USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 657 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 57 LYS NZ :NH3+ -124:sc= 0 (180deg=-1.23) USER MOD Set 1.2: A 61 LYS NZ :NH3+ -145:sc= -0.0147 (180deg=-1.47!) USER MOD Set 2.1: A 13 ASN : amide:sc= -0.233 X(o=-0.22,f=-0.41) USER MOD Set 2.2: A 25 TYR OH : rot 45:sc= 0.011 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 41:sc= 0.476 USER MOD Single : A 5 SER OG : rot -160:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -157:sc= -0.0377 (180deg=-0.302) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.0475 K(o=-0.047,f=-1!) USER MOD Single : A 27 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 28 CYS SG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 40 CYS SG : rot 100:sc= -5.28 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 150:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.202 USER MOD Single : A 53 SER OG : rot 28:sc= 0.546 USER MOD Single : A 56 THR OG1 : rot 180:sc=-0.00812 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= -5.26! C(o=-5.3!,f=-5!) USER MOD Single : A 66 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0806) USER MOD Single : A 69 TYR OH : rot 180:sc= -0.032 USER MOD Single : A 70 GLN : amide:sc= -0.0602 X(o=-0.06,f=-0.44) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot -50:sc= 0.6 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= -0.135 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.330 -23.218 -11.841 1.00 0.00 N ATOM 2 CA GLY A 1 -1.019 -21.882 -12.314 1.00 0.00 C ATOM 3 C GLY A 1 -0.905 -20.879 -11.184 1.00 0.00 C ATOM 4 O GLY A 1 -1.871 -20.636 -10.461 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.397 -23.866 -12.651 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.579 -23.543 -11.199 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.237 -23.204 -11.333 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.082 -21.906 -12.870 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.794 -21.556 -13.008 1.00 0.00 H new ATOM 8 N SER A 2 0.279 -20.294 -11.031 1.00 0.00 N ATOM 9 CA SER A 2 0.517 -19.315 -9.977 1.00 0.00 C ATOM 10 C SER A 2 -0.248 -18.024 -10.252 1.00 0.00 C ATOM 11 O SER A 2 0.315 -17.049 -10.749 1.00 0.00 O ATOM 12 CB SER A 2 2.013 -19.018 -9.855 1.00 0.00 C ATOM 13 OG SER A 2 2.712 -20.132 -9.326 1.00 0.00 O ATOM 0 H SER A 2 1.088 -20.481 -11.623 1.00 0.00 H new ATOM 0 HA SER A 2 0.160 -19.736 -9.037 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.417 -18.762 -10.834 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.164 -18.151 -9.212 1.00 0.00 H new ATOM 0 HG SER A 2 3.666 -19.918 -9.259 1.00 0.00 H new ATOM 19 N SER A 3 -1.537 -18.026 -9.925 1.00 0.00 N ATOM 20 CA SER A 3 -2.382 -16.857 -10.140 1.00 0.00 C ATOM 21 C SER A 3 -1.845 -15.650 -9.376 1.00 0.00 C ATOM 22 O SER A 3 -1.902 -15.603 -8.148 1.00 0.00 O ATOM 23 CB SER A 3 -3.818 -17.152 -9.704 1.00 0.00 C ATOM 24 OG SER A 3 -3.861 -17.604 -8.362 1.00 0.00 O ATOM 0 H SER A 3 -2.018 -18.824 -9.510 1.00 0.00 H new ATOM 0 HA SER A 3 -2.373 -16.625 -11.205 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.425 -16.252 -9.808 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.253 -17.907 -10.359 1.00 0.00 H new ATOM 0 HG SER A 3 -3.232 -17.083 -7.821 1.00 0.00 H new ATOM 30 N GLY A 4 -1.322 -14.675 -10.114 1.00 0.00 N ATOM 31 CA GLY A 4 -0.782 -13.482 -9.490 1.00 0.00 C ATOM 32 C GLY A 4 -1.864 -12.511 -9.062 1.00 0.00 C ATOM 33 O GLY A 4 -2.933 -12.922 -8.610 1.00 0.00 O ATOM 0 H GLY A 4 -1.263 -14.691 -11.132 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.189 -13.767 -8.621 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.107 -12.985 -10.187 1.00 0.00 H new ATOM 37 N SER A 5 -1.586 -11.218 -9.202 1.00 0.00 N ATOM 38 CA SER A 5 -2.543 -10.185 -8.820 1.00 0.00 C ATOM 39 C SER A 5 -2.650 -9.117 -9.904 1.00 0.00 C ATOM 40 O SER A 5 -1.640 -8.606 -10.389 1.00 0.00 O ATOM 41 CB SER A 5 -2.131 -9.543 -7.494 1.00 0.00 C ATOM 42 OG SER A 5 -2.197 -10.479 -6.432 1.00 0.00 O ATOM 0 H SER A 5 -0.707 -10.861 -9.577 1.00 0.00 H new ATOM 0 HA SER A 5 -3.519 -10.655 -8.699 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.117 -9.152 -7.575 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.783 -8.697 -7.278 1.00 0.00 H new ATOM 0 HG SER A 5 -2.245 -10.001 -5.578 1.00 0.00 H new ATOM 48 N SER A 6 -3.881 -8.785 -10.279 1.00 0.00 N ATOM 49 CA SER A 6 -4.121 -7.780 -11.309 1.00 0.00 C ATOM 50 C SER A 6 -3.216 -6.569 -11.108 1.00 0.00 C ATOM 51 O SER A 6 -2.583 -6.090 -12.048 1.00 0.00 O ATOM 52 CB SER A 6 -5.587 -7.343 -11.292 1.00 0.00 C ATOM 53 OG SER A 6 -5.865 -6.450 -12.357 1.00 0.00 O ATOM 0 H SER A 6 -4.727 -9.197 -9.886 1.00 0.00 H new ATOM 0 HA SER A 6 -3.892 -8.226 -12.277 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.232 -8.218 -11.370 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.815 -6.862 -10.341 1.00 0.00 H new ATOM 0 HG SER A 6 -6.808 -6.187 -12.325 1.00 0.00 H new ATOM 59 N GLY A 7 -3.159 -6.078 -9.873 1.00 0.00 N ATOM 60 CA GLY A 7 -2.329 -4.927 -9.570 1.00 0.00 C ATOM 61 C GLY A 7 -1.640 -5.048 -8.225 1.00 0.00 C ATOM 62 O GLY A 7 -1.763 -6.067 -7.546 1.00 0.00 O ATOM 0 H GLY A 7 -3.673 -6.457 -9.078 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.577 -4.809 -10.351 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.943 -4.027 -9.581 1.00 0.00 H new ATOM 66 N TYR A 8 -0.911 -4.006 -7.841 1.00 0.00 N ATOM 67 CA TYR A 8 -0.195 -4.001 -6.570 1.00 0.00 C ATOM 68 C TYR A 8 -1.053 -3.394 -5.464 1.00 0.00 C ATOM 69 O TYR A 8 -0.948 -3.781 -4.300 1.00 0.00 O ATOM 70 CB TYR A 8 1.114 -3.222 -6.702 1.00 0.00 C ATOM 71 CG TYR A 8 1.710 -3.268 -8.091 1.00 0.00 C ATOM 72 CD1 TYR A 8 1.227 -2.445 -9.102 1.00 0.00 C ATOM 73 CD2 TYR A 8 2.753 -4.133 -8.393 1.00 0.00 C ATOM 74 CE1 TYR A 8 1.767 -2.484 -10.373 1.00 0.00 C ATOM 75 CE2 TYR A 8 3.300 -4.178 -9.661 1.00 0.00 C ATOM 76 CZ TYR A 8 2.804 -3.351 -10.647 1.00 0.00 C ATOM 77 OH TYR A 8 3.345 -3.393 -11.911 1.00 0.00 O ATOM 0 H TYR A 8 -0.800 -3.154 -8.391 1.00 0.00 H new ATOM 0 HA TYR A 8 0.030 -5.034 -6.304 1.00 0.00 H new ATOM 0 HB2 TYR A 8 0.937 -2.182 -6.426 1.00 0.00 H new ATOM 0 HB3 TYR A 8 1.838 -3.622 -5.992 1.00 0.00 H new ATOM 0 HD1 TYR A 8 0.416 -1.764 -8.890 1.00 0.00 H new ATOM 0 HD2 TYR A 8 3.144 -4.782 -7.623 1.00 0.00 H new ATOM 0 HE1 TYR A 8 1.379 -1.839 -11.148 1.00 0.00 H new ATOM 0 HE2 TYR A 8 4.111 -4.857 -9.879 1.00 0.00 H new ATOM 0 HH TYR A 8 4.067 -4.055 -11.936 1.00 0.00 H new ATOM 87 N ILE A 9 -1.901 -2.442 -5.838 1.00 0.00 N ATOM 88 CA ILE A 9 -2.778 -1.782 -4.879 1.00 0.00 C ATOM 89 C ILE A 9 -3.206 -2.742 -3.774 1.00 0.00 C ATOM 90 O ILE A 9 -3.229 -2.381 -2.598 1.00 0.00 O ATOM 91 CB ILE A 9 -4.034 -1.213 -5.564 1.00 0.00 C ATOM 92 CG1 ILE A 9 -3.642 -0.378 -6.785 1.00 0.00 C ATOM 93 CG2 ILE A 9 -4.841 -0.377 -4.581 1.00 0.00 C ATOM 94 CD1 ILE A 9 -2.628 0.702 -6.478 1.00 0.00 C ATOM 0 H ILE A 9 -1.999 -2.111 -6.798 1.00 0.00 H new ATOM 0 HA ILE A 9 -2.208 -0.961 -4.443 1.00 0.00 H new ATOM 0 HB ILE A 9 -4.655 -2.044 -5.900 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -3.237 -1.038 -7.552 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.537 0.083 -7.202 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -5.726 0.018 -5.080 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -5.147 -0.999 -3.740 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.229 0.449 -4.218 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -2.397 1.254 -7.389 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -3.038 1.385 -5.734 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -1.717 0.246 -6.089 1.00 0.00 H new ATOM 106 N GLY A 10 -3.543 -3.968 -4.161 1.00 0.00 N ATOM 107 CA GLY A 10 -3.965 -4.962 -3.191 1.00 0.00 C ATOM 108 C GLY A 10 -2.820 -5.841 -2.727 1.00 0.00 C ATOM 109 O GLY A 10 -2.815 -6.320 -1.592 1.00 0.00 O ATOM 0 H GLY A 10 -3.531 -4.291 -5.128 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -4.406 -4.460 -2.330 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -4.744 -5.586 -3.630 1.00 0.00 H new ATOM 113 N LEU A 11 -1.848 -6.056 -3.607 1.00 0.00 N ATOM 114 CA LEU A 11 -0.692 -6.886 -3.282 1.00 0.00 C ATOM 115 C LEU A 11 -0.287 -6.708 -1.822 1.00 0.00 C ATOM 116 O LEU A 11 -0.165 -7.681 -1.078 1.00 0.00 O ATOM 117 CB LEU A 11 0.484 -6.536 -4.195 1.00 0.00 C ATOM 118 CG LEU A 11 0.518 -7.248 -5.548 1.00 0.00 C ATOM 119 CD1 LEU A 11 1.735 -6.812 -6.350 1.00 0.00 C ATOM 120 CD2 LEU A 11 0.517 -8.758 -5.356 1.00 0.00 C ATOM 0 H LEU A 11 -1.837 -5.668 -4.550 1.00 0.00 H new ATOM 0 HA LEU A 11 -0.969 -7.929 -3.439 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.472 -5.461 -4.373 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.409 -6.761 -3.665 1.00 0.00 H new ATOM 0 HG LEU A 11 -0.377 -6.972 -6.105 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.743 -7.329 -7.310 1.00 0.00 H new ATOM 0 HD12 LEU A 11 1.694 -5.736 -6.518 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.642 -7.059 -5.798 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.541 -9.249 -6.329 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.394 -9.052 -4.779 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.385 -9.056 -4.822 1.00 0.00 H new ATOM 132 N VAL A 12 -0.083 -5.458 -1.418 1.00 0.00 N ATOM 133 CA VAL A 12 0.305 -5.152 -0.046 1.00 0.00 C ATOM 134 C VAL A 12 -0.701 -5.721 0.949 1.00 0.00 C ATOM 135 O VAL A 12 -0.351 -6.528 1.808 1.00 0.00 O ATOM 136 CB VAL A 12 0.429 -3.633 0.177 1.00 0.00 C ATOM 137 CG1 VAL A 12 0.702 -3.329 1.642 1.00 0.00 C ATOM 138 CG2 VAL A 12 1.520 -3.052 -0.710 1.00 0.00 C ATOM 0 H VAL A 12 -0.180 -4.641 -2.021 1.00 0.00 H new ATOM 0 HA VAL A 12 1.277 -5.616 0.119 1.00 0.00 H new ATOM 0 HB VAL A 12 -0.517 -3.164 -0.096 1.00 0.00 H new ATOM 0 HG11 VAL A 12 0.787 -2.251 1.780 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -0.117 -3.710 2.251 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.633 -3.808 1.946 1.00 0.00 H new ATOM 0 HG21 VAL A 12 1.594 -1.978 -0.540 1.00 0.00 H new ATOM 0 HG22 VAL A 12 2.473 -3.524 -0.471 1.00 0.00 H new ATOM 0 HG23 VAL A 12 1.276 -3.237 -1.756 1.00 0.00 H new ATOM 148 N ASN A 13 -1.953 -5.293 0.826 1.00 0.00 N ATOM 149 CA ASN A 13 -3.011 -5.759 1.714 1.00 0.00 C ATOM 150 C ASN A 13 -2.786 -7.215 2.111 1.00 0.00 C ATOM 151 O ASN A 13 -2.667 -7.536 3.293 1.00 0.00 O ATOM 152 CB ASN A 13 -4.376 -5.608 1.040 1.00 0.00 C ATOM 153 CG ASN A 13 -5.006 -4.254 1.308 1.00 0.00 C ATOM 154 OD1 ASN A 13 -5.037 -3.786 2.446 1.00 0.00 O ATOM 155 ND2 ASN A 13 -5.513 -3.620 0.258 1.00 0.00 N ATOM 0 H ASN A 13 -2.260 -4.624 0.120 1.00 0.00 H new ATOM 0 HA ASN A 13 -2.989 -5.147 2.616 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -4.265 -5.748 -0.035 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -5.043 -6.393 1.396 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -5.951 -2.706 0.376 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -5.465 -4.046 -0.667 1.00 0.00 H new ATOM 162 N SER A 14 -2.729 -8.092 1.114 1.00 0.00 N ATOM 163 CA SER A 14 -2.521 -9.515 1.358 1.00 0.00 C ATOM 164 C SER A 14 -1.104 -9.779 1.858 1.00 0.00 C ATOM 165 O SER A 14 -0.896 -10.568 2.780 1.00 0.00 O ATOM 166 CB SER A 14 -2.781 -10.316 0.081 1.00 0.00 C ATOM 167 OG SER A 14 -4.125 -10.173 -0.346 1.00 0.00 O ATOM 0 H SER A 14 -2.824 -7.842 0.130 1.00 0.00 H new ATOM 0 HA SER A 14 -3.224 -9.833 2.128 1.00 0.00 H new ATOM 0 HB2 SER A 14 -2.108 -9.979 -0.707 1.00 0.00 H new ATOM 0 HB3 SER A 14 -2.562 -11.369 0.258 1.00 0.00 H new ATOM 0 HG SER A 14 -4.265 -10.693 -1.165 1.00 0.00 H new ATOM 173 N PHE A 15 -0.133 -9.113 1.243 1.00 0.00 N ATOM 174 CA PHE A 15 1.266 -9.276 1.623 1.00 0.00 C ATOM 175 C PHE A 15 1.430 -9.193 3.138 1.00 0.00 C ATOM 176 O PHE A 15 1.712 -10.192 3.798 1.00 0.00 O ATOM 177 CB PHE A 15 2.128 -8.209 0.946 1.00 0.00 C ATOM 178 CG PHE A 15 3.576 -8.591 0.833 1.00 0.00 C ATOM 179 CD1 PHE A 15 4.350 -8.770 1.968 1.00 0.00 C ATOM 180 CD2 PHE A 15 4.163 -8.773 -0.409 1.00 0.00 C ATOM 181 CE1 PHE A 15 5.683 -9.121 1.867 1.00 0.00 C ATOM 182 CE2 PHE A 15 5.496 -9.125 -0.517 1.00 0.00 C ATOM 183 CZ PHE A 15 6.256 -9.300 0.623 1.00 0.00 C ATOM 0 H PHE A 15 -0.289 -8.455 0.479 1.00 0.00 H new ATOM 0 HA PHE A 15 1.595 -10.261 1.293 1.00 0.00 H new ATOM 0 HB2 PHE A 15 1.733 -8.013 -0.051 1.00 0.00 H new ATOM 0 HB3 PHE A 15 2.049 -7.279 1.508 1.00 0.00 H new ATOM 0 HD1 PHE A 15 3.907 -8.634 2.943 1.00 0.00 H new ATOM 0 HD2 PHE A 15 3.573 -8.638 -1.303 1.00 0.00 H new ATOM 0 HE1 PHE A 15 6.276 -9.255 2.760 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.942 -9.263 -1.491 1.00 0.00 H new ATOM 0 HZ PHE A 15 7.297 -9.576 0.542 1.00 0.00 H new ATOM 193 N ALA A 16 1.252 -7.993 3.682 1.00 0.00 N ATOM 194 CA ALA A 16 1.379 -7.779 5.118 1.00 0.00 C ATOM 195 C ALA A 16 0.869 -8.984 5.900 1.00 0.00 C ATOM 196 O ALA A 16 1.558 -9.502 6.778 1.00 0.00 O ATOM 197 CB ALA A 16 0.628 -6.522 5.532 1.00 0.00 C ATOM 0 H ALA A 16 1.019 -7.155 3.150 1.00 0.00 H new ATOM 0 HA ALA A 16 2.436 -7.650 5.349 1.00 0.00 H new ATOM 0 HB1 ALA A 16 0.731 -6.374 6.607 1.00 0.00 H new ATOM 0 HB2 ALA A 16 1.041 -5.661 5.006 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -0.427 -6.629 5.280 1.00 0.00 H new ATOM 203 N GLN A 17 -0.343 -9.425 5.576 1.00 0.00 N ATOM 204 CA GLN A 17 -0.945 -10.569 6.250 1.00 0.00 C ATOM 205 C GLN A 17 0.028 -11.742 6.306 1.00 0.00 C ATOM 206 O GLN A 17 0.210 -12.361 7.354 1.00 0.00 O ATOM 207 CB GLN A 17 -2.230 -10.990 5.535 1.00 0.00 C ATOM 208 CG GLN A 17 -3.207 -11.736 6.430 1.00 0.00 C ATOM 209 CD GLN A 17 -4.112 -12.672 5.653 1.00 0.00 C ATOM 210 OE1 GLN A 17 -3.656 -13.667 5.088 1.00 0.00 O ATOM 211 NE2 GLN A 17 -5.402 -12.359 5.622 1.00 0.00 N ATOM 0 H GLN A 17 -0.927 -9.007 4.851 1.00 0.00 H new ATOM 0 HA GLN A 17 -1.186 -10.272 7.271 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -2.721 -10.103 5.135 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -1.973 -11.622 4.685 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.650 -12.308 7.172 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.817 -11.016 6.975 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -5.736 -11.525 6.105 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.059 -12.953 5.116 1.00 0.00 H new ATOM 220 N LYS A 18 0.651 -12.042 5.172 1.00 0.00 N ATOM 221 CA LYS A 18 1.607 -13.140 5.091 1.00 0.00 C ATOM 222 C LYS A 18 2.703 -12.986 6.140 1.00 0.00 C ATOM 223 O LYS A 18 3.115 -13.960 6.770 1.00 0.00 O ATOM 224 CB LYS A 18 2.229 -13.200 3.694 1.00 0.00 C ATOM 225 CG LYS A 18 1.207 -13.337 2.579 1.00 0.00 C ATOM 226 CD LYS A 18 1.874 -13.388 1.214 1.00 0.00 C ATOM 227 CE LYS A 18 2.325 -14.798 0.867 1.00 0.00 C ATOM 228 NZ LYS A 18 2.840 -14.888 -0.528 1.00 0.00 N ATOM 0 H LYS A 18 0.511 -11.540 4.295 1.00 0.00 H new ATOM 0 HA LYS A 18 1.071 -14.069 5.284 1.00 0.00 H new ATOM 0 HB2 LYS A 18 2.817 -12.297 3.528 1.00 0.00 H new ATOM 0 HB3 LYS A 18 2.919 -14.042 3.649 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.620 -14.242 2.732 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.513 -12.497 2.615 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.179 -13.030 0.455 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.733 -12.717 1.202 1.00 0.00 H new ATOM 0 HE2 LYS A 18 3.103 -15.112 1.562 1.00 0.00 H new ATOM 0 HE3 LYS A 18 1.490 -15.487 0.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 3.137 -15.865 -0.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 2.090 -14.613 -1.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 3.653 -14.249 -0.640 1.00 0.00 H new ATOM 242 N LYS A 19 3.170 -11.756 6.325 1.00 0.00 N ATOM 243 CA LYS A 19 4.216 -11.473 7.301 1.00 0.00 C ATOM 244 C LYS A 19 3.614 -11.088 8.648 1.00 0.00 C ATOM 245 O LYS A 19 4.285 -10.496 9.494 1.00 0.00 O ATOM 246 CB LYS A 19 5.122 -10.348 6.795 1.00 0.00 C ATOM 247 CG LYS A 19 6.313 -10.841 5.992 1.00 0.00 C ATOM 248 CD LYS A 19 5.986 -10.936 4.511 1.00 0.00 C ATOM 249 CE LYS A 19 5.443 -12.309 4.147 1.00 0.00 C ATOM 250 NZ LYS A 19 6.490 -13.363 4.243 1.00 0.00 N ATOM 0 H LYS A 19 2.840 -10.939 5.812 1.00 0.00 H new ATOM 0 HA LYS A 19 4.809 -12.378 7.434 1.00 0.00 H new ATOM 0 HB2 LYS A 19 4.534 -9.669 6.177 1.00 0.00 H new ATOM 0 HB3 LYS A 19 5.482 -9.772 7.647 1.00 0.00 H new ATOM 0 HG2 LYS A 19 7.156 -10.165 6.137 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.622 -11.819 6.361 1.00 0.00 H new ATOM 0 HD2 LYS A 19 5.253 -10.173 4.249 1.00 0.00 H new ATOM 0 HD3 LYS A 19 6.882 -10.731 3.926 1.00 0.00 H new ATOM 0 HE2 LYS A 19 4.614 -12.559 4.809 1.00 0.00 H new ATOM 0 HE3 LYS A 19 5.044 -12.285 3.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 6.226 -14.170 3.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 7.401 -12.977 3.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 6.575 -13.679 5.230 1.00 0.00 H new ATOM 264 N LYS A 20 2.345 -11.429 8.843 1.00 0.00 N ATOM 265 CA LYS A 20 1.652 -11.122 10.089 1.00 0.00 C ATOM 266 C LYS A 20 1.990 -9.713 10.567 1.00 0.00 C ATOM 267 O LYS A 20 2.143 -9.473 11.765 1.00 0.00 O ATOM 268 CB LYS A 20 2.025 -12.141 11.168 1.00 0.00 C ATOM 269 CG LYS A 20 1.541 -13.549 10.868 1.00 0.00 C ATOM 270 CD LYS A 20 2.213 -14.573 11.768 1.00 0.00 C ATOM 271 CE LYS A 20 1.328 -15.792 11.983 1.00 0.00 C ATOM 272 NZ LYS A 20 2.065 -16.903 12.646 1.00 0.00 N ATOM 0 H LYS A 20 1.775 -11.919 8.153 1.00 0.00 H new ATOM 0 HA LYS A 20 0.580 -11.176 9.902 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.109 -12.155 11.283 1.00 0.00 H new ATOM 0 HB3 LYS A 20 1.607 -11.818 12.121 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.460 -13.599 11.001 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.745 -13.790 9.825 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.160 -14.883 11.325 1.00 0.00 H new ATOM 0 HD3 LYS A 20 2.446 -14.117 12.730 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.468 -15.513 12.591 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.942 -16.134 11.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.427 -17.715 12.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.871 -17.187 12.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 2.412 -16.585 13.573 1.00 0.00 H new ATOM 286 N LEU A 21 2.104 -8.785 9.623 1.00 0.00 N ATOM 287 CA LEU A 21 2.423 -7.399 9.948 1.00 0.00 C ATOM 288 C LEU A 21 1.153 -6.563 10.069 1.00 0.00 C ATOM 289 O LEU A 21 0.051 -7.050 9.817 1.00 0.00 O ATOM 290 CB LEU A 21 3.340 -6.802 8.879 1.00 0.00 C ATOM 291 CG LEU A 21 4.824 -7.154 8.996 1.00 0.00 C ATOM 292 CD1 LEU A 21 5.481 -7.158 7.624 1.00 0.00 C ATOM 293 CD2 LEU A 21 5.532 -6.180 9.926 1.00 0.00 C ATOM 0 H LEU A 21 1.980 -8.967 8.627 1.00 0.00 H new ATOM 0 HA LEU A 21 2.938 -7.386 10.908 1.00 0.00 H new ATOM 0 HB2 LEU A 21 2.986 -7.128 7.901 1.00 0.00 H new ATOM 0 HB3 LEU A 21 3.241 -5.717 8.908 1.00 0.00 H new ATOM 0 HG LEU A 21 4.908 -8.155 9.420 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.536 -7.410 7.727 1.00 0.00 H new ATOM 0 HD12 LEU A 21 4.992 -7.896 6.988 1.00 0.00 H new ATOM 0 HD13 LEU A 21 5.386 -6.170 7.172 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.587 -6.446 9.997 1.00 0.00 H new ATOM 0 HD22 LEU A 21 5.439 -5.168 9.532 1.00 0.00 H new ATOM 0 HD23 LEU A 21 5.078 -6.227 10.916 1.00 0.00 H new ATOM 305 N SER A 22 1.316 -5.301 10.454 1.00 0.00 N ATOM 306 CA SER A 22 0.182 -4.397 10.610 1.00 0.00 C ATOM 307 C SER A 22 0.264 -3.247 9.611 1.00 0.00 C ATOM 308 O SER A 22 1.242 -2.500 9.586 1.00 0.00 O ATOM 309 CB SER A 22 0.134 -3.847 12.037 1.00 0.00 C ATOM 310 OG SER A 22 -0.645 -4.678 12.879 1.00 0.00 O ATOM 0 H SER A 22 2.222 -4.882 10.664 1.00 0.00 H new ATOM 0 HA SER A 22 -0.731 -4.960 10.415 1.00 0.00 H new ATOM 0 HB2 SER A 22 1.146 -3.769 12.434 1.00 0.00 H new ATOM 0 HB3 SER A 22 -0.283 -2.840 12.028 1.00 0.00 H new ATOM 0 HG SER A 22 -0.658 -4.305 13.785 1.00 0.00 H new ATOM 316 N VAL A 23 -0.772 -3.111 8.789 1.00 0.00 N ATOM 317 CA VAL A 23 -0.820 -2.051 7.788 1.00 0.00 C ATOM 318 C VAL A 23 -1.794 -0.952 8.198 1.00 0.00 C ATOM 319 O VAL A 23 -2.919 -1.229 8.610 1.00 0.00 O ATOM 320 CB VAL A 23 -1.232 -2.600 6.409 1.00 0.00 C ATOM 321 CG1 VAL A 23 -2.745 -2.716 6.311 1.00 0.00 C ATOM 322 CG2 VAL A 23 -0.683 -1.717 5.299 1.00 0.00 C ATOM 0 H VAL A 23 -1.589 -3.721 8.796 1.00 0.00 H new ATOM 0 HA VAL A 23 0.185 -1.634 7.719 1.00 0.00 H new ATOM 0 HB VAL A 23 -0.807 -3.597 6.292 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.017 -3.105 5.330 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.109 -3.393 7.084 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -3.195 -1.733 6.449 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -0.984 -2.119 4.332 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -1.076 -0.707 5.410 1.00 0.00 H new ATOM 0 HG23 VAL A 23 0.405 -1.691 5.359 1.00 0.00 H new ATOM 332 N ASN A 24 -1.352 0.296 8.080 1.00 0.00 N ATOM 333 CA ASN A 24 -2.186 1.438 8.437 1.00 0.00 C ATOM 334 C ASN A 24 -2.235 2.453 7.299 1.00 0.00 C ATOM 335 O ASN A 24 -1.342 2.496 6.452 1.00 0.00 O ATOM 336 CB ASN A 24 -1.655 2.105 9.708 1.00 0.00 C ATOM 337 CG ASN A 24 -2.068 1.365 10.965 1.00 0.00 C ATOM 338 OD1 ASN A 24 -2.716 0.320 10.899 1.00 0.00 O ATOM 339 ND2 ASN A 24 -1.694 1.904 12.119 1.00 0.00 N ATOM 0 H ASN A 24 -0.422 0.542 7.740 1.00 0.00 H new ATOM 0 HA ASN A 24 -3.197 1.075 8.620 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -0.567 2.156 9.661 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -2.021 3.131 9.757 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -1.943 1.451 12.998 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.158 2.772 12.127 1.00 0.00 H new ATOM 346 N TYR A 25 -3.283 3.269 7.287 1.00 0.00 N ATOM 347 CA TYR A 25 -3.450 4.283 6.253 1.00 0.00 C ATOM 348 C TYR A 25 -3.817 5.631 6.866 1.00 0.00 C ATOM 349 O TYR A 25 -4.890 5.789 7.447 1.00 0.00 O ATOM 350 CB TYR A 25 -4.529 3.853 5.257 1.00 0.00 C ATOM 351 CG TYR A 25 -4.218 2.551 4.553 1.00 0.00 C ATOM 352 CD1 TYR A 25 -4.390 1.332 5.197 1.00 0.00 C ATOM 353 CD2 TYR A 25 -3.752 2.540 3.244 1.00 0.00 C ATOM 354 CE1 TYR A 25 -4.107 0.140 4.559 1.00 0.00 C ATOM 355 CE2 TYR A 25 -3.468 1.353 2.597 1.00 0.00 C ATOM 356 CZ TYR A 25 -3.647 0.156 3.259 1.00 0.00 C ATOM 357 OH TYR A 25 -3.364 -1.029 2.618 1.00 0.00 O ATOM 0 H TYR A 25 -4.030 3.248 7.982 1.00 0.00 H new ATOM 0 HA TYR A 25 -2.501 4.389 5.728 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -5.479 3.754 5.783 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -4.657 4.638 4.512 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -4.751 1.316 6.215 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -3.609 3.475 2.724 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -4.245 -0.799 5.075 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -3.108 1.362 1.579 1.00 0.00 H new ATOM 0 HH TYR A 25 -4.084 -1.672 2.786 1.00 0.00 H new ATOM 367 N GLU A 26 -2.917 6.600 6.730 1.00 0.00 N ATOM 368 CA GLU A 26 -3.145 7.935 7.270 1.00 0.00 C ATOM 369 C GLU A 26 -3.758 8.851 6.215 1.00 0.00 C ATOM 370 O GLU A 26 -3.559 8.654 5.016 1.00 0.00 O ATOM 371 CB GLU A 26 -1.833 8.534 7.781 1.00 0.00 C ATOM 372 CG GLU A 26 -2.018 9.811 8.583 1.00 0.00 C ATOM 373 CD GLU A 26 -3.032 9.657 9.699 1.00 0.00 C ATOM 374 OE1 GLU A 26 -2.736 8.935 10.674 1.00 0.00 O ATOM 375 OE2 GLU A 26 -4.123 10.257 9.598 1.00 0.00 O ATOM 0 H GLU A 26 -2.024 6.485 6.251 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.844 7.848 8.102 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -1.324 7.796 8.401 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -1.182 8.740 6.931 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.060 10.111 9.007 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -2.337 10.612 7.916 1.00 0.00 H new ATOM 382 N GLN A 27 -4.503 9.853 6.671 1.00 0.00 N ATOM 383 CA GLN A 27 -5.146 10.799 5.766 1.00 0.00 C ATOM 384 C GLN A 27 -4.328 12.080 5.647 1.00 0.00 C ATOM 385 O GLN A 27 -3.554 12.420 6.543 1.00 0.00 O ATOM 386 CB GLN A 27 -6.558 11.126 6.256 1.00 0.00 C ATOM 387 CG GLN A 27 -7.491 9.925 6.268 1.00 0.00 C ATOM 388 CD GLN A 27 -8.874 10.266 6.787 1.00 0.00 C ATOM 389 OE1 GLN A 27 -9.220 11.438 6.942 1.00 0.00 O ATOM 390 NE2 GLN A 27 -9.674 9.241 7.058 1.00 0.00 N ATOM 0 H GLN A 27 -4.676 10.031 7.660 1.00 0.00 H new ATOM 0 HA GLN A 27 -5.208 10.336 4.781 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -6.498 11.539 7.263 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -6.985 11.901 5.619 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -7.575 9.525 5.258 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -7.058 9.139 6.887 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -9.346 8.286 6.915 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -10.617 9.409 7.409 1.00 0.00 H new ATOM 399 N CYS A 28 -4.503 12.786 4.535 1.00 0.00 N ATOM 400 CA CYS A 28 -3.779 14.030 4.298 1.00 0.00 C ATOM 401 C CYS A 28 -3.926 14.980 5.483 1.00 0.00 C ATOM 402 O CYS A 28 -4.772 14.775 6.352 1.00 0.00 O ATOM 403 CB CYS A 28 -4.287 14.705 3.023 1.00 0.00 C ATOM 404 SG CYS A 28 -5.951 15.396 3.166 1.00 0.00 S ATOM 0 H CYS A 28 -5.139 12.518 3.784 1.00 0.00 H new ATOM 0 HA CYS A 28 -2.723 13.789 4.178 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -3.597 15.502 2.747 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -4.276 13.978 2.211 1.00 0.00 H new ATOM 0 HG CYS A 28 -6.291 15.947 2.038 1.00 0.00 H new ATOM 410 N GLU A 29 -3.095 16.017 5.510 1.00 0.00 N ATOM 411 CA GLU A 29 -3.131 16.996 6.590 1.00 0.00 C ATOM 412 C GLU A 29 -4.036 18.171 6.229 1.00 0.00 C ATOM 413 O GLU A 29 -4.107 18.601 5.078 1.00 0.00 O ATOM 414 CB GLU A 29 -1.720 17.500 6.899 1.00 0.00 C ATOM 415 CG GLU A 29 -1.111 18.328 5.780 1.00 0.00 C ATOM 416 CD GLU A 29 0.379 18.545 5.959 1.00 0.00 C ATOM 417 OE1 GLU A 29 1.032 17.683 6.585 1.00 0.00 O ATOM 418 OE2 GLU A 29 0.892 19.574 5.473 1.00 0.00 O ATOM 0 H GLU A 29 -2.389 16.201 4.797 1.00 0.00 H new ATOM 0 HA GLU A 29 -3.536 16.507 7.476 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -1.749 18.099 7.809 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.074 16.645 7.100 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.290 17.831 4.827 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -1.612 19.295 5.734 1.00 0.00 H new ATOM 425 N PRO A 30 -4.745 18.702 7.236 1.00 0.00 N ATOM 426 CA PRO A 30 -5.658 19.834 7.050 1.00 0.00 C ATOM 427 C PRO A 30 -4.917 21.134 6.755 1.00 0.00 C ATOM 428 O PRO A 30 -5.472 22.054 6.157 1.00 0.00 O ATOM 429 CB PRO A 30 -6.386 19.927 8.393 1.00 0.00 C ATOM 430 CG PRO A 30 -5.446 19.320 9.376 1.00 0.00 C ATOM 431 CD PRO A 30 -4.710 18.240 8.633 1.00 0.00 C ATOM 0 HA PRO A 30 -6.322 19.686 6.199 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.613 20.962 8.649 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.334 19.389 8.368 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.754 20.066 9.766 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.986 18.909 10.229 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -3.688 18.129 8.994 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.195 17.271 8.748 1.00 0.00 H new ATOM 439 N ASN A 31 -3.659 21.202 7.179 1.00 0.00 N ATOM 440 CA ASN A 31 -2.842 22.390 6.960 1.00 0.00 C ATOM 441 C ASN A 31 -3.021 22.920 5.541 1.00 0.00 C ATOM 442 O ASN A 31 -3.585 23.995 5.336 1.00 0.00 O ATOM 443 CB ASN A 31 -1.367 22.074 7.216 1.00 0.00 C ATOM 444 CG ASN A 31 -0.595 23.281 7.714 1.00 0.00 C ATOM 445 OD1 ASN A 31 -0.946 24.422 7.416 1.00 0.00 O ATOM 446 ND2 ASN A 31 0.464 23.032 8.476 1.00 0.00 N ATOM 0 H ASN A 31 -3.184 20.449 7.676 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.169 23.159 7.660 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -1.292 21.271 7.949 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -0.911 21.709 6.295 1.00 0.00 H new ATOM 0 HD21 ASN A 31 1.023 23.804 8.840 1.00 0.00 H new ATOM 0 HD22 ASN A 31 0.718 22.069 8.697 1.00 0.00 H new ATOM 453 N SER A 32 -2.539 22.158 4.565 1.00 0.00 N ATOM 454 CA SER A 32 -2.643 22.552 3.165 1.00 0.00 C ATOM 455 C SER A 32 -4.086 22.451 2.678 1.00 0.00 C ATOM 456 O SER A 32 -4.817 21.536 3.056 1.00 0.00 O ATOM 457 CB SER A 32 -1.738 21.675 2.298 1.00 0.00 C ATOM 458 OG SER A 32 -1.381 22.340 1.098 1.00 0.00 O ATOM 0 H SER A 32 -2.072 21.264 4.718 1.00 0.00 H new ATOM 0 HA SER A 32 -2.321 23.590 3.080 1.00 0.00 H new ATOM 0 HB2 SER A 32 -0.838 21.414 2.854 1.00 0.00 H new ATOM 0 HB3 SER A 32 -2.249 20.741 2.062 1.00 0.00 H new ATOM 0 HG SER A 32 -0.801 21.759 0.562 1.00 0.00 H new ATOM 464 N GLU A 33 -4.488 23.398 1.837 1.00 0.00 N ATOM 465 CA GLU A 33 -5.843 23.417 1.299 1.00 0.00 C ATOM 466 C GLU A 33 -5.852 22.993 -0.167 1.00 0.00 C ATOM 467 O GLU A 33 -6.646 22.143 -0.574 1.00 0.00 O ATOM 468 CB GLU A 33 -6.453 24.813 1.441 1.00 0.00 C ATOM 469 CG GLU A 33 -7.960 24.841 1.249 1.00 0.00 C ATOM 470 CD GLU A 33 -8.588 26.127 1.750 1.00 0.00 C ATOM 471 OE1 GLU A 33 -8.298 26.521 2.899 1.00 0.00 O ATOM 472 OE2 GLU A 33 -9.369 26.740 0.992 1.00 0.00 O ATOM 0 H GLU A 33 -3.895 24.162 1.513 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.442 22.707 1.869 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.214 25.206 2.429 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.990 25.479 0.712 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -8.190 24.717 0.191 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -8.405 23.995 1.773 1.00 0.00 H new ATOM 479 N LEU A 34 -4.965 23.590 -0.955 1.00 0.00 N ATOM 480 CA LEU A 34 -4.871 23.275 -2.376 1.00 0.00 C ATOM 481 C LEU A 34 -3.567 22.547 -2.687 1.00 0.00 C ATOM 482 O LEU A 34 -2.553 22.723 -2.011 1.00 0.00 O ATOM 483 CB LEU A 34 -4.964 24.555 -3.209 1.00 0.00 C ATOM 484 CG LEU A 34 -6.251 25.366 -3.051 1.00 0.00 C ATOM 485 CD1 LEU A 34 -6.057 26.781 -3.574 1.00 0.00 C ATOM 486 CD2 LEU A 34 -7.404 24.683 -3.771 1.00 0.00 C ATOM 0 H LEU A 34 -4.301 24.295 -0.634 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.703 22.619 -2.634 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.121 25.195 -2.950 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.852 24.290 -4.260 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.494 25.422 -1.990 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -6.983 27.344 -3.454 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -5.260 27.270 -3.014 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.789 26.745 -4.630 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.311 25.274 -3.648 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.170 24.595 -4.832 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -7.558 23.689 -3.350 1.00 0.00 H new ATOM 498 N PRO A 35 -3.591 21.711 -3.736 1.00 0.00 N ATOM 499 CA PRO A 35 -4.793 21.494 -4.547 1.00 0.00 C ATOM 500 C PRO A 35 -5.874 20.731 -3.789 1.00 0.00 C ATOM 501 O PRO A 35 -5.628 20.200 -2.707 1.00 0.00 O ATOM 502 CB PRO A 35 -4.279 20.663 -5.726 1.00 0.00 C ATOM 503 CG PRO A 35 -3.069 19.970 -5.202 1.00 0.00 C ATOM 504 CD PRO A 35 -2.448 20.913 -4.210 1.00 0.00 C ATOM 0 HA PRO A 35 -5.262 22.433 -4.841 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -5.030 19.948 -6.064 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -4.035 21.295 -6.579 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -3.335 19.025 -4.728 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -2.373 19.738 -6.008 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -1.966 20.376 -3.393 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -1.686 21.539 -4.674 1.00 0.00 H new ATOM 512 N GLN A 36 -7.071 20.682 -4.366 1.00 0.00 N ATOM 513 CA GLN A 36 -8.189 19.984 -3.743 1.00 0.00 C ATOM 514 C GLN A 36 -8.108 18.483 -4.004 1.00 0.00 C ATOM 515 O GLN A 36 -8.903 17.932 -4.764 1.00 0.00 O ATOM 516 CB GLN A 36 -9.517 20.533 -4.268 1.00 0.00 C ATOM 517 CG GLN A 36 -9.815 21.950 -3.804 1.00 0.00 C ATOM 518 CD GLN A 36 -11.195 22.421 -4.219 1.00 0.00 C ATOM 519 OE1 GLN A 36 -11.664 22.117 -5.316 1.00 0.00 O ATOM 520 NE2 GLN A 36 -11.854 23.169 -3.341 1.00 0.00 N ATOM 0 H GLN A 36 -7.291 21.117 -5.262 1.00 0.00 H new ATOM 0 HA GLN A 36 -8.134 20.151 -2.667 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -9.504 20.511 -5.358 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -10.325 19.876 -3.946 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -9.730 21.998 -2.718 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -9.066 22.628 -4.213 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -11.427 23.397 -2.443 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -12.787 23.515 -3.565 1.00 0.00 H new ATOM 529 N ARG A 37 -7.141 17.829 -3.368 1.00 0.00 N ATOM 530 CA ARG A 37 -6.954 16.393 -3.533 1.00 0.00 C ATOM 531 C ARG A 37 -6.718 15.717 -2.186 1.00 0.00 C ATOM 532 O ARG A 37 -6.313 16.362 -1.218 1.00 0.00 O ATOM 533 CB ARG A 37 -5.777 16.114 -4.469 1.00 0.00 C ATOM 534 CG ARG A 37 -4.419 16.325 -3.820 1.00 0.00 C ATOM 535 CD ARG A 37 -3.376 15.376 -4.388 1.00 0.00 C ATOM 536 NE ARG A 37 -2.039 15.963 -4.379 1.00 0.00 N ATOM 537 CZ ARG A 37 -1.375 16.263 -3.268 1.00 0.00 C ATOM 538 NH1 ARG A 37 -1.922 16.031 -2.083 1.00 0.00 N ATOM 539 NH2 ARG A 37 -0.162 16.795 -3.341 1.00 0.00 N ATOM 0 H ARG A 37 -6.475 18.271 -2.734 1.00 0.00 H new ATOM 0 HA ARG A 37 -7.863 15.982 -3.972 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -5.844 15.086 -4.826 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -5.857 16.761 -5.343 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -4.097 17.355 -3.974 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -4.502 16.174 -2.744 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -3.371 14.454 -3.807 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -3.647 15.108 -5.409 1.00 0.00 H new ATOM 0 HE ARG A 37 -1.590 16.153 -5.275 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -2.854 15.621 -2.023 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -1.411 16.262 -1.231 1.00 0.00 H new ATOM 0 HH21 ARG A 37 0.262 16.974 -4.251 1.00 0.00 H new ATOM 0 HH22 ARG A 37 0.346 17.025 -2.487 1.00 0.00 H new ATOM 553 N PHE A 38 -6.974 14.414 -2.130 1.00 0.00 N ATOM 554 CA PHE A 38 -6.790 13.651 -0.900 1.00 0.00 C ATOM 555 C PHE A 38 -5.507 12.828 -0.958 1.00 0.00 C ATOM 556 O PHE A 38 -5.057 12.435 -2.035 1.00 0.00 O ATOM 557 CB PHE A 38 -7.990 12.731 -0.662 1.00 0.00 C ATOM 558 CG PHE A 38 -9.128 13.403 0.050 1.00 0.00 C ATOM 559 CD1 PHE A 38 -9.709 14.549 -0.470 1.00 0.00 C ATOM 560 CD2 PHE A 38 -9.618 12.890 1.240 1.00 0.00 C ATOM 561 CE1 PHE A 38 -10.757 15.170 0.183 1.00 0.00 C ATOM 562 CE2 PHE A 38 -10.666 13.506 1.897 1.00 0.00 C ATOM 563 CZ PHE A 38 -11.236 14.648 1.369 1.00 0.00 C ATOM 0 H PHE A 38 -7.309 13.864 -2.921 1.00 0.00 H new ATOM 0 HA PHE A 38 -6.711 14.356 -0.072 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -8.344 12.354 -1.621 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -7.666 11.868 -0.080 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -9.338 14.962 -1.397 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -9.176 11.998 1.659 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -11.201 16.062 -0.233 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -11.039 13.095 2.823 1.00 0.00 H new ATOM 0 HZ PHE A 38 -12.054 15.132 1.882 1.00 0.00 H new ATOM 573 N ILE A 39 -4.923 12.571 0.208 1.00 0.00 N ATOM 574 CA ILE A 39 -3.693 11.795 0.290 1.00 0.00 C ATOM 575 C ILE A 39 -3.839 10.635 1.270 1.00 0.00 C ATOM 576 O ILE A 39 -4.586 10.724 2.245 1.00 0.00 O ATOM 577 CB ILE A 39 -2.502 12.671 0.723 1.00 0.00 C ATOM 578 CG1 ILE A 39 -2.517 14.000 -0.034 1.00 0.00 C ATOM 579 CG2 ILE A 39 -1.191 11.936 0.488 1.00 0.00 C ATOM 580 CD1 ILE A 39 -1.842 15.129 0.712 1.00 0.00 C ATOM 0 H ILE A 39 -5.282 12.889 1.108 1.00 0.00 H new ATOM 0 HA ILE A 39 -3.501 11.402 -0.708 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.592 12.881 1.789 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.024 13.866 -0.997 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.550 14.279 -0.241 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.359 12.568 0.799 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.182 11.013 1.068 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -1.091 11.700 -0.571 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.891 16.040 0.115 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.349 15.291 1.663 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.799 14.871 0.896 1.00 0.00 H new ATOM 592 N CYS A 40 -3.120 9.550 1.006 1.00 0.00 N ATOM 593 CA CYS A 40 -3.168 8.373 1.866 1.00 0.00 C ATOM 594 C CYS A 40 -1.767 7.823 2.114 1.00 0.00 C ATOM 595 O CYS A 40 -1.134 7.275 1.212 1.00 0.00 O ATOM 596 CB CYS A 40 -4.049 7.293 1.237 1.00 0.00 C ATOM 597 SG CYS A 40 -4.877 6.224 2.437 1.00 0.00 S ATOM 0 H CYS A 40 -2.497 9.461 0.203 1.00 0.00 H new ATOM 0 HA CYS A 40 -3.596 8.670 2.823 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -4.803 7.772 0.613 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -3.436 6.676 0.580 1.00 0.00 H new ATOM 0 HG CYS A 40 -6.107 6.615 2.590 1.00 0.00 H new ATOM 603 N LYS A 41 -1.288 7.974 3.344 1.00 0.00 N ATOM 604 CA LYS A 41 0.039 7.494 3.713 1.00 0.00 C ATOM 605 C LYS A 41 -0.040 6.104 4.337 1.00 0.00 C ATOM 606 O LYS A 41 -0.502 5.946 5.468 1.00 0.00 O ATOM 607 CB LYS A 41 0.702 8.466 4.691 1.00 0.00 C ATOM 608 CG LYS A 41 1.501 9.564 4.009 1.00 0.00 C ATOM 609 CD LYS A 41 1.892 10.659 4.987 1.00 0.00 C ATOM 610 CE LYS A 41 0.815 11.729 5.085 1.00 0.00 C ATOM 611 NZ LYS A 41 1.276 12.910 5.865 1.00 0.00 N ATOM 0 H LYS A 41 -1.799 8.425 4.103 1.00 0.00 H new ATOM 0 HA LYS A 41 0.641 7.433 2.806 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -0.067 8.922 5.315 1.00 0.00 H new ATOM 0 HB3 LYS A 41 1.361 7.907 5.355 1.00 0.00 H new ATOM 0 HG2 LYS A 41 2.399 9.137 3.561 1.00 0.00 H new ATOM 0 HG3 LYS A 41 0.913 9.993 3.198 1.00 0.00 H new ATOM 0 HD2 LYS A 41 2.065 10.224 5.971 1.00 0.00 H new ATOM 0 HD3 LYS A 41 2.830 11.114 4.670 1.00 0.00 H new ATOM 0 HE2 LYS A 41 0.526 12.046 4.083 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -0.074 11.308 5.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 0.514 13.616 5.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 1.528 12.612 6.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 2.109 13.328 5.403 1.00 0.00 H new ATOM 625 N CYS A 42 0.414 5.101 3.595 1.00 0.00 N ATOM 626 CA CYS A 42 0.396 3.724 4.076 1.00 0.00 C ATOM 627 C CYS A 42 1.604 3.442 4.963 1.00 0.00 C ATOM 628 O CYS A 42 2.743 3.434 4.496 1.00 0.00 O ATOM 629 CB CYS A 42 0.375 2.750 2.897 1.00 0.00 C ATOM 630 SG CYS A 42 0.431 1.008 3.378 1.00 0.00 S ATOM 0 H CYS A 42 0.799 5.215 2.657 1.00 0.00 H new ATOM 0 HA CYS A 42 -0.508 3.584 4.669 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -0.527 2.925 2.311 1.00 0.00 H new ATOM 0 HB3 CYS A 42 1.224 2.964 2.248 1.00 0.00 H new ATOM 0 HG CYS A 42 0.407 0.263 2.313 1.00 0.00 H new ATOM 636 N LYS A 43 1.348 3.212 6.247 1.00 0.00 N ATOM 637 CA LYS A 43 2.413 2.929 7.201 1.00 0.00 C ATOM 638 C LYS A 43 2.295 1.509 7.744 1.00 0.00 C ATOM 639 O LYS A 43 1.231 1.099 8.210 1.00 0.00 O ATOM 640 CB LYS A 43 2.371 3.933 8.356 1.00 0.00 C ATOM 641 CG LYS A 43 3.203 5.180 8.108 1.00 0.00 C ATOM 642 CD LYS A 43 3.712 5.777 9.409 1.00 0.00 C ATOM 643 CE LYS A 43 4.483 7.066 9.167 1.00 0.00 C ATOM 644 NZ LYS A 43 3.574 8.212 8.886 1.00 0.00 N ATOM 0 H LYS A 43 0.411 3.216 6.650 1.00 0.00 H new ATOM 0 HA LYS A 43 3.366 3.022 6.681 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.336 4.226 8.534 1.00 0.00 H new ATOM 0 HB3 LYS A 43 2.725 3.445 9.264 1.00 0.00 H new ATOM 0 HG2 LYS A 43 4.048 4.933 7.465 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.603 5.919 7.577 1.00 0.00 H new ATOM 0 HD2 LYS A 43 2.871 5.974 10.074 1.00 0.00 H new ATOM 0 HD3 LYS A 43 4.355 5.056 9.914 1.00 0.00 H new ATOM 0 HE2 LYS A 43 5.094 7.293 10.041 1.00 0.00 H new ATOM 0 HE3 LYS A 43 5.165 6.929 8.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 4.138 9.071 8.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 3.009 8.007 8.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.940 8.359 9.697 1.00 0.00 H new ATOM 658 N ILE A 44 3.392 0.763 7.682 1.00 0.00 N ATOM 659 CA ILE A 44 3.411 -0.610 8.171 1.00 0.00 C ATOM 660 C ILE A 44 4.029 -0.690 9.563 1.00 0.00 C ATOM 661 O ILE A 44 5.248 -0.636 9.716 1.00 0.00 O ATOM 662 CB ILE A 44 4.194 -1.535 7.220 1.00 0.00 C ATOM 663 CG1 ILE A 44 3.813 -1.249 5.766 1.00 0.00 C ATOM 664 CG2 ILE A 44 3.932 -2.993 7.565 1.00 0.00 C ATOM 665 CD1 ILE A 44 2.450 -1.782 5.383 1.00 0.00 C ATOM 0 H ILE A 44 4.280 1.086 7.298 1.00 0.00 H new ATOM 0 HA ILE A 44 2.374 -0.943 8.217 1.00 0.00 H new ATOM 0 HB ILE A 44 5.259 -1.339 7.342 1.00 0.00 H new ATOM 0 HG12 ILE A 44 3.833 -0.172 5.599 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.564 -1.688 5.109 1.00 0.00 H new ATOM 0 HG21 ILE A 44 4.492 -3.634 6.884 1.00 0.00 H new ATOM 0 HG22 ILE A 44 4.249 -3.187 8.590 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.867 -3.204 7.468 1.00 0.00 H new ATOM 0 HD11 ILE A 44 2.246 -1.543 4.339 1.00 0.00 H new ATOM 0 HD12 ILE A 44 2.431 -2.863 5.518 1.00 0.00 H new ATOM 0 HD13 ILE A 44 1.689 -1.324 6.015 1.00 0.00 H new ATOM 677 N GLY A 45 3.177 -0.822 10.575 1.00 0.00 N ATOM 678 CA GLY A 45 3.657 -0.910 11.942 1.00 0.00 C ATOM 679 C GLY A 45 4.390 0.343 12.380 1.00 0.00 C ATOM 680 O GLY A 45 5.456 0.264 12.990 1.00 0.00 O ATOM 0 H GLY A 45 2.163 -0.870 10.473 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.814 -1.086 12.610 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.322 -1.768 12.036 1.00 0.00 H new ATOM 684 N GLN A 46 3.818 1.501 12.068 1.00 0.00 N ATOM 685 CA GLN A 46 4.425 2.775 12.432 1.00 0.00 C ATOM 686 C GLN A 46 5.664 3.049 11.586 1.00 0.00 C ATOM 687 O GLN A 46 6.574 3.764 12.009 1.00 0.00 O ATOM 688 CB GLN A 46 4.795 2.782 13.916 1.00 0.00 C ATOM 689 CG GLN A 46 4.881 4.177 14.515 1.00 0.00 C ATOM 690 CD GLN A 46 5.416 4.171 15.933 1.00 0.00 C ATOM 691 OE1 GLN A 46 6.469 4.745 16.214 1.00 0.00 O ATOM 692 NE2 GLN A 46 4.693 3.520 16.837 1.00 0.00 N ATOM 0 H GLN A 46 2.935 1.583 11.564 1.00 0.00 H new ATOM 0 HA GLN A 46 3.696 3.563 12.243 1.00 0.00 H new ATOM 0 HB2 GLN A 46 4.055 2.203 14.469 1.00 0.00 H new ATOM 0 HB3 GLN A 46 5.754 2.280 14.045 1.00 0.00 H new ATOM 0 HG2 GLN A 46 5.524 4.797 13.891 1.00 0.00 H new ATOM 0 HG3 GLN A 46 3.891 4.634 14.506 1.00 0.00 H new ATOM 0 HE21 GLN A 46 3.826 3.058 16.561 1.00 0.00 H new ATOM 0 HE22 GLN A 46 5.004 3.482 17.808 1.00 0.00 H new ATOM 701 N THR A 47 5.695 2.476 10.386 1.00 0.00 N ATOM 702 CA THR A 47 6.822 2.657 9.481 1.00 0.00 C ATOM 703 C THR A 47 6.363 3.200 8.133 1.00 0.00 C ATOM 704 O THR A 47 5.374 2.733 7.569 1.00 0.00 O ATOM 705 CB THR A 47 7.581 1.335 9.258 1.00 0.00 C ATOM 706 OG1 THR A 47 8.066 0.832 10.508 1.00 0.00 O ATOM 707 CG2 THR A 47 8.746 1.535 8.300 1.00 0.00 C ATOM 0 H THR A 47 4.951 1.882 10.019 1.00 0.00 H new ATOM 0 HA THR A 47 7.492 3.377 9.950 1.00 0.00 H new ATOM 0 HB THR A 47 6.890 0.614 8.820 1.00 0.00 H new ATOM 0 HG1 THR A 47 8.546 -0.009 10.358 1.00 0.00 H new ATOM 0 HG21 THR A 47 9.267 0.588 8.158 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.371 1.890 7.340 1.00 0.00 H new ATOM 0 HG23 THR A 47 9.436 2.270 8.715 1.00 0.00 H new ATOM 715 N MET A 48 7.088 4.189 7.620 1.00 0.00 N ATOM 716 CA MET A 48 6.756 4.794 6.336 1.00 0.00 C ATOM 717 C MET A 48 7.121 3.862 5.185 1.00 0.00 C ATOM 718 O MET A 48 8.272 3.447 5.051 1.00 0.00 O ATOM 719 CB MET A 48 7.481 6.132 6.175 1.00 0.00 C ATOM 720 CG MET A 48 7.027 6.927 4.962 1.00 0.00 C ATOM 721 SD MET A 48 8.267 8.111 4.404 1.00 0.00 S ATOM 722 CE MET A 48 7.324 9.049 3.204 1.00 0.00 C ATOM 0 H MET A 48 7.909 4.588 8.074 1.00 0.00 H new ATOM 0 HA MET A 48 5.680 4.967 6.312 1.00 0.00 H new ATOM 0 HB2 MET A 48 7.324 6.731 7.072 1.00 0.00 H new ATOM 0 HB3 MET A 48 8.553 5.948 6.098 1.00 0.00 H new ATOM 0 HG2 MET A 48 6.794 6.240 4.148 1.00 0.00 H new ATOM 0 HG3 MET A 48 6.106 7.458 5.204 1.00 0.00 H new ATOM 0 HE1 MET A 48 7.956 9.823 2.769 1.00 0.00 H new ATOM 0 HE2 MET A 48 6.972 8.383 2.416 1.00 0.00 H new ATOM 0 HE3 MET A 48 6.469 9.513 3.695 1.00 0.00 H new ATOM 732 N TYR A 49 6.134 3.537 4.357 1.00 0.00 N ATOM 733 CA TYR A 49 6.352 2.652 3.219 1.00 0.00 C ATOM 734 C TYR A 49 6.026 3.360 1.908 1.00 0.00 C ATOM 735 O TYR A 49 6.890 3.528 1.048 1.00 0.00 O ATOM 736 CB TYR A 49 5.498 1.391 3.357 1.00 0.00 C ATOM 737 CG TYR A 49 6.186 0.272 4.105 1.00 0.00 C ATOM 738 CD1 TYR A 49 6.498 0.401 5.453 1.00 0.00 C ATOM 739 CD2 TYR A 49 6.525 -0.913 3.465 1.00 0.00 C ATOM 740 CE1 TYR A 49 7.127 -0.619 6.141 1.00 0.00 C ATOM 741 CE2 TYR A 49 7.154 -1.938 4.145 1.00 0.00 C ATOM 742 CZ TYR A 49 7.453 -1.786 5.483 1.00 0.00 C ATOM 743 OH TYR A 49 8.080 -2.805 6.164 1.00 0.00 O ATOM 0 H TYR A 49 5.176 3.873 4.453 1.00 0.00 H new ATOM 0 HA TYR A 49 7.405 2.370 3.206 1.00 0.00 H new ATOM 0 HB2 TYR A 49 4.571 1.645 3.872 1.00 0.00 H new ATOM 0 HB3 TYR A 49 5.224 1.037 2.363 1.00 0.00 H new ATOM 0 HD1 TYR A 49 6.245 1.314 5.972 1.00 0.00 H new ATOM 0 HD2 TYR A 49 6.293 -1.035 2.417 1.00 0.00 H new ATOM 0 HE1 TYR A 49 7.362 -0.503 7.189 1.00 0.00 H new ATOM 0 HE2 TYR A 49 7.410 -2.853 3.632 1.00 0.00 H new ATOM 0 HH TYR A 49 7.826 -3.666 5.771 1.00 0.00 H new ATOM 753 N GLY A 50 4.771 3.775 1.763 1.00 0.00 N ATOM 754 CA GLY A 50 4.351 4.461 0.555 1.00 0.00 C ATOM 755 C GLY A 50 3.084 5.268 0.757 1.00 0.00 C ATOM 756 O GLY A 50 2.278 4.964 1.637 1.00 0.00 O ATOM 0 H GLY A 50 4.038 3.648 2.461 1.00 0.00 H new ATOM 0 HA2 GLY A 50 5.150 5.123 0.220 1.00 0.00 H new ATOM 0 HA3 GLY A 50 4.190 3.730 -0.237 1.00 0.00 H new ATOM 760 N THR A 51 2.907 6.303 -0.059 1.00 0.00 N ATOM 761 CA THR A 51 1.731 7.159 0.036 1.00 0.00 C ATOM 762 C THR A 51 1.083 7.356 -1.329 1.00 0.00 C ATOM 763 O THR A 51 1.710 7.131 -2.363 1.00 0.00 O ATOM 764 CB THR A 51 2.085 8.537 0.627 1.00 0.00 C ATOM 765 OG1 THR A 51 0.924 9.374 0.648 1.00 0.00 O ATOM 766 CG2 THR A 51 3.186 9.206 -0.182 1.00 0.00 C ATOM 0 H THR A 51 3.564 6.568 -0.793 1.00 0.00 H new ATOM 0 HA THR A 51 1.028 6.657 0.700 1.00 0.00 H new ATOM 0 HB THR A 51 2.444 8.390 1.646 1.00 0.00 H new ATOM 0 HG1 THR A 51 1.157 10.247 1.027 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.419 10.177 0.254 1.00 0.00 H new ATOM 0 HG22 THR A 51 4.078 8.580 -0.170 1.00 0.00 H new ATOM 0 HG23 THR A 51 2.851 9.341 -1.210 1.00 0.00 H new ATOM 774 N GLY A 52 -0.177 7.779 -1.325 1.00 0.00 N ATOM 775 CA GLY A 52 -0.890 8.000 -2.570 1.00 0.00 C ATOM 776 C GLY A 52 -1.620 9.328 -2.593 1.00 0.00 C ATOM 777 O GLY A 52 -2.242 9.719 -1.605 1.00 0.00 O ATOM 0 H GLY A 52 -0.717 7.973 -0.482 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.185 7.962 -3.400 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.606 7.193 -2.723 1.00 0.00 H new ATOM 781 N SER A 53 -1.543 10.025 -3.722 1.00 0.00 N ATOM 782 CA SER A 53 -2.197 11.320 -3.867 1.00 0.00 C ATOM 783 C SER A 53 -3.145 11.319 -5.063 1.00 0.00 C ATOM 784 O SER A 53 -2.733 11.074 -6.196 1.00 0.00 O ATOM 785 CB SER A 53 -1.154 12.427 -4.030 1.00 0.00 C ATOM 786 OG SER A 53 -0.483 12.316 -5.273 1.00 0.00 O ATOM 0 H SER A 53 -1.034 9.715 -4.550 1.00 0.00 H new ATOM 0 HA SER A 53 -2.778 11.509 -2.964 1.00 0.00 H new ATOM 0 HB2 SER A 53 -1.639 13.401 -3.960 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.431 12.372 -3.216 1.00 0.00 H new ATOM 0 HG SER A 53 -1.076 11.893 -5.928 1.00 0.00 H new ATOM 792 N GLY A 54 -4.419 11.595 -4.801 1.00 0.00 N ATOM 793 CA GLY A 54 -5.406 11.621 -5.864 1.00 0.00 C ATOM 794 C GLY A 54 -6.558 12.559 -5.563 1.00 0.00 C ATOM 795 O GLY A 54 -6.839 12.857 -4.402 1.00 0.00 O ATOM 0 H GLY A 54 -4.785 11.801 -3.871 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -4.926 11.927 -6.794 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.793 10.614 -6.021 1.00 0.00 H new ATOM 799 N VAL A 55 -7.227 13.029 -6.612 1.00 0.00 N ATOM 800 CA VAL A 55 -8.354 13.940 -6.454 1.00 0.00 C ATOM 801 C VAL A 55 -9.363 13.397 -5.448 1.00 0.00 C ATOM 802 O VAL A 55 -10.117 14.155 -4.837 1.00 0.00 O ATOM 803 CB VAL A 55 -9.067 14.187 -7.797 1.00 0.00 C ATOM 804 CG1 VAL A 55 -8.165 14.962 -8.746 1.00 0.00 C ATOM 805 CG2 VAL A 55 -9.503 12.869 -8.419 1.00 0.00 C ATOM 0 H VAL A 55 -7.008 12.794 -7.580 1.00 0.00 H new ATOM 0 HA VAL A 55 -7.950 14.883 -6.086 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.958 14.786 -7.611 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -8.686 15.127 -9.689 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.908 15.923 -8.300 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.254 14.392 -8.929 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -10.005 13.062 -9.367 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -8.629 12.242 -8.593 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -10.188 12.357 -7.744 1.00 0.00 H new ATOM 815 N THR A 56 -9.371 12.078 -5.280 1.00 0.00 N ATOM 816 CA THR A 56 -10.288 11.433 -4.348 1.00 0.00 C ATOM 817 C THR A 56 -9.534 10.555 -3.355 1.00 0.00 C ATOM 818 O THR A 56 -8.496 9.980 -3.682 1.00 0.00 O ATOM 819 CB THR A 56 -11.329 10.573 -5.089 1.00 0.00 C ATOM 820 OG1 THR A 56 -11.893 11.315 -6.176 1.00 0.00 O ATOM 821 CG2 THR A 56 -12.435 10.129 -4.144 1.00 0.00 C ATOM 0 H THR A 56 -8.753 11.436 -5.777 1.00 0.00 H new ATOM 0 HA THR A 56 -10.803 12.228 -3.809 1.00 0.00 H new ATOM 0 HB THR A 56 -10.826 9.687 -5.477 1.00 0.00 H new ATOM 0 HG1 THR A 56 -12.553 10.761 -6.643 1.00 0.00 H new ATOM 0 HG21 THR A 56 -13.158 9.523 -4.690 1.00 0.00 H new ATOM 0 HG22 THR A 56 -12.006 9.540 -3.333 1.00 0.00 H new ATOM 0 HG23 THR A 56 -12.934 11.005 -3.731 1.00 0.00 H new ATOM 829 N LYS A 57 -10.064 10.456 -2.140 1.00 0.00 N ATOM 830 CA LYS A 57 -9.443 9.646 -1.099 1.00 0.00 C ATOM 831 C LYS A 57 -9.107 8.253 -1.620 1.00 0.00 C ATOM 832 O LYS A 57 -7.961 7.812 -1.544 1.00 0.00 O ATOM 833 CB LYS A 57 -10.371 9.539 0.114 1.00 0.00 C ATOM 834 CG LYS A 57 -9.633 9.386 1.433 1.00 0.00 C ATOM 835 CD LYS A 57 -9.381 7.925 1.765 1.00 0.00 C ATOM 836 CE LYS A 57 -8.956 7.748 3.214 1.00 0.00 C ATOM 837 NZ LYS A 57 -9.025 6.324 3.643 1.00 0.00 N ATOM 0 H LYS A 57 -10.922 10.927 -1.853 1.00 0.00 H new ATOM 0 HA LYS A 57 -8.516 10.135 -0.798 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -10.999 10.429 0.160 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -11.036 8.686 -0.022 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -8.683 9.918 1.383 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -10.214 9.846 2.232 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -10.286 7.347 1.577 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -8.607 7.529 1.107 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.938 8.117 3.341 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.596 8.352 3.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -9.635 6.243 4.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -9.419 5.748 2.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -8.070 5.985 3.876 1.00 0.00 H new ATOM 851 N GLN A 58 -10.114 7.566 -2.150 1.00 0.00 N ATOM 852 CA GLN A 58 -9.924 6.222 -2.684 1.00 0.00 C ATOM 853 C GLN A 58 -8.672 6.154 -3.552 1.00 0.00 C ATOM 854 O GLN A 58 -7.820 5.287 -3.359 1.00 0.00 O ATOM 855 CB GLN A 58 -11.147 5.797 -3.499 1.00 0.00 C ATOM 856 CG GLN A 58 -11.049 4.384 -4.052 1.00 0.00 C ATOM 857 CD GLN A 58 -12.402 3.802 -4.408 1.00 0.00 C ATOM 858 OE1 GLN A 58 -13.113 3.281 -3.548 1.00 0.00 O ATOM 859 NE2 GLN A 58 -12.767 3.887 -5.682 1.00 0.00 N ATOM 0 H GLN A 58 -11.069 7.917 -2.221 1.00 0.00 H new ATOM 0 HA GLN A 58 -9.800 5.538 -1.844 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -12.035 5.872 -2.872 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -11.282 6.494 -4.327 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -10.415 4.388 -4.938 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -10.564 3.743 -3.316 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -12.147 4.327 -6.362 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -13.667 3.512 -5.981 1.00 0.00 H new ATOM 868 N GLU A 59 -8.568 7.072 -4.507 1.00 0.00 N ATOM 869 CA GLU A 59 -7.420 7.114 -5.404 1.00 0.00 C ATOM 870 C GLU A 59 -6.114 7.008 -4.622 1.00 0.00 C ATOM 871 O GLU A 59 -5.240 6.209 -4.957 1.00 0.00 O ATOM 872 CB GLU A 59 -7.432 8.406 -6.225 1.00 0.00 C ATOM 873 CG GLU A 59 -6.456 8.397 -7.389 1.00 0.00 C ATOM 874 CD GLU A 59 -6.690 9.541 -8.356 1.00 0.00 C ATOM 875 OE1 GLU A 59 -7.868 9.861 -8.621 1.00 0.00 O ATOM 876 OE2 GLU A 59 -5.697 10.116 -8.848 1.00 0.00 O ATOM 0 H GLU A 59 -9.265 7.797 -4.679 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.489 6.262 -6.080 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.439 8.574 -6.607 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -7.196 9.245 -5.570 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -5.438 8.454 -7.005 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.543 7.451 -7.924 1.00 0.00 H new ATOM 883 N ALA A 60 -5.989 7.822 -3.578 1.00 0.00 N ATOM 884 CA ALA A 60 -4.791 7.819 -2.747 1.00 0.00 C ATOM 885 C ALA A 60 -4.590 6.463 -2.079 1.00 0.00 C ATOM 886 O ALA A 60 -3.555 5.820 -2.255 1.00 0.00 O ATOM 887 CB ALA A 60 -4.874 8.919 -1.699 1.00 0.00 C ATOM 0 H ALA A 60 -6.702 8.491 -3.288 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.931 8.009 -3.390 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.973 8.906 -1.085 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.962 9.887 -2.193 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.746 8.754 -1.067 1.00 0.00 H new ATOM 893 N LYS A 61 -5.585 6.034 -1.310 1.00 0.00 N ATOM 894 CA LYS A 61 -5.519 4.754 -0.615 1.00 0.00 C ATOM 895 C LYS A 61 -4.994 3.660 -1.539 1.00 0.00 C ATOM 896 O LYS A 61 -4.272 2.762 -1.105 1.00 0.00 O ATOM 897 CB LYS A 61 -6.900 4.367 -0.082 1.00 0.00 C ATOM 898 CG LYS A 61 -6.872 3.203 0.893 1.00 0.00 C ATOM 899 CD LYS A 61 -6.702 3.679 2.326 1.00 0.00 C ATOM 900 CE LYS A 61 -7.358 2.724 3.312 1.00 0.00 C ATOM 901 NZ LYS A 61 -7.830 3.429 4.536 1.00 0.00 N ATOM 0 H LYS A 61 -6.448 6.555 -1.152 1.00 0.00 H new ATOM 0 HA LYS A 61 -4.830 4.859 0.223 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.345 5.232 0.410 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -7.546 4.111 -0.922 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -7.796 2.632 0.806 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.055 2.529 0.633 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -5.641 3.770 2.557 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -7.138 4.672 2.435 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -8.201 2.228 2.831 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.647 1.946 3.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -7.713 2.808 5.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -7.273 4.296 4.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -8.835 3.676 4.429 1.00 0.00 H new ATOM 915 N GLN A 62 -5.360 3.742 -2.814 1.00 0.00 N ATOM 916 CA GLN A 62 -4.925 2.758 -3.798 1.00 0.00 C ATOM 917 C GLN A 62 -3.419 2.844 -4.024 1.00 0.00 C ATOM 918 O GLN A 62 -2.665 1.973 -3.589 1.00 0.00 O ATOM 919 CB GLN A 62 -5.664 2.968 -5.121 1.00 0.00 C ATOM 920 CG GLN A 62 -7.148 2.644 -5.047 1.00 0.00 C ATOM 921 CD GLN A 62 -7.444 1.191 -5.362 1.00 0.00 C ATOM 922 OE1 GLN A 62 -7.953 0.453 -4.517 1.00 0.00 O ATOM 923 NE2 GLN A 62 -7.128 0.773 -6.581 1.00 0.00 N ATOM 0 H GLN A 62 -5.956 4.479 -3.190 1.00 0.00 H new ATOM 0 HA GLN A 62 -5.160 1.766 -3.412 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -5.542 4.005 -5.435 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -5.203 2.346 -5.888 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -7.518 2.878 -4.049 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.690 3.281 -5.745 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -6.708 1.419 -7.249 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -7.305 -0.195 -6.850 1.00 0.00 H new ATOM 932 N LEU A 63 -2.988 3.897 -4.708 1.00 0.00 N ATOM 933 CA LEU A 63 -1.571 4.097 -4.993 1.00 0.00 C ATOM 934 C LEU A 63 -0.723 3.820 -3.756 1.00 0.00 C ATOM 935 O LEU A 63 0.281 3.112 -3.825 1.00 0.00 O ATOM 936 CB LEU A 63 -1.325 5.525 -5.484 1.00 0.00 C ATOM 937 CG LEU A 63 -2.187 5.987 -6.660 1.00 0.00 C ATOM 938 CD1 LEU A 63 -2.424 7.488 -6.589 1.00 0.00 C ATOM 939 CD2 LEU A 63 -1.533 5.611 -7.981 1.00 0.00 C ATOM 0 H LEU A 63 -3.599 4.626 -5.076 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.281 3.396 -5.775 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.487 6.208 -4.650 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -0.277 5.614 -5.770 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.152 5.483 -6.599 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.039 7.800 -7.433 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.935 7.732 -5.658 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -1.468 8.009 -6.625 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.160 5.948 -8.806 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -0.555 6.087 -8.051 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -1.415 4.529 -8.033 1.00 0.00 H new ATOM 951 N ALA A 64 -1.135 4.381 -2.624 1.00 0.00 N ATOM 952 CA ALA A 64 -0.416 4.191 -1.371 1.00 0.00 C ATOM 953 C ALA A 64 0.206 2.800 -1.300 1.00 0.00 C ATOM 954 O ALA A 64 1.280 2.619 -0.728 1.00 0.00 O ATOM 955 CB ALA A 64 -1.347 4.416 -0.188 1.00 0.00 C ATOM 0 H ALA A 64 -1.964 4.971 -2.549 1.00 0.00 H new ATOM 0 HA ALA A 64 0.390 4.924 -1.329 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.796 4.271 0.741 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.739 5.432 -0.222 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -2.173 3.706 -0.235 1.00 0.00 H new ATOM 961 N ALA A 65 -0.477 1.822 -1.885 1.00 0.00 N ATOM 962 CA ALA A 65 0.010 0.448 -1.889 1.00 0.00 C ATOM 963 C ALA A 65 1.038 0.233 -2.994 1.00 0.00 C ATOM 964 O ALA A 65 2.093 -0.361 -2.769 1.00 0.00 O ATOM 965 CB ALA A 65 -1.151 -0.523 -2.050 1.00 0.00 C ATOM 0 H ALA A 65 -1.369 1.955 -2.362 1.00 0.00 H new ATOM 0 HA ALA A 65 0.498 0.259 -0.933 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -0.773 -1.545 -2.051 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -1.849 -0.396 -1.223 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -1.663 -0.325 -2.991 1.00 0.00 H new ATOM 971 N LYS A 66 0.725 0.719 -4.190 1.00 0.00 N ATOM 972 CA LYS A 66 1.621 0.581 -5.332 1.00 0.00 C ATOM 973 C LYS A 66 3.071 0.806 -4.915 1.00 0.00 C ATOM 974 O LYS A 66 3.966 0.070 -5.328 1.00 0.00 O ATOM 975 CB LYS A 66 1.236 1.572 -6.432 1.00 0.00 C ATOM 976 CG LYS A 66 1.861 1.258 -7.780 1.00 0.00 C ATOM 977 CD LYS A 66 1.190 2.035 -8.901 1.00 0.00 C ATOM 978 CE LYS A 66 1.941 1.879 -10.214 1.00 0.00 C ATOM 979 NZ LYS A 66 3.231 2.624 -10.208 1.00 0.00 N ATOM 0 H LYS A 66 -0.144 1.213 -4.394 1.00 0.00 H new ATOM 0 HA LYS A 66 1.525 -0.434 -5.717 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.151 1.581 -6.537 1.00 0.00 H new ATOM 0 HB3 LYS A 66 1.535 2.575 -6.127 1.00 0.00 H new ATOM 0 HG2 LYS A 66 2.924 1.499 -7.754 1.00 0.00 H new ATOM 0 HG3 LYS A 66 1.782 0.189 -7.979 1.00 0.00 H new ATOM 0 HD2 LYS A 66 0.164 1.687 -9.024 1.00 0.00 H new ATOM 0 HD3 LYS A 66 1.138 3.090 -8.633 1.00 0.00 H new ATOM 0 HE2 LYS A 66 2.133 0.822 -10.399 1.00 0.00 H new ATOM 0 HE3 LYS A 66 1.318 2.238 -11.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 3.613 2.664 -11.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 3.072 3.591 -9.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 3.909 2.139 -9.587 1.00 0.00 H new ATOM 993 N GLU A 67 3.294 1.828 -4.094 1.00 0.00 N ATOM 994 CA GLU A 67 4.636 2.148 -3.622 1.00 0.00 C ATOM 995 C GLU A 67 5.053 1.212 -2.491 1.00 0.00 C ATOM 996 O GLU A 67 6.069 0.524 -2.584 1.00 0.00 O ATOM 997 CB GLU A 67 4.700 3.601 -3.145 1.00 0.00 C ATOM 998 CG GLU A 67 4.784 4.610 -4.278 1.00 0.00 C ATOM 999 CD GLU A 67 3.669 4.444 -5.292 1.00 0.00 C ATOM 1000 OE1 GLU A 67 2.505 4.280 -4.870 1.00 0.00 O ATOM 1001 OE2 GLU A 67 3.959 4.478 -6.506 1.00 0.00 O ATOM 0 H GLU A 67 2.564 2.447 -3.743 1.00 0.00 H new ATOM 0 HA GLU A 67 5.327 2.015 -4.454 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.817 3.816 -2.543 1.00 0.00 H new ATOM 0 HB3 GLU A 67 5.567 3.724 -2.495 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.747 5.618 -3.865 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.746 4.507 -4.781 1.00 0.00 H new ATOM 1008 N ALA A 68 4.261 1.193 -1.424 1.00 0.00 N ATOM 1009 CA ALA A 68 4.546 0.341 -0.276 1.00 0.00 C ATOM 1010 C ALA A 68 5.009 -1.042 -0.721 1.00 0.00 C ATOM 1011 O ALA A 68 5.922 -1.621 -0.132 1.00 0.00 O ATOM 1012 CB ALA A 68 3.319 0.228 0.615 1.00 0.00 C ATOM 0 H ALA A 68 3.417 1.758 -1.331 1.00 0.00 H new ATOM 0 HA ALA A 68 5.354 0.800 0.294 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.546 -0.411 1.468 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.034 1.219 0.969 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.495 -0.205 0.047 1.00 0.00 H new ATOM 1018 N TYR A 69 4.373 -1.567 -1.762 1.00 0.00 N ATOM 1019 CA TYR A 69 4.718 -2.884 -2.283 1.00 0.00 C ATOM 1020 C TYR A 69 6.205 -2.967 -2.615 1.00 0.00 C ATOM 1021 O TYR A 69 6.908 -3.859 -2.141 1.00 0.00 O ATOM 1022 CB TYR A 69 3.888 -3.196 -3.530 1.00 0.00 C ATOM 1023 CG TYR A 69 4.108 -4.591 -4.071 1.00 0.00 C ATOM 1024 CD1 TYR A 69 3.673 -5.707 -3.366 1.00 0.00 C ATOM 1025 CD2 TYR A 69 4.751 -4.793 -5.286 1.00 0.00 C ATOM 1026 CE1 TYR A 69 3.872 -6.983 -3.856 1.00 0.00 C ATOM 1027 CE2 TYR A 69 4.953 -6.065 -5.784 1.00 0.00 C ATOM 1028 CZ TYR A 69 4.512 -7.157 -5.065 1.00 0.00 C ATOM 1029 OH TYR A 69 4.713 -8.426 -5.557 1.00 0.00 O ATOM 0 H TYR A 69 3.616 -1.101 -2.262 1.00 0.00 H new ATOM 0 HA TYR A 69 4.495 -3.621 -1.512 1.00 0.00 H new ATOM 0 HB2 TYR A 69 2.831 -3.069 -3.294 1.00 0.00 H new ATOM 0 HB3 TYR A 69 4.130 -2.472 -4.308 1.00 0.00 H new ATOM 0 HD1 TYR A 69 3.171 -5.574 -2.419 1.00 0.00 H new ATOM 0 HD2 TYR A 69 5.099 -3.941 -5.851 1.00 0.00 H new ATOM 0 HE1 TYR A 69 3.528 -7.840 -3.295 1.00 0.00 H new ATOM 0 HE2 TYR A 69 5.453 -6.204 -6.731 1.00 0.00 H new ATOM 0 HH TYR A 69 5.177 -8.373 -6.419 1.00 0.00 H new ATOM 1039 N GLN A 70 6.675 -2.030 -3.431 1.00 0.00 N ATOM 1040 CA GLN A 70 8.078 -1.997 -3.827 1.00 0.00 C ATOM 1041 C GLN A 70 8.990 -2.123 -2.611 1.00 0.00 C ATOM 1042 O GLN A 70 9.829 -3.021 -2.541 1.00 0.00 O ATOM 1043 CB GLN A 70 8.387 -0.701 -4.578 1.00 0.00 C ATOM 1044 CG GLN A 70 7.524 -0.492 -5.812 1.00 0.00 C ATOM 1045 CD GLN A 70 7.623 -1.641 -6.795 1.00 0.00 C ATOM 1046 OE1 GLN A 70 6.716 -2.468 -6.893 1.00 0.00 O ATOM 1047 NE2 GLN A 70 8.728 -1.700 -7.529 1.00 0.00 N ATOM 0 H GLN A 70 6.106 -1.284 -3.831 1.00 0.00 H new ATOM 0 HA GLN A 70 8.263 -2.845 -4.487 1.00 0.00 H new ATOM 0 HB2 GLN A 70 8.249 0.143 -3.902 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.436 -0.704 -4.875 1.00 0.00 H new ATOM 0 HG2 GLN A 70 6.485 -0.368 -5.507 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.823 0.432 -6.307 1.00 0.00 H new ATOM 0 HE21 GLN A 70 9.454 -0.993 -7.415 1.00 0.00 H new ATOM 0 HE22 GLN A 70 8.850 -2.452 -8.207 1.00 0.00 H new ATOM 1056 N LYS A 71 8.820 -1.218 -1.653 1.00 0.00 N ATOM 1057 CA LYS A 71 9.626 -1.227 -0.438 1.00 0.00 C ATOM 1058 C LYS A 71 9.808 -2.649 0.083 1.00 0.00 C ATOM 1059 O LYS A 71 10.932 -3.101 0.303 1.00 0.00 O ATOM 1060 CB LYS A 71 8.973 -0.358 0.638 1.00 0.00 C ATOM 1061 CG LYS A 71 9.723 -0.359 1.959 1.00 0.00 C ATOM 1062 CD LYS A 71 11.051 0.371 1.847 1.00 0.00 C ATOM 1063 CE LYS A 71 10.878 1.872 2.024 1.00 0.00 C ATOM 1064 NZ LYS A 71 11.002 2.280 3.451 1.00 0.00 N ATOM 0 H LYS A 71 8.130 -0.468 -1.695 1.00 0.00 H new ATOM 0 HA LYS A 71 10.607 -0.819 -0.680 1.00 0.00 H new ATOM 0 HB2 LYS A 71 8.901 0.666 0.272 1.00 0.00 H new ATOM 0 HB3 LYS A 71 7.955 -0.708 0.808 1.00 0.00 H new ATOM 0 HG2 LYS A 71 9.110 0.114 2.727 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.897 -1.386 2.279 1.00 0.00 H new ATOM 0 HD2 LYS A 71 11.741 -0.008 2.601 1.00 0.00 H new ATOM 0 HD3 LYS A 71 11.499 0.167 0.874 1.00 0.00 H new ATOM 0 HE2 LYS A 71 11.626 2.396 1.430 1.00 0.00 H new ATOM 0 HE3 LYS A 71 9.902 2.172 1.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 10.878 3.310 3.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 10.272 1.799 4.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 11.943 2.016 3.807 1.00 0.00 H new ATOM 1078 N LEU A 72 8.696 -3.350 0.276 1.00 0.00 N ATOM 1079 CA LEU A 72 8.733 -4.722 0.770 1.00 0.00 C ATOM 1080 C LEU A 72 9.644 -5.588 -0.095 1.00 0.00 C ATOM 1081 O LEU A 72 10.523 -6.285 0.414 1.00 0.00 O ATOM 1082 CB LEU A 72 7.323 -5.314 0.796 1.00 0.00 C ATOM 1083 CG LEU A 72 6.475 -4.974 2.022 1.00 0.00 C ATOM 1084 CD1 LEU A 72 5.028 -5.387 1.802 1.00 0.00 C ATOM 1085 CD2 LEU A 72 7.040 -5.646 3.265 1.00 0.00 C ATOM 0 H LEU A 72 7.758 -2.991 0.098 1.00 0.00 H new ATOM 0 HA LEU A 72 9.133 -4.706 1.784 1.00 0.00 H new ATOM 0 HB2 LEU A 72 6.792 -4.975 -0.094 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.405 -6.399 0.725 1.00 0.00 H new ATOM 0 HG LEU A 72 6.505 -3.895 2.172 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.440 -5.137 2.685 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.626 -4.859 0.937 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.979 -6.462 1.626 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.424 -5.393 4.128 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.042 -6.727 3.125 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.060 -5.300 3.434 1.00 0.00 H new ATOM 1097 N LEU A 73 9.430 -5.537 -1.405 1.00 0.00 N ATOM 1098 CA LEU A 73 10.233 -6.315 -2.342 1.00 0.00 C ATOM 1099 C LEU A 73 11.711 -5.957 -2.220 1.00 0.00 C ATOM 1100 O LEU A 73 12.578 -6.831 -2.247 1.00 0.00 O ATOM 1101 CB LEU A 73 9.755 -6.075 -3.775 1.00 0.00 C ATOM 1102 CG LEU A 73 8.248 -6.185 -4.007 1.00 0.00 C ATOM 1103 CD1 LEU A 73 7.818 -5.286 -5.156 1.00 0.00 C ATOM 1104 CD2 LEU A 73 7.854 -7.629 -4.282 1.00 0.00 C ATOM 0 H LEU A 73 8.707 -4.965 -1.842 1.00 0.00 H new ATOM 0 HA LEU A 73 10.112 -7.370 -2.097 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.078 -5.081 -4.083 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.256 -6.789 -4.428 1.00 0.00 H new ATOM 0 HG LEU A 73 7.736 -5.856 -3.103 1.00 0.00 H new ATOM 0 HD11 LEU A 73 6.742 -5.377 -5.307 1.00 0.00 H new ATOM 0 HD12 LEU A 73 8.065 -4.251 -4.920 1.00 0.00 H new ATOM 0 HD13 LEU A 73 8.338 -5.585 -6.066 1.00 0.00 H new ATOM 0 HD21 LEU A 73 6.778 -7.688 -4.445 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.375 -7.986 -5.170 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.126 -8.249 -3.428 1.00 0.00 H new ATOM 1116 N LYS A 74 11.992 -4.665 -2.084 1.00 0.00 N ATOM 1117 CA LYS A 74 13.365 -4.190 -1.954 1.00 0.00 C ATOM 1118 C LYS A 74 13.946 -4.572 -0.597 1.00 0.00 C ATOM 1119 O LYS A 74 14.809 -5.445 -0.504 1.00 0.00 O ATOM 1120 CB LYS A 74 13.420 -2.672 -2.136 1.00 0.00 C ATOM 1121 CG LYS A 74 13.522 -2.236 -3.587 1.00 0.00 C ATOM 1122 CD LYS A 74 14.288 -0.931 -3.725 1.00 0.00 C ATOM 1123 CE LYS A 74 15.778 -1.176 -3.914 1.00 0.00 C ATOM 1124 NZ LYS A 74 16.583 0.038 -3.607 1.00 0.00 N ATOM 0 H LYS A 74 11.287 -3.928 -2.061 1.00 0.00 H new ATOM 0 HA LYS A 74 13.963 -4.665 -2.732 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.527 -2.229 -1.694 1.00 0.00 H new ATOM 0 HB3 LYS A 74 14.276 -2.280 -1.587 1.00 0.00 H new ATOM 0 HG2 LYS A 74 14.019 -3.014 -4.167 1.00 0.00 H new ATOM 0 HG3 LYS A 74 12.522 -2.117 -4.003 1.00 0.00 H new ATOM 0 HD2 LYS A 74 13.900 -0.368 -4.574 1.00 0.00 H new ATOM 0 HD3 LYS A 74 14.129 -0.319 -2.837 1.00 0.00 H new ATOM 0 HE2 LYS A 74 16.096 -1.995 -3.269 1.00 0.00 H new ATOM 0 HE3 LYS A 74 15.967 -1.487 -4.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 17.592 -0.170 -3.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 16.298 0.813 -4.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 16.422 0.320 -2.619 1.00 0.00 H new ATOM 1138 N SER A 75 13.468 -3.912 0.454 1.00 0.00 N ATOM 1139 CA SER A 75 13.943 -4.181 1.806 1.00 0.00 C ATOM 1140 C SER A 75 12.785 -4.569 2.721 1.00 0.00 C ATOM 1141 O SER A 75 12.199 -3.735 3.411 1.00 0.00 O ATOM 1142 CB SER A 75 14.664 -2.956 2.369 1.00 0.00 C ATOM 1143 OG SER A 75 15.162 -3.210 3.671 1.00 0.00 O ATOM 0 H SER A 75 12.752 -3.188 0.395 1.00 0.00 H new ATOM 0 HA SER A 75 14.642 -5.016 1.760 1.00 0.00 H new ATOM 0 HB2 SER A 75 15.487 -2.679 1.709 1.00 0.00 H new ATOM 0 HB3 SER A 75 13.979 -2.108 2.397 1.00 0.00 H new ATOM 0 HG SER A 75 15.620 -2.412 4.008 1.00 0.00 H new ATOM 1149 N PRO A 76 12.446 -5.867 2.727 1.00 0.00 N ATOM 1150 CA PRO A 76 11.357 -6.397 3.553 1.00 0.00 C ATOM 1151 C PRO A 76 11.694 -6.377 5.040 1.00 0.00 C ATOM 1152 O PRO A 76 12.859 -6.398 5.437 1.00 0.00 O ATOM 1153 CB PRO A 76 11.206 -7.838 3.058 1.00 0.00 C ATOM 1154 CG PRO A 76 12.543 -8.190 2.503 1.00 0.00 C ATOM 1155 CD PRO A 76 13.101 -6.918 1.930 1.00 0.00 C ATOM 0 HA PRO A 76 10.448 -5.802 3.460 1.00 0.00 H new ATOM 0 HB2 PRO A 76 10.926 -8.508 3.871 1.00 0.00 H new ATOM 0 HB3 PRO A 76 10.429 -7.916 2.298 1.00 0.00 H new ATOM 0 HG2 PRO A 76 13.196 -8.587 3.280 1.00 0.00 H new ATOM 0 HG3 PRO A 76 12.457 -8.959 1.735 1.00 0.00 H new ATOM 0 HD2 PRO A 76 14.186 -6.877 2.025 1.00 0.00 H new ATOM 0 HD3 PRO A 76 12.870 -6.820 0.869 1.00 0.00 H new ATOM 1163 N PRO A 77 10.651 -6.335 5.883 1.00 0.00 N ATOM 1164 CA PRO A 77 10.812 -6.312 7.340 1.00 0.00 C ATOM 1165 C PRO A 77 11.327 -7.639 7.887 1.00 0.00 C ATOM 1166 O PRO A 77 12.280 -7.673 8.666 1.00 0.00 O ATOM 1167 CB PRO A 77 9.394 -6.038 7.848 1.00 0.00 C ATOM 1168 CG PRO A 77 8.500 -6.543 6.769 1.00 0.00 C ATOM 1169 CD PRO A 77 9.235 -6.308 5.479 1.00 0.00 C ATOM 0 HA PRO A 77 11.545 -5.570 7.658 1.00 0.00 H new ATOM 0 HB2 PRO A 77 9.205 -6.551 8.791 1.00 0.00 H new ATOM 0 HB3 PRO A 77 9.236 -4.974 8.027 1.00 0.00 H new ATOM 0 HG2 PRO A 77 8.282 -7.602 6.907 1.00 0.00 H new ATOM 0 HG3 PRO A 77 7.545 -6.017 6.775 1.00 0.00 H new ATOM 0 HD2 PRO A 77 9.012 -7.081 4.743 1.00 0.00 H new ATOM 0 HD3 PRO A 77 8.963 -5.353 5.030 1.00 0.00 H new ATOM 1177 N LYS A 78 10.692 -8.730 7.474 1.00 0.00 N ATOM 1178 CA LYS A 78 11.087 -10.061 7.921 1.00 0.00 C ATOM 1179 C LYS A 78 10.281 -11.138 7.202 1.00 0.00 C ATOM 1180 O LYS A 78 9.050 -11.124 7.221 1.00 0.00 O ATOM 1181 CB LYS A 78 10.896 -10.190 9.434 1.00 0.00 C ATOM 1182 CG LYS A 78 11.128 -11.597 9.958 1.00 0.00 C ATOM 1183 CD LYS A 78 10.963 -11.665 11.467 1.00 0.00 C ATOM 1184 CE LYS A 78 12.215 -11.187 12.186 1.00 0.00 C ATOM 1185 NZ LYS A 78 13.182 -12.296 12.412 1.00 0.00 N ATOM 0 H LYS A 78 9.901 -8.719 6.830 1.00 0.00 H new ATOM 0 HA LYS A 78 12.141 -10.200 7.681 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.579 -9.506 9.938 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.884 -9.877 9.692 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.427 -12.283 9.483 1.00 0.00 H new ATOM 0 HG3 LYS A 78 12.131 -11.927 9.686 1.00 0.00 H new ATOM 0 HD2 LYS A 78 10.113 -11.054 11.769 1.00 0.00 H new ATOM 0 HD3 LYS A 78 10.740 -12.690 11.764 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.693 -10.402 11.600 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.938 -10.746 13.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.022 -11.930 12.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 12.735 -13.034 12.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.466 -12.701 11.497 1.00 0.00 H new ATOM 1199 N THR A 79 10.983 -12.073 6.569 1.00 0.00 N ATOM 1200 CA THR A 79 10.333 -13.158 5.845 1.00 0.00 C ATOM 1201 C THR A 79 10.572 -14.498 6.531 1.00 0.00 C ATOM 1202 O THR A 79 11.593 -14.696 7.189 1.00 0.00 O ATOM 1203 CB THR A 79 10.835 -13.242 4.391 1.00 0.00 C ATOM 1204 OG1 THR A 79 10.090 -14.232 3.672 1.00 0.00 O ATOM 1205 CG2 THR A 79 12.317 -13.585 4.349 1.00 0.00 C ATOM 0 H THR A 79 12.002 -12.100 6.543 1.00 0.00 H new ATOM 0 HA THR A 79 9.265 -12.940 5.842 1.00 0.00 H new ATOM 0 HB THR A 79 10.690 -12.268 3.923 1.00 0.00 H new ATOM 0 HG1 THR A 79 10.414 -14.278 2.748 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.649 -13.639 3.312 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.884 -12.815 4.872 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.482 -14.548 4.833 1.00 0.00 H new ATOM 1213 N ALA A 80 9.623 -15.415 6.373 1.00 0.00 N ATOM 1214 CA ALA A 80 9.732 -16.738 6.975 1.00 0.00 C ATOM 1215 C ALA A 80 9.847 -17.820 5.907 1.00 0.00 C ATOM 1216 O ALA A 80 10.715 -18.689 5.981 1.00 0.00 O ATOM 1217 CB ALA A 80 8.536 -17.008 7.876 1.00 0.00 C ATOM 0 H ALA A 80 8.770 -15.266 5.833 1.00 0.00 H new ATOM 0 HA ALA A 80 10.640 -16.762 7.578 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.631 -17.999 8.319 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.500 -16.259 8.667 1.00 0.00 H new ATOM 0 HB3 ALA A 80 7.619 -16.959 7.288 1.00 0.00 H new ATOM 1223 N GLY A 81 8.965 -17.761 4.914 1.00 0.00 N ATOM 1224 CA GLY A 81 8.985 -18.742 3.845 1.00 0.00 C ATOM 1225 C GLY A 81 10.347 -18.858 3.189 1.00 0.00 C ATOM 1226 O GLY A 81 11.016 -19.884 3.305 1.00 0.00 O ATOM 0 H GLY A 81 8.237 -17.051 4.831 1.00 0.00 H new ATOM 0 HA2 GLY A 81 8.693 -19.714 4.243 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.245 -18.470 3.093 1.00 0.00 H new ATOM 1230 N THR A 82 10.759 -17.801 2.494 1.00 0.00 N ATOM 1231 CA THR A 82 12.048 -17.789 1.814 1.00 0.00 C ATOM 1232 C THR A 82 12.502 -16.364 1.523 1.00 0.00 C ATOM 1233 O THR A 82 11.795 -15.598 0.868 1.00 0.00 O ATOM 1234 CB THR A 82 11.993 -18.578 0.492 1.00 0.00 C ATOM 1235 OG1 THR A 82 13.291 -18.612 -0.112 1.00 0.00 O ATOM 1236 CG2 THR A 82 10.995 -17.953 -0.471 1.00 0.00 C ATOM 0 H THR A 82 10.218 -16.943 2.388 1.00 0.00 H new ATOM 0 HA THR A 82 12.763 -18.266 2.484 1.00 0.00 H new ATOM 0 HB THR A 82 11.670 -19.595 0.714 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.248 -19.117 -0.951 1.00 0.00 H new ATOM 0 HG21 THR A 82 10.974 -18.528 -1.397 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.003 -17.956 -0.020 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.292 -16.927 -0.687 1.00 0.00 H new ATOM 1244 N SER A 83 13.687 -16.013 2.014 1.00 0.00 N ATOM 1245 CA SER A 83 14.235 -14.678 1.809 1.00 0.00 C ATOM 1246 C SER A 83 14.880 -14.561 0.431 1.00 0.00 C ATOM 1247 O SER A 83 15.953 -13.978 0.283 1.00 0.00 O ATOM 1248 CB SER A 83 15.262 -14.352 2.895 1.00 0.00 C ATOM 1249 OG SER A 83 15.721 -13.017 2.779 1.00 0.00 O ATOM 0 H SER A 83 14.286 -16.635 2.557 1.00 0.00 H new ATOM 0 HA SER A 83 13.415 -13.963 1.869 1.00 0.00 H new ATOM 0 HB2 SER A 83 14.816 -14.502 3.878 1.00 0.00 H new ATOM 0 HB3 SER A 83 16.106 -15.038 2.819 1.00 0.00 H new ATOM 0 HG SER A 83 15.997 -12.845 1.855 1.00 0.00 H new ATOM 1255 N GLY A 84 14.215 -15.120 -0.576 1.00 0.00 N ATOM 1256 CA GLY A 84 14.738 -15.068 -1.929 1.00 0.00 C ATOM 1257 C GLY A 84 16.077 -15.766 -2.060 1.00 0.00 C ATOM 1258 O GLY A 84 17.027 -15.474 -1.334 1.00 0.00 O ATOM 0 H GLY A 84 13.324 -15.607 -0.479 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.023 -15.530 -2.610 1.00 0.00 H new ATOM 0 HA3 GLY A 84 14.843 -14.027 -2.235 1.00 0.00 H new ATOM 1262 N PRO A 85 16.164 -16.714 -3.005 1.00 0.00 N ATOM 1263 CA PRO A 85 17.392 -17.476 -3.250 1.00 0.00 C ATOM 1264 C PRO A 85 18.492 -16.620 -3.870 1.00 0.00 C ATOM 1265 O PRO A 85 18.440 -16.288 -5.053 1.00 0.00 O ATOM 1266 CB PRO A 85 16.945 -18.563 -4.231 1.00 0.00 C ATOM 1267 CG PRO A 85 15.758 -17.985 -4.922 1.00 0.00 C ATOM 1268 CD PRO A 85 15.071 -17.115 -3.907 1.00 0.00 C ATOM 0 HA PRO A 85 17.821 -17.865 -2.327 1.00 0.00 H new ATOM 0 HB2 PRO A 85 17.736 -18.806 -4.940 1.00 0.00 H new ATOM 0 HB3 PRO A 85 16.689 -19.486 -3.710 1.00 0.00 H new ATOM 0 HG2 PRO A 85 16.059 -17.404 -5.794 1.00 0.00 H new ATOM 0 HG3 PRO A 85 15.092 -18.771 -5.277 1.00 0.00 H new ATOM 0 HD2 PRO A 85 14.597 -16.251 -4.373 1.00 0.00 H new ATOM 0 HD3 PRO A 85 14.290 -17.658 -3.375 1.00 0.00 H new ATOM 1276 N SER A 86 19.486 -16.268 -3.061 1.00 0.00 N ATOM 1277 CA SER A 86 20.597 -15.447 -3.529 1.00 0.00 C ATOM 1278 C SER A 86 21.911 -16.220 -3.459 1.00 0.00 C ATOM 1279 O SER A 86 22.079 -17.105 -2.620 1.00 0.00 O ATOM 1280 CB SER A 86 20.700 -14.167 -2.697 1.00 0.00 C ATOM 1281 OG SER A 86 21.239 -14.435 -1.414 1.00 0.00 O ATOM 0 H SER A 86 19.545 -16.538 -2.079 1.00 0.00 H new ATOM 0 HA SER A 86 20.407 -15.181 -4.569 1.00 0.00 H new ATOM 0 HB2 SER A 86 21.328 -13.442 -3.215 1.00 0.00 H new ATOM 0 HB3 SER A 86 19.713 -13.716 -2.593 1.00 0.00 H new ATOM 0 HG SER A 86 21.296 -13.601 -0.903 1.00 0.00 H new ATOM 1287 N SER A 87 22.839 -15.879 -4.347 1.00 0.00 N ATOM 1288 CA SER A 87 24.137 -16.542 -4.389 1.00 0.00 C ATOM 1289 C SER A 87 24.819 -16.489 -3.025 1.00 0.00 C ATOM 1290 O SER A 87 25.373 -17.483 -2.557 1.00 0.00 O ATOM 1291 CB SER A 87 25.032 -15.891 -5.445 1.00 0.00 C ATOM 1292 OG SER A 87 25.484 -14.619 -5.016 1.00 0.00 O ATOM 0 H SER A 87 22.716 -15.147 -5.047 1.00 0.00 H new ATOM 0 HA SER A 87 23.975 -17.587 -4.654 1.00 0.00 H new ATOM 0 HB2 SER A 87 25.888 -16.535 -5.648 1.00 0.00 H new ATOM 0 HB3 SER A 87 24.481 -15.788 -6.380 1.00 0.00 H new ATOM 0 HG SER A 87 26.055 -14.225 -5.708 1.00 0.00 H new ATOM 1298 N GLY A 88 24.773 -15.321 -2.392 1.00 0.00 N ATOM 1299 CA GLY A 88 25.390 -15.158 -1.089 1.00 0.00 C ATOM 1300 C GLY A 88 26.441 -14.066 -1.077 1.00 0.00 C ATOM 1301 O GLY A 88 27.583 -14.290 -1.478 1.00 0.00 O ATOM 0 H GLY A 88 24.319 -14.484 -2.759 1.00 0.00 H new ATOM 0 HA2 GLY A 88 24.621 -14.925 -0.353 1.00 0.00 H new ATOM 0 HA3 GLY A 88 25.846 -16.100 -0.786 1.00 0.00 H new TER 1305 GLY A 88