USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 882 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 90 SER OG : rot -80:sc=-0.00732 USER MOD Set 1.2: A 109 GLN : amide:sc= -0.555 K(o=-0.56,f=-2.4!) USER MOD Set 2.1: A 58 MET CE :methyl 172:sc= -1.31 (180deg=-0.575) USER MOD Set 2.2: A 89 TYR OH : rot 0:sc= -0.396 USER MOD Set 3.1: A 56 TYR OH : rot 5:sc= 0.353 USER MOD Set 3.2: A 70 HIS : no HD1:sc= 0.0276 K(o=0.38,f=-1.1) USER MOD Set 3.3: A 78 THR OG1 : rot 140:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 50:sc= 1.04 USER MOD Single : A 11 THR OG1 : rot 180:sc=0.000225 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.0198 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 19 SER OG : rot -54:sc= 0.317 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0.48) USER MOD Single : A 29 MET CE :methyl 160:sc= -5.94! (180deg=-6.47!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= -1.76! USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.945 USER MOD Single : A 38 GLN : amide:sc= -0.0541 X(o=-0.054,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.283 X(o=-0.28,f=-0.06) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= 0.146 K(o=0.15,f=-0.36) USER MOD Single : A 52 TYR OH : rot 180:sc= -0.946 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -1.71 X(o=-1.7,f=-2.2) USER MOD Single : A 63 HIS : no HD1:sc= -0.825 K(o=-0.83,f=-2) USER MOD Single : A 65 ASN : amide:sc= -0.135 X(o=-0.14,f=-0.35) USER MOD Single : A 66 ASN : amide:sc= -0.0256 X(o=-0.026,f=-0.36) USER MOD Single : A 68 MET CE :methyl 157:sc= 0 (180deg=-0.21) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.0982 X(o=-0.098,f=-0.23) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.755 X(o=-0.75,f=-0.65) USER MOD Single : A 79 THR OG1 : rot 46:sc= 0.0051 USER MOD Single : A 82 ASN : amide:sc= -0.37 K(o=-0.37,f=-2.1) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= -1.21 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= -0.102 USER MOD Single : A 106 SER OG : rot 84:sc= 0.128 USER MOD Single : A 112 THR OG1 : rot -174:sc= 1.03 USER MOD Single : A 113 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 28.141 17.735 -3.746 1.00 0.00 N ATOM 2 CA GLY A 1 27.929 18.343 -2.445 1.00 0.00 C ATOM 3 C GLY A 1 26.654 19.160 -2.388 1.00 0.00 C ATOM 4 O GLY A 1 26.681 20.379 -2.555 1.00 0.00 O ATOM 0 H1 GLY A 1 29.025 17.188 -3.733 1.00 0.00 H new ATOM 0 H2 GLY A 1 27.345 17.103 -3.968 1.00 0.00 H new ATOM 0 H3 GLY A 1 28.205 18.478 -4.470 1.00 0.00 H new ATOM 0 HA2 GLY A 1 27.891 17.563 -1.685 1.00 0.00 H new ATOM 0 HA3 GLY A 1 28.778 18.983 -2.204 1.00 0.00 H new ATOM 8 N SER A 2 25.532 18.487 -2.154 1.00 0.00 N ATOM 9 CA SER A 2 24.239 19.156 -2.082 1.00 0.00 C ATOM 10 C SER A 2 23.745 19.230 -0.640 1.00 0.00 C ATOM 11 O SER A 2 23.561 18.207 0.018 1.00 0.00 O ATOM 12 CB SER A 2 23.211 18.425 -2.948 1.00 0.00 C ATOM 13 OG SER A 2 23.493 18.596 -4.326 1.00 0.00 O ATOM 0 H SER A 2 25.493 17.478 -2.011 1.00 0.00 H new ATOM 0 HA SER A 2 24.363 20.171 -2.459 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.213 17.363 -2.702 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.212 18.801 -2.728 1.00 0.00 H new ATOM 0 HG SER A 2 22.823 18.118 -4.859 1.00 0.00 H new ATOM 19 N SER A 3 23.533 20.450 -0.155 1.00 0.00 N ATOM 20 CA SER A 3 23.064 20.659 1.210 1.00 0.00 C ATOM 21 C SER A 3 22.732 22.129 1.452 1.00 0.00 C ATOM 22 O SER A 3 23.533 23.014 1.153 1.00 0.00 O ATOM 23 CB SER A 3 24.122 20.193 2.212 1.00 0.00 C ATOM 24 OG SER A 3 23.520 19.597 3.348 1.00 0.00 O ATOM 0 H SER A 3 23.679 21.308 -0.687 1.00 0.00 H new ATOM 0 HA SER A 3 22.157 20.071 1.350 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.791 19.478 1.733 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.732 21.041 2.523 1.00 0.00 H new ATOM 0 HG SER A 3 24.217 19.306 3.973 1.00 0.00 H new ATOM 30 N GLY A 4 21.545 22.380 1.994 1.00 0.00 N ATOM 31 CA GLY A 4 21.126 23.743 2.267 1.00 0.00 C ATOM 32 C GLY A 4 21.002 24.573 1.005 1.00 0.00 C ATOM 33 O GLY A 4 21.826 25.451 0.748 1.00 0.00 O ATOM 0 H GLY A 4 20.865 21.664 2.249 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.167 23.729 2.785 1.00 0.00 H new ATOM 0 HA3 GLY A 4 21.844 24.213 2.939 1.00 0.00 H new ATOM 37 N SER A 5 19.970 24.297 0.215 1.00 0.00 N ATOM 38 CA SER A 5 19.742 25.022 -1.029 1.00 0.00 C ATOM 39 C SER A 5 18.331 25.596 -1.075 1.00 0.00 C ATOM 40 O SER A 5 17.435 25.021 -1.693 1.00 0.00 O ATOM 41 CB SER A 5 19.970 24.101 -2.230 1.00 0.00 C ATOM 42 OG SER A 5 21.351 23.841 -2.419 1.00 0.00 O ATOM 0 H SER A 5 19.277 23.575 0.415 1.00 0.00 H new ATOM 0 HA SER A 5 20.452 25.848 -1.073 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.437 23.162 -2.078 1.00 0.00 H new ATOM 0 HB3 SER A 5 19.557 24.560 -3.128 1.00 0.00 H new ATOM 0 HG SER A 5 21.470 23.249 -3.191 1.00 0.00 H new ATOM 48 N SER A 6 18.139 26.734 -0.414 1.00 0.00 N ATOM 49 CA SER A 6 16.835 27.384 -0.374 1.00 0.00 C ATOM 50 C SER A 6 16.922 28.733 0.333 1.00 0.00 C ATOM 51 O SER A 6 17.924 29.047 0.975 1.00 0.00 O ATOM 52 CB SER A 6 15.815 26.490 0.333 1.00 0.00 C ATOM 53 OG SER A 6 15.067 25.731 -0.602 1.00 0.00 O ATOM 0 H SER A 6 18.870 27.224 0.101 1.00 0.00 H new ATOM 0 HA SER A 6 16.509 27.551 -1.401 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.330 25.820 1.021 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.141 27.104 0.930 1.00 0.00 H new ATOM 0 HG SER A 6 15.678 25.287 -1.226 1.00 0.00 H new ATOM 59 N GLY A 7 15.863 29.529 0.211 1.00 0.00 N ATOM 60 CA GLY A 7 15.839 30.834 0.844 1.00 0.00 C ATOM 61 C GLY A 7 14.463 31.200 1.365 1.00 0.00 C ATOM 62 O GLY A 7 13.480 30.498 1.130 1.00 0.00 O ATOM 0 H GLY A 7 15.022 29.293 -0.315 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.552 30.848 1.668 1.00 0.00 H new ATOM 0 HA3 GLY A 7 16.165 31.588 0.128 1.00 0.00 H new ATOM 66 N PRO A 8 14.382 32.325 2.091 1.00 0.00 N ATOM 67 CA PRO A 8 13.122 32.810 2.663 1.00 0.00 C ATOM 68 C PRO A 8 12.157 33.313 1.595 1.00 0.00 C ATOM 69 O PRO A 8 12.549 34.040 0.682 1.00 0.00 O ATOM 70 CB PRO A 8 13.563 33.961 3.570 1.00 0.00 C ATOM 71 CG PRO A 8 14.850 34.431 2.987 1.00 0.00 C ATOM 72 CD PRO A 8 15.514 33.212 2.409 1.00 0.00 C ATOM 0 HA PRO A 8 12.582 32.021 3.186 1.00 0.00 H new ATOM 0 HB2 PRO A 8 12.821 34.759 3.586 1.00 0.00 H new ATOM 0 HB3 PRO A 8 13.693 33.626 4.599 1.00 0.00 H new ATOM 0 HG2 PRO A 8 14.678 35.183 2.217 1.00 0.00 H new ATOM 0 HG3 PRO A 8 15.478 34.893 3.749 1.00 0.00 H new ATOM 0 HD2 PRO A 8 16.096 33.455 1.520 1.00 0.00 H new ATOM 0 HD3 PRO A 8 16.198 32.751 3.122 1.00 0.00 H new ATOM 80 N VAL A 9 10.892 32.921 1.715 1.00 0.00 N ATOM 81 CA VAL A 9 9.870 33.334 0.761 1.00 0.00 C ATOM 82 C VAL A 9 8.776 34.147 1.445 1.00 0.00 C ATOM 83 O VAL A 9 8.720 34.224 2.672 1.00 0.00 O ATOM 84 CB VAL A 9 9.231 32.119 0.062 1.00 0.00 C ATOM 85 CG1 VAL A 9 10.282 31.325 -0.698 1.00 0.00 C ATOM 86 CG2 VAL A 9 8.515 31.238 1.075 1.00 0.00 C ATOM 0 H VAL A 9 10.551 32.318 2.464 1.00 0.00 H new ATOM 0 HA VAL A 9 10.366 33.954 0.014 1.00 0.00 H new ATOM 0 HB VAL A 9 8.495 32.481 -0.656 1.00 0.00 H new ATOM 0 HG11 VAL A 9 9.811 30.471 -1.185 1.00 0.00 H new ATOM 0 HG12 VAL A 9 10.745 31.962 -1.451 1.00 0.00 H new ATOM 0 HG13 VAL A 9 11.044 30.972 -0.003 1.00 0.00 H new ATOM 0 HG21 VAL A 9 8.069 30.384 0.564 1.00 0.00 H new ATOM 0 HG22 VAL A 9 9.229 30.884 1.818 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.733 31.814 1.569 1.00 0.00 H new ATOM 96 N LEU A 10 7.908 34.752 0.642 1.00 0.00 N ATOM 97 CA LEU A 10 6.813 35.559 1.169 1.00 0.00 C ATOM 98 C LEU A 10 5.469 35.068 0.641 1.00 0.00 C ATOM 99 O LEU A 10 4.598 35.863 0.288 1.00 0.00 O ATOM 100 CB LEU A 10 7.013 37.029 0.796 1.00 0.00 C ATOM 101 CG LEU A 10 6.395 38.053 1.750 1.00 0.00 C ATOM 102 CD1 LEU A 10 7.137 38.064 3.076 1.00 0.00 C ATOM 103 CD2 LEU A 10 6.402 39.440 1.121 1.00 0.00 C ATOM 0 H LEU A 10 7.941 34.699 -0.376 1.00 0.00 H new ATOM 0 HA LEU A 10 6.813 35.461 2.255 1.00 0.00 H new ATOM 0 HB2 LEU A 10 8.083 37.224 0.729 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.597 37.191 -0.198 1.00 0.00 H new ATOM 0 HG LEU A 10 5.361 37.766 1.939 1.00 0.00 H new ATOM 0 HD11 LEU A 10 6.683 38.799 3.741 1.00 0.00 H new ATOM 0 HD12 LEU A 10 7.080 37.076 3.533 1.00 0.00 H new ATOM 0 HD13 LEU A 10 8.182 38.325 2.906 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.959 40.156 1.813 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.428 39.735 0.902 1.00 0.00 H new ATOM 0 HD23 LEU A 10 5.824 39.423 0.197 1.00 0.00 H new ATOM 115 N THR A 11 5.306 33.749 0.592 1.00 0.00 N ATOM 116 CA THR A 11 4.069 33.149 0.108 1.00 0.00 C ATOM 117 C THR A 11 3.338 32.417 1.228 1.00 0.00 C ATOM 118 O THR A 11 3.962 31.915 2.162 1.00 0.00 O ATOM 119 CB THR A 11 4.334 32.164 -1.045 1.00 0.00 C ATOM 120 OG1 THR A 11 5.646 31.603 -0.919 1.00 0.00 O ATOM 121 CG2 THR A 11 4.204 32.861 -2.392 1.00 0.00 C ATOM 0 H THR A 11 6.016 33.076 0.882 1.00 0.00 H new ATOM 0 HA THR A 11 3.445 33.965 -0.258 1.00 0.00 H new ATOM 0 HB THR A 11 3.592 31.368 -0.991 1.00 0.00 H new ATOM 0 HG1 THR A 11 5.806 30.976 -1.655 1.00 0.00 H new ATOM 0 HG21 THR A 11 4.395 32.146 -3.192 1.00 0.00 H new ATOM 0 HG22 THR A 11 3.196 33.263 -2.498 1.00 0.00 H new ATOM 0 HG23 THR A 11 4.927 33.674 -2.452 1.00 0.00 H new ATOM 129 N GLN A 12 2.014 32.360 1.127 1.00 0.00 N ATOM 130 CA GLN A 12 1.199 31.688 2.133 1.00 0.00 C ATOM 131 C GLN A 12 0.702 30.342 1.619 1.00 0.00 C ATOM 132 O GLN A 12 -0.319 30.263 0.935 1.00 0.00 O ATOM 133 CB GLN A 12 0.011 32.568 2.528 1.00 0.00 C ATOM 134 CG GLN A 12 -0.823 31.990 3.659 1.00 0.00 C ATOM 135 CD GLN A 12 -1.403 33.061 4.562 1.00 0.00 C ATOM 136 OE1 GLN A 12 -2.341 33.765 4.187 1.00 0.00 O ATOM 137 NE2 GLN A 12 -0.846 33.189 5.761 1.00 0.00 N ATOM 0 H GLN A 12 1.483 32.771 0.359 1.00 0.00 H new ATOM 0 HA GLN A 12 1.820 31.514 3.011 1.00 0.00 H new ATOM 0 HB2 GLN A 12 0.379 33.550 2.824 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -0.627 32.716 1.656 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -1.634 31.395 3.240 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -0.206 31.315 4.252 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -0.070 32.584 6.030 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -1.194 33.892 6.413 1.00 0.00 H new ATOM 146 N THR A 13 1.431 29.281 1.954 1.00 0.00 N ATOM 147 CA THR A 13 1.065 27.936 1.526 1.00 0.00 C ATOM 148 C THR A 13 -0.177 27.445 2.260 1.00 0.00 C ATOM 149 O THR A 13 -0.511 27.939 3.337 1.00 0.00 O ATOM 150 CB THR A 13 2.216 26.939 1.763 1.00 0.00 C ATOM 151 OG1 THR A 13 1.896 25.674 1.173 1.00 0.00 O ATOM 152 CG2 THR A 13 2.477 26.758 3.250 1.00 0.00 C ATOM 0 H THR A 13 2.278 29.327 2.520 1.00 0.00 H new ATOM 0 HA THR A 13 0.855 27.990 0.458 1.00 0.00 H new ATOM 0 HB THR A 13 3.117 27.340 1.298 1.00 0.00 H new ATOM 0 HG1 THR A 13 2.633 25.046 1.326 1.00 0.00 H new ATOM 0 HG21 THR A 13 3.293 26.050 3.393 1.00 0.00 H new ATOM 0 HG22 THR A 13 2.747 27.717 3.691 1.00 0.00 H new ATOM 0 HG23 THR A 13 1.578 26.377 3.734 1.00 0.00 H new ATOM 160 N SER A 14 -0.860 26.469 1.669 1.00 0.00 N ATOM 161 CA SER A 14 -2.068 25.912 2.265 1.00 0.00 C ATOM 162 C SER A 14 -2.102 24.395 2.111 1.00 0.00 C ATOM 163 O SER A 14 -1.606 23.851 1.124 1.00 0.00 O ATOM 164 CB SER A 14 -3.312 26.529 1.620 1.00 0.00 C ATOM 165 OG SER A 14 -4.128 27.162 2.590 1.00 0.00 O ATOM 0 H SER A 14 -0.597 26.048 0.778 1.00 0.00 H new ATOM 0 HA SER A 14 -2.061 26.151 3.328 1.00 0.00 H new ATOM 0 HB2 SER A 14 -3.012 27.254 0.864 1.00 0.00 H new ATOM 0 HB3 SER A 14 -3.883 25.754 1.109 1.00 0.00 H new ATOM 0 HG SER A 14 -4.915 27.550 2.153 1.00 0.00 H new ATOM 171 N GLU A 15 -2.689 23.719 3.094 1.00 0.00 N ATOM 172 CA GLU A 15 -2.786 22.264 3.067 1.00 0.00 C ATOM 173 C GLU A 15 -3.830 21.806 2.054 1.00 0.00 C ATOM 174 O GLU A 15 -4.993 22.206 2.123 1.00 0.00 O ATOM 175 CB GLU A 15 -3.139 21.730 4.457 1.00 0.00 C ATOM 176 CG GLU A 15 -2.066 21.988 5.500 1.00 0.00 C ATOM 177 CD GLU A 15 -2.271 23.298 6.237 1.00 0.00 C ATOM 178 OE1 GLU A 15 -3.290 23.423 6.949 1.00 0.00 O ATOM 179 OE2 GLU A 15 -1.416 24.197 6.102 1.00 0.00 O ATOM 0 H GLU A 15 -3.104 24.155 3.918 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.817 21.866 2.767 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -4.071 22.188 4.787 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.318 20.657 4.390 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.059 21.168 6.219 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -1.089 21.997 5.016 1.00 0.00 H new ATOM 186 N GLN A 16 -3.407 20.967 1.114 1.00 0.00 N ATOM 187 CA GLN A 16 -4.304 20.457 0.084 1.00 0.00 C ATOM 188 C GLN A 16 -4.327 18.933 0.091 1.00 0.00 C ATOM 189 O GLN A 16 -3.669 18.295 0.913 1.00 0.00 O ATOM 190 CB GLN A 16 -3.878 20.967 -1.293 1.00 0.00 C ATOM 191 CG GLN A 16 -4.768 22.076 -1.833 1.00 0.00 C ATOM 192 CD GLN A 16 -4.294 22.604 -3.173 1.00 0.00 C ATOM 193 OE1 GLN A 16 -3.096 22.780 -3.395 1.00 0.00 O ATOM 194 NE2 GLN A 16 -5.235 22.860 -4.075 1.00 0.00 N ATOM 0 H GLN A 16 -2.448 20.626 1.045 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.309 20.819 0.301 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.852 21.331 -1.235 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.881 20.135 -1.997 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -5.787 21.702 -1.934 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -4.798 22.895 -1.114 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -6.216 22.699 -3.848 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -4.976 23.217 -4.995 1.00 0.00 H new ATOM 203 N ALA A 17 -5.090 18.353 -0.831 1.00 0.00 N ATOM 204 CA ALA A 17 -5.198 16.903 -0.934 1.00 0.00 C ATOM 205 C ALA A 17 -3.850 16.275 -1.269 1.00 0.00 C ATOM 206 O ALA A 17 -2.941 16.932 -1.778 1.00 0.00 O ATOM 207 CB ALA A 17 -6.235 16.523 -1.979 1.00 0.00 C ATOM 0 H ALA A 17 -5.643 18.866 -1.518 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.518 16.518 0.034 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.304 15.437 -2.045 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -7.205 16.932 -1.695 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.940 16.927 -2.948 1.00 0.00 H new ATOM 213 N PRO A 18 -3.714 14.973 -0.979 1.00 0.00 N ATOM 214 CA PRO A 18 -2.480 14.228 -1.242 1.00 0.00 C ATOM 215 C PRO A 18 -2.234 14.022 -2.733 1.00 0.00 C ATOM 216 O PRO A 18 -3.060 13.439 -3.433 1.00 0.00 O ATOM 217 CB PRO A 18 -2.721 12.883 -0.550 1.00 0.00 C ATOM 218 CG PRO A 18 -4.203 12.736 -0.518 1.00 0.00 C ATOM 219 CD PRO A 18 -4.755 14.127 -0.372 1.00 0.00 C ATOM 0 HA PRO A 18 -1.600 14.758 -0.878 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.254 12.066 -1.099 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -2.300 12.874 0.455 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -4.568 12.265 -1.431 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -4.514 12.104 0.313 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -5.711 14.236 -0.885 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -4.923 14.385 0.674 1.00 0.00 H new ATOM 227 N SER A 19 -1.091 14.504 -3.211 1.00 0.00 N ATOM 228 CA SER A 19 -0.736 14.375 -4.620 1.00 0.00 C ATOM 229 C SER A 19 0.432 13.411 -4.802 1.00 0.00 C ATOM 230 O SER A 19 1.301 13.624 -5.647 1.00 0.00 O ATOM 231 CB SER A 19 -0.381 15.743 -5.206 1.00 0.00 C ATOM 232 OG SER A 19 -0.306 15.689 -6.620 1.00 0.00 O ATOM 0 H SER A 19 -0.395 14.987 -2.643 1.00 0.00 H new ATOM 0 HA SER A 19 -1.599 13.974 -5.151 1.00 0.00 H new ATOM 0 HB2 SER A 19 -1.130 16.476 -4.906 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.573 16.079 -4.801 1.00 0.00 H new ATOM 0 HG SER A 19 0.320 14.984 -6.888 1.00 0.00 H new ATOM 238 N SER A 20 0.445 12.350 -4.002 1.00 0.00 N ATOM 239 CA SER A 20 1.507 11.354 -4.071 1.00 0.00 C ATOM 240 C SER A 20 0.985 9.973 -3.684 1.00 0.00 C ATOM 241 O SER A 20 0.359 9.805 -2.638 1.00 0.00 O ATOM 242 CB SER A 20 2.664 11.749 -3.151 1.00 0.00 C ATOM 243 OG SER A 20 3.847 11.987 -3.895 1.00 0.00 O ATOM 0 H SER A 20 -0.268 12.158 -3.298 1.00 0.00 H new ATOM 0 HA SER A 20 1.865 11.312 -5.100 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.397 12.644 -2.589 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.841 10.957 -2.423 1.00 0.00 H new ATOM 0 HG SER A 20 4.572 12.239 -3.285 1.00 0.00 H new ATOM 249 N ALA A 21 1.247 8.990 -4.538 1.00 0.00 N ATOM 250 CA ALA A 21 0.805 7.623 -4.286 1.00 0.00 C ATOM 251 C ALA A 21 1.575 7.002 -3.126 1.00 0.00 C ATOM 252 O ALA A 21 2.697 7.399 -2.810 1.00 0.00 O ATOM 253 CB ALA A 21 0.965 6.777 -5.542 1.00 0.00 C ATOM 0 H ALA A 21 1.762 9.114 -5.410 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.250 7.653 -4.013 1.00 0.00 H new ATOM 0 HB1 ALA A 21 0.632 5.759 -5.340 1.00 0.00 H new ATOM 0 HB2 ALA A 21 0.365 7.203 -6.346 1.00 0.00 H new ATOM 0 HB3 ALA A 21 2.013 6.763 -5.840 1.00 0.00 H new ATOM 259 N PRO A 22 0.961 6.003 -2.475 1.00 0.00 N ATOM 260 CA PRO A 22 1.571 5.306 -1.338 1.00 0.00 C ATOM 261 C PRO A 22 2.751 4.436 -1.757 1.00 0.00 C ATOM 262 O PRO A 22 2.762 3.876 -2.853 1.00 0.00 O ATOM 263 CB PRO A 22 0.431 4.437 -0.802 1.00 0.00 C ATOM 264 CG PRO A 22 -0.466 4.223 -1.971 1.00 0.00 C ATOM 265 CD PRO A 22 -0.376 5.478 -2.796 1.00 0.00 C ATOM 0 HA PRO A 22 1.977 6.002 -0.604 1.00 0.00 H new ATOM 0 HB2 PRO A 22 0.805 3.490 -0.412 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -0.094 4.933 0.014 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.154 3.353 -2.549 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -1.491 4.040 -1.648 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -0.480 5.267 -3.860 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -1.160 6.188 -2.534 1.00 0.00 H new ATOM 273 N ARG A 23 3.743 4.330 -0.879 1.00 0.00 N ATOM 274 CA ARG A 23 4.928 3.529 -1.158 1.00 0.00 C ATOM 275 C ARG A 23 4.953 2.272 -0.295 1.00 0.00 C ATOM 276 O ARG A 23 4.094 2.083 0.568 1.00 0.00 O ATOM 277 CB ARG A 23 6.196 4.352 -0.916 1.00 0.00 C ATOM 278 CG ARG A 23 6.157 5.732 -1.556 1.00 0.00 C ATOM 279 CD ARG A 23 7.553 6.218 -1.915 1.00 0.00 C ATOM 280 NE ARG A 23 8.420 6.301 -0.744 1.00 0.00 N ATOM 281 CZ ARG A 23 9.704 6.638 -0.803 1.00 0.00 C ATOM 282 NH1 ARG A 23 10.265 6.922 -1.971 1.00 0.00 N ATOM 283 NH2 ARG A 23 10.430 6.691 0.307 1.00 0.00 N ATOM 0 H ARG A 23 3.749 4.789 0.032 1.00 0.00 H new ATOM 0 HA ARG A 23 4.892 3.228 -2.205 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.348 4.463 0.158 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.054 3.804 -1.305 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.539 5.701 -2.453 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.689 6.439 -0.871 1.00 0.00 H new ATOM 0 HD2 ARG A 23 7.995 5.542 -2.647 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.486 7.198 -2.387 1.00 0.00 H new ATOM 0 HE ARG A 23 8.019 6.089 0.169 1.00 0.00 H new ATOM 0 HH11 ARG A 23 9.711 6.882 -2.826 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.251 7.180 -2.014 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.002 6.473 1.207 1.00 0.00 H new ATOM 0 HH22 ARG A 23 11.415 6.950 0.260 1.00 0.00 H new ATOM 297 N ASP A 24 5.943 1.418 -0.530 1.00 0.00 N ATOM 298 CA ASP A 24 6.078 0.178 0.229 1.00 0.00 C ATOM 299 C ASP A 24 4.791 -0.637 0.173 1.00 0.00 C ATOM 300 O ASP A 24 4.494 -1.411 1.084 1.00 0.00 O ATOM 301 CB ASP A 24 6.443 0.483 1.682 1.00 0.00 C ATOM 302 CG ASP A 24 7.455 -0.497 2.242 1.00 0.00 C ATOM 303 OD1 ASP A 24 8.630 -0.439 1.827 1.00 0.00 O ATOM 304 OD2 ASP A 24 7.069 -1.324 3.097 1.00 0.00 O ATOM 0 H ASP A 24 6.663 1.560 -1.238 1.00 0.00 H new ATOM 0 HA ASP A 24 6.877 -0.411 -0.222 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.845 1.494 1.748 1.00 0.00 H new ATOM 0 HB3 ASP A 24 5.541 0.458 2.293 1.00 0.00 H new ATOM 309 N VAL A 25 4.027 -0.456 -0.900 1.00 0.00 N ATOM 310 CA VAL A 25 2.771 -1.176 -1.073 1.00 0.00 C ATOM 311 C VAL A 25 3.014 -2.592 -1.580 1.00 0.00 C ATOM 312 O VAL A 25 3.320 -2.797 -2.755 1.00 0.00 O ATOM 313 CB VAL A 25 1.837 -0.444 -2.055 1.00 0.00 C ATOM 314 CG1 VAL A 25 0.463 -1.098 -2.073 1.00 0.00 C ATOM 315 CG2 VAL A 25 1.729 1.030 -1.690 1.00 0.00 C ATOM 0 H VAL A 25 4.256 0.183 -1.662 1.00 0.00 H new ATOM 0 HA VAL A 25 2.294 -1.222 -0.094 1.00 0.00 H new ATOM 0 HB VAL A 25 2.262 -0.517 -3.056 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.183 -0.568 -2.772 1.00 0.00 H new ATOM 0 HG12 VAL A 25 0.559 -2.138 -2.385 1.00 0.00 H new ATOM 0 HG13 VAL A 25 0.028 -1.058 -1.075 1.00 0.00 H new ATOM 0 HG21 VAL A 25 1.065 1.532 -2.394 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.328 1.127 -0.681 1.00 0.00 H new ATOM 0 HG23 VAL A 25 2.717 1.489 -1.733 1.00 0.00 H new ATOM 325 N GLN A 26 2.875 -3.567 -0.689 1.00 0.00 N ATOM 326 CA GLN A 26 3.079 -4.966 -1.047 1.00 0.00 C ATOM 327 C GLN A 26 2.133 -5.872 -0.265 1.00 0.00 C ATOM 328 O GLN A 26 1.834 -5.615 0.900 1.00 0.00 O ATOM 329 CB GLN A 26 4.530 -5.374 -0.784 1.00 0.00 C ATOM 330 CG GLN A 26 4.948 -5.232 0.671 1.00 0.00 C ATOM 331 CD GLN A 26 6.368 -4.726 0.823 1.00 0.00 C ATOM 332 OE1 GLN A 26 6.592 -3.561 1.150 1.00 0.00 O ATOM 333 NE2 GLN A 26 7.338 -5.603 0.587 1.00 0.00 N ATOM 0 H GLN A 26 2.622 -3.414 0.287 1.00 0.00 H new ATOM 0 HA GLN A 26 2.864 -5.079 -2.110 1.00 0.00 H new ATOM 0 HB2 GLN A 26 4.669 -6.410 -1.094 1.00 0.00 H new ATOM 0 HB3 GLN A 26 5.188 -4.765 -1.404 1.00 0.00 H new ATOM 0 HG2 GLN A 26 4.266 -4.547 1.176 1.00 0.00 H new ATOM 0 HG3 GLN A 26 4.855 -6.198 1.168 1.00 0.00 H new ATOM 0 HE21 GLN A 26 7.107 -6.559 0.318 1.00 0.00 H new ATOM 0 HE22 GLN A 26 8.314 -5.320 0.675 1.00 0.00 H new ATOM 342 N ALA A 27 1.668 -6.933 -0.916 1.00 0.00 N ATOM 343 CA ALA A 27 0.758 -7.878 -0.281 1.00 0.00 C ATOM 344 C ALA A 27 1.406 -9.252 -0.133 1.00 0.00 C ATOM 345 O ALA A 27 1.898 -9.823 -1.106 1.00 0.00 O ATOM 346 CB ALA A 27 -0.532 -7.986 -1.080 1.00 0.00 C ATOM 0 H ALA A 27 1.906 -7.159 -1.882 1.00 0.00 H new ATOM 0 HA ALA A 27 0.526 -7.505 0.717 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -1.202 -8.695 -0.594 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -1.012 -7.009 -1.130 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -0.307 -8.332 -2.089 1.00 0.00 H new ATOM 352 N ARG A 28 1.405 -9.773 1.090 1.00 0.00 N ATOM 353 CA ARG A 28 1.995 -11.077 1.364 1.00 0.00 C ATOM 354 C ARG A 28 0.960 -12.030 1.954 1.00 0.00 C ATOM 355 O ARG A 28 0.253 -11.685 2.900 1.00 0.00 O ATOM 356 CB ARG A 28 3.177 -10.932 2.325 1.00 0.00 C ATOM 357 CG ARG A 28 2.878 -10.057 3.530 1.00 0.00 C ATOM 358 CD ARG A 28 3.985 -10.143 4.570 1.00 0.00 C ATOM 359 NE ARG A 28 5.248 -9.603 4.071 1.00 0.00 N ATOM 360 CZ ARG A 28 6.355 -9.532 4.800 1.00 0.00 C ATOM 361 NH1 ARG A 28 6.357 -9.962 6.055 1.00 0.00 N ATOM 362 NH2 ARG A 28 7.466 -9.029 4.276 1.00 0.00 N ATOM 0 H ARG A 28 1.002 -9.312 1.906 1.00 0.00 H new ATOM 0 HA ARG A 28 2.350 -11.493 0.421 1.00 0.00 H new ATOM 0 HB2 ARG A 28 3.477 -11.921 2.671 1.00 0.00 H new ATOM 0 HB3 ARG A 28 4.025 -10.513 1.784 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.759 -9.022 3.209 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.932 -10.363 3.977 1.00 0.00 H new ATOM 0 HD2 ARG A 28 3.685 -9.597 5.464 1.00 0.00 H new ATOM 0 HD3 ARG A 28 4.126 -11.183 4.864 1.00 0.00 H new ATOM 0 HE ARG A 28 5.281 -9.262 3.110 1.00 0.00 H new ATOM 0 HH11 ARG A 28 5.506 -10.349 6.463 1.00 0.00 H new ATOM 0 HH12 ARG A 28 7.210 -9.906 6.612 1.00 0.00 H new ATOM 0 HH21 ARG A 28 7.470 -8.696 3.312 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.316 -8.975 4.838 1.00 0.00 H new ATOM 376 N MET A 29 0.875 -13.228 1.387 1.00 0.00 N ATOM 377 CA MET A 29 -0.074 -14.231 1.857 1.00 0.00 C ATOM 378 C MET A 29 0.437 -14.912 3.122 1.00 0.00 C ATOM 379 O MET A 29 1.619 -15.247 3.225 1.00 0.00 O ATOM 380 CB MET A 29 -0.328 -15.274 0.767 1.00 0.00 C ATOM 381 CG MET A 29 -1.668 -15.111 0.070 1.00 0.00 C ATOM 382 SD MET A 29 -3.064 -15.385 1.177 1.00 0.00 S ATOM 383 CE MET A 29 -3.952 -16.665 0.294 1.00 0.00 C ATOM 0 H MET A 29 1.452 -13.529 0.601 1.00 0.00 H new ATOM 0 HA MET A 29 -1.012 -13.727 2.092 1.00 0.00 H new ATOM 0 HB2 MET A 29 0.468 -15.213 0.025 1.00 0.00 H new ATOM 0 HB3 MET A 29 -0.276 -16.269 1.209 1.00 0.00 H new ATOM 0 HG2 MET A 29 -1.735 -14.108 -0.351 1.00 0.00 H new ATOM 0 HG3 MET A 29 -1.727 -15.811 -0.763 1.00 0.00 H new ATOM 0 HE1 MET A 29 -4.617 -17.187 0.982 1.00 0.00 H new ATOM 0 HE2 MET A 29 -4.538 -16.215 -0.507 1.00 0.00 H new ATOM 0 HE3 MET A 29 -3.241 -17.374 -0.131 1.00 0.00 H new ATOM 393 N LEU A 30 -0.456 -15.116 4.082 1.00 0.00 N ATOM 394 CA LEU A 30 -0.096 -15.758 5.342 1.00 0.00 C ATOM 395 C LEU A 30 -0.867 -17.060 5.530 1.00 0.00 C ATOM 396 O LEU A 30 -0.385 -17.994 6.170 1.00 0.00 O ATOM 397 CB LEU A 30 -0.369 -14.815 6.515 1.00 0.00 C ATOM 398 CG LEU A 30 -0.018 -13.344 6.289 1.00 0.00 C ATOM 399 CD1 LEU A 30 -0.545 -12.488 7.430 1.00 0.00 C ATOM 400 CD2 LEU A 30 1.488 -13.172 6.144 1.00 0.00 C ATOM 0 H LEU A 30 -1.437 -14.846 4.013 1.00 0.00 H new ATOM 0 HA LEU A 30 0.969 -15.990 5.311 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.427 -14.880 6.769 1.00 0.00 H new ATOM 0 HB3 LEU A 30 0.190 -15.172 7.380 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.493 -13.015 5.365 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.286 -11.444 7.252 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.629 -12.588 7.489 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.099 -12.818 8.368 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.720 -12.119 5.984 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.983 -13.519 7.051 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.841 -13.755 5.293 1.00 0.00 H new ATOM 412 N SER A 31 -2.071 -17.115 4.966 1.00 0.00 N ATOM 413 CA SER A 31 -2.912 -18.302 5.073 1.00 0.00 C ATOM 414 C SER A 31 -3.540 -18.647 3.727 1.00 0.00 C ATOM 415 O SER A 31 -3.172 -18.083 2.695 1.00 0.00 O ATOM 416 CB SER A 31 -4.007 -18.084 6.120 1.00 0.00 C ATOM 417 OG SER A 31 -4.099 -19.191 7.000 1.00 0.00 O ATOM 0 H SER A 31 -2.485 -16.352 4.431 1.00 0.00 H new ATOM 0 HA SER A 31 -2.283 -19.136 5.384 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.795 -17.179 6.690 1.00 0.00 H new ATOM 0 HB3 SER A 31 -4.965 -17.930 5.623 1.00 0.00 H new ATOM 0 HG SER A 31 -4.804 -19.026 7.660 1.00 0.00 H new ATOM 423 N SER A 32 -4.491 -19.576 3.743 1.00 0.00 N ATOM 424 CA SER A 32 -5.168 -19.999 2.525 1.00 0.00 C ATOM 425 C SER A 32 -6.232 -18.985 2.114 1.00 0.00 C ATOM 426 O SER A 32 -6.612 -18.903 0.946 1.00 0.00 O ATOM 427 CB SER A 32 -5.807 -21.375 2.722 1.00 0.00 C ATOM 428 OG SER A 32 -4.853 -22.321 3.170 1.00 0.00 O ATOM 0 H SER A 32 -4.810 -20.050 4.588 1.00 0.00 H new ATOM 0 HA SER A 32 -4.425 -20.062 1.730 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.619 -21.302 3.446 1.00 0.00 H new ATOM 0 HB3 SER A 32 -6.246 -21.713 1.783 1.00 0.00 H new ATOM 0 HG SER A 32 -5.287 -23.192 3.290 1.00 0.00 H new ATOM 434 N THR A 33 -6.711 -18.213 3.085 1.00 0.00 N ATOM 435 CA THR A 33 -7.732 -17.207 2.828 1.00 0.00 C ATOM 436 C THR A 33 -7.499 -15.959 3.673 1.00 0.00 C ATOM 437 O THR A 33 -8.448 -15.295 4.094 1.00 0.00 O ATOM 438 CB THR A 33 -9.144 -17.751 3.114 1.00 0.00 C ATOM 439 OG1 THR A 33 -9.174 -18.384 4.398 1.00 0.00 O ATOM 440 CG2 THR A 33 -9.568 -18.745 2.043 1.00 0.00 C ATOM 0 H THR A 33 -6.407 -18.266 4.057 1.00 0.00 H new ATOM 0 HA THR A 33 -7.659 -16.947 1.772 1.00 0.00 H new ATOM 0 HB THR A 33 -9.841 -16.913 3.106 1.00 0.00 H new ATOM 0 HG1 THR A 33 -10.076 -18.726 4.573 1.00 0.00 H new ATOM 0 HG21 THR A 33 -10.568 -19.116 2.266 1.00 0.00 H new ATOM 0 HG22 THR A 33 -9.572 -18.252 1.071 1.00 0.00 H new ATOM 0 HG23 THR A 33 -8.868 -19.580 2.024 1.00 0.00 H new ATOM 448 N THR A 34 -6.231 -15.644 3.920 1.00 0.00 N ATOM 449 CA THR A 34 -5.874 -14.478 4.716 1.00 0.00 C ATOM 450 C THR A 34 -4.644 -13.779 4.146 1.00 0.00 C ATOM 451 O THR A 34 -3.567 -14.369 4.062 1.00 0.00 O ATOM 452 CB THR A 34 -5.601 -14.859 6.182 1.00 0.00 C ATOM 453 OG1 THR A 34 -6.145 -16.154 6.461 1.00 0.00 O ATOM 454 CG2 THR A 34 -6.205 -13.836 7.130 1.00 0.00 C ATOM 0 H THR A 34 -5.434 -16.182 3.579 1.00 0.00 H new ATOM 0 HA THR A 34 -6.725 -13.798 4.679 1.00 0.00 H new ATOM 0 HB THR A 34 -4.522 -14.877 6.333 1.00 0.00 H new ATOM 0 HG1 THR A 34 -5.966 -16.390 7.395 1.00 0.00 H new ATOM 0 HG21 THR A 34 -5.998 -14.128 8.160 1.00 0.00 H new ATOM 0 HG22 THR A 34 -5.767 -12.857 6.936 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.283 -13.789 6.976 1.00 0.00 H new ATOM 462 N ILE A 35 -4.812 -12.519 3.757 1.00 0.00 N ATOM 463 CA ILE A 35 -3.714 -11.741 3.197 1.00 0.00 C ATOM 464 C ILE A 35 -3.319 -10.599 4.129 1.00 0.00 C ATOM 465 O ILE A 35 -3.935 -10.396 5.175 1.00 0.00 O ATOM 466 CB ILE A 35 -4.082 -11.161 1.819 1.00 0.00 C ATOM 467 CG1 ILE A 35 -5.263 -10.198 1.945 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.404 -12.281 0.842 1.00 0.00 C ATOM 469 CD1 ILE A 35 -5.561 -9.435 0.672 1.00 0.00 C ATOM 0 H ILE A 35 -5.697 -12.016 3.819 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.870 -12.421 3.082 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.226 -10.606 1.434 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.150 -10.760 2.238 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.058 -9.487 2.745 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.662 -11.855 -0.128 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.535 -12.930 0.733 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.246 -12.862 1.219 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.410 -8.772 0.836 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.689 -8.845 0.389 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.798 -10.138 -0.126 1.00 0.00 H new ATOM 481 N LEU A 36 -2.290 -9.855 3.739 1.00 0.00 N ATOM 482 CA LEU A 36 -1.814 -8.730 4.538 1.00 0.00 C ATOM 483 C LEU A 36 -1.297 -7.608 3.644 1.00 0.00 C ATOM 484 O LEU A 36 -0.385 -7.809 2.840 1.00 0.00 O ATOM 485 CB LEU A 36 -0.708 -9.190 5.491 1.00 0.00 C ATOM 486 CG LEU A 36 -0.402 -8.256 6.662 1.00 0.00 C ATOM 487 CD1 LEU A 36 0.148 -9.041 7.842 1.00 0.00 C ATOM 488 CD2 LEU A 36 0.578 -7.172 6.237 1.00 0.00 C ATOM 0 H LEU A 36 -1.769 -10.010 2.876 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.652 -8.348 5.120 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.984 -10.165 5.892 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.206 -9.329 4.914 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.331 -7.777 6.972 1.00 0.00 H new ATOM 0 HD11 LEU A 36 0.360 -8.359 8.666 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.587 -9.779 8.162 1.00 0.00 H new ATOM 0 HD13 LEU A 36 1.066 -9.548 7.545 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.785 -6.516 7.083 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.507 -7.633 5.900 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.146 -6.589 5.423 1.00 0.00 H new ATOM 500 N VAL A 37 -1.884 -6.424 3.790 1.00 0.00 N ATOM 501 CA VAL A 37 -1.479 -5.268 2.999 1.00 0.00 C ATOM 502 C VAL A 37 -0.814 -4.211 3.870 1.00 0.00 C ATOM 503 O VAL A 37 -1.429 -3.673 4.791 1.00 0.00 O ATOM 504 CB VAL A 37 -2.684 -4.636 2.275 1.00 0.00 C ATOM 505 CG1 VAL A 37 -2.219 -3.557 1.309 1.00 0.00 C ATOM 506 CG2 VAL A 37 -3.488 -5.704 1.549 1.00 0.00 C ATOM 0 H VAL A 37 -2.641 -6.240 4.448 1.00 0.00 H new ATOM 0 HA VAL A 37 -0.764 -5.626 2.258 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.331 -4.170 3.018 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -3.083 -3.122 0.807 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.689 -2.779 1.860 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.551 -3.996 0.568 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.335 -5.241 1.043 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -2.854 -6.200 0.814 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.852 -6.437 2.269 1.00 0.00 H new ATOM 516 N GLN A 38 0.449 -3.918 3.575 1.00 0.00 N ATOM 517 CA GLN A 38 1.200 -2.924 4.334 1.00 0.00 C ATOM 518 C GLN A 38 1.873 -1.922 3.401 1.00 0.00 C ATOM 519 O GLN A 38 2.413 -2.296 2.358 1.00 0.00 O ATOM 520 CB GLN A 38 2.249 -3.608 5.212 1.00 0.00 C ATOM 521 CG GLN A 38 3.180 -4.530 4.441 1.00 0.00 C ATOM 522 CD GLN A 38 4.554 -4.637 5.074 1.00 0.00 C ATOM 523 OE1 GLN A 38 5.573 -4.570 4.388 1.00 0.00 O ATOM 524 NE2 GLN A 38 4.586 -4.802 6.391 1.00 0.00 N ATOM 0 H GLN A 38 0.973 -4.354 2.817 1.00 0.00 H new ATOM 0 HA GLN A 38 0.500 -2.384 4.972 1.00 0.00 H new ATOM 0 HB2 GLN A 38 2.842 -2.845 5.716 1.00 0.00 H new ATOM 0 HB3 GLN A 38 1.743 -4.182 5.988 1.00 0.00 H new ATOM 0 HG2 GLN A 38 2.734 -5.523 4.381 1.00 0.00 H new ATOM 0 HG3 GLN A 38 3.283 -4.164 3.419 1.00 0.00 H new ATOM 0 HE21 GLN A 38 3.715 -4.852 6.920 1.00 0.00 H new ATOM 0 HE22 GLN A 38 5.481 -4.879 6.874 1.00 0.00 H new ATOM 533 N TRP A 39 1.840 -0.651 3.782 1.00 0.00 N ATOM 534 CA TRP A 39 2.448 0.404 2.979 1.00 0.00 C ATOM 535 C TRP A 39 2.919 1.555 3.860 1.00 0.00 C ATOM 536 O TRP A 39 2.702 1.552 5.072 1.00 0.00 O ATOM 537 CB TRP A 39 1.452 0.916 1.937 1.00 0.00 C ATOM 538 CG TRP A 39 0.222 1.523 2.539 1.00 0.00 C ATOM 539 CD1 TRP A 39 0.044 2.826 2.905 1.00 0.00 C ATOM 540 CD2 TRP A 39 -1.004 0.847 2.848 1.00 0.00 C ATOM 541 NE1 TRP A 39 -1.217 3.003 3.422 1.00 0.00 N ATOM 542 CE2 TRP A 39 -1.880 1.804 3.396 1.00 0.00 C ATOM 543 CE3 TRP A 39 -1.446 -0.471 2.711 1.00 0.00 C ATOM 544 CZ2 TRP A 39 -3.170 1.481 3.809 1.00 0.00 C ATOM 545 CZ3 TRP A 39 -2.726 -0.789 3.121 1.00 0.00 C ATOM 546 CH2 TRP A 39 -3.577 0.183 3.664 1.00 0.00 C ATOM 0 H TRP A 39 1.399 -0.325 4.642 1.00 0.00 H new ATOM 0 HA TRP A 39 3.315 -0.015 2.468 1.00 0.00 H new ATOM 0 HB2 TRP A 39 1.944 1.658 1.308 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.160 0.091 1.287 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.786 3.604 2.803 1.00 0.00 H new ATOM 0 HE1 TRP A 39 -1.598 3.884 3.769 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -0.799 -1.227 2.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -3.826 2.229 4.229 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -3.077 -1.805 3.021 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -4.573 -0.098 3.974 1.00 0.00 H new ATOM 557 N LYS A 40 3.565 2.539 3.245 1.00 0.00 N ATOM 558 CA LYS A 40 4.067 3.699 3.972 1.00 0.00 C ATOM 559 C LYS A 40 3.328 4.966 3.553 1.00 0.00 C ATOM 560 O LYS A 40 2.616 4.976 2.550 1.00 0.00 O ATOM 561 CB LYS A 40 5.569 3.869 3.731 1.00 0.00 C ATOM 562 CG LYS A 40 6.431 3.002 4.632 1.00 0.00 C ATOM 563 CD LYS A 40 7.897 3.392 4.544 1.00 0.00 C ATOM 564 CE LYS A 40 8.615 3.164 5.865 1.00 0.00 C ATOM 565 NZ LYS A 40 9.751 2.210 5.722 1.00 0.00 N ATOM 0 H LYS A 40 3.754 2.557 2.243 1.00 0.00 H new ATOM 0 HA LYS A 40 3.893 3.532 5.035 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.791 3.631 2.691 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.837 4.915 3.882 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.090 3.095 5.663 1.00 0.00 H new ATOM 0 HG3 LYS A 40 6.314 1.955 4.351 1.00 0.00 H new ATOM 0 HD2 LYS A 40 8.383 2.811 3.760 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.979 4.441 4.261 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.986 4.116 6.246 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.909 2.780 6.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.214 2.081 6.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 9.394 1.294 5.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.438 2.588 5.039 1.00 0.00 H new ATOM 579 N GLU A 41 3.503 6.032 4.328 1.00 0.00 N ATOM 580 CA GLU A 41 2.853 7.303 4.035 1.00 0.00 C ATOM 581 C GLU A 41 3.359 7.883 2.718 1.00 0.00 C ATOM 582 O GLU A 41 4.430 7.528 2.225 1.00 0.00 O ATOM 583 CB GLU A 41 3.096 8.299 5.171 1.00 0.00 C ATOM 584 CG GLU A 41 1.909 8.458 6.105 1.00 0.00 C ATOM 585 CD GLU A 41 2.289 9.102 7.426 1.00 0.00 C ATOM 586 OE1 GLU A 41 3.474 9.014 7.811 1.00 0.00 O ATOM 587 OE2 GLU A 41 1.401 9.696 8.071 1.00 0.00 O ATOM 0 H GLU A 41 4.089 6.040 5.163 1.00 0.00 H new ATOM 0 HA GLU A 41 1.782 7.121 3.943 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.961 7.974 5.749 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.344 9.271 4.744 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.145 9.063 5.616 1.00 0.00 H new ATOM 0 HG3 GLU A 41 1.467 7.480 6.295 1.00 0.00 H new ATOM 594 N PRO A 42 2.572 8.797 2.132 1.00 0.00 N ATOM 595 CA PRO A 42 2.919 9.447 0.864 1.00 0.00 C ATOM 596 C PRO A 42 4.094 10.407 1.008 1.00 0.00 C ATOM 597 O PRO A 42 4.553 10.679 2.116 1.00 0.00 O ATOM 598 CB PRO A 42 1.645 10.210 0.496 1.00 0.00 C ATOM 599 CG PRO A 42 0.960 10.455 1.797 1.00 0.00 C ATOM 600 CD PRO A 42 1.282 9.268 2.663 1.00 0.00 C ATOM 0 HA PRO A 42 3.233 8.727 0.109 1.00 0.00 H new ATOM 0 HB2 PRO A 42 1.877 11.146 -0.012 1.00 0.00 H new ATOM 0 HB3 PRO A 42 1.017 9.629 -0.179 1.00 0.00 H new ATOM 0 HG2 PRO A 42 1.311 11.379 2.255 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -0.116 10.557 1.659 1.00 0.00 H new ATOM 0 HD2 PRO A 42 1.358 9.546 3.714 1.00 0.00 H new ATOM 0 HD3 PRO A 42 0.513 8.499 2.592 1.00 0.00 H new ATOM 608 N GLU A 43 4.575 10.918 -0.121 1.00 0.00 N ATOM 609 CA GLU A 43 5.698 11.849 -0.119 1.00 0.00 C ATOM 610 C GLU A 43 5.206 13.295 -0.095 1.00 0.00 C ATOM 611 O GLU A 43 5.909 14.192 0.367 1.00 0.00 O ATOM 612 CB GLU A 43 6.581 11.619 -1.348 1.00 0.00 C ATOM 613 CG GLU A 43 7.999 11.192 -1.006 1.00 0.00 C ATOM 614 CD GLU A 43 9.020 11.703 -2.005 1.00 0.00 C ATOM 615 OE1 GLU A 43 8.944 12.894 -2.372 1.00 0.00 O ATOM 616 OE2 GLU A 43 9.891 10.912 -2.420 1.00 0.00 O ATOM 0 H GLU A 43 4.206 10.704 -1.047 1.00 0.00 H new ATOM 0 HA GLU A 43 6.286 11.669 0.781 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.122 10.856 -1.977 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.618 12.536 -1.935 1.00 0.00 H new ATOM 0 HG2 GLU A 43 8.255 11.558 -0.012 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.047 10.104 -0.967 1.00 0.00 H new ATOM 623 N GLU A 44 3.995 13.509 -0.598 1.00 0.00 N ATOM 624 CA GLU A 44 3.410 14.845 -0.636 1.00 0.00 C ATOM 625 C GLU A 44 2.033 14.854 0.021 1.00 0.00 C ATOM 626 O GLU A 44 1.001 14.939 -0.643 1.00 0.00 O ATOM 627 CB GLU A 44 3.301 15.337 -2.080 1.00 0.00 C ATOM 628 CG GLU A 44 4.477 16.194 -2.522 1.00 0.00 C ATOM 629 CD GLU A 44 4.465 16.478 -4.011 1.00 0.00 C ATOM 630 OE1 GLU A 44 3.492 16.075 -4.683 1.00 0.00 O ATOM 631 OE2 GLU A 44 5.427 17.101 -4.505 1.00 0.00 O ATOM 0 H GLU A 44 3.400 12.776 -0.984 1.00 0.00 H new ATOM 0 HA GLU A 44 4.064 15.516 -0.079 1.00 0.00 H new ATOM 0 HB2 GLU A 44 3.220 14.476 -2.743 1.00 0.00 H new ATOM 0 HB3 GLU A 44 2.382 15.912 -2.191 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.460 17.137 -1.976 1.00 0.00 H new ATOM 0 HG3 GLU A 44 5.407 15.691 -2.259 1.00 0.00 H new ATOM 638 N PRO A 45 2.016 14.766 1.359 1.00 0.00 N ATOM 639 CA PRO A 45 0.773 14.761 2.136 1.00 0.00 C ATOM 640 C PRO A 45 -0.013 16.059 1.981 1.00 0.00 C ATOM 641 O PRO A 45 -1.194 16.042 1.640 1.00 0.00 O ATOM 642 CB PRO A 45 1.258 14.601 3.580 1.00 0.00 C ATOM 643 CG PRO A 45 2.682 15.034 3.552 1.00 0.00 C ATOM 644 CD PRO A 45 3.209 14.662 2.217 1.00 0.00 C ATOM 0 HA PRO A 45 0.092 13.975 1.810 1.00 0.00 H new ATOM 0 HB2 PRO A 45 0.671 15.214 4.265 1.00 0.00 H new ATOM 0 HB3 PRO A 45 1.165 13.568 3.917 1.00 0.00 H new ATOM 0 HG2 PRO A 45 2.764 16.108 3.716 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.251 14.547 4.343 1.00 0.00 H new ATOM 0 HD2 PRO A 45 4.002 15.336 1.892 1.00 0.00 H new ATOM 0 HD3 PRO A 45 3.625 13.655 2.212 1.00 0.00 H new ATOM 652 N ASN A 46 0.652 17.182 2.230 1.00 0.00 N ATOM 653 CA ASN A 46 0.015 18.489 2.117 1.00 0.00 C ATOM 654 C ASN A 46 -1.119 18.632 3.128 1.00 0.00 C ATOM 655 O ASN A 46 -2.058 19.400 2.920 1.00 0.00 O ATOM 656 CB ASN A 46 -0.521 18.697 0.700 1.00 0.00 C ATOM 657 CG ASN A 46 0.491 18.315 -0.363 1.00 0.00 C ATOM 658 OD1 ASN A 46 1.626 18.791 -0.356 1.00 0.00 O ATOM 659 ND2 ASN A 46 0.081 17.450 -1.285 1.00 0.00 N ATOM 0 H ASN A 46 1.632 17.213 2.511 1.00 0.00 H new ATOM 0 HA ASN A 46 0.765 19.250 2.330 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -1.426 18.104 0.566 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -0.803 19.742 0.571 1.00 0.00 H new ATOM 0 HD21 ASN A 46 0.717 17.155 -2.026 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -0.869 17.081 -1.251 1.00 0.00 H new ATOM 666 N GLY A 47 -1.024 17.886 4.225 1.00 0.00 N ATOM 667 CA GLY A 47 -2.047 17.943 5.252 1.00 0.00 C ATOM 668 C GLY A 47 -2.071 16.699 6.116 1.00 0.00 C ATOM 669 O GLY A 47 -1.415 15.707 5.804 1.00 0.00 O ATOM 0 H GLY A 47 -0.256 17.243 4.420 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.877 18.816 5.882 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.022 18.074 4.782 1.00 0.00 H new ATOM 673 N GLN A 48 -2.827 16.752 7.208 1.00 0.00 N ATOM 674 CA GLN A 48 -2.933 15.622 8.121 1.00 0.00 C ATOM 675 C GLN A 48 -3.723 14.481 7.488 1.00 0.00 C ATOM 676 O GLN A 48 -4.912 14.620 7.205 1.00 0.00 O ATOM 677 CB GLN A 48 -3.599 16.054 9.429 1.00 0.00 C ATOM 678 CG GLN A 48 -2.802 15.684 10.670 1.00 0.00 C ATOM 679 CD GLN A 48 -3.482 16.120 11.952 1.00 0.00 C ATOM 680 OE1 GLN A 48 -4.030 15.298 12.688 1.00 0.00 O ATOM 681 NE2 GLN A 48 -3.451 17.419 12.227 1.00 0.00 N ATOM 0 H GLN A 48 -3.376 17.567 7.481 1.00 0.00 H new ATOM 0 HA GLN A 48 -1.925 15.267 8.335 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -3.748 17.134 9.412 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.587 15.597 9.492 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.652 14.605 10.692 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -1.815 16.142 10.613 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -2.986 18.064 11.589 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -3.892 17.771 13.076 1.00 0.00 H new ATOM 690 N ILE A 49 -3.053 13.354 7.269 1.00 0.00 N ATOM 691 CA ILE A 49 -3.694 12.190 6.670 1.00 0.00 C ATOM 692 C ILE A 49 -4.764 11.616 7.592 1.00 0.00 C ATOM 693 O ILE A 49 -4.478 11.232 8.725 1.00 0.00 O ATOM 694 CB ILE A 49 -2.667 11.089 6.344 1.00 0.00 C ATOM 695 CG1 ILE A 49 -1.599 11.622 5.389 1.00 0.00 C ATOM 696 CG2 ILE A 49 -3.364 9.877 5.744 1.00 0.00 C ATOM 697 CD1 ILE A 49 -2.143 12.016 4.033 1.00 0.00 C ATOM 0 H ILE A 49 -2.068 13.223 7.497 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.160 12.527 5.744 1.00 0.00 H new ATOM 0 HB ILE A 49 -2.179 10.783 7.269 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -1.116 12.487 5.843 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -0.830 10.861 5.256 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -2.626 9.107 5.519 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.091 9.486 6.456 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.876 10.169 4.827 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.330 12.385 3.408 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.600 11.148 3.558 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.891 12.799 4.155 1.00 0.00 H new ATOM 709 N GLN A 50 -5.995 11.559 7.095 1.00 0.00 N ATOM 710 CA GLN A 50 -7.108 11.031 7.875 1.00 0.00 C ATOM 711 C GLN A 50 -7.157 9.508 7.791 1.00 0.00 C ATOM 712 O GLN A 50 -7.671 8.842 8.689 1.00 0.00 O ATOM 713 CB GLN A 50 -8.430 11.623 7.384 1.00 0.00 C ATOM 714 CG GLN A 50 -8.405 13.137 7.249 1.00 0.00 C ATOM 715 CD GLN A 50 -8.296 13.839 8.589 1.00 0.00 C ATOM 716 OE1 GLN A 50 -8.949 13.455 9.560 1.00 0.00 O ATOM 717 NE2 GLN A 50 -7.467 14.874 8.648 1.00 0.00 N ATOM 0 H GLN A 50 -6.247 11.871 6.157 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.956 11.315 8.916 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.678 11.184 6.418 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -9.224 11.341 8.076 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -7.563 13.428 6.621 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -9.311 13.468 6.742 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.946 15.158 7.819 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -7.351 15.386 9.523 1.00 0.00 H new ATOM 726 N GLY A 51 -6.621 8.962 6.703 1.00 0.00 N ATOM 727 CA GLY A 51 -6.613 7.523 6.522 1.00 0.00 C ATOM 728 C GLY A 51 -6.245 7.119 5.108 1.00 0.00 C ATOM 729 O GLY A 51 -5.557 7.857 4.403 1.00 0.00 O ATOM 0 H GLY A 51 -6.192 9.492 5.944 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -5.905 7.076 7.220 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.597 7.124 6.766 1.00 0.00 H new ATOM 733 N TYR A 52 -6.701 5.943 4.692 1.00 0.00 N ATOM 734 CA TYR A 52 -6.412 5.440 3.355 1.00 0.00 C ATOM 735 C TYR A 52 -7.559 4.577 2.838 1.00 0.00 C ATOM 736 O TYR A 52 -8.522 4.308 3.556 1.00 0.00 O ATOM 737 CB TYR A 52 -5.114 4.630 3.361 1.00 0.00 C ATOM 738 CG TYR A 52 -3.951 5.359 3.993 1.00 0.00 C ATOM 739 CD1 TYR A 52 -3.111 6.162 3.231 1.00 0.00 C ATOM 740 CD2 TYR A 52 -3.690 5.245 5.354 1.00 0.00 C ATOM 741 CE1 TYR A 52 -2.045 6.828 3.805 1.00 0.00 C ATOM 742 CE2 TYR A 52 -2.628 5.909 5.937 1.00 0.00 C ATOM 743 CZ TYR A 52 -1.809 6.699 5.158 1.00 0.00 C ATOM 744 OH TYR A 52 -0.749 7.363 5.733 1.00 0.00 O ATOM 0 H TYR A 52 -7.273 5.320 5.262 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.296 6.296 2.690 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.281 3.695 3.897 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.854 4.368 2.335 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -3.294 6.267 2.172 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.329 4.626 5.966 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -1.400 7.446 3.198 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -2.440 5.810 6.996 1.00 0.00 H new ATOM 0 HH TYR A 52 -0.722 7.167 6.693 1.00 0.00 H new ATOM 754 N ARG A 53 -7.450 4.147 1.585 1.00 0.00 N ATOM 755 CA ARG A 53 -8.478 3.315 0.970 1.00 0.00 C ATOM 756 C ARG A 53 -7.849 2.163 0.190 1.00 0.00 C ATOM 757 O ARG A 53 -6.899 2.357 -0.567 1.00 0.00 O ATOM 758 CB ARG A 53 -9.354 4.157 0.040 1.00 0.00 C ATOM 759 CG ARG A 53 -10.198 5.190 0.768 1.00 0.00 C ATOM 760 CD ARG A 53 -10.699 6.269 -0.180 1.00 0.00 C ATOM 761 NE ARG A 53 -11.771 7.062 0.412 1.00 0.00 N ATOM 762 CZ ARG A 53 -12.416 8.026 -0.236 1.00 0.00 C ATOM 763 NH1 ARG A 53 -12.097 8.315 -1.490 1.00 0.00 N ATOM 764 NH2 ARG A 53 -13.382 8.706 0.371 1.00 0.00 N ATOM 0 H ARG A 53 -6.660 4.361 0.976 1.00 0.00 H new ATOM 0 HA ARG A 53 -9.098 2.898 1.764 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -8.717 4.666 -0.684 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.011 3.495 -0.524 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -11.047 4.698 1.243 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -9.609 5.648 1.563 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.872 6.924 -0.453 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -11.056 5.806 -1.100 1.00 0.00 H new ATOM 0 HE ARG A 53 -12.040 6.866 1.376 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -11.355 7.797 -1.960 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -12.594 9.056 -1.985 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -13.630 8.488 1.336 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -13.876 9.446 -0.128 1.00 0.00 H new ATOM 778 N VAL A 54 -8.387 0.963 0.382 1.00 0.00 N ATOM 779 CA VAL A 54 -7.881 -0.221 -0.303 1.00 0.00 C ATOM 780 C VAL A 54 -8.931 -0.803 -1.242 1.00 0.00 C ATOM 781 O VAL A 54 -10.037 -1.142 -0.820 1.00 0.00 O ATOM 782 CB VAL A 54 -7.445 -1.305 0.700 1.00 0.00 C ATOM 783 CG1 VAL A 54 -6.772 -2.461 -0.024 1.00 0.00 C ATOM 784 CG2 VAL A 54 -6.522 -0.716 1.755 1.00 0.00 C ATOM 0 H VAL A 54 -9.174 0.785 1.006 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.015 0.094 -0.884 1.00 0.00 H new ATOM 0 HB VAL A 54 -8.333 -1.689 1.202 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.470 -3.218 0.700 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.470 -2.899 -0.737 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -5.893 -2.096 -0.554 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.224 -1.497 2.455 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.636 -0.303 1.273 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -7.044 0.075 2.294 1.00 0.00 H new ATOM 794 N TYR A 55 -8.578 -0.915 -2.517 1.00 0.00 N ATOM 795 CA TYR A 55 -9.490 -1.456 -3.518 1.00 0.00 C ATOM 796 C TYR A 55 -9.105 -2.884 -3.892 1.00 0.00 C ATOM 797 O TYR A 55 -8.029 -3.126 -4.441 1.00 0.00 O ATOM 798 CB TYR A 55 -9.493 -0.572 -4.767 1.00 0.00 C ATOM 799 CG TYR A 55 -10.071 0.805 -4.533 1.00 0.00 C ATOM 800 CD1 TYR A 55 -9.405 1.734 -3.744 1.00 0.00 C ATOM 801 CD2 TYR A 55 -11.283 1.177 -5.103 1.00 0.00 C ATOM 802 CE1 TYR A 55 -9.930 2.994 -3.527 1.00 0.00 C ATOM 803 CE2 TYR A 55 -11.815 2.435 -4.893 1.00 0.00 C ATOM 804 CZ TYR A 55 -11.135 3.339 -4.103 1.00 0.00 C ATOM 805 OH TYR A 55 -11.660 4.593 -3.891 1.00 0.00 O ATOM 0 H TYR A 55 -7.667 -0.638 -2.882 1.00 0.00 H new ATOM 0 HA TYR A 55 -10.492 -1.470 -3.089 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -8.471 -0.471 -5.132 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -10.064 -1.068 -5.552 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -8.461 1.467 -3.292 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -11.818 0.471 -5.721 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -9.400 3.704 -2.910 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -12.757 2.709 -5.344 1.00 0.00 H new ATOM 0 HH TYR A 55 -12.512 4.676 -4.367 1.00 0.00 H new ATOM 815 N TYR A 56 -9.992 -3.827 -3.594 1.00 0.00 N ATOM 816 CA TYR A 56 -9.746 -5.231 -3.895 1.00 0.00 C ATOM 817 C TYR A 56 -11.047 -5.952 -4.232 1.00 0.00 C ATOM 818 O TYR A 56 -12.035 -5.847 -3.504 1.00 0.00 O ATOM 819 CB TYR A 56 -9.059 -5.917 -2.713 1.00 0.00 C ATOM 820 CG TYR A 56 -9.968 -6.121 -1.521 1.00 0.00 C ATOM 821 CD1 TYR A 56 -10.252 -5.076 -0.652 1.00 0.00 C ATOM 822 CD2 TYR A 56 -10.544 -7.361 -1.268 1.00 0.00 C ATOM 823 CE1 TYR A 56 -11.079 -5.260 0.438 1.00 0.00 C ATOM 824 CE2 TYR A 56 -11.375 -7.551 -0.180 1.00 0.00 C ATOM 825 CZ TYR A 56 -11.640 -6.498 0.670 1.00 0.00 C ATOM 826 OH TYR A 56 -12.468 -6.684 1.754 1.00 0.00 O ATOM 0 H TYR A 56 -10.889 -3.643 -3.144 1.00 0.00 H new ATOM 0 HA TYR A 56 -9.090 -5.280 -4.764 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -8.676 -6.885 -3.037 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -8.200 -5.321 -2.407 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -9.819 -4.103 -0.832 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -10.339 -8.188 -1.932 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -11.286 -4.437 1.106 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -11.815 -8.520 0.004 1.00 0.00 H new ATOM 0 HH TYR A 56 -12.616 -5.826 2.204 1.00 0.00 H new ATOM 836 N THR A 57 -11.040 -6.688 -5.339 1.00 0.00 N ATOM 837 CA THR A 57 -12.219 -7.426 -5.773 1.00 0.00 C ATOM 838 C THR A 57 -11.846 -8.524 -6.763 1.00 0.00 C ATOM 839 O THR A 57 -10.999 -8.327 -7.633 1.00 0.00 O ATOM 840 CB THR A 57 -13.259 -6.496 -6.424 1.00 0.00 C ATOM 841 OG1 THR A 57 -14.499 -7.189 -6.598 1.00 0.00 O ATOM 842 CG2 THR A 57 -12.763 -5.988 -7.770 1.00 0.00 C ATOM 0 H THR A 57 -10.230 -6.789 -5.951 1.00 0.00 H new ATOM 0 HA THR A 57 -12.655 -7.876 -4.881 1.00 0.00 H new ATOM 0 HB THR A 57 -13.412 -5.642 -5.764 1.00 0.00 H new ATOM 0 HG1 THR A 57 -15.154 -6.589 -7.011 1.00 0.00 H new ATOM 0 HG21 THR A 57 -13.514 -5.333 -8.211 1.00 0.00 H new ATOM 0 HG22 THR A 57 -11.835 -5.433 -7.630 1.00 0.00 H new ATOM 0 HG23 THR A 57 -12.584 -6.833 -8.434 1.00 0.00 H new ATOM 850 N MET A 58 -12.487 -9.680 -6.626 1.00 0.00 N ATOM 851 CA MET A 58 -12.223 -10.809 -7.512 1.00 0.00 C ATOM 852 C MET A 58 -12.619 -10.479 -8.946 1.00 0.00 C ATOM 853 O MET A 58 -12.141 -11.104 -9.893 1.00 0.00 O ATOM 854 CB MET A 58 -12.982 -12.049 -7.033 1.00 0.00 C ATOM 855 CG MET A 58 -14.482 -11.970 -7.264 1.00 0.00 C ATOM 856 SD MET A 58 -15.419 -12.946 -6.072 1.00 0.00 S ATOM 857 CE MET A 58 -14.467 -14.462 -6.052 1.00 0.00 C ATOM 0 H MET A 58 -13.192 -9.860 -5.911 1.00 0.00 H new ATOM 0 HA MET A 58 -11.153 -11.015 -7.488 1.00 0.00 H new ATOM 0 HB2 MET A 58 -12.589 -12.926 -7.547 1.00 0.00 H new ATOM 0 HB3 MET A 58 -12.794 -12.192 -5.969 1.00 0.00 H new ATOM 0 HG2 MET A 58 -14.801 -10.929 -7.206 1.00 0.00 H new ATOM 0 HG3 MET A 58 -14.710 -12.318 -8.272 1.00 0.00 H new ATOM 0 HE1 MET A 58 -14.836 -15.113 -5.259 1.00 0.00 H new ATOM 0 HE2 MET A 58 -14.568 -14.967 -7.012 1.00 0.00 H new ATOM 0 HE3 MET A 58 -13.417 -14.230 -5.872 1.00 0.00 H new ATOM 867 N ASP A 59 -13.497 -9.493 -9.102 1.00 0.00 N ATOM 868 CA ASP A 59 -13.956 -9.079 -10.422 1.00 0.00 C ATOM 869 C ASP A 59 -13.440 -7.686 -10.765 1.00 0.00 C ATOM 870 O ASP A 59 -14.151 -6.687 -10.648 1.00 0.00 O ATOM 871 CB ASP A 59 -15.485 -9.100 -10.483 1.00 0.00 C ATOM 872 CG ASP A 59 -16.033 -10.480 -10.788 1.00 0.00 C ATOM 873 OD1 ASP A 59 -15.429 -11.188 -11.620 1.00 0.00 O ATOM 874 OD2 ASP A 59 -17.068 -10.851 -10.195 1.00 0.00 O ATOM 0 H ASP A 59 -13.905 -8.966 -8.330 1.00 0.00 H new ATOM 0 HA ASP A 59 -13.561 -9.783 -11.154 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -15.888 -8.754 -9.531 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -15.825 -8.400 -11.247 1.00 0.00 H new ATOM 879 N PRO A 60 -12.172 -7.613 -11.198 1.00 0.00 N ATOM 880 CA PRO A 60 -11.533 -6.347 -11.567 1.00 0.00 C ATOM 881 C PRO A 60 -12.109 -5.759 -12.851 1.00 0.00 C ATOM 882 O PRO A 60 -11.785 -4.632 -13.229 1.00 0.00 O ATOM 883 CB PRO A 60 -10.065 -6.736 -11.768 1.00 0.00 C ATOM 884 CG PRO A 60 -10.103 -8.183 -12.117 1.00 0.00 C ATOM 885 CD PRO A 60 -11.267 -8.764 -11.363 1.00 0.00 C ATOM 0 HA PRO A 60 -11.685 -5.578 -10.810 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.605 -6.149 -12.563 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.482 -6.562 -10.864 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -10.226 -8.322 -13.191 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -9.172 -8.676 -11.837 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -11.742 -9.573 -11.918 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.959 -9.175 -10.401 1.00 0.00 H new ATOM 893 N THR A 61 -12.964 -6.527 -13.518 1.00 0.00 N ATOM 894 CA THR A 61 -13.584 -6.083 -14.759 1.00 0.00 C ATOM 895 C THR A 61 -14.223 -4.709 -14.593 1.00 0.00 C ATOM 896 O THR A 61 -14.308 -3.935 -15.546 1.00 0.00 O ATOM 897 CB THR A 61 -14.655 -7.079 -15.241 1.00 0.00 C ATOM 898 OG1 THR A 61 -15.219 -6.632 -16.478 1.00 0.00 O ATOM 899 CG2 THR A 61 -15.756 -7.235 -14.203 1.00 0.00 C ATOM 0 H THR A 61 -13.243 -7.461 -13.219 1.00 0.00 H new ATOM 0 HA THR A 61 -12.791 -6.025 -15.505 1.00 0.00 H new ATOM 0 HB THR A 61 -14.177 -8.048 -15.389 1.00 0.00 H new ATOM 0 HG1 THR A 61 -15.898 -7.272 -16.778 1.00 0.00 H new ATOM 0 HG21 THR A 61 -16.501 -7.943 -14.566 1.00 0.00 H new ATOM 0 HG22 THR A 61 -15.328 -7.604 -13.271 1.00 0.00 H new ATOM 0 HG23 THR A 61 -16.230 -6.269 -14.027 1.00 0.00 H new ATOM 907 N GLN A 62 -14.671 -4.412 -13.377 1.00 0.00 N ATOM 908 CA GLN A 62 -15.302 -3.132 -13.087 1.00 0.00 C ATOM 909 C GLN A 62 -14.282 -1.998 -13.133 1.00 0.00 C ATOM 910 O GLN A 62 -13.074 -2.239 -13.177 1.00 0.00 O ATOM 911 CB GLN A 62 -15.978 -3.170 -11.716 1.00 0.00 C ATOM 912 CG GLN A 62 -16.794 -4.429 -11.475 1.00 0.00 C ATOM 913 CD GLN A 62 -17.658 -4.337 -10.232 1.00 0.00 C ATOM 914 OE1 GLN A 62 -18.828 -3.960 -10.302 1.00 0.00 O ATOM 915 NE2 GLN A 62 -17.084 -4.682 -9.086 1.00 0.00 N ATOM 0 H GLN A 62 -14.608 -5.042 -12.577 1.00 0.00 H new ATOM 0 HA GLN A 62 -16.057 -2.948 -13.851 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -15.215 -3.088 -10.942 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -16.628 -2.301 -11.617 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -17.429 -4.617 -12.341 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -16.121 -5.281 -11.382 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -16.111 -4.989 -9.075 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -17.616 -4.640 -8.217 1.00 0.00 H new ATOM 924 N HIS A 63 -14.774 -0.764 -13.123 1.00 0.00 N ATOM 925 CA HIS A 63 -13.904 0.406 -13.162 1.00 0.00 C ATOM 926 C HIS A 63 -12.969 0.429 -11.957 1.00 0.00 C ATOM 927 O HIS A 63 -11.823 -0.017 -12.039 1.00 0.00 O ATOM 928 CB HIS A 63 -14.738 1.687 -13.199 1.00 0.00 C ATOM 929 CG HIS A 63 -13.932 2.933 -12.992 1.00 0.00 C ATOM 930 ND1 HIS A 63 -13.959 3.659 -11.819 1.00 0.00 N ATOM 931 CD2 HIS A 63 -13.072 3.578 -13.814 1.00 0.00 C ATOM 932 CE1 HIS A 63 -13.153 4.699 -11.932 1.00 0.00 C ATOM 933 NE2 HIS A 63 -12.602 4.672 -13.132 1.00 0.00 N ATOM 0 H HIS A 63 -15.770 -0.548 -13.088 1.00 0.00 H new ATOM 0 HA HIS A 63 -13.300 0.348 -14.067 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -15.249 1.750 -14.160 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -15.509 1.631 -12.431 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -12.805 3.286 -14.819 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -12.975 5.445 -11.172 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -11.935 5.354 -13.493 1.00 0.00 H new ATOM 941 N VAL A 64 -13.463 0.951 -10.839 1.00 0.00 N ATOM 942 CA VAL A 64 -12.671 1.032 -9.618 1.00 0.00 C ATOM 943 C VAL A 64 -13.567 1.059 -8.383 1.00 0.00 C ATOM 944 O VAL A 64 -13.629 0.089 -7.630 1.00 0.00 O ATOM 945 CB VAL A 64 -11.771 2.281 -9.613 1.00 0.00 C ATOM 946 CG1 VAL A 64 -11.094 2.447 -8.261 1.00 0.00 C ATOM 947 CG2 VAL A 64 -10.740 2.200 -10.730 1.00 0.00 C ATOM 0 H VAL A 64 -14.408 1.324 -10.754 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.043 0.142 -9.589 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.395 3.157 -9.789 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -10.462 3.335 -8.277 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -11.852 2.555 -7.485 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.482 1.570 -8.050 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.113 3.091 -10.711 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.119 1.316 -10.588 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.249 2.135 -11.691 1.00 0.00 H new ATOM 957 N ASN A 65 -14.258 2.177 -8.186 1.00 0.00 N ATOM 958 CA ASN A 65 -15.150 2.331 -7.042 1.00 0.00 C ATOM 959 C ASN A 65 -16.151 1.182 -6.977 1.00 0.00 C ATOM 960 O ASN A 65 -16.592 0.791 -5.896 1.00 0.00 O ATOM 961 CB ASN A 65 -15.892 3.665 -7.126 1.00 0.00 C ATOM 962 CG ASN A 65 -17.132 3.585 -7.994 1.00 0.00 C ATOM 963 OD1 ASN A 65 -18.218 3.254 -7.519 1.00 0.00 O ATOM 964 ND2 ASN A 65 -16.974 3.889 -9.279 1.00 0.00 N ATOM 0 H ASN A 65 -14.218 2.989 -8.802 1.00 0.00 H new ATOM 0 HA ASN A 65 -14.546 2.315 -6.135 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -16.175 3.984 -6.123 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -15.221 4.426 -7.525 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -17.772 3.853 -9.913 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -16.055 4.158 -9.630 1.00 0.00 H new ATOM 971 N ASN A 66 -16.507 0.646 -8.140 1.00 0.00 N ATOM 972 CA ASN A 66 -17.457 -0.458 -8.213 1.00 0.00 C ATOM 973 C ASN A 66 -16.944 -1.670 -7.442 1.00 0.00 C ATOM 974 O ASN A 66 -17.715 -2.557 -7.076 1.00 0.00 O ATOM 975 CB ASN A 66 -17.713 -0.840 -9.673 1.00 0.00 C ATOM 976 CG ASN A 66 -18.896 -0.098 -10.266 1.00 0.00 C ATOM 977 OD1 ASN A 66 -19.967 -0.033 -9.662 1.00 0.00 O ATOM 978 ND2 ASN A 66 -18.706 0.464 -11.454 1.00 0.00 N ATOM 0 H ASN A 66 -16.152 0.958 -9.044 1.00 0.00 H new ATOM 0 HA ASN A 66 -18.392 -0.131 -7.759 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -16.821 -0.627 -10.263 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -17.891 -1.913 -9.739 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -19.465 0.976 -11.903 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -17.801 0.384 -11.917 1.00 0.00 H new ATOM 985 N TRP A 67 -15.639 -1.699 -7.197 1.00 0.00 N ATOM 986 CA TRP A 67 -15.023 -2.802 -6.468 1.00 0.00 C ATOM 987 C TRP A 67 -15.607 -2.919 -5.064 1.00 0.00 C ATOM 988 O TRP A 67 -16.539 -2.201 -4.707 1.00 0.00 O ATOM 989 CB TRP A 67 -13.508 -2.605 -6.390 1.00 0.00 C ATOM 990 CG TRP A 67 -12.819 -2.766 -7.712 1.00 0.00 C ATOM 991 CD1 TRP A 67 -13.400 -2.733 -8.947 1.00 0.00 C ATOM 992 CD2 TRP A 67 -11.421 -2.987 -7.927 1.00 0.00 C ATOM 993 NE1 TRP A 67 -12.445 -2.919 -9.918 1.00 0.00 N ATOM 994 CE2 TRP A 67 -11.225 -3.076 -9.319 1.00 0.00 C ATOM 995 CE3 TRP A 67 -10.317 -3.116 -7.081 1.00 0.00 C ATOM 996 CZ2 TRP A 67 -9.969 -3.291 -9.881 1.00 0.00 C ATOM 997 CZ3 TRP A 67 -9.071 -3.328 -7.640 1.00 0.00 C ATOM 998 CH2 TRP A 67 -8.905 -3.414 -9.029 1.00 0.00 C ATOM 0 H TRP A 67 -14.987 -0.972 -7.492 1.00 0.00 H new ATOM 0 HA TRP A 67 -15.235 -3.725 -7.007 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.298 -1.610 -5.998 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -13.092 -3.321 -5.682 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -14.453 -2.583 -9.133 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -12.618 -2.937 -10.923 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -10.435 -3.051 -6.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -9.839 -3.358 -10.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -8.210 -3.429 -6.995 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -7.918 -3.581 -9.435 1.00 0.00 H new ATOM 1009 N MET A 68 -15.050 -3.830 -4.271 1.00 0.00 N ATOM 1010 CA MET A 68 -15.516 -4.039 -2.905 1.00 0.00 C ATOM 1011 C MET A 68 -15.035 -2.917 -1.989 1.00 0.00 C ATOM 1012 O MET A 68 -15.777 -2.442 -1.130 1.00 0.00 O ATOM 1013 CB MET A 68 -15.026 -5.388 -2.378 1.00 0.00 C ATOM 1014 CG MET A 68 -16.136 -6.412 -2.203 1.00 0.00 C ATOM 1015 SD MET A 68 -15.698 -8.031 -2.864 1.00 0.00 S ATOM 1016 CE MET A 68 -14.294 -8.450 -1.834 1.00 0.00 C ATOM 0 H MET A 68 -14.277 -4.434 -4.551 1.00 0.00 H new ATOM 0 HA MET A 68 -16.606 -4.035 -2.914 1.00 0.00 H new ATOM 0 HB2 MET A 68 -14.279 -5.787 -3.064 1.00 0.00 H new ATOM 0 HB3 MET A 68 -14.529 -5.236 -1.420 1.00 0.00 H new ATOM 0 HG2 MET A 68 -16.372 -6.508 -1.143 1.00 0.00 H new ATOM 0 HG3 MET A 68 -17.038 -6.053 -2.699 1.00 0.00 H new ATOM 0 HE1 MET A 68 -14.164 -9.532 -1.818 1.00 0.00 H new ATOM 0 HE2 MET A 68 -13.395 -7.982 -2.236 1.00 0.00 H new ATOM 0 HE3 MET A 68 -14.467 -8.091 -0.820 1.00 0.00 H new ATOM 1026 N LYS A 69 -13.788 -2.498 -2.178 1.00 0.00 N ATOM 1027 CA LYS A 69 -13.209 -1.432 -1.370 1.00 0.00 C ATOM 1028 C LYS A 69 -13.107 -1.851 0.093 1.00 0.00 C ATOM 1029 O LYS A 69 -13.812 -2.758 0.539 1.00 0.00 O ATOM 1030 CB LYS A 69 -14.048 -0.159 -1.491 1.00 0.00 C ATOM 1031 CG LYS A 69 -14.391 0.211 -2.922 1.00 0.00 C ATOM 1032 CD LYS A 69 -15.168 1.514 -2.991 1.00 0.00 C ATOM 1033 CE LYS A 69 -14.251 2.719 -2.842 1.00 0.00 C ATOM 1034 NZ LYS A 69 -14.809 3.726 -1.897 1.00 0.00 N ATOM 0 H LYS A 69 -13.159 -2.881 -2.884 1.00 0.00 H new ATOM 0 HA LYS A 69 -12.204 -1.233 -1.742 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -14.972 -0.288 -0.927 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -13.507 0.668 -1.031 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -13.474 0.302 -3.505 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -14.978 -0.588 -3.374 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -15.697 1.573 -3.942 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -15.923 1.531 -2.205 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -13.274 2.390 -2.488 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -14.097 3.182 -3.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -14.156 4.532 -1.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -15.730 4.058 -2.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -14.932 3.292 -0.960 1.00 0.00 H new ATOM 1048 N HIS A 70 -12.229 -1.186 0.836 1.00 0.00 N ATOM 1049 CA HIS A 70 -12.039 -1.488 2.250 1.00 0.00 C ATOM 1050 C HIS A 70 -12.029 -0.210 3.082 1.00 0.00 C ATOM 1051 O HIS A 70 -12.267 0.882 2.565 1.00 0.00 O ATOM 1052 CB HIS A 70 -10.732 -2.255 2.457 1.00 0.00 C ATOM 1053 CG HIS A 70 -10.843 -3.367 3.454 1.00 0.00 C ATOM 1054 ND1 HIS A 70 -11.925 -4.222 3.512 1.00 0.00 N ATOM 1055 CD2 HIS A 70 -9.998 -3.766 4.433 1.00 0.00 C ATOM 1056 CE1 HIS A 70 -11.741 -5.095 4.485 1.00 0.00 C ATOM 1057 NE2 HIS A 70 -10.580 -4.840 5.059 1.00 0.00 N ATOM 0 H HIS A 70 -11.637 -0.434 0.482 1.00 0.00 H new ATOM 0 HA HIS A 70 -12.873 -2.108 2.579 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -10.406 -2.666 1.501 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -9.960 -1.559 2.785 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -9.044 -3.322 4.676 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -12.424 -5.884 4.764 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -10.180 -5.358 5.842 1.00 0.00 H new ATOM 1065 N ASN A 71 -11.756 -0.353 4.375 1.00 0.00 N ATOM 1066 CA ASN A 71 -11.717 0.790 5.280 1.00 0.00 C ATOM 1067 C ASN A 71 -10.383 0.856 6.018 1.00 0.00 C ATOM 1068 O ASN A 71 -9.789 -0.174 6.341 1.00 0.00 O ATOM 1069 CB ASN A 71 -12.866 0.709 6.286 1.00 0.00 C ATOM 1070 CG ASN A 71 -13.011 -0.676 6.889 1.00 0.00 C ATOM 1071 OD1 ASN A 71 -12.058 -1.227 7.440 1.00 0.00 O ATOM 1072 ND2 ASN A 71 -14.207 -1.243 6.785 1.00 0.00 N ATOM 0 H ASN A 71 -11.558 -1.249 4.820 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.827 1.697 4.685 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -12.699 1.434 7.083 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -13.797 0.987 5.793 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -14.365 -2.174 7.171 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -14.967 -0.748 6.319 1.00 0.00 H new ATOM 1079 N VAL A 72 -9.918 2.073 6.283 1.00 0.00 N ATOM 1080 CA VAL A 72 -8.656 2.272 6.984 1.00 0.00 C ATOM 1081 C VAL A 72 -8.676 3.566 7.792 1.00 0.00 C ATOM 1082 O VAL A 72 -9.262 4.563 7.372 1.00 0.00 O ATOM 1083 CB VAL A 72 -7.469 2.312 6.002 1.00 0.00 C ATOM 1084 CG1 VAL A 72 -6.167 2.559 6.749 1.00 0.00 C ATOM 1085 CG2 VAL A 72 -7.398 1.021 5.203 1.00 0.00 C ATOM 0 H VAL A 72 -10.397 2.935 6.023 1.00 0.00 H new ATOM 0 HA VAL A 72 -8.531 1.426 7.659 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.622 3.136 5.305 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.340 2.584 6.040 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -6.224 3.513 7.274 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -6.003 1.758 7.469 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.554 1.065 4.514 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.267 0.179 5.883 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.321 0.891 4.638 1.00 0.00 H new ATOM 1095 N ALA A 73 -8.031 3.539 8.954 1.00 0.00 N ATOM 1096 CA ALA A 73 -7.972 4.710 9.821 1.00 0.00 C ATOM 1097 C ALA A 73 -6.530 5.068 10.161 1.00 0.00 C ATOM 1098 O ALA A 73 -6.125 5.019 11.324 1.00 0.00 O ATOM 1099 CB ALA A 73 -8.771 4.467 11.091 1.00 0.00 C ATOM 0 H ALA A 73 -7.543 2.720 9.316 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.411 5.551 9.285 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.718 5.349 11.729 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.811 4.267 10.834 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.358 3.610 11.623 1.00 0.00 H new ATOM 1105 N ASP A 74 -5.758 5.431 9.142 1.00 0.00 N ATOM 1106 CA ASP A 74 -4.361 5.798 9.334 1.00 0.00 C ATOM 1107 C ASP A 74 -3.616 4.717 10.113 1.00 0.00 C ATOM 1108 O ASP A 74 -3.101 4.968 11.202 1.00 0.00 O ATOM 1109 CB ASP A 74 -4.259 7.136 10.068 1.00 0.00 C ATOM 1110 CG ASP A 74 -2.907 7.797 9.884 1.00 0.00 C ATOM 1111 OD1 ASP A 74 -1.882 7.090 9.991 1.00 0.00 O ATOM 1112 OD2 ASP A 74 -2.872 9.019 9.634 1.00 0.00 O ATOM 0 H ASP A 74 -6.077 5.479 8.174 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.899 5.895 8.352 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.039 7.806 9.707 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.441 6.979 11.131 1.00 0.00 H new ATOM 1117 N SER A 75 -3.566 3.517 9.547 1.00 0.00 N ATOM 1118 CA SER A 75 -2.889 2.397 10.190 1.00 0.00 C ATOM 1119 C SER A 75 -1.698 1.930 9.358 1.00 0.00 C ATOM 1120 O SER A 75 -0.760 1.329 9.881 1.00 0.00 O ATOM 1121 CB SER A 75 -3.864 1.236 10.400 1.00 0.00 C ATOM 1122 OG SER A 75 -3.744 0.699 11.705 1.00 0.00 O ATOM 0 H SER A 75 -3.986 3.294 8.644 1.00 0.00 H new ATOM 0 HA SER A 75 -2.523 2.735 11.159 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.885 1.581 10.238 1.00 0.00 H new ATOM 0 HB3 SER A 75 -3.670 0.456 9.663 1.00 0.00 H new ATOM 0 HG SER A 75 -4.378 -0.040 11.814 1.00 0.00 H new ATOM 1128 N GLN A 76 -1.744 2.213 8.060 1.00 0.00 N ATOM 1129 CA GLN A 76 -0.669 1.823 7.155 1.00 0.00 C ATOM 1130 C GLN A 76 -0.544 0.305 7.082 1.00 0.00 C ATOM 1131 O GLN A 76 0.484 -0.222 6.655 1.00 0.00 O ATOM 1132 CB GLN A 76 0.657 2.435 7.610 1.00 0.00 C ATOM 1133 CG GLN A 76 1.102 3.619 6.766 1.00 0.00 C ATOM 1134 CD GLN A 76 2.323 4.315 7.334 1.00 0.00 C ATOM 1135 OE1 GLN A 76 2.272 5.495 7.684 1.00 0.00 O ATOM 1136 NE2 GLN A 76 3.428 3.587 7.430 1.00 0.00 N ATOM 0 H GLN A 76 -2.513 2.710 7.612 1.00 0.00 H new ATOM 0 HA GLN A 76 -0.911 2.198 6.160 1.00 0.00 H new ATOM 0 HB2 GLN A 76 0.563 2.754 8.648 1.00 0.00 H new ATOM 0 HB3 GLN A 76 1.431 1.668 7.581 1.00 0.00 H new ATOM 0 HG2 GLN A 76 1.321 3.277 5.754 1.00 0.00 H new ATOM 0 HG3 GLN A 76 0.283 4.334 6.690 1.00 0.00 H new ATOM 0 HE21 GLN A 76 3.425 2.613 7.128 1.00 0.00 H new ATOM 0 HE22 GLN A 76 4.281 4.002 7.806 1.00 0.00 H new ATOM 1145 N ILE A 77 -1.595 -0.392 7.502 1.00 0.00 N ATOM 1146 CA ILE A 77 -1.601 -1.849 7.483 1.00 0.00 C ATOM 1147 C ILE A 77 -3.012 -2.395 7.674 1.00 0.00 C ATOM 1148 O ILE A 77 -3.754 -1.940 8.545 1.00 0.00 O ATOM 1149 CB ILE A 77 -0.685 -2.431 8.577 1.00 0.00 C ATOM 1150 CG1 ILE A 77 -0.553 -3.946 8.410 1.00 0.00 C ATOM 1151 CG2 ILE A 77 -1.228 -2.089 9.958 1.00 0.00 C ATOM 1152 CD1 ILE A 77 0.552 -4.552 9.246 1.00 0.00 C ATOM 0 H ILE A 77 -2.453 0.029 7.859 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.225 -2.153 6.506 1.00 0.00 H new ATOM 0 HB ILE A 77 0.305 -1.987 8.476 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.499 -4.417 8.677 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.369 -4.173 7.360 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.571 -2.506 10.721 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.275 -1.006 10.073 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.227 -2.509 10.070 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.587 -5.628 9.077 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.507 -4.109 8.963 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.359 -4.356 10.301 1.00 0.00 H new ATOM 1164 N THR A 78 -3.377 -3.375 6.855 1.00 0.00 N ATOM 1165 CA THR A 78 -4.699 -3.985 6.933 1.00 0.00 C ATOM 1166 C THR A 78 -4.649 -5.457 6.543 1.00 0.00 C ATOM 1167 O THR A 78 -3.879 -5.853 5.668 1.00 0.00 O ATOM 1168 CB THR A 78 -5.707 -3.258 6.022 1.00 0.00 C ATOM 1169 OG1 THR A 78 -7.015 -3.814 6.199 1.00 0.00 O ATOM 1170 CG2 THR A 78 -5.296 -3.370 4.563 1.00 0.00 C ATOM 0 H THR A 78 -2.775 -3.764 6.129 1.00 0.00 H new ATOM 0 HA THR A 78 -5.027 -3.898 7.969 1.00 0.00 H new ATOM 0 HB THR A 78 -5.720 -2.204 6.299 1.00 0.00 H new ATOM 0 HG1 THR A 78 -7.680 -3.094 6.197 1.00 0.00 H new ATOM 0 HG21 THR A 78 -6.023 -2.849 3.939 1.00 0.00 H new ATOM 0 HG22 THR A 78 -4.312 -2.921 4.427 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.258 -4.421 4.275 1.00 0.00 H new ATOM 1178 N THR A 79 -5.477 -6.266 7.197 1.00 0.00 N ATOM 1179 CA THR A 79 -5.527 -7.696 6.920 1.00 0.00 C ATOM 1180 C THR A 79 -6.890 -8.102 6.370 1.00 0.00 C ATOM 1181 O THR A 79 -7.911 -7.952 7.042 1.00 0.00 O ATOM 1182 CB THR A 79 -5.228 -8.525 8.184 1.00 0.00 C ATOM 1183 OG1 THR A 79 -5.854 -7.924 9.323 1.00 0.00 O ATOM 1184 CG2 THR A 79 -3.729 -8.631 8.419 1.00 0.00 C ATOM 0 H THR A 79 -6.123 -5.955 7.923 1.00 0.00 H new ATOM 0 HA THR A 79 -4.761 -7.900 6.172 1.00 0.00 H new ATOM 0 HB THR A 79 -5.628 -9.528 8.038 1.00 0.00 H new ATOM 0 HG1 THR A 79 -6.778 -7.686 9.101 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.542 -9.221 9.317 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.260 -9.115 7.563 1.00 0.00 H new ATOM 0 HG23 THR A 79 -3.309 -7.633 8.546 1.00 0.00 H new ATOM 1192 N ILE A 80 -6.899 -8.616 5.145 1.00 0.00 N ATOM 1193 CA ILE A 80 -8.137 -9.046 4.507 1.00 0.00 C ATOM 1194 C ILE A 80 -8.228 -10.566 4.451 1.00 0.00 C ATOM 1195 O ILE A 80 -7.243 -11.248 4.172 1.00 0.00 O ATOM 1196 CB ILE A 80 -8.258 -8.482 3.078 1.00 0.00 C ATOM 1197 CG1 ILE A 80 -8.207 -6.954 3.104 1.00 0.00 C ATOM 1198 CG2 ILE A 80 -9.547 -8.964 2.427 1.00 0.00 C ATOM 1199 CD1 ILE A 80 -8.117 -6.328 1.729 1.00 0.00 C ATOM 0 H ILE A 80 -6.063 -8.745 4.575 1.00 0.00 H new ATOM 0 HA ILE A 80 -8.956 -8.658 5.113 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.417 -8.844 2.487 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -9.097 -6.577 3.608 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -7.348 -6.637 3.695 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.619 -8.558 1.418 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -9.546 -10.053 2.381 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.400 -8.627 3.016 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -8.085 -5.243 1.825 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -7.213 -6.675 1.230 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -8.989 -6.615 1.141 1.00 0.00 H new ATOM 1211 N GLY A 81 -9.420 -11.093 4.715 1.00 0.00 N ATOM 1212 CA GLY A 81 -9.618 -12.531 4.687 1.00 0.00 C ATOM 1213 C GLY A 81 -10.970 -12.918 4.121 1.00 0.00 C ATOM 1214 O GLY A 81 -11.646 -12.103 3.496 1.00 0.00 O ATOM 0 H GLY A 81 -10.252 -10.550 4.948 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -8.832 -12.992 4.089 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -9.523 -12.928 5.698 1.00 0.00 H new ATOM 1218 N ASN A 82 -11.366 -14.169 4.340 1.00 0.00 N ATOM 1219 CA ASN A 82 -12.645 -14.663 3.845 1.00 0.00 C ATOM 1220 C ASN A 82 -12.682 -14.641 2.320 1.00 0.00 C ATOM 1221 O ASN A 82 -13.718 -14.347 1.718 1.00 0.00 O ATOM 1222 CB ASN A 82 -13.793 -13.823 4.407 1.00 0.00 C ATOM 1223 CG ASN A 82 -15.146 -14.465 4.176 1.00 0.00 C ATOM 1224 OD1 ASN A 82 -15.236 -15.598 3.702 1.00 0.00 O ATOM 1225 ND2 ASN A 82 -16.209 -13.743 4.511 1.00 0.00 N ATOM 0 H ASN A 82 -10.819 -14.858 4.857 1.00 0.00 H new ATOM 0 HA ASN A 82 -12.762 -15.694 4.179 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -13.642 -13.675 5.476 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -13.778 -12.836 3.944 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -17.146 -14.123 4.379 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -16.088 -12.808 4.901 1.00 0.00 H new ATOM 1232 N LEU A 83 -11.550 -14.955 1.701 1.00 0.00 N ATOM 1233 CA LEU A 83 -11.453 -14.972 0.244 1.00 0.00 C ATOM 1234 C LEU A 83 -11.404 -16.404 -0.281 1.00 0.00 C ATOM 1235 O LEU A 83 -11.576 -17.360 0.475 1.00 0.00 O ATOM 1236 CB LEU A 83 -10.211 -14.206 -0.213 1.00 0.00 C ATOM 1237 CG LEU A 83 -9.874 -12.942 0.579 1.00 0.00 C ATOM 1238 CD1 LEU A 83 -8.489 -12.435 0.207 1.00 0.00 C ATOM 1239 CD2 LEU A 83 -10.920 -11.865 0.337 1.00 0.00 C ATOM 0 H LEU A 83 -10.686 -15.201 2.184 1.00 0.00 H new ATOM 0 HA LEU A 83 -12.341 -14.486 -0.161 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.355 -14.879 -0.166 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -10.343 -13.931 -1.259 1.00 0.00 H new ATOM 0 HG LEU A 83 -9.877 -13.190 1.641 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -8.265 -11.535 0.780 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.748 -13.202 0.432 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -8.460 -12.204 -0.858 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -10.663 -10.973 0.909 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -10.950 -11.619 -0.724 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -11.897 -12.230 0.653 1.00 0.00 H new ATOM 1251 N VAL A 84 -11.167 -16.543 -1.581 1.00 0.00 N ATOM 1252 CA VAL A 84 -11.092 -17.858 -2.208 1.00 0.00 C ATOM 1253 C VAL A 84 -9.682 -18.146 -2.713 1.00 0.00 C ATOM 1254 O VAL A 84 -9.048 -17.316 -3.362 1.00 0.00 O ATOM 1255 CB VAL A 84 -12.080 -17.976 -3.383 1.00 0.00 C ATOM 1256 CG1 VAL A 84 -11.811 -16.896 -4.418 1.00 0.00 C ATOM 1257 CG2 VAL A 84 -11.998 -19.360 -4.010 1.00 0.00 C ATOM 0 H VAL A 84 -11.024 -15.762 -2.221 1.00 0.00 H new ATOM 0 HA VAL A 84 -11.358 -18.589 -1.444 1.00 0.00 H new ATOM 0 HB VAL A 84 -13.091 -17.834 -3.001 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.519 -16.996 -5.241 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -11.925 -15.915 -3.958 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -10.795 -17.002 -4.799 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -12.703 -19.426 -4.839 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -10.987 -19.533 -4.379 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -12.245 -20.113 -3.262 1.00 0.00 H new ATOM 1267 N PRO A 85 -9.180 -19.351 -2.407 1.00 0.00 N ATOM 1268 CA PRO A 85 -7.840 -19.778 -2.821 1.00 0.00 C ATOM 1269 C PRO A 85 -7.743 -20.011 -4.324 1.00 0.00 C ATOM 1270 O PRO A 85 -8.758 -20.198 -4.998 1.00 0.00 O ATOM 1271 CB PRO A 85 -7.637 -21.091 -2.062 1.00 0.00 C ATOM 1272 CG PRO A 85 -9.013 -21.605 -1.817 1.00 0.00 C ATOM 1273 CD PRO A 85 -9.881 -20.390 -1.634 1.00 0.00 C ATOM 0 HA PRO A 85 -7.086 -19.022 -2.603 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -7.048 -21.799 -2.646 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.103 -20.928 -1.126 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.359 -22.209 -2.655 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -9.040 -22.241 -0.932 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -10.891 -20.557 -2.009 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -9.972 -20.116 -0.583 1.00 0.00 H new ATOM 1281 N GLN A 86 -6.521 -19.997 -4.844 1.00 0.00 N ATOM 1282 CA GLN A 86 -6.294 -20.207 -6.269 1.00 0.00 C ATOM 1283 C GLN A 86 -7.148 -19.256 -7.101 1.00 0.00 C ATOM 1284 O GLN A 86 -7.873 -19.682 -8.002 1.00 0.00 O ATOM 1285 CB GLN A 86 -6.605 -21.656 -6.649 1.00 0.00 C ATOM 1286 CG GLN A 86 -5.876 -22.679 -5.794 1.00 0.00 C ATOM 1287 CD GLN A 86 -6.173 -24.106 -6.210 1.00 0.00 C ATOM 1288 OE1 GLN A 86 -5.365 -24.748 -6.882 1.00 0.00 O ATOM 1289 NE2 GLN A 86 -7.335 -24.609 -5.814 1.00 0.00 N ATOM 0 H GLN A 86 -5.672 -19.842 -4.300 1.00 0.00 H new ATOM 0 HA GLN A 86 -5.244 -20.002 -6.478 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -7.679 -21.823 -6.564 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -6.340 -21.814 -7.694 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -4.802 -22.502 -5.859 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -6.159 -22.543 -4.750 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -7.974 -24.040 -5.258 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -7.589 -25.564 -6.065 1.00 0.00 H new ATOM 1298 N LYS A 87 -7.060 -17.966 -6.794 1.00 0.00 N ATOM 1299 CA LYS A 87 -7.824 -16.954 -7.514 1.00 0.00 C ATOM 1300 C LYS A 87 -7.106 -15.609 -7.484 1.00 0.00 C ATOM 1301 O LYS A 87 -6.772 -15.094 -6.417 1.00 0.00 O ATOM 1302 CB LYS A 87 -9.222 -16.812 -6.907 1.00 0.00 C ATOM 1303 CG LYS A 87 -10.146 -17.972 -7.231 1.00 0.00 C ATOM 1304 CD LYS A 87 -10.373 -18.103 -8.728 1.00 0.00 C ATOM 1305 CE LYS A 87 -11.825 -18.419 -9.046 1.00 0.00 C ATOM 1306 NZ LYS A 87 -12.065 -18.509 -10.513 1.00 0.00 N ATOM 0 H LYS A 87 -6.467 -17.597 -6.051 1.00 0.00 H new ATOM 0 HA LYS A 87 -7.917 -17.274 -8.552 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.132 -16.722 -5.825 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.673 -15.887 -7.267 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.719 -18.897 -6.845 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.102 -17.828 -6.728 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -10.085 -17.176 -9.223 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.733 -18.890 -9.127 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.103 -19.361 -8.574 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.466 -17.647 -8.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.067 -18.726 -10.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.824 -17.602 -10.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.472 -19.262 -10.916 1.00 0.00 H new ATOM 1320 N THR A 88 -6.872 -15.041 -8.664 1.00 0.00 N ATOM 1321 CA THR A 88 -6.195 -13.755 -8.773 1.00 0.00 C ATOM 1322 C THR A 88 -7.028 -12.640 -8.150 1.00 0.00 C ATOM 1323 O THR A 88 -8.223 -12.517 -8.425 1.00 0.00 O ATOM 1324 CB THR A 88 -5.898 -13.399 -10.241 1.00 0.00 C ATOM 1325 OG1 THR A 88 -5.131 -14.443 -10.853 1.00 0.00 O ATOM 1326 CG2 THR A 88 -5.140 -12.083 -10.336 1.00 0.00 C ATOM 0 H THR A 88 -7.142 -15.452 -9.558 1.00 0.00 H new ATOM 0 HA THR A 88 -5.253 -13.847 -8.232 1.00 0.00 H new ATOM 0 HB THR A 88 -6.848 -13.292 -10.765 1.00 0.00 H new ATOM 0 HG1 THR A 88 -4.948 -14.210 -11.787 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.941 -11.852 -11.383 1.00 0.00 H new ATOM 0 HG22 THR A 88 -5.739 -11.286 -9.896 1.00 0.00 H new ATOM 0 HG23 THR A 88 -4.196 -12.167 -9.798 1.00 0.00 H new ATOM 1334 N TYR A 89 -6.392 -11.831 -7.310 1.00 0.00 N ATOM 1335 CA TYR A 89 -7.075 -10.727 -6.648 1.00 0.00 C ATOM 1336 C TYR A 89 -6.301 -9.423 -6.822 1.00 0.00 C ATOM 1337 O TYR A 89 -5.087 -9.379 -6.627 1.00 0.00 O ATOM 1338 CB TYR A 89 -7.256 -11.031 -5.159 1.00 0.00 C ATOM 1339 CG TYR A 89 -8.581 -11.682 -4.831 1.00 0.00 C ATOM 1340 CD1 TYR A 89 -9.713 -10.913 -4.588 1.00 0.00 C ATOM 1341 CD2 TYR A 89 -8.700 -13.064 -4.761 1.00 0.00 C ATOM 1342 CE1 TYR A 89 -10.925 -11.502 -4.286 1.00 0.00 C ATOM 1343 CE2 TYR A 89 -9.908 -13.661 -4.462 1.00 0.00 C ATOM 1344 CZ TYR A 89 -11.018 -12.878 -4.225 1.00 0.00 C ATOM 1345 OH TYR A 89 -12.223 -13.470 -3.926 1.00 0.00 O ATOM 0 H TYR A 89 -5.404 -11.919 -7.072 1.00 0.00 H new ATOM 0 HA TYR A 89 -8.055 -10.611 -7.110 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -6.448 -11.684 -4.829 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -7.167 -10.103 -4.594 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -9.644 -9.836 -4.636 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.833 -13.682 -4.944 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -11.795 -10.890 -4.099 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -9.984 -14.737 -4.414 1.00 0.00 H new ATOM 0 HH TYR A 89 -12.902 -12.777 -3.787 1.00 0.00 H new ATOM 1355 N SER A 90 -7.016 -8.363 -7.188 1.00 0.00 N ATOM 1356 CA SER A 90 -6.396 -7.058 -7.393 1.00 0.00 C ATOM 1357 C SER A 90 -6.341 -6.273 -6.087 1.00 0.00 C ATOM 1358 O SER A 90 -7.174 -6.463 -5.199 1.00 0.00 O ATOM 1359 CB SER A 90 -7.169 -6.264 -8.447 1.00 0.00 C ATOM 1360 OG SER A 90 -6.370 -5.228 -8.991 1.00 0.00 O ATOM 0 H SER A 90 -8.023 -8.382 -7.348 1.00 0.00 H new ATOM 0 HA SER A 90 -5.376 -7.217 -7.744 1.00 0.00 H new ATOM 0 HB2 SER A 90 -7.495 -6.932 -9.244 1.00 0.00 H new ATOM 0 HB3 SER A 90 -8.067 -5.838 -8.000 1.00 0.00 H new ATOM 0 HG SER A 90 -6.362 -4.464 -8.377 1.00 0.00 H new ATOM 1366 N VAL A 91 -5.353 -5.391 -5.974 1.00 0.00 N ATOM 1367 CA VAL A 91 -5.189 -4.576 -4.777 1.00 0.00 C ATOM 1368 C VAL A 91 -4.633 -3.199 -5.122 1.00 0.00 C ATOM 1369 O VAL A 91 -3.657 -3.079 -5.865 1.00 0.00 O ATOM 1370 CB VAL A 91 -4.253 -5.255 -3.759 1.00 0.00 C ATOM 1371 CG1 VAL A 91 -4.182 -4.444 -2.474 1.00 0.00 C ATOM 1372 CG2 VAL A 91 -4.716 -6.676 -3.477 1.00 0.00 C ATOM 0 H VAL A 91 -4.654 -5.223 -6.698 1.00 0.00 H new ATOM 0 HA VAL A 91 -6.178 -4.465 -4.332 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.251 -5.301 -4.187 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.516 -4.939 -1.767 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.801 -3.447 -2.694 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -5.178 -4.364 -2.039 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -4.044 -7.141 -2.756 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.727 -6.655 -3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.709 -7.251 -4.403 1.00 0.00 H new ATOM 1382 N LYS A 92 -5.258 -2.161 -4.579 1.00 0.00 N ATOM 1383 CA LYS A 92 -4.825 -0.791 -4.827 1.00 0.00 C ATOM 1384 C LYS A 92 -4.980 0.064 -3.573 1.00 0.00 C ATOM 1385 O LYS A 92 -6.050 0.107 -2.968 1.00 0.00 O ATOM 1386 CB LYS A 92 -5.628 -0.180 -5.977 1.00 0.00 C ATOM 1387 CG LYS A 92 -5.778 -1.104 -7.172 1.00 0.00 C ATOM 1388 CD LYS A 92 -6.674 -0.496 -8.239 1.00 0.00 C ATOM 1389 CE LYS A 92 -5.932 0.542 -9.067 1.00 0.00 C ATOM 1390 NZ LYS A 92 -6.566 0.744 -10.398 1.00 0.00 N ATOM 0 H LYS A 92 -6.067 -2.242 -3.963 1.00 0.00 H new ATOM 0 HA LYS A 92 -3.770 -0.814 -5.102 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.618 0.093 -5.613 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.142 0.741 -6.299 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.796 -1.314 -7.596 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -6.194 -2.057 -6.846 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -7.049 -1.284 -8.893 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -7.541 -0.034 -7.767 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.910 1.489 -8.528 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -4.897 0.227 -9.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -6.032 1.458 -10.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -6.565 -0.154 -10.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -7.546 1.069 -10.270 1.00 0.00 H new ATOM 1404 N VAL A 93 -3.905 0.746 -3.189 1.00 0.00 N ATOM 1405 CA VAL A 93 -3.923 1.602 -2.010 1.00 0.00 C ATOM 1406 C VAL A 93 -3.706 3.063 -2.388 1.00 0.00 C ATOM 1407 O VAL A 93 -2.955 3.371 -3.313 1.00 0.00 O ATOM 1408 CB VAL A 93 -2.845 1.181 -0.994 1.00 0.00 C ATOM 1409 CG1 VAL A 93 -3.001 1.958 0.304 1.00 0.00 C ATOM 1410 CG2 VAL A 93 -2.912 -0.318 -0.738 1.00 0.00 C ATOM 0 H VAL A 93 -3.010 0.722 -3.678 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.906 1.490 -1.553 1.00 0.00 H new ATOM 0 HB VAL A 93 -1.866 1.413 -1.413 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -2.230 1.647 1.009 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -2.900 3.025 0.104 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -3.984 1.760 0.730 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.144 -0.599 -0.018 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -3.894 -0.576 -0.340 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.747 -0.854 -1.672 1.00 0.00 H new ATOM 1420 N LEU A 94 -4.368 3.961 -1.665 1.00 0.00 N ATOM 1421 CA LEU A 94 -4.248 5.390 -1.923 1.00 0.00 C ATOM 1422 C LEU A 94 -4.320 6.186 -0.624 1.00 0.00 C ATOM 1423 O LEU A 94 -4.667 5.649 0.426 1.00 0.00 O ATOM 1424 CB LEU A 94 -5.351 5.851 -2.878 1.00 0.00 C ATOM 1425 CG LEU A 94 -6.717 6.120 -2.245 1.00 0.00 C ATOM 1426 CD1 LEU A 94 -6.830 7.577 -1.821 1.00 0.00 C ATOM 1427 CD2 LEU A 94 -7.834 5.757 -3.213 1.00 0.00 C ATOM 0 H LEU A 94 -4.993 3.723 -0.895 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.277 5.570 -2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.017 6.762 -3.374 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.474 5.093 -3.652 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.815 5.495 -1.357 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.808 7.751 -1.373 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.051 7.806 -1.093 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.711 8.220 -2.693 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.799 5.955 -2.746 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.740 6.356 -4.119 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.765 4.700 -3.469 1.00 0.00 H new ATOM 1439 N ALA A 95 -3.991 7.472 -0.705 1.00 0.00 N ATOM 1440 CA ALA A 95 -4.022 8.343 0.463 1.00 0.00 C ATOM 1441 C ALA A 95 -5.008 9.488 0.267 1.00 0.00 C ATOM 1442 O ALA A 95 -5.152 10.015 -0.835 1.00 0.00 O ATOM 1443 CB ALA A 95 -2.630 8.886 0.755 1.00 0.00 C ATOM 0 H ALA A 95 -3.700 7.933 -1.567 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.356 7.753 1.317 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.669 9.535 1.630 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.949 8.057 0.948 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -2.274 9.455 -0.104 1.00 0.00 H new ATOM 1449 N PHE A 96 -5.689 9.868 1.344 1.00 0.00 N ATOM 1450 CA PHE A 96 -6.664 10.951 1.292 1.00 0.00 C ATOM 1451 C PHE A 96 -6.620 11.787 2.568 1.00 0.00 C ATOM 1452 O PHE A 96 -6.396 11.263 3.659 1.00 0.00 O ATOM 1453 CB PHE A 96 -8.071 10.388 1.085 1.00 0.00 C ATOM 1454 CG PHE A 96 -8.615 9.678 2.291 1.00 0.00 C ATOM 1455 CD1 PHE A 96 -9.288 10.379 3.279 1.00 0.00 C ATOM 1456 CD2 PHE A 96 -8.454 8.309 2.436 1.00 0.00 C ATOM 1457 CE1 PHE A 96 -9.790 9.727 4.391 1.00 0.00 C ATOM 1458 CE2 PHE A 96 -8.955 7.653 3.545 1.00 0.00 C ATOM 1459 CZ PHE A 96 -9.622 8.363 4.524 1.00 0.00 C ATOM 0 H PHE A 96 -5.583 9.441 2.264 1.00 0.00 H new ATOM 0 HA PHE A 96 -6.410 11.595 0.450 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -8.744 11.203 0.818 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -8.057 9.697 0.242 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -9.422 11.446 3.180 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -7.932 7.749 1.675 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -10.313 10.284 5.154 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -8.825 6.586 3.646 1.00 0.00 H new ATOM 0 HZ PHE A 96 -10.012 7.852 5.392 1.00 0.00 H new ATOM 1469 N THR A 97 -6.834 13.092 2.421 1.00 0.00 N ATOM 1470 CA THR A 97 -6.817 14.000 3.560 1.00 0.00 C ATOM 1471 C THR A 97 -8.138 14.750 3.683 1.00 0.00 C ATOM 1472 O THR A 97 -9.026 14.608 2.843 1.00 0.00 O ATOM 1473 CB THR A 97 -5.669 15.020 3.448 1.00 0.00 C ATOM 1474 OG1 THR A 97 -5.806 15.781 2.242 1.00 0.00 O ATOM 1475 CG2 THR A 97 -4.319 14.319 3.461 1.00 0.00 C ATOM 0 H THR A 97 -7.021 13.542 1.525 1.00 0.00 H new ATOM 0 HA THR A 97 -6.664 13.389 4.450 1.00 0.00 H new ATOM 0 HB THR A 97 -5.721 15.689 4.307 1.00 0.00 H new ATOM 0 HG1 THR A 97 -5.073 16.429 2.179 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.524 15.060 3.381 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.206 13.765 4.393 1.00 0.00 H new ATOM 0 HG23 THR A 97 -4.259 13.630 2.619 1.00 0.00 H new ATOM 1483 N SER A 98 -8.262 15.553 4.736 1.00 0.00 N ATOM 1484 CA SER A 98 -9.478 16.325 4.970 1.00 0.00 C ATOM 1485 C SER A 98 -9.809 17.196 3.762 1.00 0.00 C ATOM 1486 O SER A 98 -10.969 17.537 3.529 1.00 0.00 O ATOM 1487 CB SER A 98 -9.319 17.200 6.216 1.00 0.00 C ATOM 1488 OG SER A 98 -8.368 18.226 6.000 1.00 0.00 O ATOM 0 H SER A 98 -7.536 15.686 5.440 1.00 0.00 H new ATOM 0 HA SER A 98 -10.299 15.626 5.128 1.00 0.00 H new ATOM 0 HB2 SER A 98 -10.280 17.641 6.480 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.008 16.584 7.060 1.00 0.00 H new ATOM 0 HG SER A 98 -8.286 18.772 6.810 1.00 0.00 H new ATOM 1494 N ILE A 99 -8.782 17.552 2.998 1.00 0.00 N ATOM 1495 CA ILE A 99 -8.965 18.383 1.814 1.00 0.00 C ATOM 1496 C ILE A 99 -9.625 17.596 0.687 1.00 0.00 C ATOM 1497 O ILE A 99 -10.651 18.005 0.148 1.00 0.00 O ATOM 1498 CB ILE A 99 -7.623 18.950 1.312 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -6.951 19.776 2.410 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -7.839 19.790 0.063 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -7.770 20.969 2.853 1.00 0.00 C ATOM 0 H ILE A 99 -7.816 17.279 3.177 1.00 0.00 H new ATOM 0 HA ILE A 99 -9.614 19.209 2.105 1.00 0.00 H new ATOM 0 HB ILE A 99 -6.965 18.119 1.057 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.761 19.135 3.271 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.982 20.123 2.051 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.882 20.184 -0.280 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.279 19.172 -0.720 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.511 20.617 0.292 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.234 21.509 3.633 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -7.938 21.631 2.003 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -8.729 20.628 3.242 1.00 0.00 H new ATOM 1513 N GLY A 100 -9.029 16.459 0.337 1.00 0.00 N ATOM 1514 CA GLY A 100 -9.574 15.632 -0.723 1.00 0.00 C ATOM 1515 C GLY A 100 -8.918 14.266 -0.787 1.00 0.00 C ATOM 1516 O GLY A 100 -8.441 13.751 0.224 1.00 0.00 O ATOM 0 H GLY A 100 -8.179 16.097 0.769 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.646 15.510 -0.570 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.444 16.139 -1.679 1.00 0.00 H new ATOM 1520 N ASP A 101 -8.897 13.678 -1.978 1.00 0.00 N ATOM 1521 CA ASP A 101 -8.296 12.363 -2.169 1.00 0.00 C ATOM 1522 C ASP A 101 -7.007 12.467 -2.977 1.00 0.00 C ATOM 1523 O ASP A 101 -6.678 13.529 -3.507 1.00 0.00 O ATOM 1524 CB ASP A 101 -9.280 11.427 -2.873 1.00 0.00 C ATOM 1525 CG ASP A 101 -10.129 12.148 -3.901 1.00 0.00 C ATOM 1526 OD1 ASP A 101 -9.632 12.384 -5.022 1.00 0.00 O ATOM 1527 OD2 ASP A 101 -11.292 12.476 -3.584 1.00 0.00 O ATOM 0 H ASP A 101 -9.289 14.090 -2.825 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.056 11.954 -1.188 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -8.728 10.624 -3.361 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -9.929 10.962 -2.131 1.00 0.00 H new ATOM 1532 N GLY A 102 -6.278 11.359 -3.068 1.00 0.00 N ATOM 1533 CA GLY A 102 -5.032 11.348 -3.812 1.00 0.00 C ATOM 1534 C GLY A 102 -4.983 10.239 -4.844 1.00 0.00 C ATOM 1535 O GLY A 102 -5.869 9.386 -4.913 1.00 0.00 O ATOM 0 H GLY A 102 -6.528 10.468 -2.639 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.901 12.309 -4.309 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.199 11.232 -3.118 1.00 0.00 H new ATOM 1539 N PRO A 103 -3.929 10.243 -5.673 1.00 0.00 N ATOM 1540 CA PRO A 103 -3.743 9.236 -6.724 1.00 0.00 C ATOM 1541 C PRO A 103 -3.416 7.859 -6.155 1.00 0.00 C ATOM 1542 O PRO A 103 -2.677 7.739 -5.178 1.00 0.00 O ATOM 1543 CB PRO A 103 -2.559 9.778 -7.528 1.00 0.00 C ATOM 1544 CG PRO A 103 -1.805 10.630 -6.566 1.00 0.00 C ATOM 1545 CD PRO A 103 -2.836 11.229 -5.649 1.00 0.00 C ATOM 0 HA PRO A 103 -4.647 9.091 -7.316 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -1.937 8.969 -7.911 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -2.896 10.356 -8.388 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -1.080 10.039 -6.006 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -1.247 11.408 -7.087 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -2.444 11.370 -4.642 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -3.168 12.206 -6.001 1.00 0.00 H new ATOM 1553 N LEU A 104 -3.971 6.822 -6.774 1.00 0.00 N ATOM 1554 CA LEU A 104 -3.738 5.453 -6.331 1.00 0.00 C ATOM 1555 C LEU A 104 -2.310 5.015 -6.643 1.00 0.00 C ATOM 1556 O LEU A 104 -1.534 5.768 -7.231 1.00 0.00 O ATOM 1557 CB LEU A 104 -4.732 4.503 -7.000 1.00 0.00 C ATOM 1558 CG LEU A 104 -6.185 4.621 -6.541 1.00 0.00 C ATOM 1559 CD1 LEU A 104 -7.114 4.763 -7.738 1.00 0.00 C ATOM 1560 CD2 LEU A 104 -6.578 3.416 -5.700 1.00 0.00 C ATOM 0 H LEU A 104 -4.585 6.904 -7.584 1.00 0.00 H new ATOM 0 HA LEU A 104 -3.882 5.418 -5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.697 4.672 -8.076 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.399 3.480 -6.827 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.279 5.516 -5.925 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.144 4.846 -7.391 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.848 5.657 -8.301 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.016 3.888 -8.380 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.616 3.517 -5.382 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.467 2.507 -6.292 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.934 3.359 -4.823 1.00 0.00 H new ATOM 1572 N SER A 105 -1.972 3.793 -6.247 1.00 0.00 N ATOM 1573 CA SER A 105 -0.637 3.253 -6.484 1.00 0.00 C ATOM 1574 C SER A 105 -0.644 2.280 -7.657 1.00 0.00 C ATOM 1575 O SER A 105 -1.682 2.038 -8.271 1.00 0.00 O ATOM 1576 CB SER A 105 -0.117 2.554 -5.226 1.00 0.00 C ATOM 1577 OG SER A 105 -0.180 1.144 -5.366 1.00 0.00 O ATOM 0 H SER A 105 -2.604 3.157 -5.760 1.00 0.00 H new ATOM 0 HA SER A 105 0.026 4.083 -6.730 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.912 2.859 -5.035 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.706 2.864 -4.363 1.00 0.00 H new ATOM 0 HG SER A 105 0.159 0.719 -4.551 1.00 0.00 H new ATOM 1583 N SER A 106 0.524 1.723 -7.963 1.00 0.00 N ATOM 1584 CA SER A 106 0.655 0.778 -9.064 1.00 0.00 C ATOM 1585 C SER A 106 -0.220 -0.451 -8.833 1.00 0.00 C ATOM 1586 O SER A 106 0.017 -1.230 -7.911 1.00 0.00 O ATOM 1587 CB SER A 106 2.116 0.353 -9.230 1.00 0.00 C ATOM 1588 OG SER A 106 2.976 1.177 -8.461 1.00 0.00 O ATOM 0 H SER A 106 1.393 1.911 -7.463 1.00 0.00 H new ATOM 0 HA SER A 106 0.322 1.274 -9.976 1.00 0.00 H new ATOM 0 HB2 SER A 106 2.233 -0.687 -8.924 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.397 0.409 -10.282 1.00 0.00 H new ATOM 0 HG SER A 106 3.011 0.844 -7.540 1.00 0.00 H new ATOM 1594 N ASP A 107 -1.232 -0.616 -9.678 1.00 0.00 N ATOM 1595 CA ASP A 107 -2.144 -1.749 -9.568 1.00 0.00 C ATOM 1596 C ASP A 107 -1.371 -3.063 -9.509 1.00 0.00 C ATOM 1597 O ASP A 107 -0.717 -3.453 -10.477 1.00 0.00 O ATOM 1598 CB ASP A 107 -3.115 -1.766 -10.749 1.00 0.00 C ATOM 1599 CG ASP A 107 -2.442 -1.403 -12.058 1.00 0.00 C ATOM 1600 OD1 ASP A 107 -2.223 -0.197 -12.298 1.00 0.00 O ATOM 1601 OD2 ASP A 107 -2.133 -2.325 -12.841 1.00 0.00 O ATOM 0 H ASP A 107 -1.442 0.021 -10.447 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.712 -1.640 -8.644 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -3.560 -2.757 -10.835 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -3.929 -1.067 -10.556 1.00 0.00 H new ATOM 1606 N ILE A 108 -1.451 -3.741 -8.370 1.00 0.00 N ATOM 1607 CA ILE A 108 -0.760 -5.010 -8.185 1.00 0.00 C ATOM 1608 C ILE A 108 -1.747 -6.172 -8.140 1.00 0.00 C ATOM 1609 O ILE A 108 -2.943 -5.974 -7.928 1.00 0.00 O ATOM 1610 CB ILE A 108 0.078 -5.012 -6.893 1.00 0.00 C ATOM 1611 CG1 ILE A 108 -0.761 -4.519 -5.714 1.00 0.00 C ATOM 1612 CG2 ILE A 108 1.320 -4.151 -7.066 1.00 0.00 C ATOM 1613 CD1 ILE A 108 -0.013 -4.516 -4.399 1.00 0.00 C ATOM 0 H ILE A 108 -1.988 -3.432 -7.560 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.095 -5.134 -9.039 1.00 0.00 H new ATOM 0 HB ILE A 108 0.395 -6.034 -6.685 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.112 -3.509 -5.925 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.645 -5.150 -5.619 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.902 -4.162 -6.144 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.925 -4.545 -7.882 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.024 -3.127 -7.295 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.670 -4.155 -3.608 1.00 0.00 H new ATOM 0 HD12 ILE A 108 0.315 -5.529 -4.164 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.856 -3.862 -4.476 1.00 0.00 H new ATOM 1625 N GLN A 109 -1.237 -7.383 -8.338 1.00 0.00 N ATOM 1626 CA GLN A 109 -2.074 -8.577 -8.320 1.00 0.00 C ATOM 1627 C GLN A 109 -1.413 -9.692 -7.518 1.00 0.00 C ATOM 1628 O GLN A 109 -0.277 -10.080 -7.792 1.00 0.00 O ATOM 1629 CB GLN A 109 -2.351 -9.054 -9.746 1.00 0.00 C ATOM 1630 CG GLN A 109 -2.895 -7.964 -10.657 1.00 0.00 C ATOM 1631 CD GLN A 109 -4.344 -7.628 -10.366 1.00 0.00 C ATOM 1632 OE1 GLN A 109 -5.047 -8.388 -9.698 1.00 0.00 O ATOM 1633 NE2 GLN A 109 -4.799 -6.486 -10.865 1.00 0.00 N ATOM 0 H GLN A 109 -0.248 -7.563 -8.513 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.019 -8.320 -7.841 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -1.429 -9.447 -10.174 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -3.064 -9.878 -9.713 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -2.288 -7.066 -10.544 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -2.802 -8.283 -11.695 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -4.181 -5.887 -11.413 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -5.766 -6.207 -10.701 1.00 0.00 H new ATOM 1642 N VAL A 110 -2.131 -10.206 -6.523 1.00 0.00 N ATOM 1643 CA VAL A 110 -1.613 -11.277 -5.680 1.00 0.00 C ATOM 1644 C VAL A 110 -2.530 -12.494 -5.716 1.00 0.00 C ATOM 1645 O VAL A 110 -3.747 -12.373 -5.565 1.00 0.00 O ATOM 1646 CB VAL A 110 -1.450 -10.814 -4.220 1.00 0.00 C ATOM 1647 CG1 VAL A 110 -2.798 -10.434 -3.626 1.00 0.00 C ATOM 1648 CG2 VAL A 110 -0.778 -11.898 -3.391 1.00 0.00 C ATOM 0 H VAL A 110 -3.073 -9.898 -6.282 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.635 -11.549 -6.078 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.813 -9.930 -4.206 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.663 -10.110 -2.594 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.236 -9.622 -4.207 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.463 -11.297 -3.650 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.670 -11.555 -2.362 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.388 -12.801 -3.410 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.206 -12.116 -3.806 1.00 0.00 H new ATOM 1658 N ILE A 111 -1.940 -13.667 -5.917 1.00 0.00 N ATOM 1659 CA ILE A 111 -2.704 -14.908 -5.970 1.00 0.00 C ATOM 1660 C ILE A 111 -2.842 -15.528 -4.585 1.00 0.00 C ATOM 1661 O ILE A 111 -1.888 -15.561 -3.807 1.00 0.00 O ATOM 1662 CB ILE A 111 -2.048 -15.932 -6.916 1.00 0.00 C ATOM 1663 CG1 ILE A 111 -1.937 -15.357 -8.328 1.00 0.00 C ATOM 1664 CG2 ILE A 111 -2.844 -17.228 -6.927 1.00 0.00 C ATOM 1665 CD1 ILE A 111 -0.557 -15.497 -8.931 1.00 0.00 C ATOM 0 H ILE A 111 -0.935 -13.785 -6.046 1.00 0.00 H new ATOM 0 HA ILE A 111 -3.693 -14.654 -6.351 1.00 0.00 H new ATOM 0 HB ILE A 111 -1.043 -16.148 -6.553 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -2.659 -15.858 -8.973 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -2.209 -14.302 -8.304 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.368 -17.942 -7.600 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.876 -17.644 -5.920 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.860 -17.028 -7.269 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -0.552 -15.068 -9.933 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.167 -14.972 -8.308 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -0.290 -16.552 -8.987 1.00 0.00 H new ATOM 1677 N THR A 112 -4.039 -16.023 -4.280 1.00 0.00 N ATOM 1678 CA THR A 112 -4.304 -16.642 -2.989 1.00 0.00 C ATOM 1679 C THR A 112 -3.705 -18.043 -2.918 1.00 0.00 C ATOM 1680 O THR A 112 -4.360 -19.025 -3.263 1.00 0.00 O ATOM 1681 CB THR A 112 -5.815 -16.728 -2.706 1.00 0.00 C ATOM 1682 OG1 THR A 112 -6.517 -17.096 -3.898 1.00 0.00 O ATOM 1683 CG2 THR A 112 -6.346 -15.399 -2.189 1.00 0.00 C ATOM 0 H THR A 112 -4.840 -16.006 -4.912 1.00 0.00 H new ATOM 0 HA THR A 112 -3.836 -16.010 -2.234 1.00 0.00 H new ATOM 0 HB THR A 112 -5.976 -17.488 -1.941 1.00 0.00 H new ATOM 0 HG1 THR A 112 -7.482 -17.058 -3.734 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.415 -15.485 -1.996 1.00 0.00 H new ATOM 0 HG22 THR A 112 -5.831 -15.136 -1.265 1.00 0.00 H new ATOM 0 HG23 THR A 112 -6.173 -14.623 -2.935 1.00 0.00 H new ATOM 1691 N GLN A 113 -2.458 -18.126 -2.468 1.00 0.00 N ATOM 1692 CA GLN A 113 -1.771 -19.407 -2.352 1.00 0.00 C ATOM 1693 C GLN A 113 -0.923 -19.458 -1.086 1.00 0.00 C ATOM 1694 O GLN A 113 -0.204 -18.508 -0.769 1.00 0.00 O ATOM 1695 CB GLN A 113 -0.892 -19.651 -3.580 1.00 0.00 C ATOM 1696 CG GLN A 113 0.376 -18.813 -3.598 1.00 0.00 C ATOM 1697 CD GLN A 113 1.219 -19.054 -4.834 1.00 0.00 C ATOM 1698 OE1 GLN A 113 1.092 -20.086 -5.494 1.00 0.00 O ATOM 1699 NE2 GLN A 113 2.085 -18.101 -5.156 1.00 0.00 N ATOM 0 H GLN A 113 -1.902 -17.322 -2.178 1.00 0.00 H new ATOM 0 HA GLN A 113 -2.526 -20.191 -2.293 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -0.621 -20.706 -3.618 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -1.471 -19.438 -4.479 1.00 0.00 H new ATOM 0 HG2 GLN A 113 0.110 -17.757 -3.545 1.00 0.00 H new ATOM 0 HG3 GLN A 113 0.968 -19.037 -2.710 1.00 0.00 H new ATOM 0 HE21 GLN A 113 2.157 -17.262 -4.581 1.00 0.00 H new ATOM 0 HE22 GLN A 113 2.678 -18.208 -5.979 1.00 0.00 H new ATOM 1708 N THR A 114 -1.009 -20.571 -0.364 1.00 0.00 N ATOM 1709 CA THR A 114 -0.251 -20.745 0.867 1.00 0.00 C ATOM 1710 C THR A 114 0.755 -21.883 0.738 1.00 0.00 C ATOM 1711 O THR A 114 1.791 -21.889 1.400 1.00 0.00 O ATOM 1712 CB THR A 114 -1.178 -21.028 2.063 1.00 0.00 C ATOM 1713 OG1 THR A 114 -0.404 -21.420 3.202 1.00 0.00 O ATOM 1714 CG2 THR A 114 -2.181 -22.120 1.724 1.00 0.00 C ATOM 0 H THR A 114 -1.598 -21.366 -0.612 1.00 0.00 H new ATOM 0 HA THR A 114 0.282 -19.811 1.043 1.00 0.00 H new ATOM 0 HB THR A 114 -1.725 -20.114 2.294 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.001 -21.597 3.958 1.00 0.00 H new ATOM 0 HG21 THR A 114 -2.825 -22.302 2.584 1.00 0.00 H new ATOM 0 HG22 THR A 114 -2.789 -21.805 0.876 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.649 -23.036 1.468 1.00 0.00 H new ATOM 1722 N GLY A 115 0.441 -22.850 -0.121 1.00 0.00 N ATOM 1723 CA GLY A 115 1.328 -23.981 -0.321 1.00 0.00 C ATOM 1724 C GLY A 115 0.598 -25.308 -0.253 1.00 0.00 C ATOM 1725 O GLY A 115 -0.128 -25.577 0.702 1.00 0.00 O ATOM 0 H GLY A 115 -0.411 -22.869 -0.681 1.00 0.00 H new ATOM 0 HA2 GLY A 115 1.818 -23.888 -1.290 1.00 0.00 H new ATOM 0 HA3 GLY A 115 2.113 -23.962 0.435 1.00 0.00 H new ATOM 1729 N SER A 116 0.790 -26.139 -1.273 1.00 0.00 N ATOM 1730 CA SER A 116 0.141 -27.444 -1.328 1.00 0.00 C ATOM 1731 C SER A 116 1.164 -28.550 -1.567 1.00 0.00 C ATOM 1732 O SER A 116 2.285 -28.291 -2.003 1.00 0.00 O ATOM 1733 CB SER A 116 -0.916 -27.463 -2.434 1.00 0.00 C ATOM 1734 OG SER A 116 -2.187 -27.086 -1.931 1.00 0.00 O ATOM 0 H SER A 116 1.389 -25.932 -2.072 1.00 0.00 H new ATOM 0 HA SER A 116 -0.343 -27.623 -0.368 1.00 0.00 H new ATOM 0 HB2 SER A 116 -0.622 -26.784 -3.234 1.00 0.00 H new ATOM 0 HB3 SER A 116 -0.975 -28.461 -2.868 1.00 0.00 H new ATOM 0 HG SER A 116 -2.845 -27.104 -2.657 1.00 0.00 H new ATOM 1740 N GLY A 117 0.768 -29.786 -1.277 1.00 0.00 N ATOM 1741 CA GLY A 117 1.661 -30.914 -1.466 1.00 0.00 C ATOM 1742 C GLY A 117 2.744 -30.980 -0.407 1.00 0.00 C ATOM 1743 O GLY A 117 3.906 -30.658 -0.656 1.00 0.00 O ATOM 0 H GLY A 117 -0.155 -30.026 -0.915 1.00 0.00 H new ATOM 0 HA2 GLY A 117 1.083 -31.838 -1.448 1.00 0.00 H new ATOM 0 HA3 GLY A 117 2.124 -30.846 -2.451 1.00 0.00 H new ATOM 1747 N PRO A 118 2.364 -31.406 0.807 1.00 0.00 N ATOM 1748 CA PRO A 118 3.296 -31.521 1.932 1.00 0.00 C ATOM 1749 C PRO A 118 4.298 -32.655 1.741 1.00 0.00 C ATOM 1750 O PRO A 118 4.111 -33.524 0.889 1.00 0.00 O ATOM 1751 CB PRO A 118 2.380 -31.814 3.124 1.00 0.00 C ATOM 1752 CG PRO A 118 1.171 -32.444 2.525 1.00 0.00 C ATOM 1753 CD PRO A 118 0.996 -31.806 1.175 1.00 0.00 C ATOM 0 HA PRO A 118 3.901 -30.623 2.052 1.00 0.00 H new ATOM 0 HB2 PRO A 118 2.861 -32.481 3.839 1.00 0.00 H new ATOM 0 HB3 PRO A 118 2.126 -30.901 3.662 1.00 0.00 H new ATOM 0 HG2 PRO A 118 1.298 -33.523 2.433 1.00 0.00 H new ATOM 0 HG3 PRO A 118 0.294 -32.279 3.151 1.00 0.00 H new ATOM 0 HD2 PRO A 118 0.573 -32.504 0.452 1.00 0.00 H new ATOM 0 HD3 PRO A 118 0.325 -30.948 1.220 1.00 0.00 H new ATOM 1761 N SER A 119 5.362 -32.640 2.538 1.00 0.00 N ATOM 1762 CA SER A 119 6.396 -33.665 2.453 1.00 0.00 C ATOM 1763 C SER A 119 5.959 -34.937 3.173 1.00 0.00 C ATOM 1764 O SER A 119 6.231 -36.047 2.715 1.00 0.00 O ATOM 1765 CB SER A 119 7.706 -33.150 3.054 1.00 0.00 C ATOM 1766 OG SER A 119 8.171 -32.008 2.356 1.00 0.00 O ATOM 0 H SER A 119 5.530 -31.929 3.250 1.00 0.00 H new ATOM 0 HA SER A 119 6.555 -33.899 1.400 1.00 0.00 H new ATOM 0 HB2 SER A 119 7.555 -32.902 4.105 1.00 0.00 H new ATOM 0 HB3 SER A 119 8.461 -33.936 3.017 1.00 0.00 H new ATOM 0 HG SER A 119 9.008 -31.696 2.759 1.00 0.00 H new ATOM 1772 N SER A 120 5.281 -34.768 4.303 1.00 0.00 N ATOM 1773 CA SER A 120 4.808 -35.901 5.089 1.00 0.00 C ATOM 1774 C SER A 120 3.284 -35.967 5.086 1.00 0.00 C ATOM 1775 O SER A 120 2.698 -37.046 5.011 1.00 0.00 O ATOM 1776 CB SER A 120 5.323 -35.802 6.527 1.00 0.00 C ATOM 1777 OG SER A 120 6.739 -35.773 6.559 1.00 0.00 O ATOM 0 H SER A 120 5.047 -33.856 4.695 1.00 0.00 H new ATOM 0 HA SER A 120 5.194 -36.813 4.634 1.00 0.00 H new ATOM 0 HB2 SER A 120 4.927 -34.902 6.998 1.00 0.00 H new ATOM 0 HB3 SER A 120 4.960 -36.651 7.106 1.00 0.00 H new ATOM 0 HG SER A 120 7.044 -35.708 7.488 1.00 0.00 H new ATOM 1783 N GLY A 121 2.647 -34.803 5.170 1.00 0.00 N ATOM 1784 CA GLY A 121 1.197 -34.749 5.176 1.00 0.00 C ATOM 1785 C GLY A 121 0.601 -35.338 6.439 1.00 0.00 C ATOM 1786 O GLY A 121 0.769 -34.789 7.528 1.00 0.00 O ATOM 0 H GLY A 121 3.110 -33.896 5.234 1.00 0.00 H new ATOM 0 HA2 GLY A 121 0.875 -33.713 5.075 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.813 -35.289 4.310 1.00 0.00 H new TER 1790 GLY A 121