USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 794 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 Single : A 1 GLY N :NH3+ 142:sc= 0.0616 (180deg=0) USER MOD Single : A 2 SER OG : rot 40:sc= 0.494 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 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.0124 USER MOD Single : A 12 ASN :FLIP amide:sc= -0.621 F(o=-3.7!,f=-0.62) USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.949 USER MOD Single : A 18 GLN :FLIP amide:sc= -0.779 F(o=-2.9,f=-0.78) USER MOD Single : A 20 SER OG : rot -34:sc= 1.13 USER MOD Single : A 23 GLN :FLIP amide:sc= -4.17! C(o=-4.8!,f=-4.2!) USER MOD Single : A 25 SER OG : rot 180:sc= -0.674 USER MOD Single : A 36 THR OG1 : rot -29:sc= 0.571 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -63:sc= -0.613! USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot 20:sc= 0.116 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= -0.256 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.849 USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS : no HD1:sc= -0.0371 X(o=-0.037,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.00769) USER MOD Single : A 96 HIS : no HD1:sc= -0.0624 X(o=-0.062,f=-0.25) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.383 29.144 7.419 1.00 0.00 N ATOM 2 CA GLY A 1 -17.059 29.701 7.207 1.00 0.00 C ATOM 3 C GLY A 1 -16.128 29.443 8.375 1.00 0.00 C ATOM 4 O GLY A 1 -16.577 29.152 9.483 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.098 29.793 7.034 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.454 28.225 6.937 1.00 0.00 H new ATOM 0 H3 GLY A 1 -18.546 29.014 8.438 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.629 29.273 6.302 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.142 30.775 7.043 1.00 0.00 H new ATOM 8 N SER A 2 -14.826 29.547 8.126 1.00 0.00 N ATOM 9 CA SER A 2 -13.829 29.316 9.164 1.00 0.00 C ATOM 10 C SER A 2 -12.480 29.908 8.763 1.00 0.00 C ATOM 11 O SER A 2 -11.923 30.747 9.469 1.00 0.00 O ATOM 12 CB SER A 2 -13.681 27.819 9.436 1.00 0.00 C ATOM 13 OG SER A 2 -14.503 27.413 10.517 1.00 0.00 O ATOM 0 H SER A 2 -14.438 29.790 7.215 1.00 0.00 H new ATOM 0 HA SER A 2 -14.168 29.811 10.074 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.947 27.256 8.541 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.640 27.588 9.660 1.00 0.00 H new ATOM 0 HG SER A 2 -15.369 27.868 10.458 1.00 0.00 H new ATOM 19 N SER A 3 -11.962 29.463 7.622 1.00 0.00 N ATOM 20 CA SER A 3 -10.678 29.943 7.128 1.00 0.00 C ATOM 21 C SER A 3 -9.594 29.787 8.189 1.00 0.00 C ATOM 22 O SER A 3 -9.871 29.405 9.325 1.00 0.00 O ATOM 23 CB SER A 3 -10.787 31.409 6.705 1.00 0.00 C ATOM 24 OG SER A 3 -10.229 31.612 5.418 1.00 0.00 O ATOM 0 H SER A 3 -12.412 28.771 7.023 1.00 0.00 H new ATOM 0 HA SER A 3 -10.402 29.342 6.262 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.834 31.713 6.703 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.273 32.039 7.431 1.00 0.00 H new ATOM 0 HG SER A 3 -10.313 32.556 5.170 1.00 0.00 H new ATOM 30 N GLY A 4 -8.355 30.086 7.809 1.00 0.00 N ATOM 31 CA GLY A 4 -7.246 29.973 8.739 1.00 0.00 C ATOM 32 C GLY A 4 -5.901 30.004 8.044 1.00 0.00 C ATOM 33 O GLY A 4 -5.827 30.184 6.828 1.00 0.00 O ATOM 0 H GLY A 4 -8.100 30.404 6.874 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.297 30.788 9.461 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.340 29.043 9.300 1.00 0.00 H new ATOM 37 N SER A 5 -4.832 29.830 8.816 1.00 0.00 N ATOM 38 CA SER A 5 -3.482 29.845 8.266 1.00 0.00 C ATOM 39 C SER A 5 -2.765 28.528 8.551 1.00 0.00 C ATOM 40 O SER A 5 -2.503 28.188 9.704 1.00 0.00 O ATOM 41 CB SER A 5 -2.682 31.010 8.854 1.00 0.00 C ATOM 42 OG SER A 5 -3.062 32.240 8.260 1.00 0.00 O ATOM 0 H SER A 5 -4.875 29.677 9.824 1.00 0.00 H new ATOM 0 HA SER A 5 -3.558 29.973 7.186 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.841 31.058 9.931 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.617 30.840 8.697 1.00 0.00 H new ATOM 0 HG SER A 5 -2.538 32.969 8.653 1.00 0.00 H new ATOM 48 N SER A 6 -2.452 27.791 7.490 1.00 0.00 N ATOM 49 CA SER A 6 -1.770 26.511 7.623 1.00 0.00 C ATOM 50 C SER A 6 -0.271 26.711 7.827 1.00 0.00 C ATOM 51 O SER A 6 0.221 27.838 7.829 1.00 0.00 O ATOM 52 CB SER A 6 -2.016 25.646 6.385 1.00 0.00 C ATOM 53 OG SER A 6 -2.376 24.324 6.749 1.00 0.00 O ATOM 0 H SER A 6 -2.661 28.060 6.528 1.00 0.00 H new ATOM 0 HA SER A 6 -2.174 26.003 8.499 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.808 26.088 5.780 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.118 25.625 5.768 1.00 0.00 H new ATOM 0 HG SER A 6 -2.529 23.792 5.940 1.00 0.00 H new ATOM 59 N GLY A 7 0.450 25.607 7.998 1.00 0.00 N ATOM 60 CA GLY A 7 1.885 25.683 8.201 1.00 0.00 C ATOM 61 C GLY A 7 2.513 24.318 8.405 1.00 0.00 C ATOM 62 O GLY A 7 2.670 23.863 9.539 1.00 0.00 O ATOM 0 H GLY A 7 0.066 24.662 8.000 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.346 26.167 7.340 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.094 26.309 9.068 1.00 0.00 H new ATOM 66 N ILE A 8 2.875 23.664 7.307 1.00 0.00 N ATOM 67 CA ILE A 8 3.489 22.344 7.371 1.00 0.00 C ATOM 68 C ILE A 8 4.815 22.319 6.619 1.00 0.00 C ATOM 69 O ILE A 8 4.951 22.927 5.557 1.00 0.00 O ATOM 70 CB ILE A 8 2.561 21.262 6.790 1.00 0.00 C ATOM 71 CG1 ILE A 8 1.737 21.833 5.634 1.00 0.00 C ATOM 72 CG2 ILE A 8 1.648 20.708 7.874 1.00 0.00 C ATOM 73 CD1 ILE A 8 1.193 20.775 4.699 1.00 0.00 C ATOM 0 H ILE A 8 2.754 24.027 6.362 1.00 0.00 H new ATOM 0 HA ILE A 8 3.667 22.129 8.425 1.00 0.00 H new ATOM 0 HB ILE A 8 3.175 20.446 6.407 1.00 0.00 H new ATOM 0 HG12 ILE A 8 0.906 22.409 6.041 1.00 0.00 H new ATOM 0 HG13 ILE A 8 2.356 22.526 5.064 1.00 0.00 H new ATOM 0 HG21 ILE A 8 0.998 19.944 7.447 1.00 0.00 H new ATOM 0 HG22 ILE A 8 2.251 20.269 8.668 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.040 21.514 8.284 1.00 0.00 H new ATOM 0 HD11 ILE A 8 0.620 21.252 3.904 1.00 0.00 H new ATOM 0 HD12 ILE A 8 2.020 20.214 4.264 1.00 0.00 H new ATOM 0 HD13 ILE A 8 0.547 20.096 5.255 1.00 0.00 H new ATOM 85 N LEU A 9 5.790 21.608 7.175 1.00 0.00 N ATOM 86 CA LEU A 9 7.107 21.501 6.555 1.00 0.00 C ATOM 87 C LEU A 9 7.635 22.875 6.156 1.00 0.00 C ATOM 88 O LEU A 9 6.979 23.893 6.377 1.00 0.00 O ATOM 89 CB LEU A 9 7.043 20.589 5.328 1.00 0.00 C ATOM 90 CG LEU A 9 6.382 21.185 4.084 1.00 0.00 C ATOM 91 CD1 LEU A 9 7.086 20.703 2.825 1.00 0.00 C ATOM 92 CD2 LEU A 9 4.904 20.827 4.042 1.00 0.00 C ATOM 0 H LEU A 9 5.694 21.098 8.053 1.00 0.00 H new ATOM 0 HA LEU A 9 7.791 21.068 7.285 1.00 0.00 H new ATOM 0 HB2 LEU A 9 8.059 20.291 5.068 1.00 0.00 H new ATOM 0 HB3 LEU A 9 6.505 19.682 5.602 1.00 0.00 H new ATOM 0 HG LEU A 9 6.470 22.270 4.133 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.603 21.137 1.949 1.00 0.00 H new ATOM 0 HD12 LEU A 9 8.131 21.011 2.852 1.00 0.00 H new ATOM 0 HD13 LEU A 9 7.029 19.616 2.770 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.450 21.259 3.150 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.793 19.743 4.017 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.409 21.222 4.929 1.00 0.00 H new ATOM 104 N THR A 10 8.825 22.896 5.563 1.00 0.00 N ATOM 105 CA THR A 10 9.440 24.145 5.131 1.00 0.00 C ATOM 106 C THR A 10 9.379 24.292 3.614 1.00 0.00 C ATOM 107 O THR A 10 9.333 25.404 3.091 1.00 0.00 O ATOM 108 CB THR A 10 10.910 24.233 5.584 1.00 0.00 C ATOM 109 OG1 THR A 10 11.491 22.925 5.621 1.00 0.00 O ATOM 110 CG2 THR A 10 11.014 24.878 6.958 1.00 0.00 C ATOM 0 H THR A 10 9.381 22.063 5.371 1.00 0.00 H new ATOM 0 HA THR A 10 8.875 24.953 5.595 1.00 0.00 H new ATOM 0 HB THR A 10 11.452 24.850 4.867 1.00 0.00 H new ATOM 0 HG1 THR A 10 12.426 22.990 5.908 1.00 0.00 H new ATOM 0 HG21 THR A 10 12.061 24.930 7.257 1.00 0.00 H new ATOM 0 HG22 THR A 10 10.597 25.885 6.920 1.00 0.00 H new ATOM 0 HG23 THR A 10 10.458 24.283 7.682 1.00 0.00 H new ATOM 118 N GLU A 11 9.378 23.161 2.915 1.00 0.00 N ATOM 119 CA GLU A 11 9.323 23.167 1.457 1.00 0.00 C ATOM 120 C GLU A 11 9.342 21.742 0.907 1.00 0.00 C ATOM 121 O GLU A 11 8.787 21.469 -0.155 1.00 0.00 O ATOM 122 CB GLU A 11 10.495 23.963 0.882 1.00 0.00 C ATOM 123 CG GLU A 11 11.657 24.120 1.850 1.00 0.00 C ATOM 124 CD GLU A 11 12.946 24.510 1.154 1.00 0.00 C ATOM 125 OE1 GLU A 11 13.033 24.335 -0.080 1.00 0.00 O ATOM 126 OE2 GLU A 11 13.870 24.993 1.844 1.00 0.00 O ATOM 0 H GLU A 11 9.415 22.231 3.333 1.00 0.00 H new ATOM 0 HA GLU A 11 8.390 23.643 1.156 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.850 23.469 -0.022 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.142 24.951 0.587 1.00 0.00 H new ATOM 0 HG2 GLU A 11 11.406 24.877 2.593 1.00 0.00 H new ATOM 0 HG3 GLU A 11 11.807 23.183 2.387 1.00 0.00 H new ATOM 133 N ASN A 12 9.988 20.841 1.639 1.00 0.00 N ATOM 134 CA ASN A 12 10.082 19.445 1.225 1.00 0.00 C ATOM 135 C ASN A 12 10.611 18.575 2.361 1.00 0.00 C ATOM 136 O ASN A 12 11.176 17.506 2.128 1.00 0.00 O ATOM 137 CB ASN A 12 10.991 19.315 0.002 1.00 0.00 C ATOM 138 CG ASN A 12 12.214 20.209 0.091 1.00 0.00 C ATOM 139 OD1 ASN A 12 12.578 20.591 1.310 1.00 0.00 O flip ATOM 140 ND2 ASN A 12 12.822 20.551 -0.923 1.00 0.00 N flip ATOM 0 H ASN A 12 10.454 21.052 2.521 1.00 0.00 H new ATOM 0 HA ASN A 12 9.081 19.101 0.964 1.00 0.00 H new ATOM 0 HB2 ASN A 12 11.310 18.278 -0.102 1.00 0.00 H new ATOM 0 HB3 ASN A 12 10.426 19.566 -0.896 1.00 0.00 H new ATOM 0 HD21 ASN A 12 12.506 20.233 -1.839 1.00 0.00 H new ATOM 0 HD22 ASN A 12 13.642 21.153 -0.847 1.00 0.00 H new ATOM 147 N THR A 13 10.424 19.040 3.592 1.00 0.00 N ATOM 148 CA THR A 13 10.882 18.306 4.765 1.00 0.00 C ATOM 149 C THR A 13 10.464 16.841 4.694 1.00 0.00 C ATOM 150 O THR A 13 9.366 16.505 4.251 1.00 0.00 O ATOM 151 CB THR A 13 10.333 18.923 6.065 1.00 0.00 C ATOM 152 OG1 THR A 13 11.231 18.662 7.149 1.00 0.00 O ATOM 153 CG2 THR A 13 8.958 18.359 6.392 1.00 0.00 C ATOM 0 H THR A 13 9.958 19.923 3.803 1.00 0.00 H new ATOM 0 HA THR A 13 11.970 18.371 4.773 1.00 0.00 H new ATOM 0 HB THR A 13 10.243 20.000 5.920 1.00 0.00 H new ATOM 0 HG1 THR A 13 10.875 19.059 7.971 1.00 0.00 H new ATOM 0 HG21 THR A 13 8.590 18.809 7.314 1.00 0.00 H new ATOM 0 HG22 THR A 13 8.269 18.585 5.578 1.00 0.00 H new ATOM 0 HG23 THR A 13 9.029 17.279 6.519 1.00 0.00 H new ATOM 161 N PRO A 14 11.359 15.947 5.142 1.00 0.00 N ATOM 162 CA PRO A 14 11.103 14.504 5.141 1.00 0.00 C ATOM 163 C PRO A 14 10.045 14.102 6.161 1.00 0.00 C ATOM 164 O PRO A 14 9.756 14.847 7.097 1.00 0.00 O ATOM 165 CB PRO A 14 12.462 13.904 5.514 1.00 0.00 C ATOM 166 CG PRO A 14 13.152 14.978 6.280 1.00 0.00 C ATOM 167 CD PRO A 14 12.688 16.278 5.683 1.00 0.00 C ATOM 0 HA PRO A 14 10.717 14.159 4.182 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.345 13.002 6.115 1.00 0.00 H new ATOM 0 HB3 PRO A 14 13.029 13.624 4.626 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.901 14.924 7.339 1.00 0.00 H new ATOM 0 HG3 PRO A 14 14.235 14.878 6.203 1.00 0.00 H new ATOM 0 HD2 PRO A 14 12.632 17.068 6.432 1.00 0.00 H new ATOM 0 HD3 PRO A 14 13.365 16.627 4.903 1.00 0.00 H new ATOM 175 N VAL A 15 9.468 12.918 5.975 1.00 0.00 N ATOM 176 CA VAL A 15 8.442 12.417 6.880 1.00 0.00 C ATOM 177 C VAL A 15 8.516 10.899 7.008 1.00 0.00 C ATOM 178 O VAL A 15 8.994 10.212 6.105 1.00 0.00 O ATOM 179 CB VAL A 15 7.031 12.812 6.404 1.00 0.00 C ATOM 180 CG1 VAL A 15 6.058 12.826 7.573 1.00 0.00 C ATOM 181 CG2 VAL A 15 7.063 14.165 5.710 1.00 0.00 C ATOM 0 H VAL A 15 9.695 12.289 5.205 1.00 0.00 H new ATOM 0 HA VAL A 15 8.630 12.871 7.853 1.00 0.00 H new ATOM 0 HB VAL A 15 6.687 12.068 5.685 1.00 0.00 H new ATOM 0 HG11 VAL A 15 5.067 13.107 7.218 1.00 0.00 H new ATOM 0 HG12 VAL A 15 6.015 11.834 8.022 1.00 0.00 H new ATOM 0 HG13 VAL A 15 6.395 13.547 8.318 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.058 14.429 5.380 1.00 0.00 H new ATOM 0 HG22 VAL A 15 7.427 14.922 6.405 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.727 14.116 4.847 1.00 0.00 H new ATOM 191 N PHE A 16 8.041 10.383 8.137 1.00 0.00 N ATOM 192 CA PHE A 16 8.054 8.945 8.384 1.00 0.00 C ATOM 193 C PHE A 16 6.704 8.472 8.915 1.00 0.00 C ATOM 194 O PHE A 16 6.194 9.003 9.902 1.00 0.00 O ATOM 195 CB PHE A 16 9.160 8.587 9.378 1.00 0.00 C ATOM 196 CG PHE A 16 9.762 7.231 9.143 1.00 0.00 C ATOM 197 CD1 PHE A 16 10.733 7.048 8.173 1.00 0.00 C ATOM 198 CD2 PHE A 16 9.356 6.139 9.893 1.00 0.00 C ATOM 199 CE1 PHE A 16 11.288 5.802 7.954 1.00 0.00 C ATOM 200 CE2 PHE A 16 9.908 4.890 9.680 1.00 0.00 C ATOM 201 CZ PHE A 16 10.875 4.721 8.709 1.00 0.00 C ATOM 0 H PHE A 16 7.643 10.938 8.895 1.00 0.00 H new ATOM 0 HA PHE A 16 8.249 8.441 7.438 1.00 0.00 H new ATOM 0 HB2 PHE A 16 9.946 9.340 9.321 1.00 0.00 H new ATOM 0 HB3 PHE A 16 8.755 8.626 10.389 1.00 0.00 H new ATOM 0 HD1 PHE A 16 11.060 7.889 7.580 1.00 0.00 H new ATOM 0 HD2 PHE A 16 8.599 6.265 10.653 1.00 0.00 H new ATOM 0 HE1 PHE A 16 12.044 5.673 7.193 1.00 0.00 H new ATOM 0 HE2 PHE A 16 9.583 4.047 10.272 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.308 3.746 8.540 1.00 0.00 H new ATOM 211 N GLU A 17 6.131 7.472 8.253 1.00 0.00 N ATOM 212 CA GLU A 17 4.840 6.929 8.658 1.00 0.00 C ATOM 213 C GLU A 17 4.819 5.410 8.517 1.00 0.00 C ATOM 214 O GLU A 17 5.506 4.848 7.664 1.00 0.00 O ATOM 215 CB GLU A 17 3.717 7.545 7.822 1.00 0.00 C ATOM 216 CG GLU A 17 2.470 7.875 8.624 1.00 0.00 C ATOM 217 CD GLU A 17 2.691 9.006 9.610 1.00 0.00 C ATOM 218 OE1 GLU A 17 3.053 10.116 9.165 1.00 0.00 O ATOM 219 OE2 GLU A 17 2.503 8.783 10.823 1.00 0.00 O ATOM 0 H GLU A 17 6.540 7.022 7.434 1.00 0.00 H new ATOM 0 HA GLU A 17 4.683 7.181 9.707 1.00 0.00 H new ATOM 0 HB2 GLU A 17 4.086 8.455 7.349 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.451 6.855 7.021 1.00 0.00 H new ATOM 0 HG2 GLU A 17 1.665 8.146 7.941 1.00 0.00 H new ATOM 0 HG3 GLU A 17 2.144 6.986 9.164 1.00 0.00 H new ATOM 226 N GLN A 18 4.028 4.754 9.358 1.00 0.00 N ATOM 227 CA GLN A 18 3.919 3.300 9.327 1.00 0.00 C ATOM 228 C GLN A 18 2.489 2.867 9.018 1.00 0.00 C ATOM 229 O GLN A 18 1.529 3.523 9.426 1.00 0.00 O ATOM 230 CB GLN A 18 4.367 2.705 10.663 1.00 0.00 C ATOM 231 CG GLN A 18 5.793 2.177 10.646 1.00 0.00 C ATOM 232 CD GLN A 18 6.000 1.026 11.611 1.00 0.00 C ATOM 233 OE1 GLN A 18 6.694 -0.011 11.155 1.00 0.00 O flip ATOM 234 NE2 GLN A 18 5.543 1.068 12.753 1.00 0.00 N flip ATOM 0 H GLN A 18 3.453 5.205 10.069 1.00 0.00 H new ATOM 0 HA GLN A 18 4.570 2.929 8.536 1.00 0.00 H new ATOM 0 HB2 GLN A 18 4.279 3.466 11.438 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.691 1.894 10.935 1.00 0.00 H new ATOM 0 HG2 GLN A 18 6.043 1.850 9.637 1.00 0.00 H new ATOM 0 HG3 GLN A 18 6.479 2.986 10.898 1.00 0.00 H new ATOM 0 HE21 GLN A 18 5.016 1.885 13.062 1.00 0.00 H new ATOM 0 HE22 GLN A 18 5.692 0.286 13.391 1.00 0.00 H new ATOM 243 N LEU A 19 2.354 1.760 8.297 1.00 0.00 N ATOM 244 CA LEU A 19 1.040 1.240 7.932 1.00 0.00 C ATOM 245 C LEU A 19 1.004 -0.280 8.056 1.00 0.00 C ATOM 246 O LEU A 19 1.736 -0.987 7.364 1.00 0.00 O ATOM 247 CB LEU A 19 0.683 1.655 6.504 1.00 0.00 C ATOM 248 CG LEU A 19 -0.423 2.702 6.367 1.00 0.00 C ATOM 249 CD1 LEU A 19 -0.045 3.978 7.103 1.00 0.00 C ATOM 250 CD2 LEU A 19 -0.702 2.993 4.899 1.00 0.00 C ATOM 0 H LEU A 19 3.138 1.205 7.953 1.00 0.00 H new ATOM 0 HA LEU A 19 0.306 1.661 8.619 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.582 2.040 6.023 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.383 0.764 5.952 1.00 0.00 H new ATOM 0 HG LEU A 19 -1.332 2.304 6.817 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -0.844 4.711 6.994 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.104 3.758 8.160 1.00 0.00 H new ATOM 0 HD13 LEU A 19 0.877 4.381 6.683 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.492 3.740 4.820 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.204 3.371 4.424 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.018 2.077 4.400 1.00 0.00 H new ATOM 262 N SER A 20 0.146 -0.776 8.942 1.00 0.00 N ATOM 263 CA SER A 20 0.014 -2.212 9.157 1.00 0.00 C ATOM 264 C SER A 20 -1.028 -2.810 8.218 1.00 0.00 C ATOM 265 O SER A 20 -2.212 -2.483 8.297 1.00 0.00 O ATOM 266 CB SER A 20 -0.370 -2.498 10.610 1.00 0.00 C ATOM 267 OG SER A 20 -1.751 -2.794 10.724 1.00 0.00 O ATOM 0 H SER A 20 -0.468 -0.204 9.522 1.00 0.00 H new ATOM 0 HA SER A 20 0.977 -2.675 8.944 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.217 -3.336 10.986 1.00 0.00 H new ATOM 0 HB3 SER A 20 -0.128 -1.635 11.230 1.00 0.00 H new ATOM 0 HG SER A 20 -2.254 -2.265 10.070 1.00 0.00 H new ATOM 273 N VAL A 21 -0.578 -3.687 7.326 1.00 0.00 N ATOM 274 CA VAL A 21 -1.471 -4.332 6.370 1.00 0.00 C ATOM 275 C VAL A 21 -1.497 -5.842 6.576 1.00 0.00 C ATOM 276 O VAL A 21 -0.530 -6.448 7.037 1.00 0.00 O ATOM 277 CB VAL A 21 -1.052 -4.030 4.919 1.00 0.00 C ATOM 278 CG1 VAL A 21 -0.740 -2.550 4.750 1.00 0.00 C ATOM 279 CG2 VAL A 21 0.143 -4.883 4.520 1.00 0.00 C ATOM 0 H VAL A 21 0.399 -3.967 7.245 1.00 0.00 H new ATOM 0 HA VAL A 21 -2.468 -3.927 6.544 1.00 0.00 H new ATOM 0 HB VAL A 21 -1.884 -4.280 4.260 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.446 -2.356 3.719 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.625 -1.962 4.992 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.075 -2.271 5.418 1.00 0.00 H new ATOM 0 HG21 VAL A 21 0.425 -4.656 3.492 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.981 -4.667 5.182 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -0.120 -5.938 4.600 1.00 0.00 H new ATOM 289 N PRO A 22 -2.631 -6.467 6.226 1.00 0.00 N ATOM 290 CA PRO A 22 -2.811 -7.915 6.362 1.00 0.00 C ATOM 291 C PRO A 22 -1.958 -8.701 5.373 1.00 0.00 C ATOM 292 O PRO A 22 -1.588 -8.191 4.316 1.00 0.00 O ATOM 293 CB PRO A 22 -4.299 -8.117 6.063 1.00 0.00 C ATOM 294 CG PRO A 22 -4.674 -6.958 5.205 1.00 0.00 C ATOM 295 CD PRO A 22 -3.825 -5.808 5.670 1.00 0.00 C ATOM 0 HA PRO A 22 -2.507 -8.273 7.346 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -4.475 -9.063 5.550 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -4.888 -8.138 6.980 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -4.493 -7.177 4.153 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -5.734 -6.726 5.304 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -3.569 -5.140 4.848 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -4.339 -5.207 6.421 1.00 0.00 H new ATOM 303 N GLN A 23 -1.649 -9.945 5.723 1.00 0.00 N ATOM 304 CA GLN A 23 -0.839 -10.801 4.865 1.00 0.00 C ATOM 305 C GLN A 23 -1.624 -11.234 3.630 1.00 0.00 C ATOM 306 O GLN A 23 -1.055 -11.767 2.677 1.00 0.00 O ATOM 307 CB GLN A 23 -0.363 -12.032 5.638 1.00 0.00 C ATOM 308 CG GLN A 23 -1.445 -13.081 5.838 1.00 0.00 C ATOM 309 CD GLN A 23 -0.953 -14.285 6.617 1.00 0.00 C ATOM 310 OE1 GLN A 23 0.199 -14.815 6.224 1.00 0.00 O flip ATOM 311 NE2 GLN A 23 -1.601 -14.735 7.562 1.00 0.00 N flip ATOM 0 H GLN A 23 -1.947 -10.383 6.595 1.00 0.00 H new ATOM 0 HA GLN A 23 0.029 -10.228 4.539 1.00 0.00 H new ATOM 0 HB2 GLN A 23 0.475 -12.483 5.106 1.00 0.00 H new ATOM 0 HB3 GLN A 23 0.010 -11.717 6.612 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -2.288 -12.632 6.364 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -1.813 -13.408 4.866 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -2.482 -14.297 7.831 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -1.257 -15.546 8.076 1.00 0.00 H new ATOM 320 N ARG A 24 -2.931 -11.003 3.656 1.00 0.00 N ATOM 321 CA ARG A 24 -3.795 -11.370 2.540 1.00 0.00 C ATOM 322 C ARG A 24 -3.830 -10.262 1.492 1.00 0.00 C ATOM 323 O ARG A 24 -4.136 -10.507 0.326 1.00 0.00 O ATOM 324 CB ARG A 24 -5.212 -11.662 3.038 1.00 0.00 C ATOM 325 CG ARG A 24 -6.002 -10.413 3.390 1.00 0.00 C ATOM 326 CD ARG A 24 -6.918 -10.652 4.581 1.00 0.00 C ATOM 327 NE ARG A 24 -8.328 -10.627 4.201 1.00 0.00 N ATOM 328 CZ ARG A 24 -8.954 -11.652 3.633 1.00 0.00 C ATOM 329 NH1 ARG A 24 -8.298 -12.777 3.382 1.00 0.00 N ATOM 330 NH2 ARG A 24 -10.239 -11.553 3.316 1.00 0.00 N ATOM 0 H ARG A 24 -3.416 -10.563 4.438 1.00 0.00 H new ATOM 0 HA ARG A 24 -3.388 -12.270 2.079 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.750 -12.218 2.271 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -5.154 -12.305 3.916 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -5.315 -9.598 3.616 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.595 -10.101 2.530 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -6.681 -11.615 5.033 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -6.733 -9.891 5.339 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.861 -9.776 4.382 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -7.311 -12.857 3.625 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -8.781 -13.562 2.946 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -10.747 -10.690 3.508 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.719 -12.340 2.880 1.00 0.00 H new ATOM 344 N SER A 25 -3.515 -9.043 1.917 1.00 0.00 N ATOM 345 CA SER A 25 -3.515 -7.895 1.017 1.00 0.00 C ATOM 346 C SER A 25 -2.090 -7.447 0.708 1.00 0.00 C ATOM 347 O SER A 25 -1.864 -6.627 -0.181 1.00 0.00 O ATOM 348 CB SER A 25 -4.304 -6.739 1.632 1.00 0.00 C ATOM 349 OG SER A 25 -5.543 -7.185 2.153 1.00 0.00 O ATOM 0 H SER A 25 -3.256 -8.824 2.879 1.00 0.00 H new ATOM 0 HA SER A 25 -3.992 -8.195 0.084 1.00 0.00 H new ATOM 0 HB2 SER A 25 -3.718 -6.277 2.426 1.00 0.00 H new ATOM 0 HB3 SER A 25 -4.479 -5.972 0.877 1.00 0.00 H new ATOM 0 HG SER A 25 -6.027 -6.426 2.542 1.00 0.00 H new ATOM 355 N VAL A 26 -1.131 -7.993 1.450 1.00 0.00 N ATOM 356 CA VAL A 26 0.273 -7.651 1.256 1.00 0.00 C ATOM 357 C VAL A 26 0.791 -8.189 -0.073 1.00 0.00 C ATOM 358 O VAL A 26 1.791 -7.706 -0.603 1.00 0.00 O ATOM 359 CB VAL A 26 1.148 -8.205 2.397 1.00 0.00 C ATOM 360 CG1 VAL A 26 1.334 -9.706 2.247 1.00 0.00 C ATOM 361 CG2 VAL A 26 2.492 -7.492 2.429 1.00 0.00 C ATOM 0 H VAL A 26 -1.301 -8.674 2.190 1.00 0.00 H new ATOM 0 HA VAL A 26 0.337 -6.563 1.254 1.00 0.00 H new ATOM 0 HB VAL A 26 0.641 -8.020 3.344 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.955 -10.079 3.062 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.362 -10.198 2.277 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.819 -9.919 1.295 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.098 -7.895 3.240 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.007 -7.644 1.481 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.334 -6.425 2.589 1.00 0.00 H new ATOM 371 N GLY A 27 0.101 -9.192 -0.609 1.00 0.00 N ATOM 372 CA GLY A 27 0.506 -9.778 -1.873 1.00 0.00 C ATOM 373 C GLY A 27 0.089 -8.936 -3.063 1.00 0.00 C ATOM 374 O GLY A 27 0.707 -9.002 -4.125 1.00 0.00 O ATOM 0 H GLY A 27 -0.731 -9.609 -0.190 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.589 -9.903 -1.882 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.070 -10.773 -1.965 1.00 0.00 H new ATOM 378 N ARG A 28 -0.963 -8.144 -2.886 1.00 0.00 N ATOM 379 CA ARG A 28 -1.464 -7.288 -3.955 1.00 0.00 C ATOM 380 C ARG A 28 -0.827 -5.903 -3.887 1.00 0.00 C ATOM 381 O ARG A 28 -0.799 -5.172 -4.876 1.00 0.00 O ATOM 382 CB ARG A 28 -2.986 -7.166 -3.869 1.00 0.00 C ATOM 383 CG ARG A 28 -3.623 -6.595 -5.125 1.00 0.00 C ATOM 384 CD ARG A 28 -4.204 -7.692 -6.004 1.00 0.00 C ATOM 385 NE ARG A 28 -3.190 -8.300 -6.862 1.00 0.00 N ATOM 386 CZ ARG A 28 -3.473 -8.965 -7.977 1.00 0.00 C ATOM 387 NH1 ARG A 28 -4.733 -9.104 -8.367 1.00 0.00 N ATOM 388 NH2 ARG A 28 -2.495 -9.489 -8.704 1.00 0.00 N ATOM 0 H ARG A 28 -1.485 -8.077 -2.012 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.196 -7.745 -4.908 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.410 -8.150 -3.672 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -3.244 -6.532 -3.021 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -4.410 -5.894 -4.848 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.879 -6.032 -5.688 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -4.655 -8.460 -5.375 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -5.001 -7.278 -6.622 1.00 0.00 H new ATOM 0 HE ARG A 28 -2.211 -8.209 -6.590 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -5.487 -8.700 -7.811 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -4.948 -9.615 -9.223 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.525 -9.382 -8.407 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.713 -9.999 -9.560 1.00 0.00 H new ATOM 402 N ILE A 29 -0.317 -5.551 -2.711 1.00 0.00 N ATOM 403 CA ILE A 29 0.320 -4.254 -2.513 1.00 0.00 C ATOM 404 C ILE A 29 1.798 -4.306 -2.883 1.00 0.00 C ATOM 405 O ILE A 29 2.325 -3.385 -3.508 1.00 0.00 O ATOM 406 CB ILE A 29 0.183 -3.776 -1.056 1.00 0.00 C ATOM 407 CG1 ILE A 29 -1.287 -3.773 -0.633 1.00 0.00 C ATOM 408 CG2 ILE A 29 0.789 -2.390 -0.894 1.00 0.00 C ATOM 409 CD1 ILE A 29 -1.490 -3.980 0.852 1.00 0.00 C ATOM 0 H ILE A 29 -0.332 -6.145 -1.882 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.191 -3.548 -3.167 1.00 0.00 H new ATOM 0 HB ILE A 29 0.726 -4.466 -0.410 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.738 -2.825 -0.924 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.814 -4.557 -1.176 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.684 -2.066 0.141 1.00 0.00 H new ATOM 0 HG22 ILE A 29 1.846 -2.422 -1.159 1.00 0.00 H new ATOM 0 HG23 ILE A 29 0.272 -1.688 -1.548 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.556 -3.966 1.079 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.069 -4.941 1.146 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.992 -3.182 1.402 1.00 0.00 H new ATOM 421 N ILE A 30 2.463 -5.389 -2.493 1.00 0.00 N ATOM 422 CA ILE A 30 3.880 -5.562 -2.786 1.00 0.00 C ATOM 423 C ILE A 30 4.083 -6.214 -4.150 1.00 0.00 C ATOM 424 O ILE A 30 5.139 -6.071 -4.766 1.00 0.00 O ATOM 425 CB ILE A 30 4.576 -6.417 -1.712 1.00 0.00 C ATOM 426 CG1 ILE A 30 4.802 -5.596 -0.441 1.00 0.00 C ATOM 427 CG2 ILE A 30 5.896 -6.960 -2.240 1.00 0.00 C ATOM 428 CD1 ILE A 30 6.181 -4.980 -0.357 1.00 0.00 C ATOM 0 H ILE A 30 2.043 -6.159 -1.973 1.00 0.00 H new ATOM 0 HA ILE A 30 4.326 -4.567 -2.791 1.00 0.00 H new ATOM 0 HB ILE A 30 3.930 -7.260 -1.467 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.055 -4.803 -0.393 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.645 -6.235 0.428 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.376 -7.562 -1.469 1.00 0.00 H new ATOM 0 HG22 ILE A 30 5.710 -7.577 -3.119 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.549 -6.130 -2.511 1.00 0.00 H new ATOM 0 HD11 ILE A 30 6.270 -4.413 0.569 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.933 -5.769 -0.374 1.00 0.00 H new ATOM 0 HD13 ILE A 30 6.334 -4.314 -1.206 1.00 0.00 H new ATOM 440 N GLY A 31 3.064 -6.928 -4.616 1.00 0.00 N ATOM 441 CA GLY A 31 3.151 -7.590 -5.905 1.00 0.00 C ATOM 442 C GLY A 31 3.643 -9.020 -5.791 1.00 0.00 C ATOM 443 O GLY A 31 3.328 -9.716 -4.827 1.00 0.00 O ATOM 0 H GLY A 31 2.180 -7.060 -4.125 1.00 0.00 H new ATOM 0 HA2 GLY A 31 2.170 -7.583 -6.380 1.00 0.00 H new ATOM 0 HA3 GLY A 31 3.823 -7.028 -6.554 1.00 0.00 H new ATOM 447 N ARG A 32 4.416 -9.459 -6.780 1.00 0.00 N ATOM 448 CA ARG A 32 4.949 -10.815 -6.787 1.00 0.00 C ATOM 449 C ARG A 32 6.389 -10.836 -6.281 1.00 0.00 C ATOM 450 O ARG A 32 7.193 -11.668 -6.702 1.00 0.00 O ATOM 451 CB ARG A 32 4.883 -11.404 -8.197 1.00 0.00 C ATOM 452 CG ARG A 32 5.698 -10.628 -9.220 1.00 0.00 C ATOM 453 CD ARG A 32 6.642 -11.539 -9.988 1.00 0.00 C ATOM 454 NE ARG A 32 7.851 -10.839 -10.415 1.00 0.00 N ATOM 455 CZ ARG A 32 7.902 -10.039 -11.473 1.00 0.00 C ATOM 456 NH1 ARG A 32 6.817 -9.836 -12.208 1.00 0.00 N ATOM 457 NH2 ARG A 32 9.039 -9.437 -11.798 1.00 0.00 N ATOM 0 H ARG A 32 4.686 -8.895 -7.586 1.00 0.00 H new ATOM 0 HA ARG A 32 4.339 -11.422 -6.118 1.00 0.00 H new ATOM 0 HB2 ARG A 32 5.238 -12.434 -8.168 1.00 0.00 H new ATOM 0 HB3 ARG A 32 3.843 -11.434 -8.521 1.00 0.00 H new ATOM 0 HG2 ARG A 32 5.026 -10.127 -9.917 1.00 0.00 H new ATOM 0 HG3 ARG A 32 6.271 -9.850 -8.716 1.00 0.00 H new ATOM 0 HD2 ARG A 32 6.917 -12.388 -9.362 1.00 0.00 H new ATOM 0 HD3 ARG A 32 6.128 -11.941 -10.861 1.00 0.00 H new ATOM 0 HE ARG A 32 8.703 -10.972 -9.870 1.00 0.00 H new ATOM 0 HH11 ARG A 32 5.940 -10.295 -11.961 1.00 0.00 H new ATOM 0 HH12 ARG A 32 6.859 -9.221 -13.020 1.00 0.00 H new ATOM 0 HH21 ARG A 32 9.876 -9.589 -11.235 1.00 0.00 H new ATOM 0 HH22 ARG A 32 9.076 -8.823 -12.611 1.00 0.00 H new ATOM 471 N GLY A 33 6.706 -9.915 -5.378 1.00 0.00 N ATOM 472 CA GLY A 33 8.049 -9.845 -4.830 1.00 0.00 C ATOM 473 C GLY A 33 8.538 -8.419 -4.676 1.00 0.00 C ATOM 474 O GLY A 33 9.555 -8.170 -4.029 1.00 0.00 O ATOM 0 H GLY A 33 6.058 -9.216 -5.015 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.068 -10.339 -3.859 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.732 -10.392 -5.480 1.00 0.00 H new ATOM 478 N GLY A 34 7.813 -7.478 -5.274 1.00 0.00 N ATOM 479 CA GLY A 34 8.196 -6.080 -5.189 1.00 0.00 C ATOM 480 C GLY A 34 7.847 -5.306 -6.444 1.00 0.00 C ATOM 481 O GLY A 34 7.599 -4.103 -6.389 1.00 0.00 O ATOM 0 H GLY A 34 6.968 -7.659 -5.816 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.700 -5.622 -4.334 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.269 -6.011 -5.010 1.00 0.00 H new ATOM 485 N GLU A 35 7.829 -5.999 -7.580 1.00 0.00 N ATOM 486 CA GLU A 35 7.510 -5.366 -8.855 1.00 0.00 C ATOM 487 C GLU A 35 6.393 -4.340 -8.688 1.00 0.00 C ATOM 488 O GLU A 35 6.320 -3.360 -9.430 1.00 0.00 O ATOM 489 CB GLU A 35 7.100 -6.422 -9.883 1.00 0.00 C ATOM 490 CG GLU A 35 5.768 -7.086 -9.575 1.00 0.00 C ATOM 491 CD GLU A 35 4.612 -6.448 -10.319 1.00 0.00 C ATOM 492 OE1 GLU A 35 4.255 -5.298 -9.985 1.00 0.00 O ATOM 493 OE2 GLU A 35 4.064 -7.096 -11.235 1.00 0.00 O ATOM 0 H GLU A 35 8.031 -6.997 -7.643 1.00 0.00 H new ATOM 0 HA GLU A 35 8.402 -4.850 -9.211 1.00 0.00 H new ATOM 0 HB2 GLU A 35 7.046 -5.957 -10.867 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.875 -7.187 -9.934 1.00 0.00 H new ATOM 0 HG2 GLU A 35 5.824 -8.143 -9.836 1.00 0.00 H new ATOM 0 HG3 GLU A 35 5.579 -7.032 -8.503 1.00 0.00 H new ATOM 500 N THR A 36 5.525 -4.572 -7.709 1.00 0.00 N ATOM 501 CA THR A 36 4.411 -3.671 -7.446 1.00 0.00 C ATOM 502 C THR A 36 4.780 -2.632 -6.393 1.00 0.00 C ATOM 503 O THR A 36 4.324 -1.489 -6.449 1.00 0.00 O ATOM 504 CB THR A 36 3.163 -4.441 -6.974 1.00 0.00 C ATOM 505 OG1 THR A 36 2.814 -5.445 -7.933 1.00 0.00 O ATOM 506 CG2 THR A 36 1.989 -3.497 -6.769 1.00 0.00 C ATOM 0 H THR A 36 5.572 -5.377 -7.085 1.00 0.00 H new ATOM 0 HA THR A 36 4.185 -3.168 -8.386 1.00 0.00 H new ATOM 0 HB THR A 36 3.396 -4.916 -6.021 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.101 -5.159 -8.825 1.00 0.00 H new ATOM 0 HG21 THR A 36 1.120 -4.064 -6.436 1.00 0.00 H new ATOM 0 HG22 THR A 36 2.248 -2.753 -6.015 1.00 0.00 H new ATOM 0 HG23 THR A 36 1.757 -2.996 -7.709 1.00 0.00 H new ATOM 514 N ILE A 37 5.610 -3.036 -5.437 1.00 0.00 N ATOM 515 CA ILE A 37 6.043 -2.137 -4.373 1.00 0.00 C ATOM 516 C ILE A 37 7.053 -1.119 -4.891 1.00 0.00 C ATOM 517 O ILE A 37 7.351 -0.129 -4.220 1.00 0.00 O ATOM 518 CB ILE A 37 6.669 -2.916 -3.201 1.00 0.00 C ATOM 519 CG1 ILE A 37 6.488 -2.141 -1.893 1.00 0.00 C ATOM 520 CG2 ILE A 37 8.144 -3.178 -3.467 1.00 0.00 C ATOM 521 CD1 ILE A 37 5.046 -1.804 -1.586 1.00 0.00 C ATOM 0 H ILE A 37 5.996 -3.978 -5.377 1.00 0.00 H new ATOM 0 HA ILE A 37 5.155 -1.614 -4.018 1.00 0.00 H new ATOM 0 HB ILE A 37 6.161 -3.876 -3.108 1.00 0.00 H new ATOM 0 HG12 ILE A 37 6.898 -2.729 -1.072 1.00 0.00 H new ATOM 0 HG13 ILE A 37 7.066 -1.218 -1.944 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.572 -3.729 -2.630 1.00 0.00 H new ATOM 0 HG22 ILE A 37 8.251 -3.764 -4.380 1.00 0.00 H new ATOM 0 HG23 ILE A 37 8.667 -2.229 -3.582 1.00 0.00 H new ATOM 0 HD11 ILE A 37 4.993 -1.255 -0.646 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.637 -1.190 -2.388 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.467 -2.724 -1.503 1.00 0.00 H new ATOM 533 N ARG A 38 7.575 -1.366 -6.087 1.00 0.00 N ATOM 534 CA ARG A 38 8.551 -0.470 -6.695 1.00 0.00 C ATOM 535 C ARG A 38 7.857 0.622 -7.504 1.00 0.00 C ATOM 536 O ARG A 38 8.220 1.795 -7.421 1.00 0.00 O ATOM 537 CB ARG A 38 9.506 -1.257 -7.594 1.00 0.00 C ATOM 538 CG ARG A 38 10.353 -2.271 -6.844 1.00 0.00 C ATOM 539 CD ARG A 38 11.660 -2.553 -7.569 1.00 0.00 C ATOM 540 NE ARG A 38 12.791 -2.633 -6.649 1.00 0.00 N ATOM 541 CZ ARG A 38 13.017 -3.670 -5.850 1.00 0.00 C ATOM 542 NH1 ARG A 38 12.194 -4.711 -5.861 1.00 0.00 N ATOM 543 NH2 ARG A 38 14.068 -3.669 -5.040 1.00 0.00 N ATOM 0 H ARG A 38 7.338 -2.180 -6.655 1.00 0.00 H new ATOM 0 HA ARG A 38 9.122 0.002 -5.895 1.00 0.00 H new ATOM 0 HB2 ARG A 38 8.927 -1.775 -8.359 1.00 0.00 H new ATOM 0 HB3 ARG A 38 10.164 -0.558 -8.111 1.00 0.00 H new ATOM 0 HG2 ARG A 38 10.565 -1.899 -5.842 1.00 0.00 H new ATOM 0 HG3 ARG A 38 9.793 -3.199 -6.728 1.00 0.00 H new ATOM 0 HD2 ARG A 38 11.574 -3.490 -8.120 1.00 0.00 H new ATOM 0 HD3 ARG A 38 11.844 -1.768 -8.302 1.00 0.00 H new ATOM 0 HE ARG A 38 13.443 -1.850 -6.618 1.00 0.00 H new ATOM 0 HH11 ARG A 38 11.386 -4.716 -6.484 1.00 0.00 H new ATOM 0 HH12 ARG A 38 12.369 -5.506 -5.247 1.00 0.00 H new ATOM 0 HH21 ARG A 38 14.704 -2.871 -5.030 1.00 0.00 H new ATOM 0 HH22 ARG A 38 14.240 -4.466 -4.427 1.00 0.00 H new ATOM 557 N SER A 39 6.858 0.227 -8.286 1.00 0.00 N ATOM 558 CA SER A 39 6.116 1.172 -9.113 1.00 0.00 C ATOM 559 C SER A 39 5.503 2.276 -8.259 1.00 0.00 C ATOM 560 O SER A 39 5.353 3.412 -8.710 1.00 0.00 O ATOM 561 CB SER A 39 5.018 0.445 -9.893 1.00 0.00 C ATOM 562 OG SER A 39 4.951 0.910 -11.230 1.00 0.00 O ATOM 0 H SER A 39 6.544 -0.740 -8.365 1.00 0.00 H new ATOM 0 HA SER A 39 6.813 1.627 -9.817 1.00 0.00 H new ATOM 0 HB2 SER A 39 5.212 -0.628 -9.887 1.00 0.00 H new ATOM 0 HB3 SER A 39 4.057 0.598 -9.403 1.00 0.00 H new ATOM 0 HG SER A 39 4.243 0.429 -11.708 1.00 0.00 H new ATOM 568 N ILE A 40 5.150 1.935 -7.025 1.00 0.00 N ATOM 569 CA ILE A 40 4.554 2.898 -6.106 1.00 0.00 C ATOM 570 C ILE A 40 5.577 3.937 -5.660 1.00 0.00 C ATOM 571 O ILE A 40 5.366 5.139 -5.822 1.00 0.00 O ATOM 572 CB ILE A 40 3.969 2.203 -4.864 1.00 0.00 C ATOM 573 CG1 ILE A 40 3.028 1.070 -5.281 1.00 0.00 C ATOM 574 CG2 ILE A 40 3.238 3.209 -3.989 1.00 0.00 C ATOM 575 CD1 ILE A 40 2.714 0.102 -4.163 1.00 0.00 C ATOM 0 H ILE A 40 5.266 0.999 -6.637 1.00 0.00 H new ATOM 0 HA ILE A 40 3.748 3.394 -6.647 1.00 0.00 H new ATOM 0 HB ILE A 40 4.789 1.776 -4.286 1.00 0.00 H new ATOM 0 HG12 ILE A 40 2.097 1.500 -5.651 1.00 0.00 H new ATOM 0 HG13 ILE A 40 3.477 0.522 -6.109 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.830 2.702 -3.115 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.933 3.984 -3.667 1.00 0.00 H new ATOM 0 HG23 ILE A 40 2.426 3.663 -4.557 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.042 -0.674 -4.531 1.00 0.00 H new ATOM 0 HD12 ILE A 40 3.637 -0.356 -3.808 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.236 0.637 -3.342 1.00 0.00 H new ATOM 587 N CYS A 41 6.685 3.465 -5.100 1.00 0.00 N ATOM 588 CA CYS A 41 7.742 4.354 -4.629 1.00 0.00 C ATOM 589 C CYS A 41 8.121 5.365 -5.707 1.00 0.00 C ATOM 590 O CYS A 41 8.414 6.523 -5.411 1.00 0.00 O ATOM 591 CB CYS A 41 8.972 3.544 -4.218 1.00 0.00 C ATOM 592 SG CYS A 41 10.507 4.498 -4.184 1.00 0.00 S ATOM 0 H CYS A 41 6.875 2.473 -4.961 1.00 0.00 H new ATOM 0 HA CYS A 41 7.367 4.897 -3.762 1.00 0.00 H new ATOM 0 HB2 CYS A 41 8.800 3.118 -3.230 1.00 0.00 H new ATOM 0 HB3 CYS A 41 9.091 2.709 -4.908 1.00 0.00 H new ATOM 0 HG CYS A 41 11.489 3.727 -3.823 1.00 0.00 H new ATOM 598 N LYS A 42 8.116 4.918 -6.958 1.00 0.00 N ATOM 599 CA LYS A 42 8.459 5.782 -8.081 1.00 0.00 C ATOM 600 C LYS A 42 7.254 6.606 -8.523 1.00 0.00 C ATOM 601 O LYS A 42 7.403 7.654 -9.149 1.00 0.00 O ATOM 602 CB LYS A 42 8.976 4.947 -9.255 1.00 0.00 C ATOM 603 CG LYS A 42 7.872 4.317 -10.086 1.00 0.00 C ATOM 604 CD LYS A 42 8.406 3.770 -11.399 1.00 0.00 C ATOM 605 CE LYS A 42 9.462 2.700 -11.169 1.00 0.00 C ATOM 606 NZ LYS A 42 9.699 1.882 -12.391 1.00 0.00 N ATOM 0 H LYS A 42 7.878 3.961 -7.220 1.00 0.00 H new ATOM 0 HA LYS A 42 9.244 6.464 -7.754 1.00 0.00 H new ATOM 0 HB2 LYS A 42 9.588 5.580 -9.898 1.00 0.00 H new ATOM 0 HB3 LYS A 42 9.625 4.160 -8.872 1.00 0.00 H new ATOM 0 HG2 LYS A 42 7.403 3.513 -9.520 1.00 0.00 H new ATOM 0 HG3 LYS A 42 7.099 5.058 -10.287 1.00 0.00 H new ATOM 0 HD2 LYS A 42 7.585 3.353 -11.981 1.00 0.00 H new ATOM 0 HD3 LYS A 42 8.832 4.583 -11.987 1.00 0.00 H new ATOM 0 HE2 LYS A 42 10.395 3.171 -10.861 1.00 0.00 H new ATOM 0 HE3 LYS A 42 9.148 2.050 -10.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 10.425 1.164 -12.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 8.815 1.412 -12.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 10.023 2.498 -13.164 1.00 0.00 H new ATOM 620 N ALA A 43 6.060 6.125 -8.189 1.00 0.00 N ATOM 621 CA ALA A 43 4.830 6.820 -8.548 1.00 0.00 C ATOM 622 C ALA A 43 4.525 7.943 -7.562 1.00 0.00 C ATOM 623 O ALA A 43 3.874 8.927 -7.909 1.00 0.00 O ATOM 624 CB ALA A 43 3.668 5.839 -8.608 1.00 0.00 C ATOM 0 H ALA A 43 5.919 5.258 -7.671 1.00 0.00 H new ATOM 0 HA ALA A 43 4.968 7.265 -9.533 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.756 6.372 -8.877 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.876 5.074 -9.356 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.539 5.368 -7.634 1.00 0.00 H new ATOM 630 N SER A 44 4.999 7.786 -6.330 1.00 0.00 N ATOM 631 CA SER A 44 4.773 8.785 -5.291 1.00 0.00 C ATOM 632 C SER A 44 6.064 9.534 -4.968 1.00 0.00 C ATOM 633 O SER A 44 6.046 10.732 -4.691 1.00 0.00 O ATOM 634 CB SER A 44 4.224 8.122 -4.027 1.00 0.00 C ATOM 635 OG SER A 44 4.823 6.856 -3.814 1.00 0.00 O ATOM 0 H SER A 44 5.542 6.977 -6.027 1.00 0.00 H new ATOM 0 HA SER A 44 4.041 9.502 -5.663 1.00 0.00 H new ATOM 0 HB2 SER A 44 4.409 8.765 -3.166 1.00 0.00 H new ATOM 0 HB3 SER A 44 3.144 8.007 -4.113 1.00 0.00 H new ATOM 0 HG SER A 44 4.592 6.256 -4.554 1.00 0.00 H new ATOM 641 N GLY A 45 7.182 8.816 -5.006 1.00 0.00 N ATOM 642 CA GLY A 45 8.466 9.428 -4.715 1.00 0.00 C ATOM 643 C GLY A 45 8.951 9.117 -3.314 1.00 0.00 C ATOM 644 O GLY A 45 10.091 9.420 -2.962 1.00 0.00 O ATOM 0 H GLY A 45 7.222 7.822 -5.233 1.00 0.00 H new ATOM 0 HA2 GLY A 45 9.204 9.079 -5.438 1.00 0.00 H new ATOM 0 HA3 GLY A 45 8.386 10.508 -4.837 1.00 0.00 H new ATOM 648 N ALA A 46 8.083 8.512 -2.508 1.00 0.00 N ATOM 649 CA ALA A 46 8.429 8.161 -1.137 1.00 0.00 C ATOM 650 C ALA A 46 8.852 6.699 -1.036 1.00 0.00 C ATOM 651 O ALA A 46 8.355 5.845 -1.769 1.00 0.00 O ATOM 652 CB ALA A 46 7.257 8.439 -0.208 1.00 0.00 C ATOM 0 H ALA A 46 7.135 8.255 -2.782 1.00 0.00 H new ATOM 0 HA ALA A 46 9.273 8.779 -0.832 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.530 8.172 0.813 1.00 0.00 H new ATOM 0 HB2 ALA A 46 7.003 9.498 -0.250 1.00 0.00 H new ATOM 0 HB3 ALA A 46 6.397 7.847 -0.520 1.00 0.00 H new ATOM 658 N LYS A 47 9.774 6.416 -0.121 1.00 0.00 N ATOM 659 CA LYS A 47 10.264 5.057 0.078 1.00 0.00 C ATOM 660 C LYS A 47 9.256 4.226 0.864 1.00 0.00 C ATOM 661 O LYS A 47 8.774 4.648 1.915 1.00 0.00 O ATOM 662 CB LYS A 47 11.606 5.080 0.813 1.00 0.00 C ATOM 663 CG LYS A 47 12.654 4.171 0.195 1.00 0.00 C ATOM 664 CD LYS A 47 12.327 2.705 0.427 1.00 0.00 C ATOM 665 CE LYS A 47 13.375 1.796 -0.196 1.00 0.00 C ATOM 666 NZ LYS A 47 12.924 0.377 -0.238 1.00 0.00 N ATOM 0 H LYS A 47 10.197 7.111 0.495 1.00 0.00 H new ATOM 0 HA LYS A 47 10.401 4.599 -0.902 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.986 6.102 0.826 1.00 0.00 H new ATOM 0 HB3 LYS A 47 11.448 4.785 1.850 1.00 0.00 H new ATOM 0 HG2 LYS A 47 12.720 4.365 -0.876 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.631 4.399 0.621 1.00 0.00 H new ATOM 0 HD2 LYS A 47 12.264 2.510 1.498 1.00 0.00 H new ATOM 0 HD3 LYS A 47 11.349 2.478 0.004 1.00 0.00 H new ATOM 0 HE2 LYS A 47 13.596 2.137 -1.207 1.00 0.00 H new ATOM 0 HE3 LYS A 47 14.302 1.866 0.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 13.666 -0.210 -0.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 12.737 0.043 0.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 12.054 0.306 -0.803 1.00 0.00 H new ATOM 680 N ILE A 48 8.943 3.042 0.348 1.00 0.00 N ATOM 681 CA ILE A 48 7.994 2.150 1.003 1.00 0.00 C ATOM 682 C ILE A 48 8.586 0.756 1.185 1.00 0.00 C ATOM 683 O ILE A 48 8.931 0.084 0.214 1.00 0.00 O ATOM 684 CB ILE A 48 6.683 2.039 0.204 1.00 0.00 C ATOM 685 CG1 ILE A 48 6.183 3.429 -0.194 1.00 0.00 C ATOM 686 CG2 ILE A 48 5.628 1.304 1.018 1.00 0.00 C ATOM 687 CD1 ILE A 48 6.219 3.679 -1.686 1.00 0.00 C ATOM 0 H ILE A 48 9.333 2.678 -0.522 1.00 0.00 H new ATOM 0 HA ILE A 48 7.778 2.581 1.981 1.00 0.00 H new ATOM 0 HB ILE A 48 6.876 1.469 -0.705 1.00 0.00 H new ATOM 0 HG12 ILE A 48 5.161 3.555 0.163 1.00 0.00 H new ATOM 0 HG13 ILE A 48 6.791 4.182 0.307 1.00 0.00 H new ATOM 0 HG21 ILE A 48 4.707 1.233 0.440 1.00 0.00 H new ATOM 0 HG22 ILE A 48 5.985 0.302 1.256 1.00 0.00 H new ATOM 0 HG23 ILE A 48 5.436 1.850 1.942 1.00 0.00 H new ATOM 0 HD11 ILE A 48 5.851 4.683 -1.896 1.00 0.00 H new ATOM 0 HD12 ILE A 48 7.244 3.586 -2.046 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.589 2.948 -2.193 1.00 0.00 H new ATOM 699 N THR A 49 8.699 0.328 2.438 1.00 0.00 N ATOM 700 CA THR A 49 9.249 -0.987 2.750 1.00 0.00 C ATOM 701 C THR A 49 8.347 -1.744 3.718 1.00 0.00 C ATOM 702 O THR A 49 7.634 -1.138 4.519 1.00 0.00 O ATOM 703 CB THR A 49 10.659 -0.877 3.359 1.00 0.00 C ATOM 704 OG1 THR A 49 11.373 -2.103 3.166 1.00 0.00 O ATOM 705 CG2 THR A 49 10.584 -0.556 4.844 1.00 0.00 C ATOM 0 H THR A 49 8.417 0.872 3.254 1.00 0.00 H new ATOM 0 HA THR A 49 9.310 -1.535 1.810 1.00 0.00 H new ATOM 0 HB THR A 49 11.186 -0.067 2.855 1.00 0.00 H new ATOM 0 HG1 THR A 49 12.269 -2.024 3.555 1.00 0.00 H new ATOM 0 HG21 THR A 49 11.592 -0.483 5.252 1.00 0.00 H new ATOM 0 HG22 THR A 49 10.066 0.393 4.985 1.00 0.00 H new ATOM 0 HG23 THR A 49 10.040 -1.347 5.360 1.00 0.00 H new ATOM 713 N CYS A 50 8.384 -3.069 3.640 1.00 0.00 N ATOM 714 CA CYS A 50 7.570 -3.909 4.511 1.00 0.00 C ATOM 715 C CYS A 50 8.376 -4.388 5.714 1.00 0.00 C ATOM 716 O CYS A 50 9.574 -4.650 5.607 1.00 0.00 O ATOM 717 CB CYS A 50 7.029 -5.111 3.734 1.00 0.00 C ATOM 718 SG CYS A 50 8.292 -6.312 3.256 1.00 0.00 S ATOM 0 H CYS A 50 8.969 -3.585 2.983 1.00 0.00 H new ATOM 0 HA CYS A 50 6.733 -3.311 4.872 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.277 -5.614 4.342 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.526 -4.753 2.836 1.00 0.00 H new ATOM 0 HG CYS A 50 9.347 -6.151 3.999 1.00 0.00 H new ATOM 724 N ASP A 51 7.711 -4.498 6.859 1.00 0.00 N ATOM 725 CA ASP A 51 8.365 -4.944 8.083 1.00 0.00 C ATOM 726 C ASP A 51 9.388 -6.036 7.786 1.00 0.00 C ATOM 727 O ASP A 51 9.301 -6.724 6.769 1.00 0.00 O ATOM 728 CB ASP A 51 7.328 -5.458 9.083 1.00 0.00 C ATOM 729 CG ASP A 51 7.600 -4.980 10.496 1.00 0.00 C ATOM 730 OD1 ASP A 51 8.778 -4.725 10.820 1.00 0.00 O ATOM 731 OD2 ASP A 51 6.633 -4.860 11.278 1.00 0.00 O ATOM 0 H ASP A 51 6.719 -4.284 6.965 1.00 0.00 H new ATOM 0 HA ASP A 51 8.886 -4.091 8.518 1.00 0.00 H new ATOM 0 HB2 ASP A 51 6.336 -5.128 8.775 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.320 -6.548 9.066 1.00 0.00 H new ATOM 736 N LYS A 52 10.360 -6.190 8.680 1.00 0.00 N ATOM 737 CA LYS A 52 11.400 -7.197 8.515 1.00 0.00 C ATOM 738 C LYS A 52 11.602 -7.987 9.803 1.00 0.00 C ATOM 739 O LYS A 52 11.637 -9.217 9.789 1.00 0.00 O ATOM 740 CB LYS A 52 12.716 -6.537 8.097 1.00 0.00 C ATOM 741 CG LYS A 52 13.000 -5.233 8.822 1.00 0.00 C ATOM 742 CD LYS A 52 13.951 -5.439 9.989 1.00 0.00 C ATOM 743 CE LYS A 52 15.303 -4.792 9.727 1.00 0.00 C ATOM 744 NZ LYS A 52 15.954 -4.338 10.987 1.00 0.00 N ATOM 0 H LYS A 52 10.448 -5.629 9.527 1.00 0.00 H new ATOM 0 HA LYS A 52 11.082 -7.887 7.733 1.00 0.00 H new ATOM 0 HB2 LYS A 52 13.536 -7.231 8.282 1.00 0.00 H new ATOM 0 HB3 LYS A 52 12.693 -6.349 7.024 1.00 0.00 H new ATOM 0 HG2 LYS A 52 13.429 -4.514 8.124 1.00 0.00 H new ATOM 0 HG3 LYS A 52 12.065 -4.806 9.185 1.00 0.00 H new ATOM 0 HD2 LYS A 52 13.514 -5.018 10.894 1.00 0.00 H new ATOM 0 HD3 LYS A 52 14.085 -6.506 10.166 1.00 0.00 H new ATOM 0 HE2 LYS A 52 15.953 -5.503 9.218 1.00 0.00 H new ATOM 0 HE3 LYS A 52 15.175 -3.941 9.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 16.872 -3.903 10.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 15.345 -3.640 11.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 16.100 -5.153 11.616 1.00 0.00 H new ATOM 758 N GLU A 53 11.733 -7.272 10.916 1.00 0.00 N ATOM 759 CA GLU A 53 11.931 -7.908 12.214 1.00 0.00 C ATOM 760 C GLU A 53 11.074 -9.166 12.339 1.00 0.00 C ATOM 761 O GLU A 53 11.426 -10.099 13.060 1.00 0.00 O ATOM 762 CB GLU A 53 11.590 -6.931 13.342 1.00 0.00 C ATOM 763 CG GLU A 53 12.812 -6.378 14.057 1.00 0.00 C ATOM 764 CD GLU A 53 12.470 -5.740 15.388 1.00 0.00 C ATOM 765 OE1 GLU A 53 11.902 -4.626 15.383 1.00 0.00 O ATOM 766 OE2 GLU A 53 12.769 -6.351 16.435 1.00 0.00 O ATOM 0 H GLU A 53 11.706 -6.253 10.945 1.00 0.00 H new ATOM 0 HA GLU A 53 12.980 -8.194 12.295 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.013 -6.102 12.932 1.00 0.00 H new ATOM 0 HB3 GLU A 53 10.952 -7.435 14.068 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.529 -7.183 14.218 1.00 0.00 H new ATOM 0 HG3 GLU A 53 13.299 -5.640 13.419 1.00 0.00 H new ATOM 773 N SER A 54 9.949 -9.181 11.631 1.00 0.00 N ATOM 774 CA SER A 54 9.040 -10.320 11.666 1.00 0.00 C ATOM 775 C SER A 54 9.396 -11.332 10.582 1.00 0.00 C ATOM 776 O SER A 54 9.907 -10.968 9.523 1.00 0.00 O ATOM 777 CB SER A 54 7.595 -9.853 11.489 1.00 0.00 C ATOM 778 OG SER A 54 7.427 -9.170 10.259 1.00 0.00 O ATOM 0 H SER A 54 9.646 -8.417 11.027 1.00 0.00 H new ATOM 0 HA SER A 54 9.141 -10.804 12.638 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.925 -10.712 11.526 1.00 0.00 H new ATOM 0 HB3 SER A 54 7.318 -9.197 12.314 1.00 0.00 H new ATOM 0 HG SER A 54 6.494 -8.883 10.169 1.00 0.00 H new ATOM 784 N GLU A 55 9.122 -12.604 10.854 1.00 0.00 N ATOM 785 CA GLU A 55 9.413 -13.669 9.902 1.00 0.00 C ATOM 786 C GLU A 55 9.119 -13.217 8.474 1.00 0.00 C ATOM 787 O GLU A 55 9.849 -13.554 7.542 1.00 0.00 O ATOM 788 CB GLU A 55 8.594 -14.918 10.232 1.00 0.00 C ATOM 789 CG GLU A 55 9.007 -15.593 11.529 1.00 0.00 C ATOM 790 CD GLU A 55 9.866 -16.821 11.299 1.00 0.00 C ATOM 791 OE1 GLU A 55 9.689 -17.481 10.254 1.00 0.00 O ATOM 792 OE2 GLU A 55 10.714 -17.123 12.165 1.00 0.00 O ATOM 0 H GLU A 55 8.699 -12.922 11.726 1.00 0.00 H new ATOM 0 HA GLU A 55 10.473 -13.909 9.978 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.541 -14.645 10.294 1.00 0.00 H new ATOM 0 HB3 GLU A 55 8.691 -15.632 9.414 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.555 -14.881 12.146 1.00 0.00 H new ATOM 0 HG3 GLU A 55 8.115 -15.878 12.086 1.00 0.00 H new ATOM 799 N GLY A 56 8.044 -12.453 8.310 1.00 0.00 N ATOM 800 CA GLY A 56 7.672 -11.968 6.994 1.00 0.00 C ATOM 801 C GLY A 56 7.428 -13.094 6.009 1.00 0.00 C ATOM 802 O GLY A 56 7.684 -12.950 4.814 1.00 0.00 O ATOM 0 H GLY A 56 7.424 -12.161 9.065 1.00 0.00 H new ATOM 0 HA2 GLY A 56 6.772 -11.359 7.076 1.00 0.00 H new ATOM 0 HA3 GLY A 56 8.461 -11.320 6.612 1.00 0.00 H new ATOM 806 N THR A 57 6.932 -14.220 6.512 1.00 0.00 N ATOM 807 CA THR A 57 6.655 -15.376 5.668 1.00 0.00 C ATOM 808 C THR A 57 5.155 -15.626 5.551 1.00 0.00 C ATOM 809 O THR A 57 4.551 -15.363 4.511 1.00 0.00 O ATOM 810 CB THR A 57 7.334 -16.646 6.215 1.00 0.00 C ATOM 811 OG1 THR A 57 8.748 -16.441 6.315 1.00 0.00 O ATOM 812 CG2 THR A 57 7.052 -17.841 5.316 1.00 0.00 C ATOM 0 H THR A 57 6.714 -14.356 7.499 1.00 0.00 H new ATOM 0 HA THR A 57 7.061 -15.151 4.682 1.00 0.00 H new ATOM 0 HB THR A 57 6.926 -16.852 7.205 1.00 0.00 H new ATOM 0 HG1 THR A 57 9.172 -17.252 6.665 1.00 0.00 H new ATOM 0 HG21 THR A 57 7.542 -18.726 5.723 1.00 0.00 H new ATOM 0 HG22 THR A 57 5.977 -18.012 5.265 1.00 0.00 H new ATOM 0 HG23 THR A 57 7.435 -17.642 4.315 1.00 0.00 H new ATOM 820 N LEU A 58 4.561 -16.135 6.625 1.00 0.00 N ATOM 821 CA LEU A 58 3.129 -16.419 6.643 1.00 0.00 C ATOM 822 C LEU A 58 2.474 -15.834 7.889 1.00 0.00 C ATOM 823 O LEU A 58 1.336 -16.170 8.221 1.00 0.00 O ATOM 824 CB LEU A 58 2.889 -17.929 6.587 1.00 0.00 C ATOM 825 CG LEU A 58 1.478 -18.370 6.199 1.00 0.00 C ATOM 826 CD1 LEU A 58 1.303 -18.332 4.689 1.00 0.00 C ATOM 827 CD2 LEU A 58 1.188 -19.764 6.736 1.00 0.00 C ATOM 0 H LEU A 58 5.047 -16.359 7.493 1.00 0.00 H new ATOM 0 HA LEU A 58 2.679 -15.953 5.766 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.592 -18.362 5.876 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.124 -18.351 7.564 1.00 0.00 H new ATOM 0 HG LEU A 58 0.766 -17.675 6.644 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.292 -18.649 4.432 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.467 -17.316 4.329 1.00 0.00 H new ATOM 0 HD13 LEU A 58 2.024 -19.003 4.222 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.179 -20.061 6.450 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.906 -20.471 6.320 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.271 -19.760 7.823 1.00 0.00 H new ATOM 839 N LEU A 59 3.197 -14.955 8.575 1.00 0.00 N ATOM 840 CA LEU A 59 2.685 -14.320 9.784 1.00 0.00 C ATOM 841 C LEU A 59 1.262 -13.813 9.573 1.00 0.00 C ATOM 842 O LEU A 59 0.736 -13.854 8.460 1.00 0.00 O ATOM 843 CB LEU A 59 3.594 -13.163 10.200 1.00 0.00 C ATOM 844 CG LEU A 59 4.115 -12.279 9.067 1.00 0.00 C ATOM 845 CD1 LEU A 59 2.994 -11.932 8.100 1.00 0.00 C ATOM 846 CD2 LEU A 59 4.749 -11.012 9.627 1.00 0.00 C ATOM 0 H LEU A 59 4.140 -14.666 8.314 1.00 0.00 H new ATOM 0 HA LEU A 59 2.671 -15.067 10.578 1.00 0.00 H new ATOM 0 HB2 LEU A 59 3.049 -12.534 10.904 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.449 -13.574 10.736 1.00 0.00 H new ATOM 0 HG LEU A 59 4.878 -12.834 8.522 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.385 -11.302 7.301 1.00 0.00 H new ATOM 0 HD12 LEU A 59 2.585 -12.848 7.673 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.207 -11.397 8.632 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.114 -10.395 8.806 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.006 -10.455 10.197 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.581 -11.279 10.279 1.00 0.00 H new ATOM 858 N LEU A 60 0.643 -13.336 10.647 1.00 0.00 N ATOM 859 CA LEU A 60 -0.718 -12.819 10.579 1.00 0.00 C ATOM 860 C LEU A 60 -0.817 -11.674 9.575 1.00 0.00 C ATOM 861 O LEU A 60 -1.233 -11.873 8.433 1.00 0.00 O ATOM 862 CB LEU A 60 -1.173 -12.341 11.959 1.00 0.00 C ATOM 863 CG LEU A 60 -0.062 -11.943 12.931 1.00 0.00 C ATOM 864 CD1 LEU A 60 -0.486 -10.742 13.763 1.00 0.00 C ATOM 865 CD2 LEU A 60 0.306 -13.114 13.830 1.00 0.00 C ATOM 0 H LEU A 60 1.063 -13.297 11.576 1.00 0.00 H new ATOM 0 HA LEU A 60 -1.370 -13.627 10.247 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -1.835 -11.485 11.825 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.764 -13.133 12.419 1.00 0.00 H new ATOM 0 HG LEU A 60 0.819 -11.666 12.352 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.317 -10.473 14.449 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.698 -9.900 13.104 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.381 -10.992 14.332 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.098 -12.812 14.515 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.569 -13.423 14.401 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.653 -13.947 13.219 1.00 0.00 H new ATOM 877 N SER A 61 -0.431 -10.480 10.007 1.00 0.00 N ATOM 878 CA SER A 61 -0.477 -9.304 9.146 1.00 0.00 C ATOM 879 C SER A 61 0.914 -8.699 8.976 1.00 0.00 C ATOM 880 O SER A 61 1.772 -8.833 9.849 1.00 0.00 O ATOM 881 CB SER A 61 -1.431 -8.257 9.726 1.00 0.00 C ATOM 882 OG SER A 61 -1.138 -8.000 11.089 1.00 0.00 O ATOM 0 H SER A 61 -0.082 -10.300 10.949 1.00 0.00 H new ATOM 0 HA SER A 61 -0.841 -9.616 8.167 1.00 0.00 H new ATOM 0 HB2 SER A 61 -1.353 -7.333 9.153 1.00 0.00 H new ATOM 0 HB3 SER A 61 -2.460 -8.605 9.631 1.00 0.00 H new ATOM 0 HG SER A 61 -1.760 -7.327 11.436 1.00 0.00 H new ATOM 888 N ARG A 62 1.129 -8.036 7.844 1.00 0.00 N ATOM 889 CA ARG A 62 2.416 -7.413 7.558 1.00 0.00 C ATOM 890 C ARG A 62 2.378 -5.919 7.872 1.00 0.00 C ATOM 891 O ARG A 62 1.314 -5.354 8.128 1.00 0.00 O ATOM 892 CB ARG A 62 2.795 -7.627 6.092 1.00 0.00 C ATOM 893 CG ARG A 62 3.887 -8.665 5.890 1.00 0.00 C ATOM 894 CD ARG A 62 5.173 -8.028 5.389 1.00 0.00 C ATOM 895 NE ARG A 62 5.399 -8.294 3.970 1.00 0.00 N ATOM 896 CZ ARG A 62 5.623 -9.506 3.476 1.00 0.00 C ATOM 897 NH1 ARG A 62 5.652 -10.559 4.281 1.00 0.00 N ATOM 898 NH2 ARG A 62 5.820 -9.666 2.174 1.00 0.00 N ATOM 0 H ARG A 62 0.430 -7.917 7.111 1.00 0.00 H new ATOM 0 HA ARG A 62 3.168 -7.882 8.193 1.00 0.00 H new ATOM 0 HB2 ARG A 62 1.908 -7.933 5.537 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.125 -6.678 5.669 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.078 -9.182 6.830 1.00 0.00 H new ATOM 0 HG3 ARG A 62 3.549 -9.416 5.176 1.00 0.00 H new ATOM 0 HD2 ARG A 62 5.132 -6.951 5.554 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.015 -8.408 5.968 1.00 0.00 H new ATOM 0 HE ARG A 62 5.384 -7.505 3.323 1.00 0.00 H new ATOM 0 HH11 ARG A 62 5.502 -10.439 5.283 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.824 -11.489 3.899 1.00 0.00 H new ATOM 0 HH21 ARG A 62 5.799 -8.858 1.552 1.00 0.00 H new ATOM 0 HH22 ARG A 62 5.992 -10.597 1.795 1.00 0.00 H new ATOM 912 N LEU A 63 3.546 -5.287 7.851 1.00 0.00 N ATOM 913 CA LEU A 63 3.648 -3.859 8.134 1.00 0.00 C ATOM 914 C LEU A 63 4.370 -3.130 7.005 1.00 0.00 C ATOM 915 O LEU A 63 5.154 -3.730 6.268 1.00 0.00 O ATOM 916 CB LEU A 63 4.383 -3.632 9.456 1.00 0.00 C ATOM 917 CG LEU A 63 3.834 -2.518 10.347 1.00 0.00 C ATOM 918 CD1 LEU A 63 4.487 -2.561 11.719 1.00 0.00 C ATOM 919 CD2 LEU A 63 4.047 -1.160 9.696 1.00 0.00 C ATOM 0 H LEU A 63 4.435 -5.740 7.641 1.00 0.00 H new ATOM 0 HA LEU A 63 2.638 -3.457 8.214 1.00 0.00 H new ATOM 0 HB2 LEU A 63 4.367 -4.563 10.022 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.427 -3.411 9.235 1.00 0.00 H new ATOM 0 HG LEU A 63 2.763 -2.675 10.472 1.00 0.00 H new ATOM 0 HD11 LEU A 63 4.084 -1.761 12.339 1.00 0.00 H new ATOM 0 HD12 LEU A 63 4.282 -3.523 12.189 1.00 0.00 H new ATOM 0 HD13 LEU A 63 5.564 -2.431 11.614 1.00 0.00 H new ATOM 0 HD21 LEU A 63 3.650 -0.379 10.345 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.113 -0.995 9.540 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.531 -1.132 8.736 1.00 0.00 H new ATOM 931 N ILE A 64 4.102 -1.835 6.876 1.00 0.00 N ATOM 932 CA ILE A 64 4.728 -1.025 5.840 1.00 0.00 C ATOM 933 C ILE A 64 5.291 0.269 6.419 1.00 0.00 C ATOM 934 O ILE A 64 4.778 0.794 7.407 1.00 0.00 O ATOM 935 CB ILE A 64 3.734 -0.682 4.716 1.00 0.00 C ATOM 936 CG1 ILE A 64 3.250 -1.959 4.025 1.00 0.00 C ATOM 937 CG2 ILE A 64 4.378 0.259 3.708 1.00 0.00 C ATOM 938 CD1 ILE A 64 4.175 -2.443 2.931 1.00 0.00 C ATOM 0 H ILE A 64 3.455 -1.325 7.477 1.00 0.00 H new ATOM 0 HA ILE A 64 5.542 -1.619 5.424 1.00 0.00 H new ATOM 0 HB ILE A 64 2.872 -0.179 5.155 1.00 0.00 H new ATOM 0 HG12 ILE A 64 3.140 -2.746 4.771 1.00 0.00 H new ATOM 0 HG13 ILE A 64 2.262 -1.781 3.601 1.00 0.00 H new ATOM 0 HG21 ILE A 64 3.663 0.492 2.919 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.678 1.179 4.209 1.00 0.00 H new ATOM 0 HG23 ILE A 64 5.255 -0.220 3.272 1.00 0.00 H new ATOM 0 HD11 ILE A 64 3.769 -3.351 2.486 1.00 0.00 H new ATOM 0 HD12 ILE A 64 4.266 -1.673 2.165 1.00 0.00 H new ATOM 0 HD13 ILE A 64 5.158 -2.654 3.352 1.00 0.00 H new ATOM 950 N LYS A 65 6.346 0.781 5.794 1.00 0.00 N ATOM 951 CA LYS A 65 6.977 2.016 6.244 1.00 0.00 C ATOM 952 C LYS A 65 7.138 2.997 5.087 1.00 0.00 C ATOM 953 O LYS A 65 7.915 2.759 4.162 1.00 0.00 O ATOM 954 CB LYS A 65 8.342 1.718 6.867 1.00 0.00 C ATOM 955 CG LYS A 65 8.345 1.780 8.385 1.00 0.00 C ATOM 956 CD LYS A 65 9.716 1.457 8.954 1.00 0.00 C ATOM 957 CE LYS A 65 9.634 0.388 10.033 1.00 0.00 C ATOM 958 NZ LYS A 65 10.933 0.212 10.740 1.00 0.00 N ATOM 0 H LYS A 65 6.782 0.359 4.974 1.00 0.00 H new ATOM 0 HA LYS A 65 6.333 2.471 6.996 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.667 0.727 6.552 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.071 2.430 6.481 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.041 2.775 8.710 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.611 1.077 8.780 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.373 1.117 8.153 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.161 2.361 9.369 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.862 0.658 10.754 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.334 -0.559 9.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.835 -0.525 11.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 11.665 -0.070 10.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 11.207 1.108 11.190 1.00 0.00 H new ATOM 972 N ILE A 66 6.400 4.101 5.146 1.00 0.00 N ATOM 973 CA ILE A 66 6.463 5.118 4.105 1.00 0.00 C ATOM 974 C ILE A 66 7.284 6.320 4.560 1.00 0.00 C ATOM 975 O ILE A 66 6.996 6.927 5.591 1.00 0.00 O ATOM 976 CB ILE A 66 5.057 5.596 3.697 1.00 0.00 C ATOM 977 CG1 ILE A 66 4.181 4.402 3.312 1.00 0.00 C ATOM 978 CG2 ILE A 66 5.147 6.587 2.546 1.00 0.00 C ATOM 979 CD1 ILE A 66 2.854 4.367 4.037 1.00 0.00 C ATOM 0 H ILE A 66 5.752 4.313 5.904 1.00 0.00 H new ATOM 0 HA ILE A 66 6.945 4.657 3.243 1.00 0.00 H new ATOM 0 HB ILE A 66 4.599 6.099 4.548 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.998 4.427 2.238 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.724 3.481 3.521 1.00 0.00 H new ATOM 0 HG21 ILE A 66 4.145 6.915 2.269 1.00 0.00 H new ATOM 0 HG22 ILE A 66 5.739 7.449 2.853 1.00 0.00 H new ATOM 0 HG23 ILE A 66 5.621 6.108 1.689 1.00 0.00 H new ATOM 0 HD11 ILE A 66 2.286 3.494 3.715 1.00 0.00 H new ATOM 0 HD12 ILE A 66 3.028 4.310 5.112 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.290 5.271 3.808 1.00 0.00 H new ATOM 991 N SER A 67 8.308 6.660 3.782 1.00 0.00 N ATOM 992 CA SER A 67 9.172 7.789 4.106 1.00 0.00 C ATOM 993 C SER A 67 9.318 8.722 2.908 1.00 0.00 C ATOM 994 O SER A 67 9.263 8.288 1.758 1.00 0.00 O ATOM 995 CB SER A 67 10.548 7.294 4.552 1.00 0.00 C ATOM 996 OG SER A 67 11.064 6.334 3.645 1.00 0.00 O ATOM 0 H SER A 67 8.559 6.170 2.924 1.00 0.00 H new ATOM 0 HA SER A 67 8.712 8.344 4.923 1.00 0.00 H new ATOM 0 HB2 SER A 67 11.235 8.137 4.624 1.00 0.00 H new ATOM 0 HB3 SER A 67 10.475 6.856 5.547 1.00 0.00 H new ATOM 0 HG SER A 67 11.945 6.034 3.952 1.00 0.00 H new ATOM 1002 N GLY A 68 9.505 10.008 3.188 1.00 0.00 N ATOM 1003 CA GLY A 68 9.657 10.985 2.123 1.00 0.00 C ATOM 1004 C GLY A 68 9.060 12.331 2.482 1.00 0.00 C ATOM 1005 O GLY A 68 8.778 12.603 3.649 1.00 0.00 O ATOM 0 H GLY A 68 9.554 10.392 4.132 1.00 0.00 H new ATOM 0 HA2 GLY A 68 10.716 11.109 1.897 1.00 0.00 H new ATOM 0 HA3 GLY A 68 9.180 10.609 1.218 1.00 0.00 H new ATOM 1009 N THR A 69 8.869 13.179 1.476 1.00 0.00 N ATOM 1010 CA THR A 69 8.305 14.505 1.691 1.00 0.00 C ATOM 1011 C THR A 69 6.808 14.428 1.974 1.00 0.00 C ATOM 1012 O THR A 69 6.135 13.489 1.548 1.00 0.00 O ATOM 1013 CB THR A 69 8.538 15.419 0.473 1.00 0.00 C ATOM 1014 OG1 THR A 69 7.870 14.885 -0.675 1.00 0.00 O ATOM 1015 CG2 THR A 69 10.025 15.562 0.182 1.00 0.00 C ATOM 0 H THR A 69 9.097 12.970 0.504 1.00 0.00 H new ATOM 0 HA THR A 69 8.815 14.928 2.557 1.00 0.00 H new ATOM 0 HB THR A 69 8.132 16.404 0.702 1.00 0.00 H new ATOM 0 HG1 THR A 69 8.022 15.473 -1.445 1.00 0.00 H new ATOM 0 HG21 THR A 69 10.166 16.212 -0.682 1.00 0.00 H new ATOM 0 HG22 THR A 69 10.525 15.996 1.048 1.00 0.00 H new ATOM 0 HG23 THR A 69 10.451 14.581 -0.029 1.00 0.00 H new ATOM 1023 N GLN A 70 6.295 15.419 2.694 1.00 0.00 N ATOM 1024 CA GLN A 70 4.878 15.461 3.034 1.00 0.00 C ATOM 1025 C GLN A 70 4.015 15.255 1.793 1.00 0.00 C ATOM 1026 O GLN A 70 2.838 14.907 1.893 1.00 0.00 O ATOM 1027 CB GLN A 70 4.529 16.795 3.696 1.00 0.00 C ATOM 1028 CG GLN A 70 3.135 16.830 4.299 1.00 0.00 C ATOM 1029 CD GLN A 70 3.091 16.260 5.702 1.00 0.00 C ATOM 1030 OE1 GLN A 70 3.507 16.910 6.663 1.00 0.00 O ATOM 1031 NE2 GLN A 70 2.586 15.039 5.831 1.00 0.00 N ATOM 0 H GLN A 70 6.839 16.204 3.053 1.00 0.00 H new ATOM 0 HA GLN A 70 4.674 14.652 3.735 1.00 0.00 H new ATOM 0 HB2 GLN A 70 5.259 17.005 4.478 1.00 0.00 H new ATOM 0 HB3 GLN A 70 4.616 17.591 2.957 1.00 0.00 H new ATOM 0 HG2 GLN A 70 2.777 17.860 4.318 1.00 0.00 H new ATOM 0 HG3 GLN A 70 2.453 16.268 3.661 1.00 0.00 H new ATOM 0 HE21 GLN A 70 2.253 14.536 5.009 1.00 0.00 H new ATOM 0 HE22 GLN A 70 2.531 14.604 6.752 1.00 0.00 H new ATOM 1040 N LYS A 71 4.607 15.473 0.624 1.00 0.00 N ATOM 1041 CA LYS A 71 3.894 15.310 -0.638 1.00 0.00 C ATOM 1042 C LYS A 71 3.843 13.842 -1.048 1.00 0.00 C ATOM 1043 O LYS A 71 2.860 13.387 -1.634 1.00 0.00 O ATOM 1044 CB LYS A 71 4.567 16.135 -1.737 1.00 0.00 C ATOM 1045 CG LYS A 71 4.260 17.620 -1.657 1.00 0.00 C ATOM 1046 CD LYS A 71 2.764 17.878 -1.606 1.00 0.00 C ATOM 1047 CE LYS A 71 2.432 19.313 -1.986 1.00 0.00 C ATOM 1048 NZ LYS A 71 1.213 19.395 -2.836 1.00 0.00 N ATOM 0 H LYS A 71 5.580 15.763 0.524 1.00 0.00 H new ATOM 0 HA LYS A 71 2.873 15.665 -0.499 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.646 15.992 -1.678 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.248 15.759 -2.709 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.733 18.043 -0.771 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.689 18.128 -2.521 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.253 17.194 -2.283 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.392 17.671 -0.603 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.284 19.903 -1.081 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.276 19.752 -2.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.021 20.389 -3.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.363 18.853 -3.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.402 19.000 -2.319 1.00 0.00 H new ATOM 1062 N GLU A 72 4.904 13.106 -0.735 1.00 0.00 N ATOM 1063 CA GLU A 72 4.978 11.690 -1.071 1.00 0.00 C ATOM 1064 C GLU A 72 4.319 10.838 0.011 1.00 0.00 C ATOM 1065 O GLU A 72 3.275 10.227 -0.214 1.00 0.00 O ATOM 1066 CB GLU A 72 6.435 11.261 -1.256 1.00 0.00 C ATOM 1067 CG GLU A 72 7.247 12.220 -2.111 1.00 0.00 C ATOM 1068 CD GLU A 72 8.739 12.100 -1.863 1.00 0.00 C ATOM 1069 OE1 GLU A 72 9.130 11.371 -0.929 1.00 0.00 O ATOM 1070 OE2 GLU A 72 9.515 12.736 -2.606 1.00 0.00 O ATOM 0 H GLU A 72 5.725 13.467 -0.249 1.00 0.00 H new ATOM 0 HA GLU A 72 4.441 11.538 -2.007 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.906 11.172 -0.277 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.459 10.271 -1.712 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.040 12.027 -3.164 1.00 0.00 H new ATOM 0 HG3 GLU A 72 6.929 13.242 -1.906 1.00 0.00 H new ATOM 1077 N VAL A 73 4.938 10.804 1.187 1.00 0.00 N ATOM 1078 CA VAL A 73 4.414 10.029 2.305 1.00 0.00 C ATOM 1079 C VAL A 73 2.891 10.079 2.341 1.00 0.00 C ATOM 1080 O VAL A 73 2.238 9.130 2.774 1.00 0.00 O ATOM 1081 CB VAL A 73 4.965 10.539 3.649 1.00 0.00 C ATOM 1082 CG1 VAL A 73 4.358 9.760 4.806 1.00 0.00 C ATOM 1083 CG2 VAL A 73 6.483 10.447 3.672 1.00 0.00 C ATOM 0 H VAL A 73 5.803 11.304 1.390 1.00 0.00 H new ATOM 0 HA VAL A 73 4.738 8.999 2.156 1.00 0.00 H new ATOM 0 HB VAL A 73 4.686 11.587 3.762 1.00 0.00 H new ATOM 0 HG11 VAL A 73 4.760 10.135 5.747 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.275 9.883 4.799 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.604 8.703 4.702 1.00 0.00 H new ATOM 0 HG21 VAL A 73 6.855 10.812 4.629 1.00 0.00 H new ATOM 0 HG22 VAL A 73 6.787 9.409 3.536 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.897 11.054 2.867 1.00 0.00 H new ATOM 1093 N ALA A 74 2.329 11.194 1.883 1.00 0.00 N ATOM 1094 CA ALA A 74 0.883 11.368 1.861 1.00 0.00 C ATOM 1095 C ALA A 74 0.277 10.765 0.598 1.00 0.00 C ATOM 1096 O ALA A 74 -0.782 10.139 0.644 1.00 0.00 O ATOM 1097 CB ALA A 74 0.526 12.843 1.967 1.00 0.00 C ATOM 0 H ALA A 74 2.855 11.990 1.522 1.00 0.00 H new ATOM 0 HA ALA A 74 0.466 10.842 2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -0.558 12.957 1.949 1.00 0.00 H new ATOM 0 HB2 ALA A 74 0.918 13.246 2.901 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.962 13.384 1.127 1.00 0.00 H new ATOM 1103 N ALA A 75 0.955 10.956 -0.528 1.00 0.00 N ATOM 1104 CA ALA A 75 0.484 10.430 -1.803 1.00 0.00 C ATOM 1105 C ALA A 75 0.662 8.917 -1.872 1.00 0.00 C ATOM 1106 O ALA A 75 -0.292 8.181 -2.122 1.00 0.00 O ATOM 1107 CB ALA A 75 1.217 11.101 -2.955 1.00 0.00 C ATOM 0 H ALA A 75 1.833 11.472 -0.583 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.580 10.650 -1.887 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.855 10.698 -3.901 1.00 0.00 H new ATOM 0 HB2 ALA A 75 1.036 12.175 -2.925 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.287 10.911 -2.866 1.00 0.00 H new ATOM 1113 N ALA A 76 1.890 8.459 -1.649 1.00 0.00 N ATOM 1114 CA ALA A 76 2.191 7.033 -1.684 1.00 0.00 C ATOM 1115 C ALA A 76 1.187 6.239 -0.858 1.00 0.00 C ATOM 1116 O ALA A 76 0.737 5.169 -1.270 1.00 0.00 O ATOM 1117 CB ALA A 76 3.606 6.781 -1.184 1.00 0.00 C ATOM 0 H ALA A 76 2.692 9.055 -1.442 1.00 0.00 H new ATOM 0 HA ALA A 76 2.117 6.696 -2.718 1.00 0.00 H new ATOM 0 HB1 ALA A 76 3.818 5.712 -1.215 1.00 0.00 H new ATOM 0 HB2 ALA A 76 4.316 7.311 -1.819 1.00 0.00 H new ATOM 0 HB3 ALA A 76 3.699 7.139 -0.159 1.00 0.00 H new ATOM 1123 N LYS A 77 0.838 6.768 0.310 1.00 0.00 N ATOM 1124 CA LYS A 77 -0.115 6.108 1.194 1.00 0.00 C ATOM 1125 C LYS A 77 -1.402 5.768 0.451 1.00 0.00 C ATOM 1126 O LYS A 77 -2.043 4.753 0.730 1.00 0.00 O ATOM 1127 CB LYS A 77 -0.429 7.002 2.396 1.00 0.00 C ATOM 1128 CG LYS A 77 -0.767 6.228 3.658 1.00 0.00 C ATOM 1129 CD LYS A 77 -1.409 7.122 4.707 1.00 0.00 C ATOM 1130 CE LYS A 77 -0.393 7.587 5.739 1.00 0.00 C ATOM 1131 NZ LYS A 77 -0.140 9.052 5.648 1.00 0.00 N ATOM 0 H LYS A 77 1.201 7.652 0.666 1.00 0.00 H new ATOM 0 HA LYS A 77 0.336 5.180 1.546 1.00 0.00 H new ATOM 0 HB2 LYS A 77 0.428 7.646 2.593 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.266 7.654 2.145 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.444 5.409 3.413 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.140 5.781 4.065 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.860 7.988 4.222 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.214 6.581 5.205 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -0.752 7.342 6.738 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.543 7.047 5.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.558 9.329 6.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.227 9.283 4.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.028 9.568 5.810 1.00 0.00 H new ATOM 1145 N HIS A 78 -1.776 6.620 -0.498 1.00 0.00 N ATOM 1146 CA HIS A 78 -2.987 6.408 -1.284 1.00 0.00 C ATOM 1147 C HIS A 78 -2.758 5.346 -2.355 1.00 0.00 C ATOM 1148 O HIS A 78 -3.668 4.588 -2.696 1.00 0.00 O ATOM 1149 CB HIS A 78 -3.434 7.718 -1.935 1.00 0.00 C ATOM 1150 CG HIS A 78 -4.835 7.675 -2.461 1.00 0.00 C ATOM 1151 ND1 HIS A 78 -5.892 8.309 -1.842 1.00 0.00 N ATOM 1152 CD2 HIS A 78 -5.350 7.073 -3.559 1.00 0.00 C ATOM 1153 CE1 HIS A 78 -6.996 8.096 -2.534 1.00 0.00 C ATOM 1154 NE2 HIS A 78 -6.695 7.349 -3.581 1.00 0.00 N ATOM 0 H HIS A 78 -1.258 7.464 -0.742 1.00 0.00 H new ATOM 0 HA HIS A 78 -3.771 6.059 -0.612 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -3.353 8.524 -1.205 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -2.754 7.959 -2.753 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -4.805 6.485 -4.283 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -7.979 8.469 -2.286 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -7.354 7.029 -4.290 1.00 0.00 H new ATOM 1162 N LEU A 79 -1.541 5.296 -2.883 1.00 0.00 N ATOM 1163 CA LEU A 79 -1.194 4.327 -3.918 1.00 0.00 C ATOM 1164 C LEU A 79 -1.035 2.931 -3.324 1.00 0.00 C ATOM 1165 O LEU A 79 -1.172 1.928 -4.025 1.00 0.00 O ATOM 1166 CB LEU A 79 0.098 4.745 -4.622 1.00 0.00 C ATOM 1167 CG LEU A 79 0.104 6.144 -5.239 1.00 0.00 C ATOM 1168 CD1 LEU A 79 1.481 6.477 -5.792 1.00 0.00 C ATOM 1169 CD2 LEU A 79 -0.952 6.249 -6.331 1.00 0.00 C ATOM 0 H LEU A 79 -0.777 5.915 -2.612 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.005 4.302 -4.646 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.916 4.683 -3.904 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.309 4.022 -5.409 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.136 6.866 -4.459 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.466 7.476 -6.227 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.215 6.443 -4.987 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.750 5.751 -6.559 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.934 7.251 -6.759 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.743 5.517 -7.111 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.936 6.054 -5.905 1.00 0.00 H new ATOM 1181 N ILE A 80 -0.746 2.874 -2.028 1.00 0.00 N ATOM 1182 CA ILE A 80 -0.573 1.601 -1.340 1.00 0.00 C ATOM 1183 C ILE A 80 -1.918 0.940 -1.059 1.00 0.00 C ATOM 1184 O ILE A 80 -2.091 -0.259 -1.282 1.00 0.00 O ATOM 1185 CB ILE A 80 0.187 1.778 -0.012 1.00 0.00 C ATOM 1186 CG1 ILE A 80 1.551 2.425 -0.262 1.00 0.00 C ATOM 1187 CG2 ILE A 80 0.351 0.437 0.687 1.00 0.00 C ATOM 1188 CD1 ILE A 80 2.056 3.243 0.906 1.00 0.00 C ATOM 0 H ILE A 80 -0.627 3.694 -1.434 1.00 0.00 H new ATOM 0 HA ILE A 80 0.012 0.962 -2.002 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.392 2.435 0.636 1.00 0.00 H new ATOM 0 HG12 ILE A 80 2.278 1.645 -0.490 1.00 0.00 H new ATOM 0 HG13 ILE A 80 1.484 3.065 -1.142 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.890 0.579 1.624 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.631 0.012 0.894 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.912 -0.242 0.045 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.027 3.671 0.657 1.00 0.00 H new ATOM 0 HD12 ILE A 80 1.350 4.045 1.121 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.155 2.603 1.783 1.00 0.00 H new ATOM 1200 N LEU A 81 -2.868 1.729 -0.568 1.00 0.00 N ATOM 1201 CA LEU A 81 -4.199 1.222 -0.258 1.00 0.00 C ATOM 1202 C LEU A 81 -4.929 0.793 -1.527 1.00 0.00 C ATOM 1203 O LEU A 81 -5.679 -0.183 -1.524 1.00 0.00 O ATOM 1204 CB LEU A 81 -5.015 2.287 0.477 1.00 0.00 C ATOM 1205 CG LEU A 81 -5.057 2.166 2.001 1.00 0.00 C ATOM 1206 CD1 LEU A 81 -5.009 3.542 2.647 1.00 0.00 C ATOM 1207 CD2 LEU A 81 -6.303 1.412 2.441 1.00 0.00 C ATOM 0 H LEU A 81 -2.740 2.723 -0.376 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.086 0.350 0.387 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.611 3.267 0.221 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.038 2.256 0.102 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.182 1.604 2.326 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.040 3.436 3.731 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.088 4.048 2.358 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.865 4.130 2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -6.317 1.335 3.528 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.190 1.948 2.104 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.296 0.412 2.007 1.00 0.00 H new ATOM 1219 N GLU A 82 -4.700 1.527 -2.611 1.00 0.00 N ATOM 1220 CA GLU A 82 -5.335 1.222 -3.889 1.00 0.00 C ATOM 1221 C GLU A 82 -5.265 -0.273 -4.186 1.00 0.00 C ATOM 1222 O GLU A 82 -6.139 -0.827 -4.855 1.00 0.00 O ATOM 1223 CB GLU A 82 -4.665 2.009 -5.017 1.00 0.00 C ATOM 1224 CG GLU A 82 -5.056 3.477 -5.049 1.00 0.00 C ATOM 1225 CD GLU A 82 -5.682 3.885 -6.369 1.00 0.00 C ATOM 1226 OE1 GLU A 82 -6.186 2.996 -7.087 1.00 0.00 O ATOM 1227 OE2 GLU A 82 -5.667 5.093 -6.685 1.00 0.00 O ATOM 0 H GLU A 82 -4.080 2.337 -2.631 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.383 1.514 -3.825 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.583 1.932 -4.910 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.924 1.552 -5.972 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.758 3.680 -4.240 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.173 4.089 -4.866 1.00 0.00 H new ATOM 1234 N LYS A 83 -4.220 -0.922 -3.686 1.00 0.00 N ATOM 1235 CA LYS A 83 -4.034 -2.354 -3.896 1.00 0.00 C ATOM 1236 C LYS A 83 -4.842 -3.161 -2.883 1.00 0.00 C ATOM 1237 O LYS A 83 -5.467 -4.163 -3.231 1.00 0.00 O ATOM 1238 CB LYS A 83 -2.552 -2.718 -3.788 1.00 0.00 C ATOM 1239 CG LYS A 83 -1.772 -2.474 -5.068 1.00 0.00 C ATOM 1240 CD LYS A 83 -1.675 -0.991 -5.388 1.00 0.00 C ATOM 1241 CE LYS A 83 -0.931 -0.749 -6.693 1.00 0.00 C ATOM 1242 NZ LYS A 83 -1.842 -0.802 -7.869 1.00 0.00 N ATOM 0 H LYS A 83 -3.487 -0.479 -3.132 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.390 -2.599 -4.897 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.102 -2.139 -2.982 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.464 -3.769 -3.513 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.770 -2.892 -4.970 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.255 -2.995 -5.895 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -2.677 -0.566 -5.455 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -1.163 -0.475 -4.575 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.441 0.224 -6.657 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.146 -1.497 -6.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.297 -0.632 -8.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.290 -1.739 -7.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -2.576 -0.072 -7.773 1.00 0.00 H new ATOM 1256 N VAL A 84 -4.824 -2.718 -1.630 1.00 0.00 N ATOM 1257 CA VAL A 84 -5.556 -3.398 -0.569 1.00 0.00 C ATOM 1258 C VAL A 84 -7.023 -3.577 -0.941 1.00 0.00 C ATOM 1259 O VAL A 84 -7.633 -4.600 -0.627 1.00 0.00 O ATOM 1260 CB VAL A 84 -5.466 -2.625 0.760 1.00 0.00 C ATOM 1261 CG1 VAL A 84 -6.247 -3.342 1.850 1.00 0.00 C ATOM 1262 CG2 VAL A 84 -4.013 -2.437 1.169 1.00 0.00 C ATOM 0 H VAL A 84 -4.310 -1.891 -1.325 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.094 -4.377 -0.443 1.00 0.00 H new ATOM 0 HB VAL A 84 -5.910 -1.640 0.618 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -6.171 -2.780 2.781 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -7.294 -3.419 1.557 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.836 -4.341 1.995 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -3.968 -1.889 2.110 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.541 -3.412 1.294 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.487 -1.876 0.397 1.00 0.00 H new ATOM 1272 N SER A 85 -7.585 -2.578 -1.614 1.00 0.00 N ATOM 1273 CA SER A 85 -8.982 -2.624 -2.026 1.00 0.00 C ATOM 1274 C SER A 85 -9.177 -3.604 -3.180 1.00 0.00 C ATOM 1275 O SER A 85 -10.211 -4.263 -3.279 1.00 0.00 O ATOM 1276 CB SER A 85 -9.460 -1.231 -2.441 1.00 0.00 C ATOM 1277 OG SER A 85 -10.528 -1.312 -3.369 1.00 0.00 O ATOM 0 H SER A 85 -7.093 -1.727 -1.885 1.00 0.00 H new ATOM 0 HA SER A 85 -9.573 -2.966 -1.177 1.00 0.00 H new ATOM 0 HB2 SER A 85 -9.782 -0.676 -1.560 1.00 0.00 H new ATOM 0 HB3 SER A 85 -8.632 -0.676 -2.882 1.00 0.00 H new ATOM 0 HG SER A 85 -10.816 -0.408 -3.617 1.00 0.00 H new ATOM 1283 N GLU A 86 -8.174 -3.693 -4.048 1.00 0.00 N ATOM 1284 CA GLU A 86 -8.234 -4.592 -5.194 1.00 0.00 C ATOM 1285 C GLU A 86 -8.426 -6.037 -4.743 1.00 0.00 C ATOM 1286 O GLU A 86 -9.429 -6.673 -5.071 1.00 0.00 O ATOM 1287 CB GLU A 86 -6.959 -4.473 -6.031 1.00 0.00 C ATOM 1288 CG GLU A 86 -6.980 -3.312 -7.011 1.00 0.00 C ATOM 1289 CD GLU A 86 -5.675 -3.165 -7.770 1.00 0.00 C ATOM 1290 OE1 GLU A 86 -5.096 -4.201 -8.157 1.00 0.00 O ATOM 1291 OE2 GLU A 86 -5.234 -2.016 -7.977 1.00 0.00 O ATOM 0 H GLU A 86 -7.311 -3.154 -3.979 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.089 -4.303 -5.805 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -6.105 -4.358 -5.363 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.809 -5.401 -6.583 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.795 -3.455 -7.721 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -7.187 -2.389 -6.470 1.00 0.00 H new ATOM 1298 N ASP A 87 -7.459 -6.549 -3.989 1.00 0.00 N ATOM 1299 CA ASP A 87 -7.522 -7.919 -3.492 1.00 0.00 C ATOM 1300 C ASP A 87 -8.721 -8.107 -2.568 1.00 0.00 C ATOM 1301 O ASP A 87 -9.472 -9.072 -2.702 1.00 0.00 O ATOM 1302 CB ASP A 87 -6.231 -8.274 -2.752 1.00 0.00 C ATOM 1303 CG ASP A 87 -5.993 -9.770 -2.690 1.00 0.00 C ATOM 1304 OD1 ASP A 87 -6.817 -10.476 -2.072 1.00 0.00 O ATOM 1305 OD2 ASP A 87 -4.983 -10.235 -3.259 1.00 0.00 O ATOM 0 H ASP A 87 -6.623 -6.036 -3.709 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.637 -8.585 -4.347 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.387 -7.795 -3.249 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.274 -7.873 -1.739 1.00 0.00 H new ATOM 1310 N GLU A 88 -8.892 -7.180 -1.632 1.00 0.00 N ATOM 1311 CA GLU A 88 -9.999 -7.246 -0.685 1.00 0.00 C ATOM 1312 C GLU A 88 -11.291 -7.654 -1.386 1.00 0.00 C ATOM 1313 O GLU A 88 -12.055 -8.472 -0.875 1.00 0.00 O ATOM 1314 CB GLU A 88 -10.187 -5.895 0.010 1.00 0.00 C ATOM 1315 CG GLU A 88 -11.486 -5.788 0.790 1.00 0.00 C ATOM 1316 CD GLU A 88 -11.409 -6.462 2.146 1.00 0.00 C ATOM 1317 OE1 GLU A 88 -10.759 -5.899 3.052 1.00 0.00 O ATOM 1318 OE2 GLU A 88 -11.999 -7.552 2.303 1.00 0.00 O ATOM 0 H GLU A 88 -8.279 -6.374 -1.509 1.00 0.00 H new ATOM 0 HA GLU A 88 -9.758 -8.001 0.064 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.351 -5.725 0.688 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -10.156 -5.103 -0.739 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -11.739 -4.736 0.925 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -12.292 -6.238 0.210 1.00 0.00 H new ATOM 1325 N GLU A 89 -11.528 -7.076 -2.560 1.00 0.00 N ATOM 1326 CA GLU A 89 -12.728 -7.379 -3.331 1.00 0.00 C ATOM 1327 C GLU A 89 -12.502 -8.581 -4.242 1.00 0.00 C ATOM 1328 O GLU A 89 -13.369 -9.444 -4.378 1.00 0.00 O ATOM 1329 CB GLU A 89 -13.145 -6.165 -4.164 1.00 0.00 C ATOM 1330 CG GLU A 89 -14.384 -5.460 -3.636 1.00 0.00 C ATOM 1331 CD GLU A 89 -15.045 -4.582 -4.680 1.00 0.00 C ATOM 1332 OE1 GLU A 89 -14.326 -3.811 -5.349 1.00 0.00 O ATOM 1333 OE2 GLU A 89 -16.283 -4.665 -4.827 1.00 0.00 O ATOM 0 H GLU A 89 -10.906 -6.396 -2.997 1.00 0.00 H new ATOM 0 HA GLU A 89 -13.527 -7.622 -2.630 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -12.319 -5.455 -4.195 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -13.329 -6.485 -5.190 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -15.100 -6.204 -3.287 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -14.111 -4.851 -2.774 1.00 0.00 H new ATOM 1340 N LEU A 90 -11.329 -8.630 -4.865 1.00 0.00 N ATOM 1341 CA LEU A 90 -10.987 -9.726 -5.765 1.00 0.00 C ATOM 1342 C LEU A 90 -11.284 -11.075 -5.117 1.00 0.00 C ATOM 1343 O LEU A 90 -11.705 -12.017 -5.789 1.00 0.00 O ATOM 1344 CB LEU A 90 -9.509 -9.649 -6.155 1.00 0.00 C ATOM 1345 CG LEU A 90 -8.633 -10.815 -5.695 1.00 0.00 C ATOM 1346 CD1 LEU A 90 -8.981 -12.080 -6.465 1.00 0.00 C ATOM 1347 CD2 LEU A 90 -7.159 -10.474 -5.866 1.00 0.00 C ATOM 0 H LEU A 90 -10.600 -7.924 -4.763 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.599 -9.632 -6.662 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.443 -9.577 -7.241 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.094 -8.726 -5.749 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.825 -10.993 -4.637 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.348 -12.899 -6.124 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.027 -12.334 -6.293 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.818 -11.914 -7.530 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -6.550 -11.315 -5.534 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.952 -10.269 -6.916 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.918 -9.594 -5.270 1.00 0.00 H new ATOM 1359 N ARG A 91 -11.065 -11.159 -3.810 1.00 0.00 N ATOM 1360 CA ARG A 91 -11.311 -12.392 -3.071 1.00 0.00 C ATOM 1361 C ARG A 91 -12.791 -12.536 -2.731 1.00 0.00 C ATOM 1362 O ARG A 91 -13.301 -13.647 -2.586 1.00 0.00 O ATOM 1363 CB ARG A 91 -10.477 -12.419 -1.789 1.00 0.00 C ATOM 1364 CG ARG A 91 -9.082 -12.992 -1.982 1.00 0.00 C ATOM 1365 CD ARG A 91 -8.219 -12.782 -0.748 1.00 0.00 C ATOM 1366 NE ARG A 91 -6.864 -13.295 -0.934 1.00 0.00 N ATOM 1367 CZ ARG A 91 -6.531 -14.570 -0.762 1.00 0.00 C ATOM 1368 NH1 ARG A 91 -7.449 -15.455 -0.400 1.00 0.00 N ATOM 1369 NH2 ARG A 91 -5.277 -14.960 -0.950 1.00 0.00 N ATOM 0 H ARG A 91 -10.717 -10.388 -3.240 1.00 0.00 H new ATOM 0 HA ARG A 91 -11.018 -13.230 -3.704 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -10.393 -11.405 -1.399 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -11.002 -13.008 -1.037 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -9.152 -14.057 -2.202 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -8.609 -12.520 -2.843 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -8.175 -11.719 -0.513 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -8.680 -13.278 0.106 1.00 0.00 H new ATOM 0 HE ARG A 91 -6.134 -12.639 -1.211 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -8.414 -15.158 -0.253 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -7.191 -16.433 -0.269 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.568 -14.281 -1.227 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -5.022 -15.939 -0.818 1.00 0.00 H new ATOM 1383 N LYS A 92 -13.476 -11.405 -2.603 1.00 0.00 N ATOM 1384 CA LYS A 92 -14.899 -11.403 -2.280 1.00 0.00 C ATOM 1385 C LYS A 92 -15.732 -11.801 -3.495 1.00 0.00 C ATOM 1386 O LYS A 92 -16.747 -12.487 -3.364 1.00 0.00 O ATOM 1387 CB LYS A 92 -15.328 -10.021 -1.784 1.00 0.00 C ATOM 1388 CG LYS A 92 -14.915 -9.733 -0.351 1.00 0.00 C ATOM 1389 CD LYS A 92 -16.112 -9.376 0.513 1.00 0.00 C ATOM 1390 CE LYS A 92 -16.234 -7.872 0.702 1.00 0.00 C ATOM 1391 NZ LYS A 92 -15.229 -7.350 1.669 1.00 0.00 N ATOM 0 H LYS A 92 -13.069 -10.477 -2.718 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.069 -12.134 -1.490 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -14.899 -9.261 -2.437 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -16.412 -9.936 -1.865 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -14.412 -10.605 0.066 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -14.197 -8.913 -0.336 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -17.022 -9.761 0.053 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -16.017 -9.859 1.485 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -16.106 -7.374 -0.259 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -17.237 -7.631 1.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -15.420 -6.346 1.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -15.289 -7.889 2.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -14.275 -7.450 1.267 1.00 0.00 H new ATOM 1405 N ARG A 93 -15.297 -11.369 -4.673 1.00 0.00 N ATOM 1406 CA ARG A 93 -16.004 -11.680 -5.910 1.00 0.00 C ATOM 1407 C ARG A 93 -16.059 -13.188 -6.139 1.00 0.00 C ATOM 1408 O ARG A 93 -16.821 -13.671 -6.978 1.00 0.00 O ATOM 1409 CB ARG A 93 -15.323 -10.998 -7.097 1.00 0.00 C ATOM 1410 CG ARG A 93 -15.408 -9.481 -7.058 1.00 0.00 C ATOM 1411 CD ARG A 93 -15.001 -8.865 -8.387 1.00 0.00 C ATOM 1412 NE ARG A 93 -15.950 -7.848 -8.833 1.00 0.00 N ATOM 1413 CZ ARG A 93 -17.183 -8.123 -9.243 1.00 0.00 C ATOM 1414 NH1 ARG A 93 -17.614 -9.377 -9.263 1.00 0.00 N ATOM 1415 NH2 ARG A 93 -17.987 -7.143 -9.633 1.00 0.00 N ATOM 0 H ARG A 93 -14.458 -10.802 -4.798 1.00 0.00 H new ATOM 0 HA ARG A 93 -17.024 -11.305 -5.821 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -14.274 -11.294 -7.123 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -15.778 -11.355 -8.021 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -16.426 -9.179 -6.813 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -14.763 -9.100 -6.266 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -14.011 -8.420 -8.292 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -14.927 -9.648 -9.142 1.00 0.00 H new ATOM 0 HE ARG A 93 -15.649 -6.873 -8.829 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -16.998 -10.133 -8.963 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -18.561 -9.586 -9.578 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -17.659 -6.177 -9.618 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -18.934 -7.355 -9.948 1.00 0.00 H new ATOM 1429 N ILE A 94 -15.245 -13.925 -5.391 1.00 0.00 N ATOM 1430 CA ILE A 94 -15.202 -15.377 -5.512 1.00 0.00 C ATOM 1431 C ILE A 94 -16.186 -16.039 -4.553 1.00 0.00 C ATOM 1432 O ILE A 94 -16.930 -16.940 -4.937 1.00 0.00 O ATOM 1433 CB ILE A 94 -13.788 -15.923 -5.237 1.00 0.00 C ATOM 1434 CG1 ILE A 94 -12.732 -14.979 -5.815 1.00 0.00 C ATOM 1435 CG2 ILE A 94 -13.637 -17.319 -5.822 1.00 0.00 C ATOM 1436 CD1 ILE A 94 -12.884 -14.738 -7.301 1.00 0.00 C ATOM 0 H ILE A 94 -14.606 -13.541 -4.695 1.00 0.00 H new ATOM 0 HA ILE A 94 -15.482 -15.616 -6.538 1.00 0.00 H new ATOM 0 HB ILE A 94 -13.641 -15.985 -4.159 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -12.786 -14.024 -5.293 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -11.742 -15.392 -5.622 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -12.633 -17.692 -5.620 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -14.370 -17.985 -5.367 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -13.800 -17.282 -6.899 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -12.102 -14.060 -7.641 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -12.800 -15.685 -7.834 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -13.860 -14.295 -7.500 1.00 0.00 H new ATOM 1448 N ALA A 95 -16.184 -15.583 -3.304 1.00 0.00 N ATOM 1449 CA ALA A 95 -17.079 -16.128 -2.292 1.00 0.00 C ATOM 1450 C ALA A 95 -18.539 -15.919 -2.679 1.00 0.00 C ATOM 1451 O ALA A 95 -19.373 -16.807 -2.500 1.00 0.00 O ATOM 1452 CB ALA A 95 -16.794 -15.493 -0.939 1.00 0.00 C ATOM 0 H ALA A 95 -15.573 -14.838 -2.970 1.00 0.00 H new ATOM 0 HA ALA A 95 -16.899 -17.201 -2.224 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -17.470 -15.909 -0.192 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -15.763 -15.699 -0.650 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -16.944 -14.415 -1.004 1.00 0.00 H new ATOM 1458 N HIS A 96 -18.842 -14.738 -3.210 1.00 0.00 N ATOM 1459 CA HIS A 96 -20.203 -14.412 -3.622 1.00 0.00 C ATOM 1460 C HIS A 96 -20.578 -15.159 -4.899 1.00 0.00 C ATOM 1461 O HIS A 96 -19.867 -15.087 -5.902 1.00 0.00 O ATOM 1462 CB HIS A 96 -20.346 -12.905 -3.839 1.00 0.00 C ATOM 1463 CG HIS A 96 -21.292 -12.250 -2.881 1.00 0.00 C ATOM 1464 ND1 HIS A 96 -22.555 -12.737 -2.619 1.00 0.00 N ATOM 1465 CD2 HIS A 96 -21.153 -11.139 -2.119 1.00 0.00 C ATOM 1466 CE1 HIS A 96 -23.152 -11.954 -1.738 1.00 0.00 C ATOM 1467 NE2 HIS A 96 -22.323 -10.977 -1.418 1.00 0.00 N ATOM 0 H HIS A 96 -18.164 -13.992 -3.365 1.00 0.00 H new ATOM 0 HA HIS A 96 -20.881 -14.723 -2.827 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -19.366 -12.438 -3.745 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -20.690 -12.724 -4.857 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -20.284 -10.500 -2.071 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -24.149 -12.090 -1.346 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -22.520 -10.225 -0.758 1.00 0.00 H new ATOM 1475 N SER A 97 -21.695 -15.876 -4.853 1.00 0.00 N ATOM 1476 CA SER A 97 -22.161 -16.640 -6.005 1.00 0.00 C ATOM 1477 C SER A 97 -23.686 -16.648 -6.070 1.00 0.00 C ATOM 1478 O SER A 97 -24.358 -16.941 -5.082 1.00 0.00 O ATOM 1479 CB SER A 97 -21.634 -18.075 -5.939 1.00 0.00 C ATOM 1480 OG SER A 97 -20.747 -18.342 -7.012 1.00 0.00 O ATOM 0 H SER A 97 -22.295 -15.944 -4.031 1.00 0.00 H new ATOM 0 HA SER A 97 -21.779 -16.162 -6.907 1.00 0.00 H new ATOM 0 HB2 SER A 97 -21.121 -18.234 -4.991 1.00 0.00 H new ATOM 0 HB3 SER A 97 -22.469 -18.774 -5.971 1.00 0.00 H new ATOM 0 HG SER A 97 -20.423 -19.264 -6.947 1.00 0.00 H new ATOM 1486 N ALA A 98 -24.224 -16.327 -7.242 1.00 0.00 N ATOM 1487 CA ALA A 98 -25.667 -16.299 -7.438 1.00 0.00 C ATOM 1488 C ALA A 98 -26.184 -17.658 -7.901 1.00 0.00 C ATOM 1489 O ALA A 98 -26.815 -18.385 -7.136 1.00 0.00 O ATOM 1490 CB ALA A 98 -26.043 -15.220 -8.443 1.00 0.00 C ATOM 0 H ALA A 98 -23.681 -16.083 -8.070 1.00 0.00 H new ATOM 0 HA ALA A 98 -26.134 -16.067 -6.481 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -27.124 -15.211 -8.579 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -25.716 -14.248 -8.073 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -25.559 -15.427 -9.397 1.00 0.00 H new ATOM 1496 N SER A 99 -25.913 -17.991 -9.158 1.00 0.00 N ATOM 1497 CA SER A 99 -26.355 -19.261 -9.725 1.00 0.00 C ATOM 1498 C SER A 99 -25.371 -19.757 -10.781 1.00 0.00 C ATOM 1499 O SER A 99 -25.011 -19.025 -11.702 1.00 0.00 O ATOM 1500 CB SER A 99 -27.748 -19.112 -10.340 1.00 0.00 C ATOM 1501 OG SER A 99 -28.332 -20.379 -10.591 1.00 0.00 O ATOM 0 H SER A 99 -25.390 -17.400 -9.804 1.00 0.00 H new ATOM 0 HA SER A 99 -26.397 -19.995 -8.920 1.00 0.00 H new ATOM 0 HB2 SER A 99 -28.387 -18.540 -9.667 1.00 0.00 H new ATOM 0 HB3 SER A 99 -27.680 -18.548 -11.271 1.00 0.00 H new ATOM 0 HG SER A 99 -29.222 -20.257 -10.982 1.00 0.00 H new ATOM 1507 N GLY A 100 -24.940 -21.007 -10.638 1.00 0.00 N ATOM 1508 CA GLY A 100 -24.002 -21.580 -11.586 1.00 0.00 C ATOM 1509 C GLY A 100 -22.559 -21.348 -11.186 1.00 0.00 C ATOM 1510 O GLY A 100 -22.263 -20.916 -10.071 1.00 0.00 O ATOM 0 H GLY A 100 -25.223 -21.632 -9.884 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -24.185 -22.651 -11.671 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -24.177 -21.148 -12.571 1.00 0.00 H new ATOM 1514 N PRO A 101 -21.630 -21.639 -12.109 1.00 0.00 N ATOM 1515 CA PRO A 101 -20.195 -21.469 -11.869 1.00 0.00 C ATOM 1516 C PRO A 101 -19.791 -20.000 -11.785 1.00 0.00 C ATOM 1517 O PRO A 101 -18.619 -19.679 -11.586 1.00 0.00 O ATOM 1518 CB PRO A 101 -19.549 -22.132 -13.089 1.00 0.00 C ATOM 1519 CG PRO A 101 -20.584 -22.047 -14.157 1.00 0.00 C ATOM 1520 CD PRO A 101 -21.911 -22.157 -13.458 1.00 0.00 C ATOM 0 HA PRO A 101 -19.887 -21.904 -10.918 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -18.634 -21.617 -13.382 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -19.279 -23.167 -12.881 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -20.507 -21.106 -14.701 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -20.459 -22.848 -14.886 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -22.680 -21.571 -13.961 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -22.265 -23.188 -13.427 1.00 0.00 H new ATOM 1528 N SER A 102 -20.769 -19.113 -11.937 1.00 0.00 N ATOM 1529 CA SER A 102 -20.515 -17.678 -11.880 1.00 0.00 C ATOM 1530 C SER A 102 -19.828 -17.198 -13.156 1.00 0.00 C ATOM 1531 O SER A 102 -18.605 -17.259 -13.275 1.00 0.00 O ATOM 1532 CB SER A 102 -19.652 -17.338 -10.664 1.00 0.00 C ATOM 1533 OG SER A 102 -20.068 -16.123 -10.067 1.00 0.00 O ATOM 0 H SER A 102 -21.744 -19.363 -12.101 1.00 0.00 H new ATOM 0 HA SER A 102 -21.474 -17.168 -11.789 1.00 0.00 H new ATOM 0 HB2 SER A 102 -19.713 -18.145 -9.934 1.00 0.00 H new ATOM 0 HB3 SER A 102 -18.608 -17.260 -10.966 1.00 0.00 H new ATOM 0 HG SER A 102 -19.502 -15.929 -9.291 1.00 0.00 H new ATOM 1539 N SER A 103 -20.624 -16.722 -14.106 1.00 0.00 N ATOM 1540 CA SER A 103 -20.096 -16.234 -15.375 1.00 0.00 C ATOM 1541 C SER A 103 -19.718 -14.759 -15.276 1.00 0.00 C ATOM 1542 O SER A 103 -20.117 -13.947 -16.108 1.00 0.00 O ATOM 1543 CB SER A 103 -21.123 -16.435 -16.491 1.00 0.00 C ATOM 1544 OG SER A 103 -21.259 -17.807 -16.818 1.00 0.00 O ATOM 0 H SER A 103 -21.639 -16.663 -14.022 1.00 0.00 H new ATOM 0 HA SER A 103 -19.198 -16.806 -15.610 1.00 0.00 H new ATOM 0 HB2 SER A 103 -22.088 -16.035 -16.178 1.00 0.00 H new ATOM 0 HB3 SER A 103 -20.818 -15.876 -17.375 1.00 0.00 H new ATOM 0 HG SER A 103 -21.922 -17.909 -17.532 1.00 0.00 H new ATOM 1550 N GLY A 104 -18.944 -14.422 -14.248 1.00 0.00 N ATOM 1551 CA GLY A 104 -18.524 -13.046 -14.057 1.00 0.00 C ATOM 1552 C GLY A 104 -17.310 -12.689 -14.890 1.00 0.00 C ATOM 1553 O GLY A 104 -17.380 -12.655 -16.120 1.00 0.00 O ATOM 0 H GLY A 104 -18.601 -15.077 -13.545 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -19.347 -12.379 -14.315 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -18.299 -12.881 -13.003 1.00 0.00 H new TER 1557 GLY A 104