114 -0.741 -4.038 13.154 1.00 0.00 N ATOM 1621 CD2 HIS A 114 -2.588 -3.393 12.130 1.00 0.00 C ATOM 1622 CE1 HIS A 114 -1.792 -4.500 13.854 1.00 0.00 C ATOM 1623 NE2 HIS A 114 -2.944 -4.114 13.273 1.00 0.00 N ATOM 0 H HIS A 114 -2.053 -0.986 9.514 1.00 0.00 H new ATOM 0 HA HIS A 114 -0.227 -0.847 11.864 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -0.752 -3.157 10.005 1.00 0.00 H new ATOM 0 HB3 HIS A 114 0.628 -3.029 11.077 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -3.272 -2.954 11.419 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -1.722 -5.095 14.753 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -3.889 -4.309 13.602 1.00 0.00 H new ATOM 1631 N ILE A 115 0.650 0.749 9.896 1.00 0.00 N ATOM 1632 CA ILE A 115 1.554 1.481 9.007 1.00 0.00 C ATOM 1633 C ILE A 115 2.837 1.873 9.747 1.00 0.00 C ATOM 1634 O ILE A 115 3.400 2.927 9.487 1.00 0.00 O ATOM 1635 CB ILE A 115 0.827 2.697 8.383 1.00 0.00 C ATOM 1636 CG1 ILE A 115 -0.568 2.320 7.834 1.00 0.00 C ATOM 1637 CG2 ILE A 115 1.682 3.325 7.268 1.00 0.00 C ATOM 1638 CD1 ILE A 115 -1.697 2.691 8.782 1.00 0.00 C ATOM 0 H ILE A 115 0.133 1.355 10.533 1.00 0.00 H new ATOM 0 HA ILE A 115 1.853 0.832 8.184 1.00 0.00 H new ATOM 0 HB ILE A 115 0.683 3.428 9.179 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.724 2.820 6.878 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.599 1.248 7.642 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.154 4.178 6.842 1.00 0.00 H new ATOM 0 HG22 ILE A 115 2.634 3.657 7.683 1.00 0.00 H new ATOM 0 HG23 ILE A 115 1.864 2.585 6.489 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -2.651 2.402 8.342 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -1.562 2.170 9.730 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -1.688 3.767 8.955 1.00 0.00 H new ATOM 1650 N ASP A 116 3.303 1.084 10.716 1.00 0.00 N ATOM 1651 CA ASP A 116 4.379 1.527 11.610 1.00 0.00 C ATOM 1652 C ASP A 116 5.631 1.999 10.868 1.00 0.00 C ATOM 1653 O ASP A 116 6.333 2.891 11.347 1.00 0.00 O ATOM 1654 CB ASP A 116 4.773 0.382 12.537 1.00 0.00 C ATOM 1655 CG ASP A 116 5.520 0.926 13.753 1.00 0.00 C ATOM 1656 OD1 ASP A 116 4.907 1.632 14.589 1.00 0.00 O ATOM 1657 OD2 ASP A 116 6.745 0.684 13.860 1.00 0.00 O ATOM 0 H ASP A 116 2.957 0.143 10.903 1.00 0.00 H new ATOM 0 HA ASP A 116 3.986 2.378 12.166 1.00 0.00 H new ATOM 0 HB2 ASP A 116 3.883 -0.159 12.859 1.00 0.00 H new ATOM 0 HB3 ASP A 116 5.402 -0.330 12.002 1.00 0.00 H new ATOM 1662 N ARG A 117 5.869 1.442 9.681 1.00 0.00 N ATOM 1663 CA ARG A 117 6.883 1.877 8.733 1.00 0.00 C ATOM 1664 C ARG A 117 6.245 2.145 7.371 1.00 0.00 C ATOM 1665 O ARG A 117 5.124 1.732 7.066 1.00 0.00 O ATOM 1666 CB ARG A 117 7.967 0.801 8.647 1.00 0.00 C ATOM 1667 CG ARG A 117 8.829 0.745 9.905 1.00 0.00 C ATOM 1668 CD ARG A 117 10.028 -0.190 9.690 1.00 0.00 C ATOM 1669 NE ARG A 117 9.623 -1.607 9.697 1.00 0.00 N ATOM 1670 CZ ARG A 117 10.437 -2.668 9.649 1.00 0.00 C ATOM 1671 NH1 ARG A 117 11.739 -2.517 9.473 1.00 0.00 N ATOM 1672 NH2 ARG A 117 9.934 -3.887 9.767 1.00 0.00 N ATOM 0 H ARG A 117 5.335 0.641 9.343 1.00 0.00 H new ATOM 0 HA ARG A 117 7.340 2.808 9.066 1.00 0.00 H new ATOM 0 HB2 ARG A 117 7.499 -0.170 8.486 1.00 0.00 H new ATOM 0 HB3 ARG A 117 8.602 0.996 7.783 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.180 1.745 10.158 1.00 0.00 H new ATOM 0 HG3 ARG A 117 8.232 0.394 10.747 1.00 0.00 H new ATOM 0 HD2 ARG A 117 10.508 0.046 8.740 1.00 0.00 H new ATOM 0 HD3 ARG A 117 10.768 -0.019 10.472 1.00 0.00 H new ATOM 0 HE ARG A 117 8.622 -1.798 9.743 1.00 0.00 H new ATOM 0 HH11 ARG A 117 12.135 -1.582 9.372 1.00 0.00 H new ATOM 0 HH12 ARG A 117 12.347 -3.335 9.439 1.00 0.00 H new ATOM 0 HH21 ARG A 117 8.930 -4.014 9.894 1.00 0.00 H new ATOM 0 HH22 ARG A 117 10.551 -4.699 9.731 1.00 0.00 H new ATOM 1686 N THR A 118 6.962 2.856 6.511 1.00 0.00 N ATOM 1687 CA THR A 118 6.576 3.158 5.137 1.00 0.00 C ATOM 1688 C THR A 118 7.862 3.486 4.369 1.00 0.00 C ATOM 1689 O THR A 118 8.913 3.739 4.976 1.00 0.00 O ATOM 1690 CB THR A 118 5.585 4.343 5.145 1.00 0.00 C ATOM 1691 OG1 THR A 118 4.397 4.033 5.850 1.00 0.00 O ATOM 1692 CG2 THR A 118 5.115 4.820 3.769 1.00 0.00 C ATOM 0 H THR A 118 7.867 3.255 6.761 1.00 0.00 H new ATOM 0 HA THR A 118 6.076 2.319 4.653 1.00 0.00 H new ATOM 0 HB THR A 118 6.173 5.129 5.619 1.00 0.00 H new ATOM 0 HG1 THR A 118 4.468 3.132 6.230 1.00 0.00 H new ATOM 0 HG21 THR A 118 4.424 5.654 3.890 1.00 0.00 H new ATOM 0 HG22 THR A 118 5.975 5.144 3.183 1.00 0.00 H new ATOM 0 HG23 THR A 118 4.611 4.003 3.253 1.00 0.00 H new ATOM 1700 N GLY A 119 7.796 3.511 3.041 1.00 0.00 N ATOM 1701 CA GLY A 119 8.856 4.018 2.204 1.00 0.00 C ATOM 1702 C GLY A 119 8.317 4.321 0.818 1.00 0.00 C ATOM 1703 O GLY A 119 7.749 3.440 0.183 1.00 0.00 O ATOM 0 H GLY A 119 6.989 3.172 2.517 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.280 4.921 2.645 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.662 3.287 2.139 1.00 0.00 H new ATOM 1707 N VAL A 120 8.531 5.527 0.294 1.00 0.00 N ATOM 1708 CA VAL A 120 8.208 5.818 -1.101 1.00 0.00 C ATOM 1709 C VAL A 120 9.501 5.790 -1.901 1.00 0.00 C ATOM 1710 O VAL A 120 10.564 6.208 -1.429 1.00 0.00 O ATOM 1711 CB VAL A 120 7.415 7.131 -1.244 1.00 0.00 C ATOM 1712 CG1 VAL A 120 7.017 7.397 -2.703 1.00 0.00 C ATOM 1713 CG2 VAL A 120 6.132 7.067 -0.415 1.00 0.00 C ATOM 0 H VAL A 120 8.924 6.314 0.811 1.00 0.00 H new ATOM 0 HA VAL A 120 7.540 5.056 -1.504 1.00 0.00 H new ATOM 0 HB VAL A 120 8.064 7.933 -0.893 1.00 0.00 H new ATOM 0 HG11 VAL A 120 6.459 8.332 -2.763 1.00 0.00 H new ATOM 0 HG12 VAL A 120 7.914 7.469 -3.318 1.00 0.00 H new ATOM 0 HG13 VAL A 120 6.394 6.579 -3.065 1.00 0.00 H new ATOM 0 HG21 VAL A 120 5.581 8.001 -0.525 1.00 0.00 H new ATOM 0 HG22 VAL A 120 5.515 6.239 -0.763 1.00 0.00 H new ATOM 0 HG23 VAL A 120 6.384 6.916 0.635 1.00 0.00 H new ATOM 1723 N GLN A 121 9.410 5.270 -3.118 1.00 0.00 N ATOM 1724 CA GLN A 121 10.451 5.277 -4.120 1.00 0.00 C ATOM 1725 C GLN A 121 10.119 6.456 -5.031 1.00 0.00 C ATOM 1726 O GLN A 121 9.553 6.301 -6.111 1.00 0.00 O ATOM 1727 CB GLN A 121 10.459 3.899 -4.797 1.00 0.00 C ATOM 1728 CG GLN A 121 11.785 3.549 -5.475 1.00 0.00 C ATOM 1729 CD GLN A 121 11.871 3.996 -6.924 1.00 0.00 C ATOM 1730 OE1 GLN A 121 12.873 4.586 -7.320 1.00 0.00 O ATOM 1731 NE2 GLN A 121 10.862 3.685 -7.718 1.00 0.00 N ATOM 0 H GLN A 121 8.560 4.809 -3.443 1.00 0.00 H new ATOM 0 HA GLN A 121 11.465 5.418 -3.746 1.00 0.00 H new ATOM 0 HB2 GLN A 121 10.231 3.137 -4.051 1.00 0.00 H new ATOM 0 HB3 GLN A 121 9.662 3.866 -5.540 1.00 0.00 H new ATOM 0 HG2 GLN A 121 12.600 4.007 -4.915 1.00 0.00 H new ATOM 0 HG3 GLN A 121 11.932 2.470 -5.428 1.00 0.00 H new ATOM 0 HE21 GLN A 121 10.050 3.194 -7.343 1.00 0.00 H new ATOM 0 HE22 GLN A 121 10.895 3.936 -8.706 1.00 0.00 H new ATOM 1740 N MET A 122 10.396 7.663 -4.534 1.00 0.00 N ATOM 1741 CA MET A 122 10.176 8.917 -5.232 1.00 0.00 C ATOM 1742 C MET A 122 11.294 9.083 -6.252 1.00 0.00 C ATOM 1743 O MET A 122 12.266 9.813 -6.032 1.00 0.00 O ATOM 1744 CB MET A 122 10.097 10.046 -4.199 1.00 0.00 C ATOM 1745 CG MET A 122 9.935 11.432 -4.824 1.00 0.00 C ATOM 1746 SD MET A 122 9.038 12.598 -3.771 1.00 0.00 S ATOM 1747 CE MET A 122 7.370 11.963 -4.078 1.00 0.00 C ATOM 0 H MET A 122 10.793 7.791 -3.603 1.00 0.00 H new ATOM 0 HA MET A 122 9.234 8.937 -5.780 1.00 0.00 H new ATOM 0 HB2 MET A 122 9.258 9.857 -3.529 1.00 0.00 H new ATOM 0 HB3 MET A 122 11.000 10.034 -3.589 1.00 0.00 H new ATOM 0 HG2 MET A 122 10.921 11.839 -5.046 1.00 0.00 H new ATOM 0 HG3 MET A 122 9.410 11.334 -5.774 1.00 0.00 H new ATOM 0 HE1 MET A 122 6.777 12.727 -4.580 1.00 0.00 H new ATOM 0 HE2 MET A 122 7.429 11.076 -4.709 1.00 0.00 H new ATOM 0 HE3 MET A 122 6.899 11.703 -3.130 1.00 0.00 H new ATOM 1757 N ARG A 123 11.214 8.301 -7.322 1.00 0.00 N ATOM 1758 CA ARG A 123 12.049 8.376 -8.506 1.00 0.00 C ATOM 1759 C ARG A 123 11.248 7.664 -9.583 1.00 0.00 C ATOM 1760 O ARG A 123 10.615 6.656 -9.275 1.00 0.00 O ATOM 1761 CB ARG A 123 13.373 7.639 -8.250 1.00 0.00 C ATOM 1762 CG ARG A 123 14.602 8.328 -8.859 1.00 0.00 C ATOM 1763 CD ARG A 123 15.119 7.593 -10.103 1.00 0.00 C ATOM 1764 NE ARG A 123 15.597 6.243 -9.770 1.00 0.00 N ATOM 1765 CZ ARG A 123 16.693 5.913 -9.079 1.00 0.00 C ATOM 1766 NH1 ARG A 123 17.559 6.834 -8.680 1.00 0.00 N ATOM 1767 NH2 ARG A 123 16.922 4.638 -8.799 1.00 0.00 N ATOM 0 H ARG A 123 10.522 7.554 -7.386 1.00 0.00 H new ATOM 0 HA ARG A 123 12.296 9.400 -8.786 1.00 0.00 H new ATOM 0 HB2 ARG A 123 13.520 7.542 -7.174 1.00 0.00 H new ATOM 0 HB3 ARG A 123 13.298 6.629 -8.654 1.00 0.00 H new ATOM 0 HG2 ARG A 123 14.347 9.354 -9.124 1.00 0.00 H new ATOM 0 HG3 ARG A 123 15.395 8.379 -8.113 1.00 0.00 H new ATOM 0 HD2 ARG A 123 14.323 7.526 -10.845 1.00 0.00 H new ATOM 0 HD3 ARG A 123 15.929 8.166 -10.555 1.00 0.00 H new ATOM 0 HE ARG A 123 15.026 5.467 -10.105 1.00 0.00 H new ATOM 0 HH11 ARG A 123 17.396 7.817 -8.899 1.00 0.00 H new ATOM 0 HH12 ARG A 123 18.389 6.560 -8.154 1.00 0.00 H new ATOM 0 HH21 ARG A 123 16.266 3.922 -9.110 1.00 0.00 H new ATOM 0 HH22 ARG A 123 17.754 4.373 -8.273 1.00 0.00 H new ATOM 1781 N ALA A 124 11.235 8.156 -10.816 1.00 0.00 N ATOM 1782 CA ALA A 124 10.599 7.448 -11.904 1.00 0.00 C ATOM 1783 C ALA A 124 11.343 6.116 -12.105 1.00 0.00 C ATOM 1784 O ALA A 124 12.576 6.144 -12.208 1.00 0.00 O ATOM 1785 CB ALA A 124 10.649 8.301 -13.168 1.00 0.00 C ATOM 0 H ALA A 124 11.660 9.044 -11.081 1.00 0.00 H new ATOM 0 HA ALA A 124 9.552 7.247 -11.678 1.00 0.00 H new ATOM 0 HB1 ALA A 124 10.169 7.766 -13.987 1.00 0.00 H new ATOM 0 HB2 ALA A 124 10.126 9.241 -12.993 1.00 0.00 H new ATOM 0 HB3 ALA A 124 11.688 8.506 -13.428 1.00 0.00 H new ATOM 1791 N PRO A 125 10.649 4.971 -12.218 1.00 0.00 N ATOM 1792 CA PRO A 125 9.200 4.823 -12.144 1.00 0.00 C ATOM 1793 C PRO A 125 8.701 4.855 -10.693 1.00 0.00 C ATOM 1794 O PRO A 125 9.129 4.039 -9.879 1.00 0.00 O ATOM 1795 CB PRO A 125 8.910 3.467 -12.794 1.00 0.00 C ATOM 1796 CG PRO A 125 10.172 2.652 -12.506 1.00 0.00 C ATOM 1797 CD PRO A 125 11.289 3.692 -12.481 1.00 0.00 C ATOM 0 HA PRO A 125 8.686 5.641 -12.648 1.00 0.00 H new ATOM 0 HB2 PRO A 125 8.024 2.999 -12.366 1.00 0.00 H new ATOM 0 HB3 PRO A 125 8.732 3.566 -13.865 1.00 0.00 H new ATOM 0 HG2 PRO A 125 10.097 2.124 -11.555 1.00 0.00 H new ATOM 0 HG3 PRO A 125 10.345 1.900 -13.276 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.022 3.458 -11.709 1.00 0.00 H new ATOM 0 HD3 PRO A 125 11.823 3.712 -13.431 1.00 0.00 H new ATOM 1805 N GLN A 126 7.826 5.806 -10.352 1.00 0.00 N ATOM 1806 CA GLN A 126 7.411 6.012 -8.967 1.00 0.00 C ATOM 1807 C GLN A 126 6.588 4.835 -8.464 1.00 0.00 C ATOM 1808 O GLN A 126 5.646 4.377 -9.120 1.00 0.00 O ATOM 1809 CB GLN A 126 6.651 7.331 -8.798 1.00 0.00 C ATOM 1810 CG GLN A 126 7.524 8.538 -9.189 1.00 0.00 C ATOM 1811 CD GLN A 126 7.084 9.852 -8.547 1.00 0.00 C ATOM 1812 OE1 GLN A 126 5.956 10.016 -8.078 1.00 0.00 O ATOM 1813 NE2 GLN A 126 7.995 10.803 -8.461 1.00 0.00 N ATOM 0 H GLN A 126 7.393 6.444 -11.019 1.00 0.00 H new ATOM 0 HA GLN A 126 8.313 6.076 -8.359 1.00 0.00 H new ATOM 0 HB2 GLN A 126 5.752 7.316 -9.414 1.00 0.00 H new ATOM 0 HB3 GLN A 126 6.326 7.435 -7.763 1.00 0.00 H new ATOM 0 HG2 GLN A 126 8.557 8.334 -8.906 1.00 0.00 H new ATOM 0 HG3 GLN A 126 7.507 8.651 -10.273 1.00 0.00 H new ATOM 0 HE21 GLN A 126 8.925 10.655 -8.853 1.00 0.00 H new ATOM 0 HE22 GLN A 126 7.769 11.686 -8.002 1.00 0.00 H new ATOM 1822 N GLN A 127 6.963 4.348 -7.287 1.00 0.00 N ATOM 1823 CA GLN A 127 6.334 3.237 -6.591 1.00 0.00 C ATOM 1824 C GLN A 127 6.436 3.534 -5.092 1.00 0.00 C ATOM 1825 O GLN A 127 7.206 4.397 -4.662 1.00 0.00 O ATOM 1826 CB GLN A 127 7.012 1.900 -6.980 1.00 0.00 C ATOM 1827 CG GLN A 127 6.800 1.576 -8.472 1.00 0.00 C ATOM 1828 CD GLN A 127 7.420 0.270 -8.949 1.00 0.00 C ATOM 1829 OE1 GLN A 127 8.604 0.032 -8.733 1.00 0.00 O ATOM 1830 NE2 GLN A 127 6.672 -0.586 -9.624 1.00 0.00 N ATOM 0 H GLN A 127 7.751 4.737 -6.769 1.00 0.00 H new ATOM 0 HA GLN A 127 5.286 3.131 -6.870 1.00 0.00 H new ATOM 0 HB2 GLN A 127 8.079 1.956 -6.766 1.00 0.00 H new ATOM 0 HB3 GLN A 127 6.606 1.093 -6.370 1.00 0.00 H new ATOM 0 HG2 GLN A 127 5.729 1.545 -8.671 1.00 0.00 H new ATOM 0 HG3 GLN A 127 7.211 2.392 -9.066 1.00 0.00 H new ATOM 0 HE21 GLN A 127 5.689 -0.378 -9.798 1.00 0.00 H new ATOM 0 HE22 GLN A 127 7.078 -1.455 -9.971 1.00 0.00 H new ATOM 1839 N MET A 128 5.657 2.833 -4.285 1.00 0.00 N ATOM 1840 CA MET A 128 5.508 3.040 -2.854 1.00 0.00 C ATOM 1841 C MET A 128 5.475 1.664 -2.199 1.00 0.00 C ATOM 1842 O MET A 128 4.989 0.707 -2.802 1.00 0.00 O ATOM 1843 CB MET A 128 4.238 3.861 -2.606 1.00 0.00 C ATOM 1844 CG MET A 128 3.939 4.106 -1.119 1.00 0.00 C ATOM 1845 SD MET A 128 2.615 3.082 -0.451 1.00 0.00 S ATOM 1846 CE MET A 128 1.282 3.913 -1.351 1.00 0.00 C ATOM 0 H MET A 128 5.081 2.064 -4.628 1.00 0.00 H new ATOM 0 HA MET A 128 6.334 3.603 -2.420 1.00 0.00 H new ATOM 0 HB2 MET A 128 4.333 4.822 -3.111 1.00 0.00 H new ATOM 0 HB3 MET A 128 3.390 3.346 -3.058 1.00 0.00 H new ATOM 0 HG2 MET A 128 4.847 3.927 -0.543 1.00 0.00 H new ATOM 0 HG3 MET A 128 3.676 5.155 -0.981 1.00 0.00 H new ATOM 0 HE1 MET A 128 0.319 3.559 -0.983 1.00 0.00 H new ATOM 0 HE2 MET A 128 1.355 4.990 -1.198 1.00 0.00 H new ATOM 0 HE3 MET A 128 1.368 3.691 -2.415 1.00 0.00 H new ATOM 1856 N GLN A 129 5.983 1.553 -0.976 1.00 0.00 N ATOM 1857 CA GLN A 129 5.783 0.400 -0.127 1.00 0.00 C ATOM 1858 C GLN A 129 5.321 0.891 1.238 1.00 0.00 C ATOM 1859 O GLN A 129 5.783 1.916 1.751 1.00 0.00 O ATOM 1860 CB GLN A 129 7.053 -0.468 -0.032 1.00 0.00 C ATOM 1861 CG GLN A 129 7.172 -1.411 -1.240 1.00 0.00 C ATOM 1862 CD GLN A 129 8.370 -2.360 -1.172 1.00 0.00 C ATOM 1863 OE1 GLN A 129 9.342 -2.148 -0.454 1.00 0.00 O ATOM 1864 NE2 GLN A 129 8.294 -3.468 -1.889 1.00 0.00 N ATOM 0 H GLN A 129 6.555 2.280 -0.546 1.00 0.00 H new ATOM 0 HA GLN A 129 5.018 -0.246 -0.558 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.932 0.174 0.020 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.030 -1.052 0.888 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.259 -2.000 -1.319 1.00 0.00 H new ATOM 0 HG3 GLN A 129 7.246 -0.814 -2.149 1.00 0.00 H new ATOM 0 HE21 GLN A 129 7.482 -3.636 -2.483 1.00 0.00 H new ATOM 0 HE22 GLN A 129 9.047 -4.155 -1.848 1.00 0.00 H new ATOM 1873 N LEU A 130 4.402 0.145 1.838 1.00 0.00 N ATOM 1874 CA LEU A 130 4.154 0.224 3.270 1.00 0.00 C ATOM 1875 C LEU A 130 5.018 -0.856 3.909 1.00 0.00 C ATOM 1876 O LEU A 130 5.420 -1.802 3.225 1.00 0.00 O ATOM 1877 CB LEU A 130 2.665 0.001 3.580 1.00 0.00 C ATOM 1878 CG LEU A 130 1.719 1.015 2.911 1.00 0.00 C ATOM 1879 CD1 LEU A 130 0.273 0.709 3.313 1.00 0.00 C ATOM 1880 CD2 LEU A 130 2.057 2.470 3.252 1.00 0.00 C ATOM 0 H LEU A 130 3.812 -0.527 1.349 1.00 0.00 H new ATOM 0 HA LEU A 130 4.405 1.209 3.664 1.00 0.00 H new ATOM 0 HB2 LEU A 130 2.386 -1.003 3.261 1.00 0.00 H new ATOM 0 HB3 LEU A 130 2.520 0.044 4.659 1.00 0.00 H new ATOM 0 HG LEU A 130 1.847 0.908 1.834 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -0.396 1.427 2.839 1.00 0.00 H new ATOM 0 HD12 LEU A 130 0.011 -0.299 2.990 1.00 0.00 H new ATOM 0 HD13 LEU A 130 0.174 0.780 4.396 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.354 3.134 2.750 1.00 0.00 H new ATOM 0 HD22 LEU A 130 1.988 2.617 4.330 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.070 2.696 2.919 1.00 0.00 H new ATOM 1892 N VAL A 131 5.271 -0.755 5.215 1.00 0.00 N ATOM 1893 CA VAL A 131 5.873 -1.836 5.974 1.00 0.00 C ATOM 1894 C VAL A 131 5.109 -1.965 7.295 1.00 0.00 C ATOM 1895 O VAL A 131 4.984 -0.996 8.043 1.00 0.00 O ATOM 1896 CB VAL A 131 7.398 -1.663 6.105 1.00 0.00 C ATOM 1897 CG1 VAL A 131 7.968 -2.688 7.095 1.00 0.00 C ATOM 1898 CG2 VAL A 131 8.134 -1.858 4.774 1.00 0.00 C ATOM 0 H VAL A 131 5.063 0.077 5.768 1.00 0.00 H new ATOM 0 HA VAL A 131 5.779 -2.788 5.451 1.00 0.00 H new ATOM 0 HB VAL A 131 7.554 -0.641 6.452 1.00 0.00 H new ATOM 0 HG11 VAL A 131 9.047 -2.554 7.177 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.509 -2.544 8.073 1.00 0.00 H new ATOM 0 HG13 VAL A 131 7.754 -3.696 6.739 1.00 0.00 H new ATOM 0 HG21 VAL A 131 9.205 -1.724 4.927 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.944 -2.863 4.397 1.00 0.00 H new ATOM 0 HG23 VAL A 131 7.777 -1.126 4.050 1.00 0.00 H new ATOM 1908 N LEU A 132 4.537 -3.146 7.554 1.00 0.00 N ATOM 1909 CA LEU A 132 3.764 -3.389 8.766 1.00 0.00 C ATOM 1910 C LEU A 132 4.664 -3.425 9.994 1.00 0.00 C ATOM 1911 O LEU A 132 5.887 -3.530 9.887 1.00 0.00 O ATOM 1912 CB LEU A 132 2.946 -4.691 8.642 1.00 0.00 C ATOM 1913 CG LEU A 132 1.497 -4.417 8.215 1.00 0.00 C ATOM 1914 CD1 LEU A 132 1.378 -3.798 6.823 1.00 0.00 C ATOM 1915 CD2 LEU A 132 0.652 -5.686 8.266 1.00 0.00 C ATOM 0 H LEU A 132 4.599 -3.952 6.931 1.00 0.00 H new ATOM 0 HA LEU A 132 3.066 -2.561 8.890 1.00 0.00 H new ATOM 0 HB2 LEU A 132 3.420 -5.350 7.915 1.00 0.00 H new ATOM 0 HB3 LEU A 132 2.950 -5.215 9.598 1.00 0.00 H new ATOM 0 HG LEU A 132 1.122 -3.690 8.935 1.00 0.00 H new ATOM 0 HD11 LEU A 132 0.327 -3.632 6.587 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.910 -2.847 6.801 1.00 0.00 H new ATOM 0 HD13 LEU A 132 1.813 -4.473 6.086 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -0.368 -5.457 7.958 1.00 0.00 H new ATOM 0 HD22 LEU A 132 1.075 -6.432 7.593 1.00 0.00 H new ATOM 0 HD23 LEU A 132 0.644 -6.077 9.283 1.00 0.00 H new ATOM 1927 N ASP A 133 4.030 -3.442 11.165 1.00 0.00 N ATOM 1928 CA ASP A 133 4.693 -3.693 12.439 1.00 0.00 C ATOM 1929 C ASP A 133 5.276 -5.105 12.527 1.00 0.00 C ATOM 1930 O ASP A 133 6.306 -5.269 13.177 1.00 0.00 O ATOM 1931 CB ASP A 133 3.783 -3.381 13.640 1.00 0.00 C ATOM 1932 CG ASP A 133 2.464 -4.150 13.753 1.00 0.00 C ATOM 1933 OD1 ASP A 133 2.051 -4.866 12.811 1.00 0.00 O ATOM 1934 OD2 ASP A 133 1.749 -3.910 14.755 1.00 0.00 O ATOM 0 H ASP A 133 3.027 -3.279 11.255 1.00 0.00 H new ATOM 0 HA ASP A 133 5.534 -3.001 12.484 1.00 0.00 H new ATOM 0 HB2 ASP A 133 4.355 -3.561 14.550 1.00 0.00 H new ATOM 0 HB3 ASP A 133 3.549 -2.317 13.616 1.00 0.00 H new ATOM 1939 N ASN A 134 4.738 -6.092 11.798 1.00 0.00 N ATOM 1940 CA ASN A 134 5.395 -7.395 11.657 1.00 0.00 C ATOM 1941 C ASN A 134 6.574 -7.250 10.712 1.00 0.00 C ATOM 1942 O ASN A 134 7.605 -7.886 10.908 1.00 0.00 O ATOM 1943 CB ASN A 134 4.495 -8.498 11.067 1.00 0.00 C ATOM 1944 CG ASN A 134 3.055 -8.419 11.522 1.00 0.00 C ATOM 1945 OD1 ASN A 134 2.711 -8.799 12.634 1.00 0.00 O ATOM 1946 ND2 ASN A 134 2.185 -7.906 10.676 1.00 0.00 N ATOM 0 H ASN A 134 3.852 -6.012 11.299 1.00 0.00 H new ATOM 0 HA ASN A 134 5.679 -7.693 12.666 1.00 0.00 H new ATOM 0 HB2 ASN A 134 4.526 -8.436 9.979 1.00 0.00 H new ATOM 0 HB3 ASN A 134 4.901 -9.471 11.343 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.204 -7.819 10.943 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.492 -7.595 9.754 1.00 0.00 H new ATOM 1953 N GLY A 135 6.414 -6.428 9.670 1.00 0.00 N ATOM 1954 CA GLY A 135 7.370 -6.273 8.595 1.00 0.00 C ATOM 1955 C GLY A 135 6.826 -6.707 7.231 1.00 0.00 C ATOM 1956 O GLY A 135 7.626 -6.841 6.305 1.00 0.00 O ATOM 0 H GLY A 135 5.588 -5.840 9.558 1.00 0.00 H new ATOM 0 HA2 GLY A 135 7.678 -5.229 8.540 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.262 -6.856 8.825 1.00 0.00 H new ATOM 1960 N ASP A 136 5.516 -6.968 7.074 1.00 0.00 N ATOM 1961 CA ASP A 136 4.891 -7.218 5.763 1.00 0.00 C ATOM 1962 C ASP A 136 5.188 -6.041 4.852 1.00 0.00 C ATOM 1963 O ASP A 136 5.231 -4.913 5.340 1.00 0.00 O ATOM 1964 CB ASP A 136 3.351 -7.281 5.812 1.00 0.00 C ATOM 1965 CG ASP A 136 2.756 -8.244 6.816 1.00 0.00 C ATOM 1966 OD1 ASP A 136 2.969 -8.052 8.030 1.00 0.00 O ATOM 1967 OD2 ASP A 136 2.031 -9.166 6.383 1.00 0.00 O ATOM 0 H ASP A 136 4.860 -7.012 7.854 1.00 0.00 H new ATOM 0 HA ASP A 136 5.291 -8.173 5.424 1.00 0.00 H new ATOM 0 HB2 ASP A 136 2.973 -6.282 6.030 1.00 0.00 H new ATOM 0 HB3 ASP A 136 2.987 -7.551 4.821 1.00 0.00 H new ATOM 1972 N THR A 137 5.258 -6.266 3.545 1.00 0.00 N ATOM 1973 CA THR A 137 5.619 -5.253 2.569 1.00 0.00 C ATOM 1974 C THR A 137 4.585 -5.256 1.439 1.00 0.00 C ATOM 1975 O THR A 137 4.640 -6.099 0.538 1.00 0.00 O ATOM 1976 CB THR A 137 7.064 -5.500 2.096 1.00 0.00 C ATOM 1977 OG1 THR A 137 7.931 -5.732 3.192 1.00 0.00 O ATOM 1978 CG2 THR A 137 7.561 -4.275 1.337 1.00 0.00 C ATOM 0 H THR A 137 5.061 -7.176 3.129 1.00 0.00 H new ATOM 0 HA THR A 137 5.602 -4.253 3.003 1.00 0.00 H new ATOM 0 HB THR A 137 7.064 -6.381 1.454 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.841 -5.887 2.862 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.584 -4.446 1.000 1.00 0.00 H new ATOM 0 HG22 THR A 137 6.920 -4.097 0.474 1.00 0.00 H new ATOM 0 HG23 THR A 137 7.536 -3.405 1.993 1.00 0.00 H new ATOM 1986 N LEU A 138 3.593 -4.368 1.498 1.00 0.00 N ATOM 1987 CA LEU A 138 2.656 -4.093 0.406 1.00 0.00 C ATOM 1988 C LEU A 138 3.362 -3.179 -0.600 1.00 0.00 C ATOM 1989 O LEU A 138 3.939 -2.183 -0.172 1.00 0.00 O ATOM 1990 CB LEU A 138 1.389 -3.382 0.924 1.00 0.00 C ATOM 1991 CG LEU A 138 0.299 -4.287 1.539 1.00 0.00 C ATOM 1992 CD1 LEU A 138 0.613 -4.710 2.975 1.00 0.00 C ATOM 1993 CD2 LEU A 138 -1.048 -3.553 1.572 1.00 0.00 C ATOM 0 H LEU A 138 3.413 -3.804 2.329 1.00 0.00 H new ATOM 0 HA LEU A 138 2.354 -5.034 -0.053 1.00 0.00 H new ATOM 0 HB2 LEU A 138 1.690 -2.651 1.674 1.00 0.00 H new ATOM 0 HB3 LEU A 138 0.946 -2.827 0.097 1.00 0.00 H new ATOM 0 HG LEU A 138 0.262 -5.174 0.906 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -0.190 -5.344 3.351 1.00 0.00 H new ATOM 0 HD12 LEU A 138 1.552 -5.263 2.994 1.00 0.00 H new ATOM 0 HD13 LEU A 138 0.701 -3.824 3.604 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.806 -4.203 2.008 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -0.955 -2.649 2.174 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.341 -3.284 0.557 1.00 0.00 H new ATOM 2005 N THR A 139 3.296 -3.471 -1.903 1.00 0.00 N ATOM 2006 CA THR A 139 3.853 -2.632 -2.971 1.00 0.00 C ATOM 2007 C THR A 139 2.716 -1.974 -3.744 1.00 0.00 C ATOM 2008 O THR A 139 1.819 -2.672 -4.225 1.00 0.00 O ATOM 2009 CB THR A 139 4.705 -3.470 -3.937 1.00 0.00 C ATOM 2010 OG1 THR A 139 5.725 -4.154 -3.235 1.00 0.00 O ATOM 2011 CG2 THR A 139 5.363 -2.625 -5.039 1.00 0.00 C ATOM 0 H THR A 139 2.844 -4.316 -2.253 1.00 0.00 H new ATOM 0 HA THR A 139 4.487 -1.871 -2.517 1.00 0.00 H new ATOM 0 HB THR A 139 4.019 -4.175 -4.407 1.00 0.00 H new ATOM 0 HG1 THR A 139 6.257 -4.684 -3.865 1.00 0.00 H new ATOM 0 HG21 THR A 139 5.952 -3.271 -5.690 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.591 -2.126 -5.625 1.00 0.00 H new ATOM 0 HG23 THR A 139 6.014 -1.878 -4.585 1.00 0.00 H new ATOM 2019 N PHE A 140 2.781 -0.653 -3.910 1.00 0.00 N ATOM 2020 CA PHE A 140 1.810 0.136 -4.642 1.00 0.00 C ATOM 2021 C PHE A 140 2.513 0.864 -5.794 1.00 0.00 C ATOM 2022 O PHE A 140 3.538 1.521 -5.591 1.00 0.00 O ATOM 2023 CB PHE A 140 1.127 1.149 -3.715 1.00 0.00 C ATOM 2024 CG PHE A 140 0.323 0.626 -2.537 1.00 0.00 C ATOM 2025 CD1 PHE A 140 0.978 0.140 -1.388 1.00 0.00 C ATOM 2026 CD2 PHE A 140 -1.082 0.737 -2.536 1.00 0.00 C ATOM 2027 CE1 PHE A 140 0.235 -0.228 -0.255 1.00 0.00 C ATOM 2028 CE2 PHE A 140 -1.823 0.373 -1.397 1.00 0.00 C ATOM 2029 CZ PHE A 140 -1.163 -0.105 -0.252 1.00 0.00 C ATOM 0 H PHE A 140 3.539 -0.091 -3.523 1.00 0.00 H new ATOM 0 HA PHE A 140 1.044 -0.527 -5.044 1.00 0.00 H new ATOM 0 HB2 PHE A 140 1.898 1.811 -3.322 1.00 0.00 H new ATOM 0 HB3 PHE A 140 0.462 1.761 -4.325 1.00 0.00 H new ATOM 0 HD1 PHE A 140 2.054 0.050 -1.379 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -1.592 1.103 -3.414 1.00 0.00 H new ATOM 0 HE1 PHE A 140 0.742 -0.608 0.619 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -2.899 0.461 -1.402 1.00 0.00 H new ATOM 0 HZ PHE A 140 -1.729 -0.377 0.627 1.00 0.00 H new ATOM 2039 N ASP A 141 1.962 0.782 -7.000 1.00 0.00 N ATOM 2040 CA ASP A 141 2.405 1.536 -8.175 1.00 0.00 C ATOM 2041 C ASP A 141 1.759 2.919 -8.170 1.00 0.00 C ATOM 2042 O ASP A 141 0.633 3.062 -7.695 1.00 0.00 O ATOM 2043 CB ASP A 141 2.008 0.782 -9.452 1.00 0.00 C ATOM 2044 CG ASP A 141 3.183 -0.068 -9.933 1.00 0.00 C ATOM 2045 OD1 ASP A 141 4.185 0.501 -10.424 1.00 0.00 O ATOM 2046 OD2 ASP A 141 3.139 -1.301 -9.738 1.00 0.00 O ATOM 0 H ASP A 141 1.170 0.171 -7.197 1.00 0.00 H new ATOM 0 HA ASP A 141 3.489 1.646 -8.146 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.143 0.148 -9.258 1.00 0.00 H new ATOM 0 HB3 ASP A 141 1.716 1.490 -10.228 1.00 0.00 H new ATOM 2051 N ARG A 142 2.435 3.950 -8.694 1.00 0.00 N ATOM 2052 CA ARG A 142 1.873 5.298 -8.863 1.00 0.00 C ATOM 2053 C ARG A 142 0.816 5.247 -9.975 1.00 0.00 C ATOM 2054 O ARG A 142 1.114 4.670 -11.025 1.00 0.00 O ATOM 2055 CB ARG A 142 3.036 6.261 -9.183 1.00 0.00 C ATOM 2056 CG ARG A 142 2.649 7.742 -9.288 1.00 0.00 C ATOM 2057 CD ARG A 142 2.628 8.409 -7.906 1.00 0.00 C ATOM 2058 NE ARG A 142 2.305 9.842 -7.981 1.00 0.00 N ATOM 2059 CZ ARG A 142 1.087 10.384 -8.037 1.00 0.00 C ATOM 2060 NH1 ARG A 142 0.011 9.604 -8.056 1.00 0.00 N ATOM 2061 NH2 ARG A 142 0.953 11.704 -8.054 1.00 0.00 N ATOM 0 H ARG A 142 3.399 3.871 -9.017 1.00 0.00 H new ATOM 0 HA ARG A 142 1.379 5.658 -7.961 1.00 0.00 H new ATOM 0 HB2 ARG A 142 3.797 6.155 -8.410 1.00 0.00 H new ATOM 0 HB3 ARG A 142 3.492 5.954 -10.124 1.00 0.00 H new ATOM 0 HG2 ARG A 142 3.357 8.261 -9.934 1.00 0.00 H new ATOM 0 HG3 ARG A 142 1.667 7.832 -9.753 1.00 0.00 H new ATOM 0 HD2 ARG A 142 1.896 7.907 -7.274 1.00 0.00 H new ATOM 0 HD3 ARG A 142 3.600 8.283 -7.430 1.00 0.00 H new ATOM 0 HE ARG A 142 3.094 10.488 -7.991 1.00 0.00 H new ATOM 0 HH11 ARG A 142 0.116 8.590 -8.028 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -0.919 10.020 -8.099 1.00 0.00 H new ATOM 0 HH21 ARG A 142 1.780 12.301 -8.024 1.00 0.00 H new ATOM 0 HH22 ARG A 142 0.023 12.122 -8.097 1.00 0.00 H new ATOM 2075 N SER A 143 -0.389 5.821 -9.795 1.00 0.00 N ATOM 2076 CA SER A 143 -1.443 5.769 -10.810 1.00 0.00 C ATOM 2077 C SER A 143 -2.070 7.147 -11.001 1.00 0.00 C ATOM 2078 O SER A 143 -3.280 7.332 -10.833 1.00 0.00 O ATOM 2079 CB SER A 143 -2.409 4.653 -10.423 1.00 0.00 C ATOM 2080 OG SER A 143 -3.626 4.640 -11.139 1.00 0.00 O ATOM 0 H SER A 143 -0.651 6.327 -8.949 1.00 0.00 H new ATOM 0 HA SER A 143 -1.054 5.520 -11.797 1.00 0.00 H new ATOM 0 HB2 SER A 143 -1.910 3.695 -10.568 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.632 4.739 -9.359 1.00 0.00 H new ATOM 0 HG SER A 143 -3.956 5.557 -11.240 1.00 0.00 H new ATOM 2086 N THR A 144 -1.245 8.104 -11.412 1.00 0.00 N ATOM 2087 CA THR A 144 -1.673 9.477 -11.698 1.00 0.00 C ATOM 2088 C THR A 144 -2.438 9.654 -13.013 1.00 0.00 C ATOM 2089 O THR A 144 -2.817 10.784 -13.333 1.00 0.00 O ATOM 2090 CB THR A 144 -0.517 10.498 -11.599 1.00 0.00 C ATOM 2091 OG1 THR A 144 0.663 9.982 -11.003 1.00 0.00 O ATOM 2092 CG2 THR A 144 -0.990 11.679 -10.739 1.00 0.00 C ATOM 0 H THR A 144 -0.247 7.951 -11.559 1.00 0.00 H new ATOM 0 HA THR A 144 -2.389 9.689 -10.904 1.00 0.00 H new ATOM 0 HB THR A 144 -0.267 10.783 -12.621 1.00 0.00 H new ATOM 0 HG1 THR A 144 1.349 10.682 -10.976 1.00 0.00 H new ATOM 0 HG21 THR A 144 -0.188 12.413 -10.656 1.00 0.00 H new ATOM 0 HG22 THR A 144 -1.860 12.143 -11.205 1.00 0.00 H new ATOM 0 HG23 THR A 144 -1.258 11.321 -9.745 1.00 0.00 H new ATOM 2100 N ARG A 145 -2.711 8.558 -13.729 1.00 0.00 N ATOM 2101 CA ARG A 145 -3.237 8.552 -15.092 1.00 0.00 C ATOM 2102 C ARG A 145 -2.299 9.220 -16.096 1.00 0.00 C ATOM 2103 O ARG A 145 -2.643 9.241 -17.300 1.00 0.00 O ATOM 2104 CB ARG A 145 -4.653 9.153 -15.095 1.00 0.00 C ATOM 2105 CG ARG A 145 -5.550 8.412 -16.086 1.00 0.00 C ATOM 2106 CD ARG A 145 -6.945 9.020 -16.143 1.00 0.00 C ATOM 2107 NE ARG A 145 -7.613 9.065 -14.832 1.00 0.00 N ATOM 2108 CZ ARG A 145 -8.368 8.120 -14.263 1.00 0.00 C ATOM 2109 NH1 ARG A 145 -8.424 6.881 -14.748 1.00 0.00 N ATOM 2110 NH2 ARG A 145 -9.086 8.440 -13.195 1.00 0.00 N ATOM 0 H ARG A 145 -2.565 7.619 -13.359 1.00 0.00 H new ATOM 0 HA ARG A 145 -3.303 7.519 -15.432 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -5.081 9.094 -14.094 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -4.605 10.209 -15.359 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -5.099 8.441 -17.078 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -5.621 7.363 -15.799 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -6.877 10.031 -16.544 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -7.558 8.443 -16.836 1.00 0.00 H new ATOM 0 HE ARG A 145 -7.484 9.921 -14.292 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -7.882 6.632 -15.575 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -9.009 6.181 -14.292 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -9.054 9.390 -12.825 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -9.670 7.736 -12.743 1.00 0.00 H new TER 2124 ARG A 145