USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1136 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 80 LYS NZ :NH3+ 163:sc= 0.0205 (180deg=0) USER MOD Set 1.2: A 84 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 68 ASN : amide:sc= -0.397 K(o=-0.38,f=-1.3) USER MOD Set 2.2: A 81 ASN : amide:sc= 0.0163 K(o=-0.38,f=-2.5) 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 40:sc= 0.159 USER MOD Single : A 5 SER OG : rot -57:sc= 0.048 USER MOD Single : A 6 SER OG : rot -66:sc= 0.289 USER MOD Single : A 8 MET CE :methyl 145:sc= -0.0533 (180deg=-0.974) USER MOD Single : A 12 LYS NZ :NH3+ -120:sc= -0.654 (180deg=-1.3) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 14 CYS SG : rot 180:sc= -0.0215 USER MOD Single : A 16 GLN :FLIP amide:sc= -0.311 F(o=-1.2,f=-0.31) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 CYS SG : rot 141:sc= -3.66! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS :FLIP no HD1:sc= -11.7! C(o=-13!,f=-12!) USER MOD Single : A 31 THR OG1 : rot -64:sc= 0.908 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 42 GLN : amide:sc= -0.0928 K(o=-0.093,f=-0.73) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 91:sc= -3.71! USER MOD Single : A 52 GLN : amide:sc= 0 K(o=0,f=-3.4!) USER MOD Single : A 55 ASN : amide:sc= -2.68 K(o=-2.7,f=-15!) USER MOD Single : A 56 ASN : amide:sc= -0.701 X(o=-0.7,f=-0.69) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 88:sc= -0.0242 USER MOD Single : A 63 ASN : amide:sc= -0.594 K(o=-0.59,f=-3.4) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 MET CE :methyl 154:sc= -0.14 (180deg=-0.579) USER MOD Single : A 74 SER OG : rot 92:sc= 0.203 USER MOD Single : A 75 GLN : amide:sc= -0.0762 K(o=-0.076,f=-0.65) USER MOD Single : A 78 CYS SG : rot 125:sc= -0.423 USER MOD Single : A 87 THR OG1 : rot 68:sc= 0.768 USER MOD Single : A 89 CYS SG : rot 126:sc= 0.482 USER MOD Single : A 90 CYS SG : rot -20:sc= 0.124 USER MOD Single : A 92 THR OG1 : rot -173:sc= 0.431 USER MOD Single : A 95 MET CE :methyl 179:sc= -0.116 (180deg=-0.124) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 110:sc= -0.149 USER MOD Single : A 120 SER OG : rot -120:sc= -1.1 USER MOD Single : A 123 SER OG : rot -65:sc= 0.115 USER MOD Single : A 125 THR OG1 : rot -97:sc= 1.08 USER MOD Single : A 131 THR OG1 : rot -70:sc= 0.245 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.894 -6.324 25.274 1.00 0.00 N ATOM 2 CA GLY A 1 18.729 -7.010 24.746 1.00 0.00 C ATOM 3 C GLY A 1 18.098 -6.270 23.584 1.00 0.00 C ATOM 4 O GLY A 1 18.099 -6.758 22.454 1.00 0.00 O ATOM 0 H1 GLY A 1 20.289 -6.870 26.066 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.611 -6.231 24.526 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.618 -5.379 25.608 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.016 -8.011 24.423 1.00 0.00 H new ATOM 0 HA3 GLY A 1 17.992 -7.131 25.540 1.00 0.00 H new ATOM 8 N SER A 2 17.555 -5.088 23.861 1.00 0.00 N ATOM 9 CA SER A 2 16.912 -4.282 22.830 1.00 0.00 C ATOM 10 C SER A 2 17.942 -3.732 21.849 1.00 0.00 C ATOM 11 O SER A 2 18.488 -2.647 22.048 1.00 0.00 O ATOM 12 CB SER A 2 16.132 -3.130 23.467 1.00 0.00 C ATOM 13 OG SER A 2 15.404 -2.406 22.490 1.00 0.00 O ATOM 0 H SER A 2 17.548 -4.668 24.790 1.00 0.00 H new ATOM 0 HA SER A 2 16.220 -4.922 22.282 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.447 -3.522 24.219 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.821 -2.461 23.982 1.00 0.00 H new ATOM 0 HG SER A 2 14.913 -1.676 22.922 1.00 0.00 H new ATOM 19 N SER A 3 18.203 -4.490 20.788 1.00 0.00 N ATOM 20 CA SER A 3 19.170 -4.082 19.776 1.00 0.00 C ATOM 21 C SER A 3 18.510 -3.210 18.713 1.00 0.00 C ATOM 22 O SER A 3 17.576 -3.639 18.035 1.00 0.00 O ATOM 23 CB SER A 3 19.806 -5.311 19.123 1.00 0.00 C ATOM 24 OG SER A 3 18.815 -6.219 18.674 1.00 0.00 O ATOM 0 H SER A 3 17.758 -5.390 20.607 1.00 0.00 H new ATOM 0 HA SER A 3 19.948 -3.497 20.267 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.427 -5.000 18.283 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.462 -5.808 19.837 1.00 0.00 H new ATOM 0 HG SER A 3 18.070 -5.721 18.278 1.00 0.00 H new ATOM 30 N GLY A 4 19.002 -1.983 18.572 1.00 0.00 N ATOM 31 CA GLY A 4 18.448 -1.070 17.590 1.00 0.00 C ATOM 32 C GLY A 4 19.097 -1.219 16.228 1.00 0.00 C ATOM 33 O GLY A 4 18.802 -2.161 15.492 1.00 0.00 O ATOM 0 H GLY A 4 19.774 -1.605 19.121 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.376 -1.246 17.499 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.575 -0.045 17.939 1.00 0.00 H new ATOM 37 N SER A 5 19.982 -0.287 15.891 1.00 0.00 N ATOM 38 CA SER A 5 20.671 -0.316 14.606 1.00 0.00 C ATOM 39 C SER A 5 19.687 -0.116 13.458 1.00 0.00 C ATOM 40 O SER A 5 19.720 -0.840 12.463 1.00 0.00 O ATOM 41 CB SER A 5 21.413 -1.642 14.431 1.00 0.00 C ATOM 42 OG SER A 5 22.387 -1.550 13.406 1.00 0.00 O ATOM 0 H SER A 5 20.239 0.498 16.490 1.00 0.00 H new ATOM 0 HA SER A 5 21.393 0.501 14.590 1.00 0.00 H new ATOM 0 HB2 SER A 5 21.893 -1.920 15.369 1.00 0.00 H new ATOM 0 HB3 SER A 5 20.701 -2.432 14.191 1.00 0.00 H new ATOM 0 HG SER A 5 21.956 -1.278 12.569 1.00 0.00 H new ATOM 48 N SER A 6 18.811 0.873 13.603 1.00 0.00 N ATOM 49 CA SER A 6 17.813 1.168 12.581 1.00 0.00 C ATOM 50 C SER A 6 17.974 2.592 12.059 1.00 0.00 C ATOM 51 O SER A 6 17.274 3.507 12.492 1.00 0.00 O ATOM 52 CB SER A 6 16.404 0.974 13.142 1.00 0.00 C ATOM 53 OG SER A 6 15.431 1.550 12.288 1.00 0.00 O ATOM 0 H SER A 6 18.772 1.484 14.419 1.00 0.00 H new ATOM 0 HA SER A 6 17.964 0.477 11.752 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.201 -0.090 13.264 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.338 1.427 14.131 1.00 0.00 H new ATOM 0 HG SER A 6 15.538 2.524 12.280 1.00 0.00 H new ATOM 59 N GLY A 7 18.903 2.773 11.125 1.00 0.00 N ATOM 60 CA GLY A 7 19.141 4.088 10.560 1.00 0.00 C ATOM 61 C GLY A 7 18.196 4.407 9.418 1.00 0.00 C ATOM 62 O GLY A 7 17.590 5.478 9.386 1.00 0.00 O ATOM 0 H GLY A 7 19.495 2.032 10.750 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.031 4.841 11.340 1.00 0.00 H new ATOM 0 HA3 GLY A 7 20.170 4.147 10.204 1.00 0.00 H new ATOM 66 N MET A 8 18.071 3.477 8.477 1.00 0.00 N ATOM 67 CA MET A 8 17.194 3.665 7.328 1.00 0.00 C ATOM 68 C MET A 8 15.797 3.122 7.615 1.00 0.00 C ATOM 69 O MET A 8 15.630 1.936 7.900 1.00 0.00 O ATOM 70 CB MET A 8 17.778 2.975 6.094 1.00 0.00 C ATOM 71 CG MET A 8 17.419 3.661 4.787 1.00 0.00 C ATOM 72 SD MET A 8 18.635 4.898 4.294 1.00 0.00 S ATOM 73 CE MET A 8 17.721 6.409 4.591 1.00 0.00 C ATOM 0 H MET A 8 18.566 2.585 8.488 1.00 0.00 H new ATOM 0 HA MET A 8 17.116 4.735 7.134 1.00 0.00 H new ATOM 0 HB2 MET A 8 18.863 2.937 6.189 1.00 0.00 H new ATOM 0 HB3 MET A 8 17.425 1.944 6.063 1.00 0.00 H new ATOM 0 HG2 MET A 8 17.330 2.912 4.001 1.00 0.00 H new ATOM 0 HG3 MET A 8 16.443 4.136 4.887 1.00 0.00 H new ATOM 0 HE1 MET A 8 18.403 7.184 4.942 1.00 0.00 H new ATOM 0 HE2 MET A 8 17.246 6.735 3.665 1.00 0.00 H new ATOM 0 HE3 MET A 8 16.957 6.229 5.347 1.00 0.00 H new ATOM 83 N GLU A 9 14.799 3.996 7.539 1.00 0.00 N ATOM 84 CA GLU A 9 13.418 3.602 7.793 1.00 0.00 C ATOM 85 C GLU A 9 12.988 2.487 6.845 1.00 0.00 C ATOM 86 O GLU A 9 13.562 2.293 5.772 1.00 0.00 O ATOM 87 CB GLU A 9 12.485 4.805 7.638 1.00 0.00 C ATOM 88 CG GLU A 9 12.257 5.568 8.933 1.00 0.00 C ATOM 89 CD GLU A 9 13.440 6.435 9.316 1.00 0.00 C ATOM 90 OE1 GLU A 9 14.507 5.873 9.642 1.00 0.00 O ATOM 91 OE2 GLU A 9 13.300 7.676 9.289 1.00 0.00 O ATOM 0 H GLU A 9 14.920 4.981 7.304 1.00 0.00 H new ATOM 0 HA GLU A 9 13.355 3.231 8.816 1.00 0.00 H new ATOM 0 HB2 GLU A 9 12.902 5.484 6.894 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.524 4.462 7.254 1.00 0.00 H new ATOM 0 HG2 GLU A 9 11.371 6.194 8.830 1.00 0.00 H new ATOM 0 HG3 GLU A 9 12.055 4.860 9.737 1.00 0.00 H new ATOM 98 N PRO A 10 11.954 1.733 7.248 1.00 0.00 N ATOM 99 CA PRO A 10 11.424 0.624 6.451 1.00 0.00 C ATOM 100 C PRO A 10 10.709 1.105 5.192 1.00 0.00 C ATOM 101 O PRO A 10 10.757 0.449 4.152 1.00 0.00 O ATOM 102 CB PRO A 10 10.435 -0.055 7.401 1.00 0.00 C ATOM 103 CG PRO A 10 10.023 1.018 8.349 1.00 0.00 C ATOM 104 CD PRO A 10 11.223 1.907 8.515 1.00 0.00 C ATOM 0 HA PRO A 10 12.215 -0.036 6.094 1.00 0.00 H new ATOM 0 HB2 PRO A 10 9.578 -0.456 6.860 1.00 0.00 H new ATOM 0 HB3 PRO A 10 10.900 -0.890 7.926 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.173 1.578 7.959 1.00 0.00 H new ATOM 0 HG3 PRO A 10 9.715 0.596 9.306 1.00 0.00 H new ATOM 0 HD2 PRO A 10 10.935 2.946 8.673 1.00 0.00 H new ATOM 0 HD3 PRO A 10 11.828 1.610 9.372 1.00 0.00 H new ATOM 112 N TRP A 11 10.048 2.252 5.295 1.00 0.00 N ATOM 113 CA TRP A 11 9.323 2.820 4.164 1.00 0.00 C ATOM 114 C TRP A 11 10.289 3.368 3.119 1.00 0.00 C ATOM 115 O TRP A 11 10.094 3.176 1.918 1.00 0.00 O ATOM 116 CB TRP A 11 8.384 3.929 4.640 1.00 0.00 C ATOM 117 CG TRP A 11 9.102 5.168 5.083 1.00 0.00 C ATOM 118 CD1 TRP A 11 9.615 5.419 6.323 1.00 0.00 C ATOM 119 CD2 TRP A 11 9.386 6.324 4.288 1.00 0.00 C ATOM 120 NE1 TRP A 11 10.201 6.661 6.348 1.00 0.00 N ATOM 121 CE2 TRP A 11 10.075 7.237 5.111 1.00 0.00 C ATOM 122 CE3 TRP A 11 9.128 6.677 2.960 1.00 0.00 C ATOM 123 CZ2 TRP A 11 10.505 8.478 4.649 1.00 0.00 C ATOM 124 CZ3 TRP A 11 9.556 7.909 2.503 1.00 0.00 C ATOM 125 CH2 TRP A 11 10.239 8.797 3.345 1.00 0.00 C ATOM 0 H TRP A 11 9.999 2.807 6.149 1.00 0.00 H new ATOM 0 HA TRP A 11 8.733 2.026 3.706 1.00 0.00 H new ATOM 0 HB2 TRP A 11 7.698 4.185 3.833 1.00 0.00 H new ATOM 0 HB3 TRP A 11 7.780 3.554 5.466 1.00 0.00 H new ATOM 0 HD1 TRP A 11 9.567 4.740 7.162 1.00 0.00 H new ATOM 0 HE1 TRP A 11 10.656 7.086 7.156 1.00 0.00 H new ATOM 0 HE3 TRP A 11 8.604 5.999 2.303 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 11.030 9.165 5.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 9.361 8.192 1.479 1.00 0.00 H new ATOM 0 HH2 TRP A 11 10.562 9.752 2.957 1.00 0.00 H new ATOM 136 N LYS A 12 11.330 4.051 3.582 1.00 0.00 N ATOM 137 CA LYS A 12 12.328 4.625 2.687 1.00 0.00 C ATOM 138 C LYS A 12 12.539 3.737 1.466 1.00 0.00 C ATOM 139 O LYS A 12 12.390 4.185 0.329 1.00 0.00 O ATOM 140 CB LYS A 12 13.654 4.819 3.426 1.00 0.00 C ATOM 141 CG LYS A 12 13.554 5.751 4.621 1.00 0.00 C ATOM 142 CD LYS A 12 13.959 7.169 4.258 1.00 0.00 C ATOM 143 CE LYS A 12 13.017 7.771 3.227 1.00 0.00 C ATOM 144 NZ LYS A 12 13.512 7.567 1.837 1.00 0.00 N ATOM 0 H LYS A 12 11.505 4.221 4.572 1.00 0.00 H new ATOM 0 HA LYS A 12 11.962 5.595 2.349 1.00 0.00 H new ATOM 0 HB2 LYS A 12 14.018 3.848 3.763 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.394 5.213 2.730 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.532 5.749 5.000 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.193 5.384 5.424 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.962 7.788 5.155 1.00 0.00 H new ATOM 0 HD3 LYS A 12 14.976 7.169 3.867 1.00 0.00 H new ATOM 0 HE2 LYS A 12 12.030 7.321 3.331 1.00 0.00 H new ATOM 0 HE3 LYS A 12 12.903 8.838 3.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 13.658 8.490 1.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 14.412 7.047 1.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 12.812 7.021 1.296 1.00 0.00 H new ATOM 158 N GLN A 13 12.885 2.477 1.708 1.00 0.00 N ATOM 159 CA GLN A 13 13.116 1.527 0.627 1.00 0.00 C ATOM 160 C GLN A 13 11.814 1.199 -0.097 1.00 0.00 C ATOM 161 O GLN A 13 11.778 1.126 -1.326 1.00 0.00 O ATOM 162 CB GLN A 13 13.746 0.244 1.173 1.00 0.00 C ATOM 163 CG GLN A 13 12.912 -0.434 2.247 1.00 0.00 C ATOM 164 CD GLN A 13 13.660 -1.551 2.949 1.00 0.00 C ATOM 165 OE1 GLN A 13 13.385 -2.731 2.730 1.00 0.00 O ATOM 166 NE2 GLN A 13 14.613 -1.183 3.797 1.00 0.00 N ATOM 0 H GLN A 13 13.012 2.090 2.643 1.00 0.00 H new ATOM 0 HA GLN A 13 13.802 1.986 -0.085 1.00 0.00 H new ATOM 0 HB2 GLN A 13 13.900 -0.454 0.350 1.00 0.00 H new ATOM 0 HB3 GLN A 13 14.729 0.477 1.582 1.00 0.00 H new ATOM 0 HG2 GLN A 13 12.601 0.308 2.982 1.00 0.00 H new ATOM 0 HG3 GLN A 13 12.005 -0.836 1.797 1.00 0.00 H new ATOM 0 HE21 GLN A 13 14.807 -0.193 3.948 1.00 0.00 H new ATOM 0 HE22 GLN A 13 15.151 -1.890 4.298 1.00 0.00 H new ATOM 175 N CYS A 14 10.749 1.004 0.672 1.00 0.00 N ATOM 176 CA CYS A 14 9.444 0.683 0.103 1.00 0.00 C ATOM 177 C CYS A 14 9.132 1.587 -1.085 1.00 0.00 C ATOM 178 O CYS A 14 8.764 1.112 -2.159 1.00 0.00 O ATOM 179 CB CYS A 14 8.353 0.823 1.166 1.00 0.00 C ATOM 180 SG CYS A 14 6.681 0.511 0.553 1.00 0.00 S ATOM 0 H CYS A 14 10.763 1.062 1.690 1.00 0.00 H new ATOM 0 HA CYS A 14 9.471 -0.349 -0.246 1.00 0.00 H new ATOM 0 HB2 CYS A 14 8.564 0.131 1.982 1.00 0.00 H new ATOM 0 HB3 CYS A 14 8.394 1.829 1.583 1.00 0.00 H new ATOM 0 HG CYS A 14 5.829 0.652 1.525 1.00 0.00 H new ATOM 186 N ALA A 15 9.280 2.892 -0.884 1.00 0.00 N ATOM 187 CA ALA A 15 9.014 3.862 -1.939 1.00 0.00 C ATOM 188 C ALA A 15 9.486 3.344 -3.293 1.00 0.00 C ATOM 189 O ALA A 15 8.732 3.348 -4.266 1.00 0.00 O ATOM 190 CB ALA A 15 9.684 5.190 -1.617 1.00 0.00 C ATOM 0 H ALA A 15 9.583 3.302 -0.000 1.00 0.00 H new ATOM 0 HA ALA A 15 7.936 4.015 -1.994 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.477 5.905 -2.414 1.00 0.00 H new ATOM 0 HB2 ALA A 15 9.295 5.575 -0.674 1.00 0.00 H new ATOM 0 HB3 ALA A 15 10.761 5.043 -1.532 1.00 0.00 H new ATOM 196 N GLN A 16 10.737 2.900 -3.348 1.00 0.00 N ATOM 197 CA GLN A 16 11.309 2.380 -4.584 1.00 0.00 C ATOM 198 C GLN A 16 10.362 1.385 -5.246 1.00 0.00 C ATOM 199 O GLN A 16 9.875 1.618 -6.353 1.00 0.00 O ATOM 200 CB GLN A 16 12.657 1.711 -4.306 1.00 0.00 C ATOM 201 CG GLN A 16 13.681 2.644 -3.680 1.00 0.00 C ATOM 202 CD GLN A 16 13.968 3.858 -4.541 1.00 0.00 C ATOM 203 OE1 GLN A 16 13.067 4.833 -4.509 1.00 0.00 O flip ATOM 204 NE2 GLN A 16 14.988 3.920 -5.227 1.00 0.00 N flip ATOM 0 H GLN A 16 11.374 2.890 -2.551 1.00 0.00 H new ATOM 0 HA GLN A 16 11.461 3.218 -5.265 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.501 0.859 -3.644 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.058 1.319 -5.240 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.320 2.972 -2.705 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.608 2.097 -3.509 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.654 3.147 -5.222 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.167 4.744 -5.801 1.00 0.00 H new ATOM 213 N TRP A 17 10.105 0.275 -4.563 1.00 0.00 N ATOM 214 CA TRP A 17 9.216 -0.756 -5.085 1.00 0.00 C ATOM 215 C TRP A 17 7.953 -0.138 -5.675 1.00 0.00 C ATOM 216 O TRP A 17 7.544 -0.477 -6.786 1.00 0.00 O ATOM 217 CB TRP A 17 8.845 -1.747 -3.980 1.00 0.00 C ATOM 218 CG TRP A 17 8.107 -2.949 -4.484 1.00 0.00 C ATOM 219 CD1 TRP A 17 8.581 -3.905 -5.337 1.00 0.00 C ATOM 220 CD2 TRP A 17 6.761 -3.324 -4.168 1.00 0.00 C ATOM 221 NE1 TRP A 17 7.612 -4.850 -5.570 1.00 0.00 N ATOM 222 CE2 TRP A 17 6.487 -4.517 -4.864 1.00 0.00 C ATOM 223 CE3 TRP A 17 5.763 -2.768 -3.363 1.00 0.00 C ATOM 224 CZ2 TRP A 17 5.255 -5.161 -4.779 1.00 0.00 C ATOM 225 CZ3 TRP A 17 4.541 -3.408 -3.280 1.00 0.00 C ATOM 226 CH2 TRP A 17 4.296 -4.595 -3.984 1.00 0.00 C ATOM 0 H TRP A 17 10.500 0.066 -3.646 1.00 0.00 H new ATOM 0 HA TRP A 17 9.743 -1.287 -5.878 1.00 0.00 H new ATOM 0 HB2 TRP A 17 9.754 -2.073 -3.474 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.232 -1.238 -3.236 1.00 0.00 H new ATOM 0 HD1 TRP A 17 9.572 -3.916 -5.765 1.00 0.00 H new ATOM 0 HE1 TRP A 17 7.714 -5.667 -6.172 1.00 0.00 H new ATOM 0 HE3 TRP A 17 5.944 -1.855 -2.816 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 5.063 -6.075 -5.322 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 3.762 -2.987 -2.662 1.00 0.00 H new ATOM 0 HH2 TRP A 17 3.331 -5.072 -3.897 1.00 0.00 H new ATOM 237 N LEU A 18 7.338 0.771 -4.925 1.00 0.00 N ATOM 238 CA LEU A 18 6.121 1.437 -5.375 1.00 0.00 C ATOM 239 C LEU A 18 6.339 2.120 -6.721 1.00 0.00 C ATOM 240 O LEU A 18 5.574 1.915 -7.663 1.00 0.00 O ATOM 241 CB LEU A 18 5.665 2.464 -4.337 1.00 0.00 C ATOM 242 CG LEU A 18 5.086 1.897 -3.041 1.00 0.00 C ATOM 243 CD1 LEU A 18 5.171 2.924 -1.923 1.00 0.00 C ATOM 244 CD2 LEU A 18 3.646 1.452 -3.250 1.00 0.00 C ATOM 0 H LEU A 18 7.662 1.063 -4.003 1.00 0.00 H new ATOM 0 HA LEU A 18 5.345 0.680 -5.494 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.515 3.098 -4.085 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.914 3.106 -4.797 1.00 0.00 H new ATOM 0 HG LEU A 18 5.676 1.027 -2.753 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.754 2.502 -1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.214 3.194 -1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.606 3.814 -2.202 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.250 1.051 -2.317 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.044 2.305 -3.563 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.612 0.681 -4.020 1.00 0.00 H new ATOM 256 N ILE A 19 7.389 2.930 -6.804 1.00 0.00 N ATOM 257 CA ILE A 19 7.710 3.640 -8.036 1.00 0.00 C ATOM 258 C ILE A 19 7.853 2.674 -9.207 1.00 0.00 C ATOM 259 O ILE A 19 7.368 2.938 -10.307 1.00 0.00 O ATOM 260 CB ILE A 19 9.010 4.453 -7.895 1.00 0.00 C ATOM 261 CG1 ILE A 19 8.898 5.437 -6.728 1.00 0.00 C ATOM 262 CG2 ILE A 19 9.317 5.192 -9.189 1.00 0.00 C ATOM 263 CD1 ILE A 19 10.208 6.107 -6.375 1.00 0.00 C ATOM 0 H ILE A 19 8.032 3.111 -6.033 1.00 0.00 H new ATOM 0 HA ILE A 19 6.883 4.323 -8.230 1.00 0.00 H new ATOM 0 HB ILE A 19 9.830 3.765 -7.689 1.00 0.00 H new ATOM 0 HG12 ILE A 19 8.163 6.203 -6.978 1.00 0.00 H new ATOM 0 HG13 ILE A 19 8.522 4.908 -5.852 1.00 0.00 H new ATOM 0 HG21 ILE A 19 10.239 5.762 -9.073 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.435 4.473 -10.000 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.498 5.872 -9.423 1.00 0.00 H new ATOM 0 HD11 ILE A 19 10.054 6.790 -5.540 1.00 0.00 H new ATOM 0 HD12 ILE A 19 10.940 5.350 -6.094 1.00 0.00 H new ATOM 0 HD13 ILE A 19 10.576 6.664 -7.237 1.00 0.00 H new ATOM 275 N HIS A 20 8.521 1.551 -8.962 1.00 0.00 N ATOM 276 CA HIS A 20 8.725 0.542 -9.995 1.00 0.00 C ATOM 277 C HIS A 20 7.441 -0.240 -10.253 1.00 0.00 C ATOM 278 O HIS A 20 7.220 -0.743 -11.356 1.00 0.00 O ATOM 279 CB HIS A 20 9.846 -0.416 -9.588 1.00 0.00 C ATOM 280 CG HIS A 20 11.215 0.082 -9.936 1.00 0.00 C ATOM 281 ND1 HIS A 20 11.934 -0.386 -11.015 1.00 0.00 N ATOM 282 CD2 HIS A 20 11.995 1.014 -9.341 1.00 0.00 C ATOM 283 CE1 HIS A 20 13.099 0.235 -11.067 1.00 0.00 C ATOM 284 NE2 HIS A 20 13.161 1.091 -10.063 1.00 0.00 N ATOM 0 H HIS A 20 8.930 1.317 -8.057 1.00 0.00 H new ATOM 0 HA HIS A 20 9.009 1.053 -10.915 1.00 0.00 H new ATOM 0 HB2 HIS A 20 9.793 -0.588 -8.513 1.00 0.00 H new ATOM 0 HB3 HIS A 20 9.684 -1.379 -10.073 1.00 0.00 H new ATOM 0 HD2 HIS A 20 11.747 1.590 -8.462 1.00 0.00 H new ATOM 0 HE1 HIS A 20 13.870 0.071 -11.805 1.00 0.00 H new ATOM 0 HE2 HIS A 20 13.946 1.708 -9.857 1.00 0.00 H new ATOM 293 N CYS A 21 6.598 -0.338 -9.231 1.00 0.00 N ATOM 294 CA CYS A 21 5.336 -1.060 -9.347 1.00 0.00 C ATOM 295 C CYS A 21 4.330 -0.267 -10.174 1.00 0.00 C ATOM 296 O CYS A 21 3.181 -0.678 -10.336 1.00 0.00 O ATOM 297 CB CYS A 21 4.761 -1.349 -7.960 1.00 0.00 C ATOM 298 SG CYS A 21 5.629 -2.653 -7.057 1.00 0.00 S ATOM 0 H CYS A 21 6.766 0.073 -8.313 1.00 0.00 H new ATOM 0 HA CYS A 21 5.531 -2.004 -9.855 1.00 0.00 H new ATOM 0 HB2 CYS A 21 4.788 -0.433 -7.369 1.00 0.00 H new ATOM 0 HB3 CYS A 21 3.713 -1.630 -8.064 1.00 0.00 H new ATOM 0 HG CYS A 21 5.724 -2.323 -5.803 1.00 0.00 H new ATOM 304 N LYS A 22 4.769 0.874 -10.694 1.00 0.00 N ATOM 305 CA LYS A 22 3.907 1.728 -11.504 1.00 0.00 C ATOM 306 C LYS A 22 2.767 2.299 -10.669 1.00 0.00 C ATOM 307 O LYS A 22 1.613 2.306 -11.097 1.00 0.00 O ATOM 308 CB LYS A 22 3.341 0.939 -12.688 1.00 0.00 C ATOM 309 CG LYS A 22 4.409 0.301 -13.560 1.00 0.00 C ATOM 310 CD LYS A 22 5.188 1.346 -14.341 1.00 0.00 C ATOM 311 CE LYS A 22 5.695 0.789 -15.663 1.00 0.00 C ATOM 312 NZ LYS A 22 4.678 0.912 -16.744 1.00 0.00 N ATOM 0 H LYS A 22 5.717 1.229 -10.569 1.00 0.00 H new ATOM 0 HA LYS A 22 4.508 2.556 -11.880 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.678 0.160 -12.311 1.00 0.00 H new ATOM 0 HB3 LYS A 22 2.734 1.605 -13.301 1.00 0.00 H new ATOM 0 HG2 LYS A 22 5.094 -0.274 -12.936 1.00 0.00 H new ATOM 0 HG3 LYS A 22 3.944 -0.400 -14.253 1.00 0.00 H new ATOM 0 HD2 LYS A 22 4.552 2.211 -14.529 1.00 0.00 H new ATOM 0 HD3 LYS A 22 6.031 1.694 -13.744 1.00 0.00 H new ATOM 0 HE2 LYS A 22 6.602 1.318 -15.956 1.00 0.00 H new ATOM 0 HE3 LYS A 22 5.965 -0.259 -15.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 5.062 0.521 -17.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 3.822 0.386 -16.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 4.439 1.915 -16.884 1.00 0.00 H new ATOM 326 N VAL A 23 3.097 2.780 -9.474 1.00 0.00 N ATOM 327 CA VAL A 23 2.101 3.356 -8.579 1.00 0.00 C ATOM 328 C VAL A 23 2.468 4.786 -8.196 1.00 0.00 C ATOM 329 O VAL A 23 1.595 5.607 -7.911 1.00 0.00 O ATOM 330 CB VAL A 23 1.945 2.517 -7.297 1.00 0.00 C ATOM 331 CG1 VAL A 23 1.469 1.112 -7.633 1.00 0.00 C ATOM 332 CG2 VAL A 23 3.256 2.474 -6.526 1.00 0.00 C ATOM 0 H VAL A 23 4.047 2.782 -9.104 1.00 0.00 H new ATOM 0 HA VAL A 23 1.154 3.359 -9.119 1.00 0.00 H new ATOM 0 HB VAL A 23 1.193 2.988 -6.664 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.365 0.534 -6.715 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.505 1.166 -8.140 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.196 0.628 -8.286 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.128 1.877 -5.623 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.030 2.027 -7.150 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.551 3.487 -6.252 1.00 0.00 H new ATOM 342 N LEU A 24 3.764 5.077 -8.193 1.00 0.00 N ATOM 343 CA LEU A 24 4.247 6.409 -7.845 1.00 0.00 C ATOM 344 C LEU A 24 5.308 6.879 -8.836 1.00 0.00 C ATOM 345 O LEU A 24 6.032 6.081 -9.432 1.00 0.00 O ATOM 346 CB LEU A 24 4.821 6.411 -6.428 1.00 0.00 C ATOM 347 CG LEU A 24 3.819 6.171 -5.298 1.00 0.00 C ATOM 348 CD1 LEU A 24 4.545 5.918 -3.985 1.00 0.00 C ATOM 349 CD2 LEU A 24 2.871 7.353 -5.166 1.00 0.00 C ATOM 0 H LEU A 24 4.499 4.409 -8.427 1.00 0.00 H new ATOM 0 HA LEU A 24 3.403 7.098 -7.889 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.594 5.645 -6.370 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.309 7.370 -6.256 1.00 0.00 H new ATOM 0 HG LEU A 24 3.232 5.285 -5.541 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.816 5.749 -3.193 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.182 5.039 -4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.158 6.784 -3.736 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.165 7.165 -4.357 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.442 8.255 -4.946 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.325 7.488 -6.100 1.00 0.00 H new ATOM 361 N PRO A 25 5.404 8.204 -9.016 1.00 0.00 N ATOM 362 CA PRO A 25 6.375 8.810 -9.931 1.00 0.00 C ATOM 363 C PRO A 25 7.809 8.676 -9.429 1.00 0.00 C ATOM 364 O PRO A 25 8.042 8.301 -8.279 1.00 0.00 O ATOM 365 CB PRO A 25 5.958 10.283 -9.968 1.00 0.00 C ATOM 366 CG PRO A 25 5.258 10.510 -8.672 1.00 0.00 C ATOM 367 CD PRO A 25 4.573 9.214 -8.338 1.00 0.00 C ATOM 0 HA PRO A 25 6.369 8.326 -10.908 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.824 10.937 -10.071 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.302 10.488 -10.814 1.00 0.00 H new ATOM 0 HG2 PRO A 25 5.965 10.790 -7.891 1.00 0.00 H new ATOM 0 HG3 PRO A 25 4.536 11.323 -8.756 1.00 0.00 H new ATOM 0 HD2 PRO A 25 4.534 9.046 -7.262 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.545 9.198 -8.700 1.00 0.00 H new ATOM 375 N THR A 26 8.767 8.983 -10.297 1.00 0.00 N ATOM 376 CA THR A 26 10.178 8.896 -9.941 1.00 0.00 C ATOM 377 C THR A 26 10.597 10.070 -9.064 1.00 0.00 C ATOM 378 O THR A 26 11.492 9.944 -8.229 1.00 0.00 O ATOM 379 CB THR A 26 11.072 8.861 -11.195 1.00 0.00 C ATOM 380 OG1 THR A 26 10.922 10.076 -11.938 1.00 0.00 O ATOM 381 CG2 THR A 26 10.720 7.674 -12.078 1.00 0.00 C ATOM 0 H THR A 26 8.592 9.294 -11.252 1.00 0.00 H new ATOM 0 HA THR A 26 10.308 7.967 -9.385 1.00 0.00 H new ATOM 0 HB THR A 26 12.108 8.759 -10.872 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.495 10.046 -12.733 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.365 7.671 -12.957 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.864 6.749 -11.519 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.679 7.750 -12.392 1.00 0.00 H new ATOM 389 N ASN A 27 9.944 11.211 -9.258 1.00 0.00 N ATOM 390 CA ASN A 27 10.250 12.408 -8.483 1.00 0.00 C ATOM 391 C ASN A 27 9.158 12.685 -7.455 1.00 0.00 C ATOM 392 O ASN A 27 8.984 13.819 -7.008 1.00 0.00 O ATOM 393 CB ASN A 27 10.411 13.614 -9.411 1.00 0.00 C ATOM 394 CG ASN A 27 11.264 13.300 -10.625 1.00 0.00 C ATOM 395 OD1 ASN A 27 10.815 13.429 -11.763 1.00 0.00 O ATOM 396 ND2 ASN A 27 12.503 12.886 -10.386 1.00 0.00 N ATOM 0 H ASN A 27 9.200 11.332 -9.945 1.00 0.00 H new ATOM 0 HA ASN A 27 11.187 12.238 -7.953 1.00 0.00 H new ATOM 0 HB2 ASN A 27 9.427 13.951 -9.739 1.00 0.00 H new ATOM 0 HB3 ASN A 27 10.861 14.438 -8.857 1.00 0.00 H new ATOM 0 HD21 ASN A 27 13.124 12.661 -11.163 1.00 0.00 H new ATOM 0 HD22 ASN A 27 12.833 12.794 -9.425 1.00 0.00 H new ATOM 403 N HIS A 28 8.424 11.640 -7.084 1.00 0.00 N ATOM 404 CA HIS A 28 7.348 11.770 -6.108 1.00 0.00 C ATOM 405 C HIS A 28 7.822 12.536 -4.876 1.00 0.00 C ATOM 406 O HIS A 28 9.016 12.788 -4.711 1.00 0.00 O ATOM 407 CB HIS A 28 6.833 10.390 -5.698 1.00 0.00 C ATOM 408 CG HIS A 28 5.389 10.383 -5.303 1.00 0.00 C ATOM 409 ND1 HIS A 28 4.314 10.986 -5.863 1.00 0.00 N flip ATOM 410 CD2 HIS A 28 4.912 9.695 -4.207 1.00 0.00 C flip ATOM 411 CE1 HIS A 28 3.219 10.654 -5.104 1.00 0.00 C flip ATOM 412 NE2 HIS A 28 3.606 9.874 -4.112 1.00 0.00 N flip ATOM 0 H HIS A 28 8.555 10.695 -7.444 1.00 0.00 H new ATOM 0 HA HIS A 28 6.536 12.329 -6.572 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.978 9.696 -6.526 1.00 0.00 H new ATOM 0 HB3 HIS A 28 7.431 10.021 -4.865 1.00 0.00 H new ATOM 0 HD2 HIS A 28 5.512 9.103 -3.532 1.00 0.00 H new ATOM 0 HE1 HIS A 28 2.206 10.978 -5.289 1.00 0.00 H new ATOM 0 HE2 HIS A 28 3.000 9.477 -3.394 1.00 0.00 H new ATOM 421 N ARG A 29 6.879 12.904 -4.015 1.00 0.00 N ATOM 422 CA ARG A 29 7.200 13.643 -2.800 1.00 0.00 C ATOM 423 C ARG A 29 7.837 12.727 -1.759 1.00 0.00 C ATOM 424 O ARG A 29 8.845 13.075 -1.143 1.00 0.00 O ATOM 425 CB ARG A 29 5.940 14.289 -2.222 1.00 0.00 C ATOM 426 CG ARG A 29 4.878 13.286 -1.802 1.00 0.00 C ATOM 427 CD ARG A 29 3.639 13.980 -1.260 1.00 0.00 C ATOM 428 NE ARG A 29 2.912 14.699 -2.304 1.00 0.00 N ATOM 429 CZ ARG A 29 3.197 15.942 -2.674 1.00 0.00 C ATOM 430 NH1 ARG A 29 4.188 16.601 -2.090 1.00 0.00 N ATOM 431 NH2 ARG A 29 2.491 16.528 -3.632 1.00 0.00 N ATOM 0 H ARG A 29 5.886 12.702 -4.136 1.00 0.00 H new ATOM 0 HA ARG A 29 7.915 14.424 -3.059 1.00 0.00 H new ATOM 0 HB2 ARG A 29 6.216 14.895 -1.359 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.516 14.965 -2.964 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.605 12.665 -2.655 1.00 0.00 H new ATOM 0 HG3 ARG A 29 5.285 12.620 -1.041 1.00 0.00 H new ATOM 0 HD2 ARG A 29 2.981 13.241 -0.803 1.00 0.00 H new ATOM 0 HD3 ARG A 29 3.929 14.678 -0.474 1.00 0.00 H new ATOM 0 HE ARG A 29 2.144 14.220 -2.774 1.00 0.00 H new ATOM 0 HH11 ARG A 29 4.734 16.153 -1.354 1.00 0.00 H new ATOM 0 HH12 ARG A 29 4.404 17.556 -2.377 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.729 16.024 -4.085 1.00 0.00 H new ATOM 0 HH22 ARG A 29 2.710 17.483 -3.916 1.00 0.00 H new ATOM 445 N VAL A 30 7.242 11.554 -1.567 1.00 0.00 N ATOM 446 CA VAL A 30 7.751 10.587 -0.602 1.00 0.00 C ATOM 447 C VAL A 30 9.251 10.378 -0.772 1.00 0.00 C ATOM 448 O VAL A 30 9.981 10.208 0.206 1.00 0.00 O ATOM 449 CB VAL A 30 7.036 9.229 -0.737 1.00 0.00 C ATOM 450 CG1 VAL A 30 5.537 9.393 -0.542 1.00 0.00 C ATOM 451 CG2 VAL A 30 7.342 8.599 -2.087 1.00 0.00 C ATOM 0 H VAL A 30 6.407 11.250 -2.067 1.00 0.00 H new ATOM 0 HA VAL A 30 7.554 10.996 0.389 1.00 0.00 H new ATOM 0 HB VAL A 30 7.407 8.563 0.041 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.049 8.423 -0.641 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.341 9.798 0.451 1.00 0.00 H new ATOM 0 HG13 VAL A 30 5.145 10.075 -1.296 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.829 7.640 -2.166 1.00 0.00 H new ATOM 0 HG22 VAL A 30 7.000 9.260 -2.883 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.417 8.444 -2.181 1.00 0.00 H new ATOM 461 N THR A 31 9.708 10.393 -2.020 1.00 0.00 N ATOM 462 CA THR A 31 11.122 10.205 -2.320 1.00 0.00 C ATOM 463 C THR A 31 11.985 11.186 -1.535 1.00 0.00 C ATOM 464 O THR A 31 12.984 10.800 -0.928 1.00 0.00 O ATOM 465 CB THR A 31 11.405 10.378 -3.824 1.00 0.00 C ATOM 466 OG1 THR A 31 11.171 11.736 -4.213 1.00 0.00 O ATOM 467 CG2 THR A 31 10.529 9.450 -4.650 1.00 0.00 C ATOM 0 H THR A 31 9.118 10.534 -2.840 1.00 0.00 H new ATOM 0 HA THR A 31 11.375 9.187 -2.026 1.00 0.00 H new ATOM 0 HB THR A 31 12.449 10.123 -4.007 1.00 0.00 H new ATOM 0 HG1 THR A 31 10.224 11.954 -4.086 1.00 0.00 H new ATOM 0 HG21 THR A 31 10.747 9.590 -5.709 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.731 8.416 -4.372 1.00 0.00 H new ATOM 0 HG23 THR A 31 9.480 9.678 -4.462 1.00 0.00 H new ATOM 475 N TRP A 32 11.593 12.455 -1.551 1.00 0.00 N ATOM 476 CA TRP A 32 12.332 13.492 -0.839 1.00 0.00 C ATOM 477 C TRP A 32 12.530 13.112 0.624 1.00 0.00 C ATOM 478 O TRP A 32 11.570 12.810 1.332 1.00 0.00 O ATOM 479 CB TRP A 32 11.597 14.829 -0.937 1.00 0.00 C ATOM 480 CG TRP A 32 11.715 15.475 -2.284 1.00 0.00 C ATOM 481 CD1 TRP A 32 11.060 15.112 -3.427 1.00 0.00 C ATOM 482 CD2 TRP A 32 12.538 16.595 -2.629 1.00 0.00 C ATOM 483 NE1 TRP A 32 11.427 15.939 -4.461 1.00 0.00 N ATOM 484 CE2 TRP A 32 12.332 16.857 -3.998 1.00 0.00 C ATOM 485 CE3 TRP A 32 13.427 17.402 -1.915 1.00 0.00 C ATOM 486 CZ2 TRP A 32 12.984 17.892 -4.663 1.00 0.00 C ATOM 487 CZ3 TRP A 32 14.074 18.428 -2.577 1.00 0.00 C ATOM 488 CH2 TRP A 32 13.849 18.667 -3.939 1.00 0.00 C ATOM 0 H TRP A 32 10.768 12.791 -2.049 1.00 0.00 H new ATOM 0 HA TRP A 32 13.312 13.590 -1.305 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.543 14.673 -0.708 1.00 0.00 H new ATOM 0 HB3 TRP A 32 11.991 15.508 -0.181 1.00 0.00 H new ATOM 0 HD1 TRP A 32 10.357 14.296 -3.506 1.00 0.00 H new ATOM 0 HE1 TRP A 32 11.081 15.879 -5.419 1.00 0.00 H new ATOM 0 HE3 TRP A 32 13.605 17.227 -0.864 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.813 18.077 -5.713 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 14.765 19.057 -2.035 1.00 0.00 H new ATOM 0 HH2 TRP A 32 14.368 19.479 -4.427 1.00 0.00 H new ATOM 499 N ASP A 33 13.781 13.130 1.071 1.00 0.00 N ATOM 500 CA ASP A 33 14.105 12.789 2.452 1.00 0.00 C ATOM 501 C ASP A 33 13.098 13.410 3.415 1.00 0.00 C ATOM 502 O ASP A 33 12.523 12.720 4.257 1.00 0.00 O ATOM 503 CB ASP A 33 15.518 13.259 2.798 1.00 0.00 C ATOM 504 CG ASP A 33 15.895 14.539 2.078 1.00 0.00 C ATOM 505 OD1 ASP A 33 15.946 14.525 0.831 1.00 0.00 O ATOM 506 OD2 ASP A 33 16.140 15.555 2.762 1.00 0.00 O ATOM 0 H ASP A 33 14.587 13.377 0.497 1.00 0.00 H new ATOM 0 HA ASP A 33 14.057 11.705 2.554 1.00 0.00 H new ATOM 0 HB2 ASP A 33 15.592 13.415 3.874 1.00 0.00 H new ATOM 0 HB3 ASP A 33 16.232 12.477 2.540 1.00 0.00 H new ATOM 511 N SER A 34 12.891 14.716 3.286 1.00 0.00 N ATOM 512 CA SER A 34 11.957 15.431 4.148 1.00 0.00 C ATOM 513 C SER A 34 10.714 14.590 4.419 1.00 0.00 C ATOM 514 O SER A 34 10.202 14.560 5.538 1.00 0.00 O ATOM 515 CB SER A 34 11.557 16.763 3.509 1.00 0.00 C ATOM 516 OG SER A 34 12.694 17.567 3.251 1.00 0.00 O ATOM 0 H SER A 34 13.357 15.301 2.593 1.00 0.00 H new ATOM 0 HA SER A 34 12.455 15.627 5.097 1.00 0.00 H new ATOM 0 HB2 SER A 34 11.021 16.577 2.578 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.873 17.296 4.170 1.00 0.00 H new ATOM 0 HG SER A 34 12.412 18.411 2.841 1.00 0.00 H new ATOM 522 N ALA A 35 10.233 13.907 3.385 1.00 0.00 N ATOM 523 CA ALA A 35 9.051 13.063 3.510 1.00 0.00 C ATOM 524 C ALA A 35 9.208 12.064 4.652 1.00 0.00 C ATOM 525 O ALA A 35 10.320 11.803 5.111 1.00 0.00 O ATOM 526 CB ALA A 35 8.782 12.333 2.202 1.00 0.00 C ATOM 0 H ALA A 35 10.644 13.922 2.452 1.00 0.00 H new ATOM 0 HA ALA A 35 8.200 13.705 3.737 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.897 11.707 2.310 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.617 13.060 1.407 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.639 11.709 1.951 1.00 0.00 H new ATOM 532 N GLN A 36 8.089 11.510 5.106 1.00 0.00 N ATOM 533 CA GLN A 36 8.103 10.542 6.196 1.00 0.00 C ATOM 534 C GLN A 36 6.964 9.538 6.048 1.00 0.00 C ATOM 535 O GLN A 36 6.021 9.762 5.289 1.00 0.00 O ATOM 536 CB GLN A 36 7.996 11.257 7.544 1.00 0.00 C ATOM 537 CG GLN A 36 9.130 12.236 7.804 1.00 0.00 C ATOM 538 CD GLN A 36 8.801 13.231 8.900 1.00 0.00 C ATOM 539 OE1 GLN A 36 7.850 13.044 9.660 1.00 0.00 O ATOM 540 NE2 GLN A 36 9.587 14.298 8.986 1.00 0.00 N ATOM 0 H GLN A 36 7.161 11.715 4.736 1.00 0.00 H new ATOM 0 HA GLN A 36 9.048 10.001 6.154 1.00 0.00 H new ATOM 0 HB2 GLN A 36 7.047 11.792 7.588 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.979 10.513 8.340 1.00 0.00 H new ATOM 0 HG2 GLN A 36 10.028 11.682 8.079 1.00 0.00 H new ATOM 0 HG3 GLN A 36 9.357 12.776 6.885 1.00 0.00 H new ATOM 0 HE21 GLN A 36 10.364 14.413 8.335 1.00 0.00 H new ATOM 0 HE22 GLN A 36 9.414 15.003 9.703 1.00 0.00 H new ATOM 549 N VAL A 37 7.059 8.431 6.778 1.00 0.00 N ATOM 550 CA VAL A 37 6.036 7.393 6.728 1.00 0.00 C ATOM 551 C VAL A 37 4.652 7.996 6.512 1.00 0.00 C ATOM 552 O VAL A 37 3.892 7.541 5.657 1.00 0.00 O ATOM 553 CB VAL A 37 6.023 6.556 8.020 1.00 0.00 C ATOM 554 CG1 VAL A 37 7.108 5.490 7.976 1.00 0.00 C ATOM 555 CG2 VAL A 37 6.194 7.452 9.237 1.00 0.00 C ATOM 0 H VAL A 37 7.833 8.230 7.411 1.00 0.00 H new ATOM 0 HA VAL A 37 6.282 6.745 5.887 1.00 0.00 H new ATOM 0 HB VAL A 37 5.058 6.056 8.099 1.00 0.00 H new ATOM 0 HG11 VAL A 37 7.084 4.908 8.897 1.00 0.00 H new ATOM 0 HG12 VAL A 37 6.936 4.830 7.126 1.00 0.00 H new ATOM 0 HG13 VAL A 37 8.083 5.967 7.874 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.182 6.844 10.141 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.144 7.982 9.168 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.378 8.174 9.275 1.00 0.00 H new ATOM 565 N PHE A 38 4.331 9.022 7.293 1.00 0.00 N ATOM 566 CA PHE A 38 3.038 9.687 7.189 1.00 0.00 C ATOM 567 C PHE A 38 2.707 10.008 5.734 1.00 0.00 C ATOM 568 O PHE A 38 1.714 9.524 5.190 1.00 0.00 O ATOM 569 CB PHE A 38 3.032 10.972 8.020 1.00 0.00 C ATOM 570 CG PHE A 38 1.672 11.347 8.535 1.00 0.00 C ATOM 571 CD1 PHE A 38 0.539 11.113 7.772 1.00 0.00 C ATOM 572 CD2 PHE A 38 1.526 11.932 9.782 1.00 0.00 C ATOM 573 CE1 PHE A 38 -0.713 11.458 8.243 1.00 0.00 C ATOM 574 CE2 PHE A 38 0.276 12.278 10.259 1.00 0.00 C ATOM 575 CZ PHE A 38 -0.846 12.040 9.489 1.00 0.00 C ATOM 0 H PHE A 38 4.949 9.411 8.005 1.00 0.00 H new ATOM 0 HA PHE A 38 2.277 9.009 7.576 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.711 10.852 8.864 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.420 11.790 7.413 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.636 10.656 6.798 1.00 0.00 H new ATOM 0 HD2 PHE A 38 2.399 12.120 10.389 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.588 11.273 7.637 1.00 0.00 H new ATOM 0 HE2 PHE A 38 0.176 12.734 11.233 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.824 12.308 9.860 1.00 0.00 H new ATOM 585 N ASP A 39 3.546 10.827 5.110 1.00 0.00 N ATOM 586 CA ASP A 39 3.345 11.213 3.718 1.00 0.00 C ATOM 587 C ASP A 39 2.932 10.010 2.875 1.00 0.00 C ATOM 588 O ASP A 39 1.851 9.994 2.285 1.00 0.00 O ATOM 589 CB ASP A 39 4.621 11.836 3.149 1.00 0.00 C ATOM 590 CG ASP A 39 4.813 13.272 3.596 1.00 0.00 C ATOM 591 OD1 ASP A 39 4.477 13.581 4.758 1.00 0.00 O ATOM 592 OD2 ASP A 39 5.298 14.086 2.784 1.00 0.00 O ATOM 0 H ASP A 39 4.372 11.237 5.546 1.00 0.00 H new ATOM 0 HA ASP A 39 2.544 11.951 3.684 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.481 11.243 3.460 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.586 11.799 2.060 1.00 0.00 H new ATOM 597 N LEU A 40 3.800 9.006 2.821 1.00 0.00 N ATOM 598 CA LEU A 40 3.526 7.799 2.049 1.00 0.00 C ATOM 599 C LEU A 40 2.259 7.110 2.545 1.00 0.00 C ATOM 600 O LEU A 40 1.556 6.454 1.778 1.00 0.00 O ATOM 601 CB LEU A 40 4.711 6.835 2.135 1.00 0.00 C ATOM 602 CG LEU A 40 4.503 5.457 1.506 1.00 0.00 C ATOM 603 CD1 LEU A 40 4.154 5.591 0.032 1.00 0.00 C ATOM 604 CD2 LEU A 40 5.744 4.595 1.687 1.00 0.00 C ATOM 0 H LEU A 40 4.699 9.004 3.302 1.00 0.00 H new ATOM 0 HA LEU A 40 3.376 8.089 1.009 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.571 7.304 1.657 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.966 6.698 3.186 1.00 0.00 H new ATOM 0 HG LEU A 40 3.670 4.969 2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.010 4.600 -0.399 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.237 6.170 -0.074 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.965 6.099 -0.489 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.578 3.618 1.233 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.595 5.078 1.207 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.949 4.471 2.750 1.00 0.00 H new ATOM 616 N ALA A 41 1.973 7.267 3.834 1.00 0.00 N ATOM 617 CA ALA A 41 0.788 6.664 4.432 1.00 0.00 C ATOM 618 C ALA A 41 -0.477 7.405 4.011 1.00 0.00 C ATOM 619 O ALA A 41 -1.562 6.827 3.975 1.00 0.00 O ATOM 620 CB ALA A 41 0.913 6.647 5.948 1.00 0.00 C ATOM 0 H ALA A 41 2.546 7.806 4.483 1.00 0.00 H new ATOM 0 HA ALA A 41 0.712 5.638 4.073 1.00 0.00 H new ATOM 0 HB1 ALA A 41 0.021 6.194 6.382 1.00 0.00 H new ATOM 0 HB2 ALA A 41 1.790 6.067 6.234 1.00 0.00 H new ATOM 0 HB3 ALA A 41 1.017 7.668 6.316 1.00 0.00 H new ATOM 626 N GLN A 42 -0.328 8.687 3.694 1.00 0.00 N ATOM 627 CA GLN A 42 -1.460 9.507 3.278 1.00 0.00 C ATOM 628 C GLN A 42 -1.889 9.159 1.856 1.00 0.00 C ATOM 629 O GLN A 42 -3.030 8.760 1.621 1.00 0.00 O ATOM 630 CB GLN A 42 -1.101 10.991 3.366 1.00 0.00 C ATOM 631 CG GLN A 42 -0.636 11.424 4.747 1.00 0.00 C ATOM 632 CD GLN A 42 -0.970 12.871 5.049 1.00 0.00 C ATOM 633 OE1 GLN A 42 -2.062 13.346 4.737 1.00 0.00 O ATOM 634 NE2 GLN A 42 -0.028 13.581 5.660 1.00 0.00 N ATOM 0 H GLN A 42 0.565 9.180 3.717 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.293 9.302 3.951 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.316 11.210 2.642 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -1.970 11.584 3.082 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -1.098 10.784 5.499 1.00 0.00 H new ATOM 0 HG3 GLN A 42 0.442 11.280 4.825 1.00 0.00 H new ATOM 0 HE21 GLN A 42 0.863 13.146 5.900 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -0.196 14.561 5.889 1.00 0.00 H new ATOM 643 N THR A 43 -0.968 9.314 0.910 1.00 0.00 N ATOM 644 CA THR A 43 -1.252 9.018 -0.488 1.00 0.00 C ATOM 645 C THR A 43 -2.046 7.724 -0.627 1.00 0.00 C ATOM 646 O THR A 43 -2.762 7.525 -1.609 1.00 0.00 O ATOM 647 CB THR A 43 0.045 8.902 -1.312 1.00 0.00 C ATOM 648 OG1 THR A 43 -0.267 8.825 -2.708 1.00 0.00 O ATOM 649 CG2 THR A 43 0.841 7.674 -0.897 1.00 0.00 C ATOM 0 H THR A 43 -0.019 9.643 1.087 1.00 0.00 H new ATOM 0 HA THR A 43 -1.846 9.848 -0.872 1.00 0.00 H new ATOM 0 HB THR A 43 0.650 9.789 -1.124 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.562 8.753 -3.225 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.752 7.613 -1.492 1.00 0.00 H new ATOM 0 HG22 THR A 43 1.101 7.749 0.159 1.00 0.00 H new ATOM 0 HG23 THR A 43 0.241 6.779 -1.060 1.00 0.00 H new ATOM 657 N LEU A 44 -1.916 6.847 0.363 1.00 0.00 N ATOM 658 CA LEU A 44 -2.623 5.571 0.352 1.00 0.00 C ATOM 659 C LEU A 44 -3.798 5.592 1.324 1.00 0.00 C ATOM 660 O LEU A 44 -4.818 4.943 1.093 1.00 0.00 O ATOM 661 CB LEU A 44 -1.667 4.433 0.714 1.00 0.00 C ATOM 662 CG LEU A 44 -0.360 4.377 -0.078 1.00 0.00 C ATOM 663 CD1 LEU A 44 0.736 3.719 0.746 1.00 0.00 C ATOM 664 CD2 LEU A 44 -0.563 3.632 -1.390 1.00 0.00 C ATOM 0 H LEU A 44 -1.328 6.996 1.183 1.00 0.00 H new ATOM 0 HA LEU A 44 -3.010 5.406 -0.654 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.423 4.513 1.773 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.192 3.487 0.578 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.052 5.397 -0.306 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.658 3.688 0.166 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.900 4.293 1.658 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.436 2.704 1.005 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.377 3.602 -1.941 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.895 2.615 -1.183 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.317 4.145 -1.987 1.00 0.00 H new ATOM 676 N ARG A 45 -3.648 6.343 2.410 1.00 0.00 N ATOM 677 CA ARG A 45 -4.698 6.449 3.416 1.00 0.00 C ATOM 678 C ARG A 45 -6.078 6.442 2.765 1.00 0.00 C ATOM 679 O ARG A 45 -6.997 5.777 3.243 1.00 0.00 O ATOM 680 CB ARG A 45 -4.517 7.725 4.240 1.00 0.00 C ATOM 681 CG ARG A 45 -5.571 7.908 5.320 1.00 0.00 C ATOM 682 CD ARG A 45 -5.836 9.380 5.596 1.00 0.00 C ATOM 683 NE ARG A 45 -7.165 9.600 6.161 1.00 0.00 N ATOM 684 CZ ARG A 45 -7.810 10.759 6.092 1.00 0.00 C ATOM 685 NH1 ARG A 45 -7.251 11.797 5.486 1.00 0.00 N ATOM 686 NH2 ARG A 45 -9.016 10.881 6.631 1.00 0.00 N ATOM 0 H ARG A 45 -2.810 6.887 2.616 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.623 5.585 4.076 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.531 7.710 4.705 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.541 8.586 3.571 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.497 7.422 5.012 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.243 7.418 6.237 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.082 9.761 6.284 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -5.738 9.946 4.670 1.00 0.00 H new ATOM 0 HE ARG A 45 -7.623 8.821 6.634 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -6.323 11.707 5.071 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -7.748 12.686 5.434 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.448 10.084 7.099 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -9.511 11.771 6.578 1.00 0.00 H new ATOM 700 N ASP A 46 -6.215 7.188 1.675 1.00 0.00 N ATOM 701 CA ASP A 46 -7.483 7.268 0.958 1.00 0.00 C ATOM 702 C ASP A 46 -7.939 5.884 0.506 1.00 0.00 C ATOM 703 O ASP A 46 -9.080 5.488 0.741 1.00 0.00 O ATOM 704 CB ASP A 46 -7.351 8.195 -0.251 1.00 0.00 C ATOM 705 CG ASP A 46 -6.253 7.758 -1.200 1.00 0.00 C ATOM 706 OD1 ASP A 46 -5.149 7.428 -0.718 1.00 0.00 O ATOM 707 OD2 ASP A 46 -6.496 7.747 -2.425 1.00 0.00 O ATOM 0 H ASP A 46 -5.464 7.746 1.268 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.232 7.674 1.638 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.300 8.225 -0.787 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -7.147 9.209 0.093 1.00 0.00 H new ATOM 712 N GLY A 47 -7.040 5.153 -0.146 1.00 0.00 N ATOM 713 CA GLY A 47 -7.370 3.822 -0.622 1.00 0.00 C ATOM 714 C GLY A 47 -7.659 3.794 -2.110 1.00 0.00 C ATOM 715 O GLY A 47 -8.392 2.930 -2.591 1.00 0.00 O ATOM 0 H GLY A 47 -6.089 5.459 -0.353 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.544 3.146 -0.403 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.239 3.450 -0.079 1.00 0.00 H new ATOM 719 N VAL A 48 -7.082 4.742 -2.842 1.00 0.00 N ATOM 720 CA VAL A 48 -7.282 4.822 -4.284 1.00 0.00 C ATOM 721 C VAL A 48 -6.082 4.259 -5.037 1.00 0.00 C ATOM 722 O VAL A 48 -6.229 3.671 -6.109 1.00 0.00 O ATOM 723 CB VAL A 48 -7.522 6.275 -4.737 1.00 0.00 C ATOM 724 CG1 VAL A 48 -7.696 6.342 -6.246 1.00 0.00 C ATOM 725 CG2 VAL A 48 -8.732 6.861 -4.026 1.00 0.00 C ATOM 0 H VAL A 48 -6.472 5.465 -2.460 1.00 0.00 H new ATOM 0 HA VAL A 48 -8.165 4.226 -4.515 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.649 6.870 -4.470 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.864 7.376 -6.547 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -6.797 5.964 -6.733 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.551 5.734 -6.541 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -8.887 7.888 -4.358 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -9.615 6.267 -4.261 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.562 6.849 -2.949 1.00 0.00 H new ATOM 735 N LEU A 49 -4.895 4.441 -4.469 1.00 0.00 N ATOM 736 CA LEU A 49 -3.668 3.950 -5.086 1.00 0.00 C ATOM 737 C LEU A 49 -3.460 2.470 -4.781 1.00 0.00 C ATOM 738 O LEU A 49 -3.129 1.682 -5.668 1.00 0.00 O ATOM 739 CB LEU A 49 -2.467 4.758 -4.594 1.00 0.00 C ATOM 740 CG LEU A 49 -1.127 4.443 -5.259 1.00 0.00 C ATOM 741 CD1 LEU A 49 -1.259 4.491 -6.774 1.00 0.00 C ATOM 742 CD2 LEU A 49 -0.054 5.412 -4.784 1.00 0.00 C ATOM 0 H LEU A 49 -4.756 4.925 -3.582 1.00 0.00 H new ATOM 0 HA LEU A 49 -3.760 4.070 -6.165 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.682 5.816 -4.740 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.363 4.599 -3.521 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.829 3.434 -4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.296 4.264 -7.231 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.996 3.756 -7.098 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.580 5.487 -7.080 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.893 5.172 -5.268 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.345 6.431 -5.040 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.060 5.328 -3.703 1.00 0.00 H new ATOM 754 N LEU A 50 -3.657 2.098 -3.521 1.00 0.00 N ATOM 755 CA LEU A 50 -3.493 0.711 -3.098 1.00 0.00 C ATOM 756 C LEU A 50 -4.068 -0.247 -4.136 1.00 0.00 C ATOM 757 O LEU A 50 -3.361 -1.109 -4.659 1.00 0.00 O ATOM 758 CB LEU A 50 -4.174 0.486 -1.747 1.00 0.00 C ATOM 759 CG LEU A 50 -3.308 0.731 -0.510 1.00 0.00 C ATOM 760 CD1 LEU A 50 -4.171 0.797 0.741 1.00 0.00 C ATOM 761 CD2 LEU A 50 -2.251 -0.356 -0.375 1.00 0.00 C ATOM 0 H LEU A 50 -3.930 2.737 -2.774 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.426 0.511 -2.998 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.047 1.137 -1.690 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.539 -0.541 -1.713 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.802 1.689 -0.628 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.538 0.972 1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.889 1.611 0.645 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.705 -0.145 0.865 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.644 -0.166 0.510 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.737 -1.327 -0.280 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.613 -0.355 -1.259 1.00 0.00 H new ATOM 773 N CYS A 51 -5.354 -0.088 -4.431 1.00 0.00 N ATOM 774 CA CYS A 51 -6.024 -0.938 -5.409 1.00 0.00 C ATOM 775 C CYS A 51 -5.227 -1.007 -6.707 1.00 0.00 C ATOM 776 O CYS A 51 -5.072 -2.078 -7.294 1.00 0.00 O ATOM 777 CB CYS A 51 -7.434 -0.414 -5.690 1.00 0.00 C ATOM 778 SG CYS A 51 -8.488 -0.310 -4.224 1.00 0.00 S ATOM 0 H CYS A 51 -5.953 0.621 -4.007 1.00 0.00 H new ATOM 0 HA CYS A 51 -6.093 -1.943 -4.993 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -7.359 0.575 -6.142 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -7.912 -1.064 -6.423 1.00 0.00 H new ATOM 0 HG CYS A 51 -8.375 0.871 -3.691 1.00 0.00 H new ATOM 784 N GLN A 52 -4.724 0.141 -7.149 1.00 0.00 N ATOM 785 CA GLN A 52 -3.945 0.210 -8.379 1.00 0.00 C ATOM 786 C GLN A 52 -2.757 -0.745 -8.325 1.00 0.00 C ATOM 787 O GLN A 52 -2.495 -1.482 -9.277 1.00 0.00 O ATOM 788 CB GLN A 52 -3.455 1.639 -8.618 1.00 0.00 C ATOM 789 CG GLN A 52 -4.566 2.676 -8.585 1.00 0.00 C ATOM 790 CD GLN A 52 -4.254 3.893 -9.434 1.00 0.00 C ATOM 791 OE1 GLN A 52 -3.224 4.543 -9.252 1.00 0.00 O ATOM 792 NE2 GLN A 52 -5.143 4.209 -10.368 1.00 0.00 N ATOM 0 H GLN A 52 -4.842 1.036 -6.674 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.590 -0.088 -9.205 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.712 1.891 -7.862 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -2.954 1.686 -9.585 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.493 2.221 -8.935 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.734 2.990 -7.555 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -5.983 3.643 -10.485 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.986 5.018 -10.969 1.00 0.00 H new ATOM 801 N LEU A 53 -2.040 -0.726 -7.207 1.00 0.00 N ATOM 802 CA LEU A 53 -0.878 -1.591 -7.028 1.00 0.00 C ATOM 803 C LEU A 53 -1.150 -2.988 -7.575 1.00 0.00 C ATOM 804 O LEU A 53 -0.517 -3.424 -8.537 1.00 0.00 O ATOM 805 CB LEU A 53 -0.503 -1.674 -5.548 1.00 0.00 C ATOM 806 CG LEU A 53 0.658 -2.607 -5.201 1.00 0.00 C ATOM 807 CD1 LEU A 53 1.924 -2.175 -5.924 1.00 0.00 C ATOM 808 CD2 LEU A 53 0.885 -2.639 -3.697 1.00 0.00 C ATOM 0 H LEU A 53 -2.242 -0.122 -6.411 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.045 -1.160 -7.584 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.254 -0.672 -5.200 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.381 -1.996 -4.989 1.00 0.00 H new ATOM 0 HG LEU A 53 0.401 -3.614 -5.531 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.739 -2.850 -5.665 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.756 -2.205 -7.001 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.185 -1.160 -5.625 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.715 -3.308 -3.468 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.120 -1.635 -3.343 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.017 -2.997 -3.200 1.00 0.00 H new ATOM 820 N LEU A 54 -2.097 -3.685 -6.957 1.00 0.00 N ATOM 821 CA LEU A 54 -2.456 -5.034 -7.383 1.00 0.00 C ATOM 822 C LEU A 54 -2.843 -5.054 -8.858 1.00 0.00 C ATOM 823 O LEU A 54 -2.402 -5.919 -9.614 1.00 0.00 O ATOM 824 CB LEU A 54 -3.610 -5.568 -6.534 1.00 0.00 C ATOM 825 CG LEU A 54 -3.420 -5.492 -5.018 1.00 0.00 C ATOM 826 CD1 LEU A 54 -4.603 -6.122 -4.299 1.00 0.00 C ATOM 827 CD2 LEU A 54 -2.121 -6.171 -4.609 1.00 0.00 C ATOM 0 H LEU A 54 -2.630 -3.339 -6.159 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.585 -5.675 -7.246 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.513 -5.015 -6.795 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.784 -6.609 -6.806 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.364 -4.442 -4.730 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.450 -6.059 -3.222 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.517 -5.591 -4.568 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.692 -7.168 -4.592 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.002 -6.107 -3.527 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.147 -7.218 -4.910 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.282 -5.674 -5.096 1.00 0.00 H new ATOM 839 N ASN A 55 -3.669 -4.094 -9.261 1.00 0.00 N ATOM 840 CA ASN A 55 -4.115 -4.001 -10.647 1.00 0.00 C ATOM 841 C ASN A 55 -2.924 -3.901 -11.595 1.00 0.00 C ATOM 842 O ASN A 55 -2.994 -4.337 -12.744 1.00 0.00 O ATOM 843 CB ASN A 55 -5.029 -2.788 -10.830 1.00 0.00 C ATOM 844 CG ASN A 55 -6.199 -2.795 -9.864 1.00 0.00 C ATOM 845 OD1 ASN A 55 -6.476 -3.803 -9.215 1.00 0.00 O ATOM 846 ND2 ASN A 55 -6.891 -1.666 -9.766 1.00 0.00 N ATOM 0 H ASN A 55 -4.043 -3.370 -8.648 1.00 0.00 H new ATOM 0 HA ASN A 55 -4.672 -4.907 -10.885 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -4.450 -1.875 -10.689 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.406 -2.771 -11.853 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.689 -1.610 -9.133 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -6.625 -0.855 -10.324 1.00 0.00 H new ATOM 853 N ASN A 56 -1.831 -3.326 -11.106 1.00 0.00 N ATOM 854 CA ASN A 56 -0.624 -3.169 -11.910 1.00 0.00 C ATOM 855 C ASN A 56 0.120 -4.495 -12.039 1.00 0.00 C ATOM 856 O ASN A 56 0.562 -4.868 -13.126 1.00 0.00 O ATOM 857 CB ASN A 56 0.295 -2.115 -11.289 1.00 0.00 C ATOM 858 CG ASN A 56 -0.027 -0.713 -11.769 1.00 0.00 C ATOM 859 OD1 ASN A 56 -0.246 -0.487 -12.959 1.00 0.00 O ATOM 860 ND2 ASN A 56 -0.058 0.238 -10.841 1.00 0.00 N ATOM 0 H ASN A 56 -1.756 -2.961 -10.157 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.922 -2.841 -12.906 1.00 0.00 H new ATOM 0 HB2 ASN A 56 0.206 -2.154 -10.203 1.00 0.00 H new ATOM 0 HB3 ASN A 56 1.331 -2.351 -11.533 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -0.270 1.200 -11.104 1.00 0.00 H new ATOM 0 HD22 ASN A 56 0.130 0.005 -9.866 1.00 0.00 H new ATOM 867 N LEU A 57 0.253 -5.203 -10.923 1.00 0.00 N ATOM 868 CA LEU A 57 0.942 -6.489 -10.910 1.00 0.00 C ATOM 869 C LEU A 57 0.153 -7.537 -11.688 1.00 0.00 C ATOM 870 O LEU A 57 0.668 -8.145 -12.626 1.00 0.00 O ATOM 871 CB LEU A 57 1.157 -6.960 -9.471 1.00 0.00 C ATOM 872 CG LEU A 57 1.694 -5.912 -8.495 1.00 0.00 C ATOM 873 CD1 LEU A 57 1.766 -6.482 -7.086 1.00 0.00 C ATOM 874 CD2 LEU A 57 3.062 -5.418 -8.942 1.00 0.00 C ATOM 0 H LEU A 57 -0.107 -4.908 -10.015 1.00 0.00 H new ATOM 0 HA LEU A 57 1.911 -6.359 -11.392 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.208 -7.333 -9.086 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.848 -7.802 -9.485 1.00 0.00 H new ATOM 0 HG LEU A 57 1.008 -5.065 -8.488 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.150 -5.722 -6.405 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.770 -6.786 -6.765 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.430 -7.347 -7.077 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.428 -4.673 -8.236 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.758 -6.256 -8.978 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.981 -4.970 -9.932 1.00 0.00 H new ATOM 886 N ARG A 58 -1.099 -7.742 -11.292 1.00 0.00 N ATOM 887 CA ARG A 58 -1.959 -8.716 -11.953 1.00 0.00 C ATOM 888 C ARG A 58 -3.125 -8.025 -12.653 1.00 0.00 C ATOM 889 O ARG A 58 -3.479 -6.894 -12.321 1.00 0.00 O ATOM 890 CB ARG A 58 -2.488 -9.732 -10.939 1.00 0.00 C ATOM 891 CG ARG A 58 -2.761 -11.103 -11.535 1.00 0.00 C ATOM 892 CD ARG A 58 -3.774 -11.879 -10.709 1.00 0.00 C ATOM 893 NE ARG A 58 -4.169 -13.127 -11.357 1.00 0.00 N ATOM 894 CZ ARG A 58 -4.896 -13.180 -12.467 1.00 0.00 C ATOM 895 NH1 ARG A 58 -5.306 -12.062 -13.049 1.00 0.00 N ATOM 896 NH2 ARG A 58 -5.215 -14.354 -12.997 1.00 0.00 N ATOM 0 H ARG A 58 -1.540 -7.247 -10.517 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.365 -9.238 -12.703 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -1.765 -9.835 -10.130 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -3.408 -9.347 -10.498 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -3.131 -10.991 -12.554 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.830 -11.667 -11.594 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.351 -12.098 -9.729 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -4.657 -11.261 -10.544 1.00 0.00 H new ATOM 0 HE ARG A 58 -3.870 -14.006 -10.934 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -5.063 -11.158 -12.644 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -5.864 -12.106 -13.902 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -4.902 -15.217 -12.552 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -5.773 -14.394 -13.850 1.00 0.00 H new ATOM 910 N ALA A 59 -3.718 -8.713 -13.624 1.00 0.00 N ATOM 911 CA ALA A 59 -4.845 -8.166 -14.369 1.00 0.00 C ATOM 912 C ALA A 59 -6.171 -8.565 -13.731 1.00 0.00 C ATOM 913 O ALA A 59 -6.314 -9.673 -13.212 1.00 0.00 O ATOM 914 CB ALA A 59 -4.794 -8.630 -15.818 1.00 0.00 C ATOM 0 H ALA A 59 -3.436 -9.650 -13.913 1.00 0.00 H new ATOM 0 HA ALA A 59 -4.772 -7.079 -14.343 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.641 -8.214 -16.363 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.865 -8.290 -16.276 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.839 -9.719 -15.853 1.00 0.00 H new ATOM 920 N HIS A 60 -7.139 -7.655 -13.771 1.00 0.00 N ATOM 921 CA HIS A 60 -8.454 -7.912 -13.196 1.00 0.00 C ATOM 922 C HIS A 60 -8.353 -8.148 -11.692 1.00 0.00 C ATOM 923 O HIS A 60 -9.097 -8.950 -11.128 1.00 0.00 O ATOM 924 CB HIS A 60 -9.102 -9.121 -13.871 1.00 0.00 C ATOM 925 CG HIS A 60 -9.799 -8.789 -15.154 1.00 0.00 C ATOM 926 ND1 HIS A 60 -11.103 -9.152 -15.418 1.00 0.00 N ATOM 927 CD2 HIS A 60 -9.367 -8.121 -16.249 1.00 0.00 C ATOM 928 CE1 HIS A 60 -11.442 -8.723 -16.621 1.00 0.00 C ATOM 929 NE2 HIS A 60 -10.406 -8.094 -17.146 1.00 0.00 N ATOM 0 H HIS A 60 -7.037 -6.733 -14.196 1.00 0.00 H new ATOM 0 HA HIS A 60 -9.076 -7.033 -13.367 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -8.336 -9.871 -14.067 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -9.819 -9.570 -13.183 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -8.387 -7.689 -16.391 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -12.403 -8.863 -17.094 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -10.382 -7.659 -18.068 1.00 0.00 H new ATOM 938 N SER A 61 -7.427 -7.444 -11.048 1.00 0.00 N ATOM 939 CA SER A 61 -7.225 -7.581 -9.610 1.00 0.00 C ATOM 940 C SER A 61 -8.285 -6.802 -8.837 1.00 0.00 C ATOM 941 O SER A 61 -8.822 -7.287 -7.840 1.00 0.00 O ATOM 942 CB SER A 61 -5.830 -7.089 -9.221 1.00 0.00 C ATOM 943 OG SER A 61 -4.842 -7.620 -10.087 1.00 0.00 O ATOM 0 H SER A 61 -6.805 -6.773 -11.499 1.00 0.00 H new ATOM 0 HA SER A 61 -7.315 -8.637 -9.354 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.802 -6.000 -9.257 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.612 -7.380 -8.193 1.00 0.00 H new ATOM 0 HG SER A 61 -4.739 -7.033 -10.865 1.00 0.00 H new ATOM 949 N ILE A 62 -8.581 -5.594 -9.304 1.00 0.00 N ATOM 950 CA ILE A 62 -9.577 -4.749 -8.657 1.00 0.00 C ATOM 951 C ILE A 62 -10.234 -3.808 -9.661 1.00 0.00 C ATOM 952 O ILE A 62 -9.553 -3.095 -10.397 1.00 0.00 O ATOM 953 CB ILE A 62 -8.956 -3.916 -7.520 1.00 0.00 C ATOM 954 CG1 ILE A 62 -8.244 -4.829 -6.520 1.00 0.00 C ATOM 955 CG2 ILE A 62 -10.026 -3.090 -6.823 1.00 0.00 C ATOM 956 CD1 ILE A 62 -7.554 -4.079 -5.402 1.00 0.00 C ATOM 0 H ILE A 62 -8.146 -5.179 -10.128 1.00 0.00 H new ATOM 0 HA ILE A 62 -10.332 -5.415 -8.238 1.00 0.00 H new ATOM 0 HB ILE A 62 -8.221 -3.235 -7.948 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -8.970 -5.519 -6.090 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.507 -5.432 -7.051 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -9.571 -2.507 -6.022 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -10.492 -2.417 -7.542 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.783 -3.754 -6.404 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -7.071 -4.789 -4.731 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.804 -3.409 -5.822 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.289 -3.498 -4.846 1.00 0.00 H new ATOM 968 N ASN A 63 -11.563 -3.809 -9.683 1.00 0.00 N ATOM 969 CA ASN A 63 -12.313 -2.954 -10.595 1.00 0.00 C ATOM 970 C ASN A 63 -12.357 -1.518 -10.083 1.00 0.00 C ATOM 971 O ASN A 63 -13.041 -1.216 -9.105 1.00 0.00 O ATOM 972 CB ASN A 63 -13.737 -3.487 -10.773 1.00 0.00 C ATOM 973 CG ASN A 63 -14.553 -2.648 -11.737 1.00 0.00 C ATOM 974 OD1 ASN A 63 -14.015 -1.792 -12.440 1.00 0.00 O ATOM 975 ND2 ASN A 63 -15.858 -2.890 -11.773 1.00 0.00 N ATOM 0 H ASN A 63 -12.142 -4.393 -9.080 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.805 -2.962 -11.560 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.695 -4.514 -11.136 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -14.236 -3.511 -9.804 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -16.458 -2.357 -12.402 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -16.260 -3.609 -11.172 1.00 0.00 H new ATOM 982 N LEU A 64 -11.622 -0.635 -10.751 1.00 0.00 N ATOM 983 CA LEU A 64 -11.576 0.771 -10.365 1.00 0.00 C ATOM 984 C LEU A 64 -12.976 1.302 -10.076 1.00 0.00 C ATOM 985 O LEU A 64 -13.173 2.099 -9.158 1.00 0.00 O ATOM 986 CB LEU A 64 -10.920 1.602 -11.469 1.00 0.00 C ATOM 987 CG LEU A 64 -9.481 1.228 -11.826 1.00 0.00 C ATOM 988 CD1 LEU A 64 -9.069 1.883 -13.135 1.00 0.00 C ATOM 989 CD2 LEU A 64 -8.533 1.628 -10.705 1.00 0.00 C ATOM 0 H LEU A 64 -11.050 -0.868 -11.563 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.981 0.854 -9.455 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.529 1.519 -12.369 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.938 2.649 -11.167 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.427 0.147 -11.952 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.042 1.606 -13.373 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.730 1.547 -13.934 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.139 2.966 -13.038 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.513 1.354 -10.976 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.590 2.705 -10.547 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.816 1.111 -9.788 1.00 0.00 H new ATOM 1001 N LYS A 65 -13.948 0.854 -10.865 1.00 0.00 N ATOM 1002 CA LYS A 65 -15.331 1.281 -10.693 1.00 0.00 C ATOM 1003 C LYS A 65 -15.858 0.877 -9.319 1.00 0.00 C ATOM 1004 O LYS A 65 -16.603 1.626 -8.687 1.00 0.00 O ATOM 1005 CB LYS A 65 -16.213 0.675 -11.787 1.00 0.00 C ATOM 1006 CG LYS A 65 -15.813 1.092 -13.191 1.00 0.00 C ATOM 1007 CD LYS A 65 -16.135 2.555 -13.451 1.00 0.00 C ATOM 1008 CE LYS A 65 -16.325 2.828 -14.935 1.00 0.00 C ATOM 1009 NZ LYS A 65 -17.729 2.582 -15.369 1.00 0.00 N ATOM 0 H LYS A 65 -13.802 0.195 -11.630 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.362 2.368 -10.770 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.172 -0.412 -11.714 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.248 0.968 -11.611 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -14.745 0.923 -13.332 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.333 0.469 -13.919 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -17.040 2.831 -12.910 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -15.330 3.180 -13.065 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -16.054 3.861 -15.152 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -15.651 2.194 -15.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -17.818 2.779 -16.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -17.980 1.590 -15.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -18.371 3.205 -14.838 1.00 0.00 H new ATOM 1023 N GLU A 66 -15.466 -0.308 -8.864 1.00 0.00 N ATOM 1024 CA GLU A 66 -15.899 -0.809 -7.565 1.00 0.00 C ATOM 1025 C GLU A 66 -15.362 0.068 -6.437 1.00 0.00 C ATOM 1026 O GLU A 66 -15.958 0.149 -5.363 1.00 0.00 O ATOM 1027 CB GLU A 66 -15.433 -2.253 -7.369 1.00 0.00 C ATOM 1028 CG GLU A 66 -16.181 -3.256 -8.230 1.00 0.00 C ATOM 1029 CD GLU A 66 -17.478 -3.719 -7.595 1.00 0.00 C ATOM 1030 OE1 GLU A 66 -18.077 -2.933 -6.831 1.00 0.00 O ATOM 1031 OE2 GLU A 66 -17.893 -4.866 -7.860 1.00 0.00 O ATOM 0 H GLU A 66 -14.849 -0.939 -9.375 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.988 -0.780 -7.538 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.368 -2.316 -7.594 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.554 -2.526 -6.321 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.396 -2.807 -9.200 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.542 -4.120 -8.413 1.00 0.00 H new ATOM 1038 N ILE A 67 -14.233 0.721 -6.690 1.00 0.00 N ATOM 1039 CA ILE A 67 -13.616 1.592 -5.698 1.00 0.00 C ATOM 1040 C ILE A 67 -13.925 3.058 -5.984 1.00 0.00 C ATOM 1041 O ILE A 67 -13.884 3.498 -7.131 1.00 0.00 O ATOM 1042 CB ILE A 67 -12.088 1.401 -5.653 1.00 0.00 C ATOM 1043 CG1 ILE A 67 -11.496 1.523 -7.058 1.00 0.00 C ATOM 1044 CG2 ILE A 67 -11.741 0.052 -5.041 1.00 0.00 C ATOM 1045 CD1 ILE A 67 -9.985 1.451 -7.085 1.00 0.00 C ATOM 0 H ILE A 67 -13.727 0.663 -7.574 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.037 1.316 -4.731 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.657 2.183 -5.028 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -11.901 0.728 -7.684 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.815 2.468 -7.497 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.658 -0.068 -5.016 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.135 0.001 -4.026 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -12.181 -0.744 -5.642 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.635 1.544 -8.113 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.571 2.262 -6.486 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -9.659 0.495 -6.676 1.00 0.00 H new ATOM 1057 N ASN A 68 -14.234 3.808 -4.931 1.00 0.00 N ATOM 1058 CA ASN A 68 -14.549 5.225 -5.069 1.00 0.00 C ATOM 1059 C ASN A 68 -13.300 6.029 -5.418 1.00 0.00 C ATOM 1060 O ASN A 68 -12.613 6.544 -4.535 1.00 0.00 O ATOM 1061 CB ASN A 68 -15.168 5.760 -3.775 1.00 0.00 C ATOM 1062 CG ASN A 68 -16.444 5.032 -3.402 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -17.525 5.357 -3.894 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -16.326 4.041 -2.526 1.00 0.00 N ATOM 0 H ASN A 68 -14.273 3.458 -3.974 1.00 0.00 H new ATOM 0 HA ASN A 68 -15.268 5.334 -5.881 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -14.447 5.663 -2.963 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -15.379 6.823 -3.889 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -17.151 3.516 -2.236 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -15.410 3.805 -2.143 1.00 0.00 H new ATOM 1071 N LEU A 69 -13.012 6.132 -6.711 1.00 0.00 N ATOM 1072 CA LEU A 69 -11.846 6.874 -7.178 1.00 0.00 C ATOM 1073 C LEU A 69 -11.757 8.235 -6.496 1.00 0.00 C ATOM 1074 O LEU A 69 -10.667 8.774 -6.305 1.00 0.00 O ATOM 1075 CB LEU A 69 -11.907 7.055 -8.696 1.00 0.00 C ATOM 1076 CG LEU A 69 -11.578 5.818 -9.533 1.00 0.00 C ATOM 1077 CD1 LEU A 69 -12.073 5.993 -10.961 1.00 0.00 C ATOM 1078 CD2 LEU A 69 -10.081 5.544 -9.515 1.00 0.00 C ATOM 0 H LEU A 69 -13.570 5.711 -7.454 1.00 0.00 H new ATOM 0 HA LEU A 69 -10.955 6.301 -6.921 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.909 7.393 -8.962 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -11.217 7.852 -8.975 1.00 0.00 H new ATOM 0 HG LEU A 69 -12.089 4.960 -9.095 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.830 5.103 -11.542 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.153 6.140 -10.956 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.591 6.862 -11.409 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.866 4.660 -10.116 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.549 6.401 -9.927 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.755 5.374 -8.489 1.00 0.00 H new ATOM 1090 N ARG A 70 -12.910 8.784 -6.129 1.00 0.00 N ATOM 1091 CA ARG A 70 -12.962 10.081 -5.466 1.00 0.00 C ATOM 1092 C ARG A 70 -13.593 9.960 -4.082 1.00 0.00 C ATOM 1093 O ARG A 70 -14.777 10.234 -3.886 1.00 0.00 O ATOM 1094 CB ARG A 70 -13.754 11.079 -6.313 1.00 0.00 C ATOM 1095 CG ARG A 70 -15.084 10.536 -6.810 1.00 0.00 C ATOM 1096 CD ARG A 70 -14.940 9.865 -8.167 1.00 0.00 C ATOM 1097 NE ARG A 70 -16.219 9.376 -8.675 1.00 0.00 N ATOM 1098 CZ ARG A 70 -16.728 8.190 -8.363 1.00 0.00 C ATOM 1099 NH1 ARG A 70 -16.070 7.375 -7.550 1.00 0.00 N ATOM 1100 NH2 ARG A 70 -17.898 7.816 -8.865 1.00 0.00 N ATOM 0 H ARG A 70 -13.821 8.351 -6.280 1.00 0.00 H new ATOM 0 HA ARG A 70 -11.940 10.442 -5.350 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -13.936 11.978 -5.724 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -13.149 11.376 -7.170 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -15.478 9.820 -6.089 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -15.807 11.349 -6.880 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -14.515 10.573 -8.878 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -14.240 9.033 -8.088 1.00 0.00 H new ATOM 0 HE ARG A 70 -16.750 9.978 -9.304 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -15.170 7.659 -7.162 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -16.464 6.465 -7.312 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -18.407 8.440 -9.491 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -18.288 6.905 -8.625 1.00 0.00 H new ATOM 1114 N PRO A 71 -12.784 9.540 -3.098 1.00 0.00 N ATOM 1115 CA PRO A 71 -13.241 9.373 -1.715 1.00 0.00 C ATOM 1116 C PRO A 71 -13.536 10.706 -1.036 1.00 0.00 C ATOM 1117 O PRO A 71 -14.207 10.753 -0.006 1.00 0.00 O ATOM 1118 CB PRO A 71 -12.061 8.675 -1.033 1.00 0.00 C ATOM 1119 CG PRO A 71 -10.873 9.063 -1.843 1.00 0.00 C ATOM 1120 CD PRO A 71 -11.362 9.196 -3.259 1.00 0.00 C ATOM 0 HA PRO A 71 -14.175 8.814 -1.660 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -11.956 8.996 0.003 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.195 7.593 -1.019 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.448 10.002 -1.487 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.088 8.310 -1.770 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -10.820 9.971 -3.800 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.234 8.269 -3.817 1.00 0.00 H new ATOM 1128 N GLN A 72 -13.029 11.787 -1.621 1.00 0.00 N ATOM 1129 CA GLN A 72 -13.239 13.121 -1.072 1.00 0.00 C ATOM 1130 C GLN A 72 -12.894 13.159 0.413 1.00 0.00 C ATOM 1131 O GLN A 72 -13.598 13.782 1.208 1.00 0.00 O ATOM 1132 CB GLN A 72 -14.689 13.561 -1.282 1.00 0.00 C ATOM 1133 CG GLN A 72 -15.114 13.577 -2.742 1.00 0.00 C ATOM 1134 CD GLN A 72 -16.384 14.371 -2.971 1.00 0.00 C ATOM 1135 OE1 GLN A 72 -17.483 13.910 -2.661 1.00 0.00 O ATOM 1136 NE2 GLN A 72 -16.241 15.573 -3.517 1.00 0.00 N ATOM 0 H GLN A 72 -12.471 11.765 -2.474 1.00 0.00 H new ATOM 0 HA GLN A 72 -12.578 13.810 -1.598 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -15.347 12.892 -0.728 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -14.822 14.558 -0.862 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -14.311 14.001 -3.345 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -15.264 12.553 -3.084 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -15.311 15.916 -3.758 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -17.061 16.153 -3.695 1.00 0.00 H new ATOM 1145 N MET A 73 -11.808 12.487 0.781 1.00 0.00 N ATOM 1146 CA MET A 73 -11.371 12.444 2.171 1.00 0.00 C ATOM 1147 C MET A 73 -12.536 12.112 3.098 1.00 0.00 C ATOM 1148 O MET A 73 -12.685 12.713 4.162 1.00 0.00 O ATOM 1149 CB MET A 73 -10.749 13.783 2.574 1.00 0.00 C ATOM 1150 CG MET A 73 -9.416 14.061 1.898 1.00 0.00 C ATOM 1151 SD MET A 73 -8.047 13.182 2.675 1.00 0.00 S ATOM 1152 CE MET A 73 -7.828 11.819 1.533 1.00 0.00 C ATOM 0 H MET A 73 -11.215 11.965 0.136 1.00 0.00 H new ATOM 0 HA MET A 73 -10.620 11.659 2.265 1.00 0.00 H new ATOM 0 HB2 MET A 73 -11.445 14.586 2.331 1.00 0.00 H new ATOM 0 HB3 MET A 73 -10.609 13.799 3.655 1.00 0.00 H new ATOM 0 HG2 MET A 73 -9.478 13.774 0.848 1.00 0.00 H new ATOM 0 HG3 MET A 73 -9.216 15.132 1.924 1.00 0.00 H new ATOM 0 HE1 MET A 73 -6.798 11.465 1.582 1.00 0.00 H new ATOM 0 HE2 MET A 73 -8.504 11.007 1.802 1.00 0.00 H new ATOM 0 HE3 MET A 73 -8.048 12.154 0.520 1.00 0.00 H new ATOM 1162 N SER A 74 -13.359 11.153 2.687 1.00 0.00 N ATOM 1163 CA SER A 74 -14.513 10.744 3.479 1.00 0.00 C ATOM 1164 C SER A 74 -14.128 9.661 4.482 1.00 0.00 C ATOM 1165 O SER A 74 -12.985 9.204 4.509 1.00 0.00 O ATOM 1166 CB SER A 74 -15.630 10.236 2.566 1.00 0.00 C ATOM 1167 OG SER A 74 -16.316 11.312 1.950 1.00 0.00 O ATOM 0 H SER A 74 -13.248 10.644 1.810 1.00 0.00 H new ATOM 0 HA SER A 74 -14.871 11.614 4.030 1.00 0.00 H new ATOM 0 HB2 SER A 74 -15.210 9.583 1.801 1.00 0.00 H new ATOM 0 HB3 SER A 74 -16.333 9.637 3.145 1.00 0.00 H new ATOM 0 HG SER A 74 -15.897 11.517 1.088 1.00 0.00 H new ATOM 1173 N GLN A 75 -15.090 9.256 5.305 1.00 0.00 N ATOM 1174 CA GLN A 75 -14.852 8.228 6.310 1.00 0.00 C ATOM 1175 C GLN A 75 -15.434 6.889 5.868 1.00 0.00 C ATOM 1176 O GLN A 75 -14.747 5.868 5.880 1.00 0.00 O ATOM 1177 CB GLN A 75 -15.460 8.644 7.650 1.00 0.00 C ATOM 1178 CG GLN A 75 -14.907 7.871 8.837 1.00 0.00 C ATOM 1179 CD GLN A 75 -15.917 7.720 9.957 1.00 0.00 C ATOM 1180 OE1 GLN A 75 -17.087 7.419 9.718 1.00 0.00 O ATOM 1181 NE2 GLN A 75 -15.469 7.928 11.190 1.00 0.00 N ATOM 0 H GLN A 75 -16.041 9.624 5.295 1.00 0.00 H new ATOM 0 HA GLN A 75 -13.774 8.114 6.428 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -15.282 9.708 7.805 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -16.540 8.505 7.608 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -14.588 6.883 8.505 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -14.022 8.381 9.217 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -14.491 8.176 11.342 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -16.103 7.840 11.984 1.00 0.00 H new ATOM 1190 N PHE A 76 -16.704 6.902 5.479 1.00 0.00 N ATOM 1191 CA PHE A 76 -17.379 5.688 5.034 1.00 0.00 C ATOM 1192 C PHE A 76 -16.753 5.158 3.748 1.00 0.00 C ATOM 1193 O PHE A 76 -16.517 3.957 3.608 1.00 0.00 O ATOM 1194 CB PHE A 76 -18.869 5.959 4.815 1.00 0.00 C ATOM 1195 CG PHE A 76 -19.663 6.006 6.090 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -19.849 4.861 6.848 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -20.224 7.194 6.528 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -20.579 4.901 8.021 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -20.955 7.240 7.701 1.00 0.00 C ATOM 1200 CZ PHE A 76 -21.133 6.092 8.448 1.00 0.00 C ATOM 0 H PHE A 76 -17.287 7.739 5.463 1.00 0.00 H new ATOM 0 HA PHE A 76 -17.264 4.933 5.811 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -18.984 6.907 4.289 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -19.280 5.184 4.169 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -19.419 3.927 6.519 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -20.089 8.094 5.947 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -20.716 4.002 8.603 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -21.386 8.173 8.033 1.00 0.00 H new ATOM 0 HZ PHE A 76 -21.704 6.126 9.364 1.00 0.00 H new ATOM 1210 N LEU A 77 -16.487 6.061 2.810 1.00 0.00 N ATOM 1211 CA LEU A 77 -15.889 5.685 1.534 1.00 0.00 C ATOM 1212 C LEU A 77 -14.458 5.192 1.728 1.00 0.00 C ATOM 1213 O LEU A 77 -14.125 4.065 1.359 1.00 0.00 O ATOM 1214 CB LEU A 77 -15.904 6.874 0.572 1.00 0.00 C ATOM 1215 CG LEU A 77 -17.278 7.469 0.262 1.00 0.00 C ATOM 1216 CD1 LEU A 77 -17.134 8.773 -0.507 1.00 0.00 C ATOM 1217 CD2 LEU A 77 -18.125 6.476 -0.521 1.00 0.00 C ATOM 0 H LEU A 77 -16.676 7.058 2.909 1.00 0.00 H new ATOM 0 HA LEU A 77 -16.479 4.873 1.109 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -15.275 7.661 0.989 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -15.445 6.562 -0.366 1.00 0.00 H new ATOM 0 HG LEU A 77 -17.782 7.681 1.205 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -18.122 9.182 -0.719 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -16.566 9.487 0.090 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -16.610 8.587 -1.444 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -19.099 6.916 -0.733 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -17.626 6.232 -1.459 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -18.257 5.568 0.067 1.00 0.00 H new ATOM 1229 N CYS A 78 -13.619 6.041 2.309 1.00 0.00 N ATOM 1230 CA CYS A 78 -12.224 5.691 2.553 1.00 0.00 C ATOM 1231 C CYS A 78 -12.116 4.330 3.233 1.00 0.00 C ATOM 1232 O CYS A 78 -11.497 3.406 2.703 1.00 0.00 O ATOM 1233 CB CYS A 78 -11.551 6.760 3.415 1.00 0.00 C ATOM 1234 SG CYS A 78 -10.988 8.208 2.489 1.00 0.00 S ATOM 0 H CYS A 78 -13.880 6.977 2.620 1.00 0.00 H new ATOM 0 HA CYS A 78 -11.715 5.638 1.591 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -12.251 7.084 4.185 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -10.698 6.315 3.927 1.00 0.00 H new ATOM 0 HG CYS A 78 -11.508 9.282 3.005 1.00 0.00 H new ATOM 1240 N LEU A 79 -12.720 4.214 4.410 1.00 0.00 N ATOM 1241 CA LEU A 79 -12.691 2.965 5.165 1.00 0.00 C ATOM 1242 C LEU A 79 -13.015 1.777 4.265 1.00 0.00 C ATOM 1243 O LEU A 79 -12.320 0.761 4.285 1.00 0.00 O ATOM 1244 CB LEU A 79 -13.685 3.026 6.327 1.00 0.00 C ATOM 1245 CG LEU A 79 -13.239 3.829 7.549 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -14.441 4.226 8.394 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -12.243 3.032 8.378 1.00 0.00 C ATOM 0 H LEU A 79 -13.236 4.969 4.863 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.685 2.832 5.562 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.619 3.451 5.959 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -13.903 2.007 6.646 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.747 4.738 7.202 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -14.105 4.797 9.260 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.119 4.837 7.798 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.961 3.329 8.731 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -11.937 3.620 9.243 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -12.709 2.106 8.715 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.369 2.798 7.771 1.00 0.00 H new ATOM 1259 N LYS A 80 -14.075 1.912 3.475 1.00 0.00 N ATOM 1260 CA LYS A 80 -14.490 0.852 2.564 1.00 0.00 C ATOM 1261 C LYS A 80 -13.389 0.537 1.557 1.00 0.00 C ATOM 1262 O LYS A 80 -12.893 -0.588 1.497 1.00 0.00 O ATOM 1263 CB LYS A 80 -15.769 1.256 1.827 1.00 0.00 C ATOM 1264 CG LYS A 80 -16.608 0.075 1.372 1.00 0.00 C ATOM 1265 CD LYS A 80 -16.140 -0.456 0.027 1.00 0.00 C ATOM 1266 CE LYS A 80 -16.671 0.388 -1.121 1.00 0.00 C ATOM 1267 NZ LYS A 80 -15.745 0.384 -2.287 1.00 0.00 N ATOM 0 H LYS A 80 -14.662 2.745 3.447 1.00 0.00 H new ATOM 0 HA LYS A 80 -14.685 -0.043 3.154 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.371 1.888 2.480 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.503 1.858 0.958 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.554 -0.719 2.117 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -17.653 0.376 1.302 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.050 -0.467 -0.002 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.472 -1.487 -0.094 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.645 0.009 -1.430 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.821 1.412 -0.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -16.251 0.715 -3.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -14.942 1.016 -2.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -15.395 -0.582 -2.449 1.00 0.00 H new ATOM 1281 N ASN A 81 -13.009 1.538 0.770 1.00 0.00 N ATOM 1282 CA ASN A 81 -11.965 1.367 -0.234 1.00 0.00 C ATOM 1283 C ASN A 81 -10.846 0.472 0.291 1.00 0.00 C ATOM 1284 O ASN A 81 -10.582 -0.597 -0.260 1.00 0.00 O ATOM 1285 CB ASN A 81 -11.396 2.727 -0.644 1.00 0.00 C ATOM 1286 CG ASN A 81 -12.407 3.576 -1.389 1.00 0.00 C ATOM 1287 OD1 ASN A 81 -13.589 3.237 -1.458 1.00 0.00 O ATOM 1288 ND2 ASN A 81 -11.947 4.687 -1.951 1.00 0.00 N ATOM 0 H ASN A 81 -13.408 2.476 0.808 1.00 0.00 H new ATOM 0 HA ASN A 81 -12.409 0.888 -1.107 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -11.062 3.261 0.246 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.519 2.576 -1.273 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -12.581 5.299 -2.465 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -10.960 4.929 -1.869 1.00 0.00 H new ATOM 1295 N ILE A 82 -10.194 0.917 1.360 1.00 0.00 N ATOM 1296 CA ILE A 82 -9.105 0.156 1.961 1.00 0.00 C ATOM 1297 C ILE A 82 -9.432 -1.333 2.001 1.00 0.00 C ATOM 1298 O ILE A 82 -8.661 -2.162 1.519 1.00 0.00 O ATOM 1299 CB ILE A 82 -8.800 0.642 3.390 1.00 0.00 C ATOM 1300 CG1 ILE A 82 -8.398 2.118 3.375 1.00 0.00 C ATOM 1301 CG2 ILE A 82 -7.702 -0.206 4.014 1.00 0.00 C ATOM 1302 CD1 ILE A 82 -8.437 2.769 4.739 1.00 0.00 C ATOM 0 H ILE A 82 -10.401 1.800 1.827 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.226 0.316 1.337 1.00 0.00 H new ATOM 0 HB ILE A 82 -9.701 0.537 3.994 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -7.391 2.208 2.967 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -9.063 2.661 2.703 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -7.497 0.149 5.024 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -8.024 -1.247 4.054 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.797 -0.129 3.412 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -8.140 3.814 4.652 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -9.449 2.711 5.141 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.750 2.252 5.409 1.00 0.00 H new ATOM 1314 N ARG A 83 -10.582 -1.665 2.579 1.00 0.00 N ATOM 1315 CA ARG A 83 -11.013 -3.054 2.682 1.00 0.00 C ATOM 1316 C ARG A 83 -10.962 -3.742 1.321 1.00 0.00 C ATOM 1317 O ARG A 83 -10.376 -4.815 1.176 1.00 0.00 O ATOM 1318 CB ARG A 83 -12.431 -3.131 3.251 1.00 0.00 C ATOM 1319 CG ARG A 83 -12.522 -2.730 4.715 1.00 0.00 C ATOM 1320 CD ARG A 83 -13.875 -2.118 5.042 1.00 0.00 C ATOM 1321 NE ARG A 83 -14.211 -2.256 6.456 1.00 0.00 N ATOM 1322 CZ ARG A 83 -14.632 -3.390 7.005 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -14.768 -4.479 6.261 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -14.917 -3.436 8.300 1.00 0.00 N ATOM 0 H ARG A 83 -11.232 -0.991 2.983 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.330 -3.570 3.357 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.084 -2.485 2.665 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -12.804 -4.149 3.138 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.356 -3.605 5.344 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -11.732 -2.015 4.947 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -13.870 -1.062 4.772 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.645 -2.598 4.438 1.00 0.00 H new ATOM 0 HE ARG A 83 -14.117 -1.436 7.056 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -14.549 -4.447 5.265 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -15.091 -5.349 6.684 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -14.813 -2.600 8.875 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -15.240 -4.307 8.720 1.00 0.00 H new ATOM 1338 N THR A 84 -11.581 -3.116 0.324 1.00 0.00 N ATOM 1339 CA THR A 84 -11.608 -3.667 -1.025 1.00 0.00 C ATOM 1340 C THR A 84 -10.246 -4.228 -1.417 1.00 0.00 C ATOM 1341 O THR A 84 -10.151 -5.325 -1.969 1.00 0.00 O ATOM 1342 CB THR A 84 -12.030 -2.605 -2.057 1.00 0.00 C ATOM 1343 OG1 THR A 84 -13.315 -2.072 -1.715 1.00 0.00 O ATOM 1344 CG2 THR A 84 -12.079 -3.200 -3.456 1.00 0.00 C ATOM 0 H THR A 84 -12.070 -2.227 0.426 1.00 0.00 H new ATOM 0 HA THR A 84 -12.342 -4.472 -1.023 1.00 0.00 H new ATOM 0 HB THR A 84 -11.290 -1.805 -2.045 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.575 -1.396 -2.375 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.379 -2.431 -4.168 1.00 0.00 H new ATOM 0 HG22 THR A 84 -11.093 -3.578 -3.725 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.800 -4.017 -3.479 1.00 0.00 H new ATOM 1352 N PHE A 85 -9.194 -3.470 -1.128 1.00 0.00 N ATOM 1353 CA PHE A 85 -7.836 -3.892 -1.451 1.00 0.00 C ATOM 1354 C PHE A 85 -7.455 -5.145 -0.668 1.00 0.00 C ATOM 1355 O PHE A 85 -7.096 -6.170 -1.250 1.00 0.00 O ATOM 1356 CB PHE A 85 -6.844 -2.767 -1.150 1.00 0.00 C ATOM 1357 CG PHE A 85 -5.446 -3.253 -0.893 1.00 0.00 C ATOM 1358 CD1 PHE A 85 -5.051 -3.623 0.383 1.00 0.00 C ATOM 1359 CD2 PHE A 85 -4.528 -3.339 -1.926 1.00 0.00 C ATOM 1360 CE1 PHE A 85 -3.765 -4.070 0.623 1.00 0.00 C ATOM 1361 CE2 PHE A 85 -3.241 -3.787 -1.693 1.00 0.00 C ATOM 1362 CZ PHE A 85 -2.859 -4.152 -0.416 1.00 0.00 C ATOM 0 H PHE A 85 -9.255 -2.560 -0.671 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.798 -4.125 -2.515 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.830 -2.072 -1.989 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.192 -2.210 -0.280 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -5.756 -3.561 1.199 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -4.821 -3.053 -2.925 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -3.469 -4.355 1.622 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -2.535 -3.852 -2.508 1.00 0.00 H new ATOM 0 HZ PHE A 85 -1.854 -4.501 -0.231 1.00 0.00 H new ATOM 1372 N LEU A 86 -7.534 -5.055 0.655 1.00 0.00 N ATOM 1373 CA LEU A 86 -7.197 -6.180 1.520 1.00 0.00 C ATOM 1374 C LEU A 86 -7.919 -7.447 1.072 1.00 0.00 C ATOM 1375 O LEU A 86 -7.419 -8.558 1.254 1.00 0.00 O ATOM 1376 CB LEU A 86 -7.558 -5.860 2.971 1.00 0.00 C ATOM 1377 CG LEU A 86 -7.001 -4.549 3.528 1.00 0.00 C ATOM 1378 CD1 LEU A 86 -7.737 -4.153 4.799 1.00 0.00 C ATOM 1379 CD2 LEU A 86 -5.508 -4.673 3.791 1.00 0.00 C ATOM 0 H LEU A 86 -7.829 -4.214 1.152 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.123 -6.351 1.449 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.644 -5.836 3.057 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -7.207 -6.677 3.601 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.155 -3.767 2.785 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.327 -3.218 5.181 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -8.797 -4.022 4.580 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -7.616 -4.935 5.548 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.129 -3.731 4.187 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.331 -5.468 4.515 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.993 -4.909 2.860 1.00 0.00 H new ATOM 1391 N THR A 87 -9.098 -7.273 0.482 1.00 0.00 N ATOM 1392 CA THR A 87 -9.889 -8.401 0.007 1.00 0.00 C ATOM 1393 C THR A 87 -9.239 -9.055 -1.207 1.00 0.00 C ATOM 1394 O THR A 87 -9.093 -10.275 -1.263 1.00 0.00 O ATOM 1395 CB THR A 87 -11.320 -7.968 -0.362 1.00 0.00 C ATOM 1396 OG1 THR A 87 -11.901 -7.228 0.718 1.00 0.00 O ATOM 1397 CG2 THR A 87 -12.187 -9.177 -0.679 1.00 0.00 C ATOM 0 H THR A 87 -9.526 -6.361 0.322 1.00 0.00 H new ATOM 0 HA THR A 87 -9.935 -9.121 0.824 1.00 0.00 H new ATOM 0 HB THR A 87 -11.268 -7.336 -1.249 1.00 0.00 H new ATOM 0 HG1 THR A 87 -11.430 -6.374 0.820 1.00 0.00 H new ATOM 0 HG21 THR A 87 -13.193 -8.846 -0.937 1.00 0.00 H new ATOM 0 HG22 THR A 87 -11.758 -9.722 -1.520 1.00 0.00 H new ATOM 0 HG23 THR A 87 -12.232 -9.831 0.192 1.00 0.00 H new ATOM 1405 N ALA A 88 -8.851 -8.234 -2.178 1.00 0.00 N ATOM 1406 CA ALA A 88 -8.214 -8.733 -3.391 1.00 0.00 C ATOM 1407 C ALA A 88 -6.934 -9.495 -3.065 1.00 0.00 C ATOM 1408 O ALA A 88 -6.610 -10.490 -3.715 1.00 0.00 O ATOM 1409 CB ALA A 88 -7.919 -7.584 -4.343 1.00 0.00 C ATOM 0 H ALA A 88 -8.967 -7.221 -2.148 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.903 -9.424 -3.876 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.444 -7.971 -5.244 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.850 -7.084 -4.610 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.251 -6.872 -3.858 1.00 0.00 H new ATOM 1415 N CYS A 89 -6.210 -9.022 -2.057 1.00 0.00 N ATOM 1416 CA CYS A 89 -4.964 -9.658 -1.646 1.00 0.00 C ATOM 1417 C CYS A 89 -5.204 -11.105 -1.226 1.00 0.00 C ATOM 1418 O CYS A 89 -4.267 -11.899 -1.137 1.00 0.00 O ATOM 1419 CB CYS A 89 -4.325 -8.880 -0.495 1.00 0.00 C ATOM 1420 SG CYS A 89 -3.189 -7.577 -1.025 1.00 0.00 S ATOM 0 H CYS A 89 -6.465 -8.200 -1.509 1.00 0.00 H new ATOM 0 HA CYS A 89 -4.285 -9.654 -2.499 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -5.114 -8.435 0.111 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -3.787 -9.578 0.146 1.00 0.00 H new ATOM 0 HG CYS A 89 -3.536 -6.450 -0.477 1.00 0.00 H new ATOM 1426 N CYS A 90 -6.463 -11.439 -0.969 1.00 0.00 N ATOM 1427 CA CYS A 90 -6.827 -12.790 -0.556 1.00 0.00 C ATOM 1428 C CYS A 90 -7.681 -13.472 -1.620 1.00 0.00 C ATOM 1429 O CYS A 90 -7.677 -14.697 -1.740 1.00 0.00 O ATOM 1430 CB CYS A 90 -7.581 -12.753 0.774 1.00 0.00 C ATOM 1431 SG CYS A 90 -8.138 -14.374 1.352 1.00 0.00 S ATOM 0 H CYS A 90 -7.249 -10.793 -1.039 1.00 0.00 H new ATOM 0 HA CYS A 90 -5.909 -13.365 -0.429 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -6.936 -12.310 1.533 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -8.447 -12.099 0.671 1.00 0.00 H new ATOM 0 HG CYS A 90 -8.171 -15.203 0.352 1.00 0.00 H new ATOM 1437 N GLU A 91 -8.413 -12.671 -2.387 1.00 0.00 N ATOM 1438 CA GLU A 91 -9.274 -13.199 -3.439 1.00 0.00 C ATOM 1439 C GLU A 91 -8.523 -13.285 -4.765 1.00 0.00 C ATOM 1440 O GLU A 91 -8.488 -14.336 -5.405 1.00 0.00 O ATOM 1441 CB GLU A 91 -10.517 -12.321 -3.600 1.00 0.00 C ATOM 1442 CG GLU A 91 -11.394 -12.275 -2.360 1.00 0.00 C ATOM 1443 CD GLU A 91 -12.451 -13.362 -2.351 1.00 0.00 C ATOM 1444 OE1 GLU A 91 -12.952 -13.711 -3.440 1.00 0.00 O ATOM 1445 OE2 GLU A 91 -12.776 -13.864 -1.255 1.00 0.00 O ATOM 0 H GLU A 91 -8.427 -11.655 -2.300 1.00 0.00 H new ATOM 0 HA GLU A 91 -9.583 -14.204 -3.150 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.205 -11.307 -3.852 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -11.107 -12.691 -4.439 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -10.768 -12.375 -1.473 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -11.880 -11.301 -2.299 1.00 0.00 H new ATOM 1452 N THR A 92 -7.923 -12.170 -5.172 1.00 0.00 N ATOM 1453 CA THR A 92 -7.175 -12.118 -6.421 1.00 0.00 C ATOM 1454 C THR A 92 -5.862 -12.884 -6.308 1.00 0.00 C ATOM 1455 O THR A 92 -5.547 -13.724 -7.151 1.00 0.00 O ATOM 1456 CB THR A 92 -6.874 -10.665 -6.835 1.00 0.00 C ATOM 1457 OG1 THR A 92 -8.096 -9.928 -6.960 1.00 0.00 O ATOM 1458 CG2 THR A 92 -6.115 -10.623 -8.152 1.00 0.00 C ATOM 0 H THR A 92 -7.941 -11.291 -4.654 1.00 0.00 H new ATOM 0 HA THR A 92 -7.800 -12.584 -7.183 1.00 0.00 H new ATOM 0 HB THR A 92 -6.254 -10.212 -6.062 1.00 0.00 H new ATOM 0 HG1 THR A 92 -7.906 -9.038 -7.323 1.00 0.00 H new ATOM 0 HG21 THR A 92 -5.914 -9.587 -8.423 1.00 0.00 H new ATOM 0 HG22 THR A 92 -5.172 -11.160 -8.046 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.714 -11.093 -8.932 1.00 0.00 H new ATOM 1466 N PHE A 93 -5.099 -12.589 -5.261 1.00 0.00 N ATOM 1467 CA PHE A 93 -3.818 -13.251 -5.037 1.00 0.00 C ATOM 1468 C PHE A 93 -4.008 -14.560 -4.277 1.00 0.00 C ATOM 1469 O PHE A 93 -3.754 -15.641 -4.807 1.00 0.00 O ATOM 1470 CB PHE A 93 -2.873 -12.330 -4.263 1.00 0.00 C ATOM 1471 CG PHE A 93 -2.263 -11.249 -5.109 1.00 0.00 C ATOM 1472 CD1 PHE A 93 -3.056 -10.265 -5.677 1.00 0.00 C ATOM 1473 CD2 PHE A 93 -0.896 -11.217 -5.336 1.00 0.00 C ATOM 1474 CE1 PHE A 93 -2.498 -9.268 -6.455 1.00 0.00 C ATOM 1475 CE2 PHE A 93 -0.333 -10.222 -6.113 1.00 0.00 C ATOM 1476 CZ PHE A 93 -1.134 -9.248 -6.674 1.00 0.00 C ATOM 0 H PHE A 93 -5.345 -11.896 -4.554 1.00 0.00 H new ATOM 0 HA PHE A 93 -3.379 -13.477 -6.009 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.420 -11.871 -3.440 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.076 -12.928 -3.822 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -4.123 -10.277 -5.510 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -0.264 -11.977 -4.901 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.127 -8.506 -6.891 1.00 0.00 H new ATOM 0 HE2 PHE A 93 0.734 -10.207 -6.281 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.695 -8.472 -7.283 1.00 0.00 H new ATOM 1486 N GLY A 94 -4.456 -14.453 -3.029 1.00 0.00 N ATOM 1487 CA GLY A 94 -4.671 -15.635 -2.215 1.00 0.00 C ATOM 1488 C GLY A 94 -3.821 -15.637 -0.960 1.00 0.00 C ATOM 1489 O GLY A 94 -3.329 -16.683 -0.537 1.00 0.00 O ATOM 0 H GLY A 94 -4.674 -13.569 -2.568 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.723 -15.695 -1.937 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.446 -16.524 -2.804 1.00 0.00 H new ATOM 1493 N MET A 95 -3.646 -14.462 -0.364 1.00 0.00 N ATOM 1494 CA MET A 95 -2.849 -14.333 0.851 1.00 0.00 C ATOM 1495 C MET A 95 -3.734 -14.388 2.091 1.00 0.00 C ATOM 1496 O MET A 95 -4.939 -14.144 2.017 1.00 0.00 O ATOM 1497 CB MET A 95 -2.059 -13.023 0.831 1.00 0.00 C ATOM 1498 CG MET A 95 -0.684 -13.151 0.195 1.00 0.00 C ATOM 1499 SD MET A 95 0.494 -11.949 0.842 1.00 0.00 S ATOM 1500 CE MET A 95 -0.331 -10.413 0.434 1.00 0.00 C ATOM 0 H MET A 95 -4.045 -13.586 -0.702 1.00 0.00 H new ATOM 0 HA MET A 95 -2.151 -15.169 0.888 1.00 0.00 H new ATOM 0 HB2 MET A 95 -2.632 -12.271 0.289 1.00 0.00 H new ATOM 0 HB3 MET A 95 -1.945 -12.661 1.853 1.00 0.00 H new ATOM 0 HG2 MET A 95 -0.301 -14.157 0.365 1.00 0.00 H new ATOM 0 HG3 MET A 95 -0.773 -13.022 -0.884 1.00 0.00 H new ATOM 0 HE1 MET A 95 0.268 -9.573 0.787 1.00 0.00 H new ATOM 0 HE2 MET A 95 -0.454 -10.342 -0.647 1.00 0.00 H new ATOM 0 HE3 MET A 95 -1.310 -10.388 0.913 1.00 0.00 H new ATOM 1510 N ARG A 96 -3.130 -14.710 3.230 1.00 0.00 N ATOM 1511 CA ARG A 96 -3.865 -14.799 4.486 1.00 0.00 C ATOM 1512 C ARG A 96 -4.316 -13.417 4.951 1.00 0.00 C ATOM 1513 O ARG A 96 -4.080 -12.415 4.275 1.00 0.00 O ATOM 1514 CB ARG A 96 -2.998 -15.453 5.564 1.00 0.00 C ATOM 1515 CG ARG A 96 -2.846 -16.956 5.394 1.00 0.00 C ATOM 1516 CD ARG A 96 -4.084 -17.699 5.870 1.00 0.00 C ATOM 1517 NE ARG A 96 -5.058 -17.883 4.799 1.00 0.00 N ATOM 1518 CZ ARG A 96 -4.841 -18.640 3.729 1.00 0.00 C ATOM 1519 NH1 ARG A 96 -3.689 -19.281 3.590 1.00 0.00 N ATOM 1520 NH2 ARG A 96 -5.778 -18.758 2.797 1.00 0.00 N ATOM 0 H ARG A 96 -2.134 -14.914 3.309 1.00 0.00 H new ATOM 0 HA ARG A 96 -4.749 -15.414 4.318 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -2.010 -14.993 5.552 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -3.433 -15.249 6.542 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -2.662 -17.188 4.345 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -1.976 -17.300 5.954 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.793 -18.672 6.266 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -4.546 -17.147 6.689 1.00 0.00 H new ATOM 0 HE ARG A 96 -5.955 -17.404 4.876 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -2.967 -19.194 4.305 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -3.524 -19.862 2.768 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -6.666 -18.267 2.902 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -5.610 -19.339 1.976 1.00 0.00 H new ATOM 1534 N LYS A 97 -4.967 -13.371 6.108 1.00 0.00 N ATOM 1535 CA LYS A 97 -5.451 -12.113 6.665 1.00 0.00 C ATOM 1536 C LYS A 97 -4.655 -11.725 7.906 1.00 0.00 C ATOM 1537 O LYS A 97 -4.530 -10.544 8.231 1.00 0.00 O ATOM 1538 CB LYS A 97 -6.937 -12.225 7.014 1.00 0.00 C ATOM 1539 CG LYS A 97 -7.493 -10.993 7.708 1.00 0.00 C ATOM 1540 CD LYS A 97 -7.841 -9.901 6.711 1.00 0.00 C ATOM 1541 CE LYS A 97 -8.437 -8.684 7.402 1.00 0.00 C ATOM 1542 NZ LYS A 97 -9.900 -8.839 7.633 1.00 0.00 N ATOM 0 H LYS A 97 -5.172 -14.191 6.679 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.318 -11.336 5.912 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.504 -12.404 6.100 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.086 -13.092 7.657 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.382 -11.265 8.276 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -6.761 -10.615 8.422 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -6.945 -9.608 6.164 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.549 -10.288 5.979 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -7.934 -8.525 8.356 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.257 -7.797 6.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.269 -7.989 8.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.384 -8.966 6.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -10.070 -9.671 8.234 1.00 0.00 H new ATOM 1556 N SER A 98 -4.116 -12.726 8.595 1.00 0.00 N ATOM 1557 CA SER A 98 -3.333 -12.489 9.802 1.00 0.00 C ATOM 1558 C SER A 98 -2.136 -11.591 9.505 1.00 0.00 C ATOM 1559 O SER A 98 -1.611 -10.924 10.396 1.00 0.00 O ATOM 1560 CB SER A 98 -2.855 -13.816 10.395 1.00 0.00 C ATOM 1561 OG SER A 98 -2.270 -13.623 11.671 1.00 0.00 O ATOM 0 H SER A 98 -4.207 -13.709 8.338 1.00 0.00 H new ATOM 0 HA SER A 98 -3.972 -11.985 10.527 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.696 -14.505 10.477 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.129 -14.277 9.725 1.00 0.00 H new ATOM 0 HG SER A 98 -1.974 -14.486 12.029 1.00 0.00 H new ATOM 1567 N GLU A 99 -1.710 -11.580 8.246 1.00 0.00 N ATOM 1568 CA GLU A 99 -0.574 -10.765 7.832 1.00 0.00 C ATOM 1569 C GLU A 99 -1.037 -9.398 7.338 1.00 0.00 C ATOM 1570 O GLU A 99 -0.299 -8.414 7.417 1.00 0.00 O ATOM 1571 CB GLU A 99 0.217 -11.476 6.731 1.00 0.00 C ATOM 1572 CG GLU A 99 -0.605 -11.781 5.491 1.00 0.00 C ATOM 1573 CD GLU A 99 -0.528 -10.678 4.453 1.00 0.00 C ATOM 1574 OE1 GLU A 99 0.246 -9.721 4.661 1.00 0.00 O ATOM 1575 OE2 GLU A 99 -1.242 -10.772 3.433 1.00 0.00 O ATOM 0 H GLU A 99 -2.134 -12.126 7.496 1.00 0.00 H new ATOM 0 HA GLU A 99 0.072 -10.620 8.698 1.00 0.00 H new ATOM 0 HB2 GLU A 99 1.068 -10.856 6.449 1.00 0.00 H new ATOM 0 HB3 GLU A 99 0.619 -12.408 7.128 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -0.257 -12.715 5.050 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -1.646 -11.933 5.778 1.00 0.00 H new ATOM 1582 N LEU A 100 -2.263 -9.343 6.829 1.00 0.00 N ATOM 1583 CA LEU A 100 -2.825 -8.096 6.322 1.00 0.00 C ATOM 1584 C LEU A 100 -2.969 -7.069 7.440 1.00 0.00 C ATOM 1585 O LEU A 100 -2.813 -7.392 8.618 1.00 0.00 O ATOM 1586 CB LEU A 100 -4.186 -8.355 5.673 1.00 0.00 C ATOM 1587 CG LEU A 100 -4.187 -9.291 4.464 1.00 0.00 C ATOM 1588 CD1 LEU A 100 -5.604 -9.507 3.957 1.00 0.00 C ATOM 1589 CD2 LEU A 100 -3.302 -8.735 3.358 1.00 0.00 C ATOM 0 H LEU A 100 -2.887 -10.147 6.756 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.142 -7.696 5.573 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.853 -8.770 6.429 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.608 -7.398 5.366 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.784 -10.255 4.775 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.585 -10.176 3.096 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.210 -9.950 4.747 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.035 -8.550 3.663 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.315 -9.414 2.506 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.675 -7.759 3.049 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.281 -8.633 3.726 1.00 0.00 H new ATOM 1601 N PHE A 101 -3.269 -5.830 7.063 1.00 0.00 N ATOM 1602 CA PHE A 101 -3.435 -4.755 8.034 1.00 0.00 C ATOM 1603 C PHE A 101 -4.893 -4.311 8.110 1.00 0.00 C ATOM 1604 O PHE A 101 -5.650 -4.468 7.152 1.00 0.00 O ATOM 1605 CB PHE A 101 -2.546 -3.565 7.666 1.00 0.00 C ATOM 1606 CG PHE A 101 -2.903 -2.935 6.351 1.00 0.00 C ATOM 1607 CD1 PHE A 101 -2.467 -3.492 5.159 1.00 0.00 C ATOM 1608 CD2 PHE A 101 -3.674 -1.784 6.305 1.00 0.00 C ATOM 1609 CE1 PHE A 101 -2.793 -2.913 3.948 1.00 0.00 C ATOM 1610 CE2 PHE A 101 -4.004 -1.201 5.096 1.00 0.00 C ATOM 1611 CZ PHE A 101 -3.563 -1.767 3.916 1.00 0.00 C ATOM 0 H PHE A 101 -3.402 -5.546 6.092 1.00 0.00 H new ATOM 0 HA PHE A 101 -3.137 -5.133 9.012 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.616 -2.812 8.451 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.507 -3.894 7.632 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.866 -4.389 5.177 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -4.021 -1.337 7.225 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.446 -3.356 3.026 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.606 -0.304 5.074 1.00 0.00 H new ATOM 0 HZ PHE A 101 -3.820 -1.314 2.970 1.00 0.00 H new ATOM 1621 N GLU A 102 -5.278 -3.757 9.255 1.00 0.00 N ATOM 1622 CA GLU A 102 -6.645 -3.292 9.456 1.00 0.00 C ATOM 1623 C GLU A 102 -6.996 -2.187 8.463 1.00 0.00 C ATOM 1624 O GLU A 102 -6.149 -1.743 7.688 1.00 0.00 O ATOM 1625 CB GLU A 102 -6.829 -2.782 10.887 1.00 0.00 C ATOM 1626 CG GLU A 102 -8.240 -2.964 11.421 1.00 0.00 C ATOM 1627 CD GLU A 102 -8.300 -2.924 12.936 1.00 0.00 C ATOM 1628 OE1 GLU A 102 -8.077 -3.980 13.566 1.00 0.00 O ATOM 1629 OE2 GLU A 102 -8.570 -1.839 13.491 1.00 0.00 O ATOM 0 H GLU A 102 -4.663 -3.619 10.057 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.316 -4.135 9.288 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.131 -3.304 11.542 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.570 -1.724 10.923 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.882 -2.182 11.015 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.637 -3.917 11.070 1.00 0.00 H new ATOM 1636 N ALA A 103 -8.250 -1.750 8.492 1.00 0.00 N ATOM 1637 CA ALA A 103 -8.713 -0.697 7.596 1.00 0.00 C ATOM 1638 C ALA A 103 -8.575 0.676 8.245 1.00 0.00 C ATOM 1639 O ALA A 103 -8.306 1.669 7.568 1.00 0.00 O ATOM 1640 CB ALA A 103 -10.158 -0.948 7.190 1.00 0.00 C ATOM 0 H ALA A 103 -8.964 -2.109 9.126 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.088 -0.712 6.703 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.491 -0.154 6.521 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.231 -1.908 6.679 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.789 -0.962 8.079 1.00 0.00 H new ATOM 1646 N PHE A 104 -8.760 0.726 9.560 1.00 0.00 N ATOM 1647 CA PHE A 104 -8.658 1.978 10.299 1.00 0.00 C ATOM 1648 C PHE A 104 -7.198 2.389 10.474 1.00 0.00 C ATOM 1649 O PHE A 104 -6.809 3.502 10.119 1.00 0.00 O ATOM 1650 CB PHE A 104 -9.328 1.843 11.668 1.00 0.00 C ATOM 1651 CG PHE A 104 -9.644 3.162 12.313 1.00 0.00 C ATOM 1652 CD1 PHE A 104 -10.773 3.876 11.944 1.00 0.00 C ATOM 1653 CD2 PHE A 104 -8.813 3.688 13.289 1.00 0.00 C ATOM 1654 CE1 PHE A 104 -11.067 5.090 12.536 1.00 0.00 C ATOM 1655 CE2 PHE A 104 -9.102 4.901 13.885 1.00 0.00 C ATOM 1656 CZ PHE A 104 -10.230 5.603 13.507 1.00 0.00 C ATOM 0 H PHE A 104 -8.981 -0.087 10.136 1.00 0.00 H new ATOM 0 HA PHE A 104 -9.169 2.751 9.726 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -10.250 1.271 11.558 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -8.675 1.272 12.328 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -11.431 3.479 11.185 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.929 3.144 13.587 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.950 5.636 12.239 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.447 5.300 14.645 1.00 0.00 H new ATOM 0 HZ PHE A 104 -10.457 6.552 13.970 1.00 0.00 H new ATOM 1666 N ASP A 105 -6.397 1.483 11.023 1.00 0.00 N ATOM 1667 CA ASP A 105 -4.980 1.750 11.244 1.00 0.00 C ATOM 1668 C ASP A 105 -4.413 2.631 10.135 1.00 0.00 C ATOM 1669 O ASP A 105 -3.634 3.549 10.395 1.00 0.00 O ATOM 1670 CB ASP A 105 -4.198 0.437 11.320 1.00 0.00 C ATOM 1671 CG ASP A 105 -4.327 -0.387 10.054 1.00 0.00 C ATOM 1672 OD1 ASP A 105 -5.314 -0.189 9.314 1.00 0.00 O ATOM 1673 OD2 ASP A 105 -3.440 -1.229 9.803 1.00 0.00 O ATOM 0 H ASP A 105 -6.704 0.558 11.323 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.879 2.280 12.191 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -3.146 0.654 11.503 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -4.555 -0.147 12.168 1.00 0.00 H new ATOM 1678 N LEU A 106 -4.808 2.345 8.900 1.00 0.00 N ATOM 1679 CA LEU A 106 -4.339 3.111 7.750 1.00 0.00 C ATOM 1680 C LEU A 106 -5.098 4.429 7.627 1.00 0.00 C ATOM 1681 O LEU A 106 -4.503 5.481 7.393 1.00 0.00 O ATOM 1682 CB LEU A 106 -4.501 2.294 6.467 1.00 0.00 C ATOM 1683 CG LEU A 106 -3.920 2.916 5.197 1.00 0.00 C ATOM 1684 CD1 LEU A 106 -2.431 2.623 5.093 1.00 0.00 C ATOM 1685 CD2 LEU A 106 -4.653 2.402 3.967 1.00 0.00 C ATOM 0 H LEU A 106 -5.452 1.588 8.669 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.283 3.334 7.900 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.033 1.321 6.618 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -5.564 2.115 6.306 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.055 3.996 5.250 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.034 3.073 4.183 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -1.917 3.041 5.959 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.274 1.545 5.063 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.226 2.856 3.073 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.550 1.318 3.909 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.709 2.663 4.037 1.00 0.00 H new ATOM 1697 N PHE A 107 -6.415 4.364 7.788 1.00 0.00 N ATOM 1698 CA PHE A 107 -7.256 5.552 7.696 1.00 0.00 C ATOM 1699 C PHE A 107 -6.777 6.633 8.660 1.00 0.00 C ATOM 1700 O PHE A 107 -6.547 7.776 8.264 1.00 0.00 O ATOM 1701 CB PHE A 107 -8.714 5.195 7.995 1.00 0.00 C ATOM 1702 CG PHE A 107 -9.674 6.317 7.719 1.00 0.00 C ATOM 1703 CD1 PHE A 107 -9.732 6.904 6.466 1.00 0.00 C ATOM 1704 CD2 PHE A 107 -10.519 6.783 8.713 1.00 0.00 C ATOM 1705 CE1 PHE A 107 -10.614 7.937 6.210 1.00 0.00 C ATOM 1706 CE2 PHE A 107 -11.403 7.816 8.463 1.00 0.00 C ATOM 1707 CZ PHE A 107 -11.452 8.393 7.210 1.00 0.00 C ATOM 0 H PHE A 107 -6.923 3.501 7.983 1.00 0.00 H new ATOM 0 HA PHE A 107 -7.185 5.939 6.680 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -8.998 4.329 7.397 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -8.801 4.902 9.041 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -9.081 6.551 5.680 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -10.487 6.334 9.695 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -10.648 8.388 5.229 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -12.055 8.171 9.247 1.00 0.00 H new ATOM 0 HZ PHE A 107 -12.143 9.199 7.012 1.00 0.00 H new ATOM 1717 N ASP A 108 -6.630 6.264 9.928 1.00 0.00 N ATOM 1718 CA ASP A 108 -6.179 7.201 10.950 1.00 0.00 C ATOM 1719 C ASP A 108 -4.659 7.169 11.082 1.00 0.00 C ATOM 1720 O ASP A 108 -4.102 7.640 12.074 1.00 0.00 O ATOM 1721 CB ASP A 108 -6.828 6.873 12.295 1.00 0.00 C ATOM 1722 CG ASP A 108 -8.149 7.590 12.491 1.00 0.00 C ATOM 1723 OD1 ASP A 108 -8.934 7.660 11.523 1.00 0.00 O ATOM 1724 OD2 ASP A 108 -8.397 8.082 13.612 1.00 0.00 O ATOM 0 H ASP A 108 -6.817 5.322 10.272 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.479 8.204 10.647 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.988 5.797 12.365 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.146 7.147 13.100 1.00 0.00 H new ATOM 1729 N VAL A 109 -3.994 6.610 10.076 1.00 0.00 N ATOM 1730 CA VAL A 109 -2.539 6.517 10.081 1.00 0.00 C ATOM 1731 C VAL A 109 -2.018 6.120 11.457 1.00 0.00 C ATOM 1732 O VAL A 109 -0.969 6.593 11.895 1.00 0.00 O ATOM 1733 CB VAL A 109 -1.890 7.850 9.663 1.00 0.00 C ATOM 1734 CG1 VAL A 109 -0.378 7.705 9.578 1.00 0.00 C ATOM 1735 CG2 VAL A 109 -2.463 8.329 8.338 1.00 0.00 C ATOM 0 H VAL A 109 -4.439 6.215 9.248 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.269 5.747 9.358 1.00 0.00 H new ATOM 0 HB VAL A 109 -2.117 8.598 10.423 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.063 8.657 9.281 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.015 7.411 10.551 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.126 6.943 8.840 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.993 9.272 8.058 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.269 7.584 7.567 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.538 8.475 8.438 1.00 0.00 H new ATOM 1745 N ARG A 110 -2.756 5.246 12.134 1.00 0.00 N ATOM 1746 CA ARG A 110 -2.369 4.785 13.461 1.00 0.00 C ATOM 1747 C ARG A 110 -0.999 4.113 13.425 1.00 0.00 C ATOM 1748 O ARG A 110 -0.092 4.490 14.168 1.00 0.00 O ATOM 1749 CB ARG A 110 -3.412 3.810 14.010 1.00 0.00 C ATOM 1750 CG ARG A 110 -4.818 4.385 14.055 1.00 0.00 C ATOM 1751 CD ARG A 110 -5.655 3.726 15.141 1.00 0.00 C ATOM 1752 NE ARG A 110 -5.272 4.178 16.476 1.00 0.00 N ATOM 1753 CZ ARG A 110 -5.910 3.818 17.584 1.00 0.00 C ATOM 1754 NH1 ARG A 110 -6.956 3.006 17.517 1.00 0.00 N ATOM 1755 NH2 ARG A 110 -5.502 4.270 18.763 1.00 0.00 N ATOM 0 H ARG A 110 -3.626 4.843 11.785 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.312 5.653 14.117 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -3.416 2.911 13.394 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -3.120 3.507 15.015 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.767 5.459 14.234 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -5.300 4.246 13.088 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.709 3.948 14.971 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -5.543 2.644 15.079 1.00 0.00 H new ATOM 0 HE ARG A 110 -4.471 4.804 16.562 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -7.273 2.656 16.613 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -7.444 2.731 18.370 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -4.698 4.895 18.819 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -5.993 3.993 19.613 1.00 0.00 H new ATOM 1769 N ASP A 111 -0.857 3.117 12.558 1.00 0.00 N ATOM 1770 CA ASP A 111 0.402 2.393 12.425 1.00 0.00 C ATOM 1771 C ASP A 111 0.664 2.022 10.968 1.00 0.00 C ATOM 1772 O ASP A 111 -0.070 1.228 10.378 1.00 0.00 O ATOM 1773 CB ASP A 111 0.384 1.133 13.290 1.00 0.00 C ATOM 1774 CG ASP A 111 -0.237 1.374 14.652 1.00 0.00 C ATOM 1775 OD1 ASP A 111 0.496 1.792 15.573 1.00 0.00 O ATOM 1776 OD2 ASP A 111 -1.456 1.146 14.797 1.00 0.00 O ATOM 0 H ASP A 111 -1.598 2.792 11.937 1.00 0.00 H new ATOM 0 HA ASP A 111 1.206 3.046 12.765 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.171 0.350 12.774 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.403 0.769 13.418 1.00 0.00 H new ATOM 1781 N PHE A 112 1.713 2.601 10.394 1.00 0.00 N ATOM 1782 CA PHE A 112 2.070 2.333 9.006 1.00 0.00 C ATOM 1783 C PHE A 112 2.919 1.070 8.898 1.00 0.00 C ATOM 1784 O PHE A 112 2.744 0.268 7.982 1.00 0.00 O ATOM 1785 CB PHE A 112 2.827 3.523 8.413 1.00 0.00 C ATOM 1786 CG PHE A 112 2.954 3.467 6.918 1.00 0.00 C ATOM 1787 CD1 PHE A 112 1.826 3.426 6.114 1.00 0.00 C ATOM 1788 CD2 PHE A 112 4.202 3.457 6.315 1.00 0.00 C ATOM 1789 CE1 PHE A 112 1.940 3.374 4.738 1.00 0.00 C ATOM 1790 CE2 PHE A 112 4.322 3.406 4.939 1.00 0.00 C ATOM 1791 CZ PHE A 112 3.189 3.365 4.149 1.00 0.00 C ATOM 0 H PHE A 112 2.331 3.259 10.869 1.00 0.00 H new ATOM 0 HA PHE A 112 1.149 2.180 8.443 1.00 0.00 H new ATOM 0 HB2 PHE A 112 2.316 4.444 8.692 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.823 3.566 8.853 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.846 3.435 6.568 1.00 0.00 H new ATOM 0 HD2 PHE A 112 5.091 3.489 6.927 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.053 3.340 4.123 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.300 3.398 4.482 1.00 0.00 H new ATOM 0 HZ PHE A 112 3.280 3.326 3.074 1.00 0.00 H new ATOM 1801 N GLY A 113 3.841 0.901 9.841 1.00 0.00 N ATOM 1802 CA GLY A 113 4.705 -0.265 9.834 1.00 0.00 C ATOM 1803 C GLY A 113 3.948 -1.545 9.539 1.00 0.00 C ATOM 1804 O GLY A 113 4.479 -2.458 8.905 1.00 0.00 O ATOM 0 H GLY A 113 4.005 1.551 10.610 1.00 0.00 H new ATOM 0 HA2 GLY A 113 5.488 -0.129 9.088 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.199 -0.353 10.802 1.00 0.00 H new ATOM 1808 N LYS A 114 2.705 -1.615 10.002 1.00 0.00 N ATOM 1809 CA LYS A 114 1.872 -2.793 9.786 1.00 0.00 C ATOM 1810 C LYS A 114 1.489 -2.926 8.316 1.00 0.00 C ATOM 1811 O LYS A 114 1.447 -4.030 7.772 1.00 0.00 O ATOM 1812 CB LYS A 114 0.610 -2.716 10.648 1.00 0.00 C ATOM 1813 CG LYS A 114 0.840 -3.105 12.098 1.00 0.00 C ATOM 1814 CD LYS A 114 -0.468 -3.180 12.869 1.00 0.00 C ATOM 1815 CE LYS A 114 -0.267 -3.784 14.250 1.00 0.00 C ATOM 1816 NZ LYS A 114 -1.511 -4.421 14.763 1.00 0.00 N ATOM 0 H LYS A 114 2.251 -0.869 10.530 1.00 0.00 H new ATOM 0 HA LYS A 114 2.448 -3.672 10.074 1.00 0.00 H new ATOM 0 HB2 LYS A 114 0.216 -1.700 10.611 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -0.152 -3.369 10.222 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.345 -4.070 12.141 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.501 -2.378 12.570 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.892 -2.181 12.966 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.187 -3.779 12.310 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.531 -4.526 14.209 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.055 -3.007 14.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -1.333 -4.821 15.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.266 -3.708 14.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.805 -5.180 14.115 1.00 0.00 H new ATOM 1830 N VAL A 115 1.212 -1.794 7.676 1.00 0.00 N ATOM 1831 CA VAL A 115 0.834 -1.784 6.268 1.00 0.00 C ATOM 1832 C VAL A 115 2.018 -2.151 5.379 1.00 0.00 C ATOM 1833 O VAL A 115 1.869 -2.885 4.402 1.00 0.00 O ATOM 1834 CB VAL A 115 0.294 -0.406 5.841 1.00 0.00 C ATOM 1835 CG1 VAL A 115 -0.205 -0.450 4.405 1.00 0.00 C ATOM 1836 CG2 VAL A 115 -0.810 0.048 6.784 1.00 0.00 C ATOM 0 H VAL A 115 1.242 -0.872 8.111 1.00 0.00 H new ATOM 0 HA VAL A 115 0.047 -2.528 6.146 1.00 0.00 H new ATOM 0 HB VAL A 115 1.108 0.317 5.896 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.583 0.532 4.121 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.615 -0.729 3.743 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.005 -1.185 4.320 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.180 1.023 6.468 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -1.626 -0.674 6.763 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.416 0.121 7.798 1.00 0.00 H new ATOM 1846 N ILE A 116 3.192 -1.636 5.726 1.00 0.00 N ATOM 1847 CA ILE A 116 4.402 -1.911 4.961 1.00 0.00 C ATOM 1848 C ILE A 116 4.681 -3.409 4.892 1.00 0.00 C ATOM 1849 O ILE A 116 4.865 -3.967 3.811 1.00 0.00 O ATOM 1850 CB ILE A 116 5.626 -1.200 5.567 1.00 0.00 C ATOM 1851 CG1 ILE A 116 5.351 0.298 5.716 1.00 0.00 C ATOM 1852 CG2 ILE A 116 6.857 -1.434 4.704 1.00 0.00 C ATOM 1853 CD1 ILE A 116 6.472 1.054 6.392 1.00 0.00 C ATOM 0 H ILE A 116 3.331 -1.026 6.532 1.00 0.00 H new ATOM 0 HA ILE A 116 4.232 -1.529 3.955 1.00 0.00 H new ATOM 0 HB ILE A 116 5.816 -1.616 6.556 1.00 0.00 H new ATOM 0 HG12 ILE A 116 5.178 0.727 4.729 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.434 0.435 6.289 1.00 0.00 H new ATOM 0 HG21 ILE A 116 7.713 -0.925 5.146 1.00 0.00 H new ATOM 0 HG22 ILE A 116 7.062 -2.503 4.644 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.679 -1.042 3.703 1.00 0.00 H new ATOM 0 HD11 ILE A 116 6.208 2.109 6.463 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.631 0.651 7.392 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.386 0.947 5.808 1.00 0.00 H new ATOM 1865 N GLU A 117 4.709 -4.054 6.055 1.00 0.00 N ATOM 1866 CA GLU A 117 4.964 -5.488 6.126 1.00 0.00 C ATOM 1867 C GLU A 117 4.110 -6.243 5.112 1.00 0.00 C ATOM 1868 O GLU A 117 4.598 -7.126 4.406 1.00 0.00 O ATOM 1869 CB GLU A 117 4.681 -6.009 7.537 1.00 0.00 C ATOM 1870 CG GLU A 117 5.242 -7.397 7.796 1.00 0.00 C ATOM 1871 CD GLU A 117 4.311 -8.499 7.330 1.00 0.00 C ATOM 1872 OE1 GLU A 117 3.085 -8.261 7.288 1.00 0.00 O ATOM 1873 OE2 GLU A 117 4.807 -9.598 7.007 1.00 0.00 O ATOM 0 H GLU A 117 4.558 -3.607 6.959 1.00 0.00 H new ATOM 0 HA GLU A 117 6.014 -5.657 5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 117 5.103 -5.314 8.263 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.603 -6.025 7.700 1.00 0.00 H new ATOM 0 HG2 GLU A 117 6.201 -7.498 7.288 1.00 0.00 H new ATOM 0 HG3 GLU A 117 5.433 -7.514 8.863 1.00 0.00 H new ATOM 1880 N THR A 118 2.830 -5.891 5.045 1.00 0.00 N ATOM 1881 CA THR A 118 1.907 -6.536 4.120 1.00 0.00 C ATOM 1882 C THR A 118 2.499 -6.614 2.718 1.00 0.00 C ATOM 1883 O THR A 118 2.478 -7.669 2.082 1.00 0.00 O ATOM 1884 CB THR A 118 0.562 -5.787 4.056 1.00 0.00 C ATOM 1885 OG1 THR A 118 0.036 -5.611 5.376 1.00 0.00 O ATOM 1886 CG2 THR A 118 -0.441 -6.549 3.203 1.00 0.00 C ATOM 0 H THR A 118 2.409 -5.162 5.621 1.00 0.00 H new ATOM 0 HA THR A 118 1.736 -7.545 4.496 1.00 0.00 H new ATOM 0 HB THR A 118 0.736 -4.812 3.601 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.085 -4.664 5.624 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.383 -6.001 3.172 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.051 -6.656 2.191 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.609 -7.536 3.634 1.00 0.00 H new ATOM 1894 N LEU A 119 3.027 -5.493 2.240 1.00 0.00 N ATOM 1895 CA LEU A 119 3.627 -5.436 0.912 1.00 0.00 C ATOM 1896 C LEU A 119 4.781 -6.426 0.792 1.00 0.00 C ATOM 1897 O LEU A 119 4.908 -7.128 -0.212 1.00 0.00 O ATOM 1898 CB LEU A 119 4.123 -4.019 0.616 1.00 0.00 C ATOM 1899 CG LEU A 119 3.157 -2.884 0.958 1.00 0.00 C ATOM 1900 CD1 LEU A 119 3.829 -1.534 0.763 1.00 0.00 C ATOM 1901 CD2 LEU A 119 1.897 -2.983 0.110 1.00 0.00 C ATOM 0 H LEU A 119 3.052 -4.611 2.752 1.00 0.00 H new ATOM 0 HA LEU A 119 2.863 -5.707 0.183 1.00 0.00 H new ATOM 0 HB2 LEU A 119 5.050 -3.858 1.166 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.366 -3.955 -0.445 1.00 0.00 H new ATOM 0 HG LEU A 119 2.874 -2.977 2.006 1.00 0.00 H new ATOM 0 HD11 LEU A 119 3.126 -0.739 1.011 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.701 -1.464 1.414 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.142 -1.430 -0.276 1.00 0.00 H new ATOM 0 HD21 LEU A 119 1.221 -2.168 0.367 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.162 -2.916 -0.945 1.00 0.00 H new ATOM 0 HD23 LEU A 119 1.404 -3.936 0.300 1.00 0.00 H new ATOM 1913 N SER A 120 5.618 -6.479 1.823 1.00 0.00 N ATOM 1914 CA SER A 120 6.763 -7.383 1.832 1.00 0.00 C ATOM 1915 C SER A 120 6.333 -8.808 1.497 1.00 0.00 C ATOM 1916 O SER A 120 7.000 -9.506 0.734 1.00 0.00 O ATOM 1917 CB SER A 120 7.451 -7.353 3.198 1.00 0.00 C ATOM 1918 OG SER A 120 8.522 -8.280 3.250 1.00 0.00 O ATOM 0 H SER A 120 5.525 -5.907 2.663 1.00 0.00 H new ATOM 0 HA SER A 120 7.467 -7.047 1.071 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.825 -6.349 3.398 1.00 0.00 H new ATOM 0 HB3 SER A 120 6.727 -7.585 3.979 1.00 0.00 H new ATOM 0 HG SER A 120 8.357 -8.931 3.963 1.00 0.00 H new ATOM 1924 N ARG A 121 5.213 -9.232 2.074 1.00 0.00 N ATOM 1925 CA ARG A 121 4.694 -10.574 1.839 1.00 0.00 C ATOM 1926 C ARG A 121 4.050 -10.673 0.459 1.00 0.00 C ATOM 1927 O ARG A 121 4.050 -11.737 -0.162 1.00 0.00 O ATOM 1928 CB ARG A 121 3.674 -10.945 2.917 1.00 0.00 C ATOM 1929 CG ARG A 121 4.283 -11.118 4.299 1.00 0.00 C ATOM 1930 CD ARG A 121 3.327 -11.828 5.245 1.00 0.00 C ATOM 1931 NE ARG A 121 3.417 -13.281 5.126 1.00 0.00 N ATOM 1932 CZ ARG A 121 3.056 -14.120 6.090 1.00 0.00 C ATOM 1933 NH1 ARG A 121 2.583 -13.654 7.237 1.00 0.00 N ATOM 1934 NH2 ARG A 121 3.168 -15.430 5.907 1.00 0.00 N ATOM 0 H ARG A 121 4.648 -8.666 2.707 1.00 0.00 H new ATOM 0 HA ARG A 121 5.529 -11.273 1.883 1.00 0.00 H new ATOM 0 HB2 ARG A 121 2.907 -10.171 2.961 1.00 0.00 H new ATOM 0 HB3 ARG A 121 3.176 -11.871 2.630 1.00 0.00 H new ATOM 0 HG2 ARG A 121 5.209 -11.688 4.221 1.00 0.00 H new ATOM 0 HG3 ARG A 121 4.543 -10.142 4.708 1.00 0.00 H new ATOM 0 HD2 ARG A 121 3.548 -11.534 6.271 1.00 0.00 H new ATOM 0 HD3 ARG A 121 2.306 -11.510 5.035 1.00 0.00 H new ATOM 0 HE ARG A 121 3.777 -13.672 4.255 1.00 0.00 H new ATOM 0 HH11 ARG A 121 2.495 -12.648 7.381 1.00 0.00 H new ATOM 0 HH12 ARG A 121 2.307 -14.301 7.975 1.00 0.00 H new ATOM 0 HH21 ARG A 121 3.532 -15.793 5.026 1.00 0.00 H new ATOM 0 HH22 ARG A 121 2.891 -16.074 6.648 1.00 0.00 H new ATOM 1948 N LEU A 122 3.503 -9.559 -0.014 1.00 0.00 N ATOM 1949 CA LEU A 122 2.855 -9.521 -1.321 1.00 0.00 C ATOM 1950 C LEU A 122 3.880 -9.669 -2.441 1.00 0.00 C ATOM 1951 O LEU A 122 3.754 -10.543 -3.299 1.00 0.00 O ATOM 1952 CB LEU A 122 2.084 -8.211 -1.491 1.00 0.00 C ATOM 1953 CG LEU A 122 1.605 -7.893 -2.908 1.00 0.00 C ATOM 1954 CD1 LEU A 122 0.500 -8.851 -3.326 1.00 0.00 C ATOM 1955 CD2 LEU A 122 1.125 -6.452 -2.998 1.00 0.00 C ATOM 0 H LEU A 122 3.495 -8.671 0.487 1.00 0.00 H new ATOM 0 HA LEU A 122 2.158 -10.357 -1.378 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.216 -8.236 -0.832 1.00 0.00 H new ATOM 0 HB3 LEU A 122 2.719 -7.392 -1.151 1.00 0.00 H new ATOM 0 HG LEU A 122 2.445 -8.019 -3.591 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.172 -8.609 -4.337 1.00 0.00 H new ATOM 0 HD12 LEU A 122 0.876 -9.874 -3.302 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.341 -8.758 -2.639 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.788 -6.244 -4.013 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.299 -6.299 -2.303 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.944 -5.779 -2.742 1.00 0.00 H new ATOM 1967 N SER A 123 4.896 -8.812 -2.425 1.00 0.00 N ATOM 1968 CA SER A 123 5.942 -8.847 -3.440 1.00 0.00 C ATOM 1969 C SER A 123 6.370 -10.282 -3.730 1.00 0.00 C ATOM 1970 O SER A 123 6.526 -10.674 -4.887 1.00 0.00 O ATOM 1971 CB SER A 123 7.149 -8.024 -2.987 1.00 0.00 C ATOM 1972 OG SER A 123 7.922 -8.734 -2.035 1.00 0.00 O ATOM 0 H SER A 123 5.017 -8.085 -1.720 1.00 0.00 H new ATOM 0 HA SER A 123 5.540 -8.415 -4.356 1.00 0.00 H new ATOM 0 HB2 SER A 123 7.767 -7.775 -3.849 1.00 0.00 H new ATOM 0 HB3 SER A 123 6.810 -7.082 -2.555 1.00 0.00 H new ATOM 0 HG SER A 123 7.393 -8.872 -1.222 1.00 0.00 H new ATOM 1978 N ARG A 124 6.559 -11.062 -2.670 1.00 0.00 N ATOM 1979 CA ARG A 124 6.970 -12.454 -2.809 1.00 0.00 C ATOM 1980 C ARG A 124 6.140 -13.162 -3.876 1.00 0.00 C ATOM 1981 O ARG A 124 6.666 -13.941 -4.672 1.00 0.00 O ATOM 1982 CB ARG A 124 6.833 -13.185 -1.472 1.00 0.00 C ATOM 1983 CG ARG A 124 7.918 -12.828 -0.469 1.00 0.00 C ATOM 1984 CD ARG A 124 9.168 -13.668 -0.679 1.00 0.00 C ATOM 1985 NE ARG A 124 8.912 -15.091 -0.472 1.00 0.00 N ATOM 1986 CZ ARG A 124 9.868 -15.983 -0.236 1.00 0.00 C ATOM 1987 NH1 ARG A 124 11.136 -15.601 -0.177 1.00 0.00 N ATOM 1988 NH2 ARG A 124 9.556 -17.261 -0.059 1.00 0.00 N ATOM 0 H ARG A 124 6.434 -10.753 -1.706 1.00 0.00 H new ATOM 0 HA ARG A 124 8.015 -12.469 -3.117 1.00 0.00 H new ATOM 0 HB2 ARG A 124 5.860 -12.954 -1.039 1.00 0.00 H new ATOM 0 HB3 ARG A 124 6.855 -14.260 -1.651 1.00 0.00 H new ATOM 0 HG2 ARG A 124 8.168 -11.771 -0.563 1.00 0.00 H new ATOM 0 HG3 ARG A 124 7.543 -12.978 0.543 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.545 -13.511 -1.690 1.00 0.00 H new ATOM 0 HD3 ARG A 124 9.947 -13.336 0.007 1.00 0.00 H new ATOM 0 HE ARG A 124 7.947 -15.418 -0.511 1.00 0.00 H new ATOM 0 HH11 ARG A 124 11.380 -14.620 -0.313 1.00 0.00 H new ATOM 0 HH12 ARG A 124 11.868 -16.288 0.004 1.00 0.00 H new ATOM 0 HH21 ARG A 124 8.582 -17.559 -0.104 1.00 0.00 H new ATOM 0 HH22 ARG A 124 10.291 -17.945 0.122 1.00 0.00 H new ATOM 2002 N THR A 125 4.840 -12.887 -3.886 1.00 0.00 N ATOM 2003 CA THR A 125 3.937 -13.498 -4.853 1.00 0.00 C ATOM 2004 C THR A 125 4.577 -13.571 -6.234 1.00 0.00 C ATOM 2005 O THR A 125 5.412 -12.745 -6.602 1.00 0.00 O ATOM 2006 CB THR A 125 2.612 -12.719 -4.955 1.00 0.00 C ATOM 2007 OG1 THR A 125 2.860 -11.388 -5.420 1.00 0.00 O ATOM 2008 CG2 THR A 125 1.909 -12.668 -3.606 1.00 0.00 C ATOM 0 H THR A 125 4.389 -12.245 -3.235 1.00 0.00 H new ATOM 0 HA THR A 125 3.730 -14.507 -4.497 1.00 0.00 H new ATOM 0 HB THR A 125 1.966 -13.236 -5.664 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.911 -10.778 -4.654 1.00 0.00 H new ATOM 0 HG21 THR A 125 0.976 -12.113 -3.703 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.695 -13.682 -3.269 1.00 0.00 H new ATOM 0 HG23 THR A 125 2.552 -12.172 -2.879 1.00 0.00 H new ATOM 2016 N PRO A 126 4.179 -14.583 -7.019 1.00 0.00 N ATOM 2017 CA PRO A 126 4.702 -14.787 -8.374 1.00 0.00 C ATOM 2018 C PRO A 126 4.224 -13.715 -9.347 1.00 0.00 C ATOM 2019 O PRO A 126 4.684 -13.650 -10.487 1.00 0.00 O ATOM 2020 CB PRO A 126 4.140 -16.155 -8.768 1.00 0.00 C ATOM 2021 CG PRO A 126 2.909 -16.312 -7.944 1.00 0.00 C ATOM 2022 CD PRO A 126 3.188 -15.606 -6.646 1.00 0.00 C ATOM 0 HA PRO A 126 5.790 -14.733 -8.404 1.00 0.00 H new ATOM 0 HB2 PRO A 126 3.911 -16.197 -9.833 1.00 0.00 H new ATOM 0 HB3 PRO A 126 4.857 -16.951 -8.564 1.00 0.00 H new ATOM 0 HG2 PRO A 126 2.045 -15.878 -8.447 1.00 0.00 H new ATOM 0 HG3 PRO A 126 2.684 -17.365 -7.775 1.00 0.00 H new ATOM 0 HD2 PRO A 126 2.285 -15.158 -6.230 1.00 0.00 H new ATOM 0 HD3 PRO A 126 3.580 -16.290 -5.893 1.00 0.00 H new ATOM 2030 N ILE A 127 3.301 -12.876 -8.889 1.00 0.00 N ATOM 2031 CA ILE A 127 2.763 -11.805 -9.720 1.00 0.00 C ATOM 2032 C ILE A 127 3.636 -10.557 -9.640 1.00 0.00 C ATOM 2033 O ILE A 127 3.866 -9.884 -10.644 1.00 0.00 O ATOM 2034 CB ILE A 127 1.325 -11.440 -9.306 1.00 0.00 C ATOM 2035 CG1 ILE A 127 0.412 -12.663 -9.421 1.00 0.00 C ATOM 2036 CG2 ILE A 127 0.801 -10.298 -10.164 1.00 0.00 C ATOM 2037 CD1 ILE A 127 0.355 -13.495 -8.159 1.00 0.00 C ATOM 0 H ILE A 127 2.910 -12.917 -7.948 1.00 0.00 H new ATOM 0 HA ILE A 127 2.754 -12.174 -10.745 1.00 0.00 H new ATOM 0 HB ILE A 127 1.333 -11.113 -8.266 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.595 -12.332 -9.674 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.758 -13.289 -10.244 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.216 -10.051 -9.860 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.440 -9.424 -10.036 1.00 0.00 H new ATOM 0 HG23 ILE A 127 0.803 -10.599 -11.212 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.310 -14.344 -8.313 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.354 -13.856 -7.916 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.020 -12.885 -7.337 1.00 0.00 H new ATOM 2049 N ALA A 128 4.119 -10.255 -8.440 1.00 0.00 N ATOM 2050 CA ALA A 128 4.970 -9.090 -8.230 1.00 0.00 C ATOM 2051 C ALA A 128 6.334 -9.282 -8.883 1.00 0.00 C ATOM 2052 O ALA A 128 6.858 -8.373 -9.529 1.00 0.00 O ATOM 2053 CB ALA A 128 5.129 -8.814 -6.742 1.00 0.00 C ATOM 0 H ALA A 128 3.936 -10.801 -7.598 1.00 0.00 H new ATOM 0 HA ALA A 128 4.490 -8.231 -8.698 1.00 0.00 H new ATOM 0 HB1 ALA A 128 5.767 -7.942 -6.600 1.00 0.00 H new ATOM 0 HB2 ALA A 128 4.151 -8.624 -6.301 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.584 -9.678 -6.258 1.00 0.00 H new ATOM 2059 N LEU A 129 6.906 -10.468 -8.710 1.00 0.00 N ATOM 2060 CA LEU A 129 8.212 -10.779 -9.282 1.00 0.00 C ATOM 2061 C LEU A 129 8.125 -10.905 -10.800 1.00 0.00 C ATOM 2062 O LEU A 129 9.041 -10.508 -11.519 1.00 0.00 O ATOM 2063 CB LEU A 129 8.758 -12.076 -8.683 1.00 0.00 C ATOM 2064 CG LEU A 129 8.789 -12.148 -7.155 1.00 0.00 C ATOM 2065 CD1 LEU A 129 9.192 -13.540 -6.695 1.00 0.00 C ATOM 2066 CD2 LEU A 129 9.738 -11.101 -6.591 1.00 0.00 C ATOM 0 H LEU A 129 6.486 -11.231 -8.178 1.00 0.00 H new ATOM 0 HA LEU A 129 8.891 -9.961 -9.041 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.156 -12.906 -9.054 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.772 -12.226 -9.055 1.00 0.00 H new ATOM 0 HG LEU A 129 7.787 -11.940 -6.780 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.209 -13.573 -5.606 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.473 -14.269 -7.069 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.184 -13.778 -7.080 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.747 -11.167 -5.503 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.743 -11.277 -6.974 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.404 -10.108 -6.892 1.00 0.00 H new ATOM 2078 N ALA A 130 7.015 -11.457 -11.281 1.00 0.00 N ATOM 2079 CA ALA A 130 6.807 -11.630 -12.713 1.00 0.00 C ATOM 2080 C ALA A 130 7.253 -10.394 -13.486 1.00 0.00 C ATOM 2081 O ALA A 130 7.970 -10.497 -14.482 1.00 0.00 O ATOM 2082 CB ALA A 130 5.344 -11.936 -13.000 1.00 0.00 C ATOM 0 H ALA A 130 6.247 -11.792 -10.700 1.00 0.00 H new ATOM 0 HA ALA A 130 7.415 -12.472 -13.045 1.00 0.00 H new ATOM 0 HB1 ALA A 130 5.203 -12.063 -14.073 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.056 -12.853 -12.485 1.00 0.00 H new ATOM 0 HB3 ALA A 130 4.724 -11.112 -12.647 1.00 0.00 H new ATOM 2088 N THR A 131 6.824 -9.225 -13.023 1.00 0.00 N ATOM 2089 CA THR A 131 7.178 -7.969 -13.672 1.00 0.00 C ATOM 2090 C THR A 131 8.691 -7.807 -13.769 1.00 0.00 C ATOM 2091 O THR A 131 9.206 -7.272 -14.750 1.00 0.00 O ATOM 2092 CB THR A 131 6.591 -6.761 -12.917 1.00 0.00 C ATOM 2093 OG1 THR A 131 7.212 -6.637 -11.633 1.00 0.00 O ATOM 2094 CG2 THR A 131 5.087 -6.909 -12.746 1.00 0.00 C ATOM 0 H THR A 131 6.230 -9.122 -12.200 1.00 0.00 H new ATOM 0 HA THR A 131 6.754 -8.002 -14.676 1.00 0.00 H new ATOM 0 HB THR A 131 6.788 -5.863 -13.503 1.00 0.00 H new ATOM 0 HG1 THR A 131 6.925 -7.377 -11.058 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.695 -6.044 -12.210 1.00 0.00 H new ATOM 0 HG22 THR A 131 4.614 -6.974 -13.726 1.00 0.00 H new ATOM 0 HG23 THR A 131 4.873 -7.815 -12.179 1.00 0.00 H new ATOM 2102 N GLY A 132 9.398 -8.273 -12.744 1.00 0.00 N ATOM 2103 CA GLY A 132 10.846 -8.171 -12.734 1.00 0.00 C ATOM 2104 C GLY A 132 11.338 -6.996 -11.912 1.00 0.00 C ATOM 2105 O GLY A 132 12.447 -6.504 -12.124 1.00 0.00 O ATOM 0 H GLY A 132 8.994 -8.719 -11.920 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.269 -9.093 -12.335 1.00 0.00 H new ATOM 0 HA3 GLY A 132 11.207 -8.071 -13.758 1.00 0.00 H new ATOM 2109 N ILE A 133 10.513 -6.546 -10.973 1.00 0.00 N ATOM 2110 CA ILE A 133 10.871 -5.422 -10.118 1.00 0.00 C ATOM 2111 C ILE A 133 11.703 -5.881 -8.925 1.00 0.00 C ATOM 2112 O ILE A 133 11.410 -6.906 -8.309 1.00 0.00 O ATOM 2113 CB ILE A 133 9.621 -4.685 -9.603 1.00 0.00 C ATOM 2114 CG1 ILE A 133 8.771 -4.195 -10.778 1.00 0.00 C ATOM 2115 CG2 ILE A 133 10.022 -3.520 -8.711 1.00 0.00 C ATOM 2116 CD1 ILE A 133 7.351 -3.844 -10.392 1.00 0.00 C ATOM 0 H ILE A 133 9.592 -6.943 -10.785 1.00 0.00 H new ATOM 0 HA ILE A 133 11.461 -4.738 -10.728 1.00 0.00 H new ATOM 0 HB ILE A 133 9.025 -5.381 -9.012 1.00 0.00 H new ATOM 0 HG12 ILE A 133 9.246 -3.319 -11.219 1.00 0.00 H new ATOM 0 HG13 ILE A 133 8.750 -4.967 -11.547 1.00 0.00 H new ATOM 0 HG21 ILE A 133 9.127 -3.009 -8.355 1.00 0.00 H new ATOM 0 HG22 ILE A 133 10.590 -3.893 -7.859 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.637 -2.822 -9.279 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.808 -3.505 -11.274 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.858 -4.724 -9.978 1.00 0.00 H new ATOM 0 HD13 ILE A 133 7.363 -3.050 -9.645 1.00 0.00 H new ATOM 2128 N ARG A 134 12.740 -5.116 -8.604 1.00 0.00 N ATOM 2129 CA ARG A 134 13.615 -5.444 -7.484 1.00 0.00 C ATOM 2130 C ARG A 134 12.800 -5.780 -6.239 1.00 0.00 C ATOM 2131 O ARG A 134 12.083 -4.942 -5.691 1.00 0.00 O ATOM 2132 CB ARG A 134 14.560 -4.278 -7.189 1.00 0.00 C ATOM 2133 CG ARG A 134 15.667 -4.117 -8.218 1.00 0.00 C ATOM 2134 CD ARG A 134 16.566 -2.934 -7.888 1.00 0.00 C ATOM 2135 NE ARG A 134 17.533 -3.256 -6.843 1.00 0.00 N ATOM 2136 CZ ARG A 134 18.115 -2.343 -6.074 1.00 0.00 C ATOM 2137 NH1 ARG A 134 17.830 -1.058 -6.233 1.00 0.00 N ATOM 2138 NH2 ARG A 134 18.985 -2.714 -5.143 1.00 0.00 N ATOM 0 H ARG A 134 12.996 -4.264 -9.103 1.00 0.00 H new ATOM 0 HA ARG A 134 14.204 -6.319 -7.759 1.00 0.00 H new ATOM 0 HB2 ARG A 134 13.982 -3.355 -7.142 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.008 -4.424 -6.206 1.00 0.00 H new ATOM 0 HG2 ARG A 134 16.263 -5.029 -8.258 1.00 0.00 H new ATOM 0 HG3 ARG A 134 15.229 -3.978 -9.207 1.00 0.00 H new ATOM 0 HD2 ARG A 134 17.096 -2.619 -8.787 1.00 0.00 H new ATOM 0 HD3 ARG A 134 15.953 -2.091 -7.568 1.00 0.00 H new ATOM 0 HE ARG A 134 17.775 -4.236 -6.695 1.00 0.00 H new ATOM 0 HH11 ARG A 134 17.162 -0.768 -6.947 1.00 0.00 H new ATOM 0 HH12 ARG A 134 18.279 -0.359 -5.641 1.00 0.00 H new ATOM 0 HH21 ARG A 134 19.207 -3.701 -5.017 1.00 0.00 H new ATOM 0 HH22 ARG A 134 19.431 -2.012 -4.553 1.00 0.00 H new ATOM 2152 N PRO A 135 12.910 -7.035 -5.780 1.00 0.00 N ATOM 2153 CA PRO A 135 12.191 -7.511 -4.594 1.00 0.00 C ATOM 2154 C PRO A 135 12.721 -6.890 -3.307 1.00 0.00 C ATOM 2155 O PRO A 135 13.929 -6.714 -3.142 1.00 0.00 O ATOM 2156 CB PRO A 135 12.448 -9.020 -4.605 1.00 0.00 C ATOM 2157 CG PRO A 135 13.728 -9.181 -5.351 1.00 0.00 C ATOM 2158 CD PRO A 135 13.746 -8.087 -6.383 1.00 0.00 C ATOM 0 HA PRO A 135 11.134 -7.245 -4.624 1.00 0.00 H new ATOM 0 HB2 PRO A 135 12.528 -9.415 -3.592 1.00 0.00 H new ATOM 0 HB3 PRO A 135 11.635 -9.557 -5.094 1.00 0.00 H new ATOM 0 HG2 PRO A 135 14.583 -9.099 -4.680 1.00 0.00 H new ATOM 0 HG3 PRO A 135 13.785 -10.163 -5.822 1.00 0.00 H new ATOM 0 HD2 PRO A 135 14.759 -7.734 -6.576 1.00 0.00 H new ATOM 0 HD3 PRO A 135 13.339 -8.427 -7.336 1.00 0.00 H new ATOM 2166 N PHE A 136 11.812 -6.560 -2.396 1.00 0.00 N ATOM 2167 CA PHE A 136 12.188 -5.957 -1.122 1.00 0.00 C ATOM 2168 C PHE A 136 11.484 -6.654 0.038 1.00 0.00 C ATOM 2169 O PHE A 136 10.256 -6.709 0.110 1.00 0.00 O ATOM 2170 CB PHE A 136 11.847 -4.466 -1.119 1.00 0.00 C ATOM 2171 CG PHE A 136 10.465 -4.168 -0.612 1.00 0.00 C ATOM 2172 CD1 PHE A 136 9.371 -4.246 -1.458 1.00 0.00 C ATOM 2173 CD2 PHE A 136 10.261 -3.809 0.711 1.00 0.00 C ATOM 2174 CE1 PHE A 136 8.098 -3.972 -0.994 1.00 0.00 C ATOM 2175 CE2 PHE A 136 8.990 -3.534 1.181 1.00 0.00 C ATOM 2176 CZ PHE A 136 7.908 -3.616 0.327 1.00 0.00 C ATOM 0 H PHE A 136 10.809 -6.700 -2.516 1.00 0.00 H new ATOM 0 HA PHE A 136 13.264 -6.076 -0.995 1.00 0.00 H new ATOM 0 HB2 PHE A 136 12.573 -3.937 -0.503 1.00 0.00 H new ATOM 0 HB3 PHE A 136 11.945 -4.077 -2.132 1.00 0.00 H new ATOM 0 HD1 PHE A 136 9.514 -4.524 -2.492 1.00 0.00 H new ATOM 0 HD2 PHE A 136 11.104 -3.743 1.382 1.00 0.00 H new ATOM 0 HE1 PHE A 136 7.253 -4.036 -1.664 1.00 0.00 H new ATOM 0 HE2 PHE A 136 8.844 -3.256 2.214 1.00 0.00 H new ATOM 0 HZ PHE A 136 6.914 -3.402 0.692 1.00 0.00 H new ATOM 2186 N PRO A 137 12.279 -7.200 0.970 1.00 0.00 N ATOM 2187 CA PRO A 137 11.755 -7.904 2.144 1.00 0.00 C ATOM 2188 C PRO A 137 11.082 -6.959 3.133 1.00 0.00 C ATOM 2189 O PRO A 137 10.788 -5.809 2.806 1.00 0.00 O ATOM 2190 CB PRO A 137 13.004 -8.530 2.769 1.00 0.00 C ATOM 2191 CG PRO A 137 14.129 -7.663 2.320 1.00 0.00 C ATOM 2192 CD PRO A 137 13.751 -7.173 0.949 1.00 0.00 C ATOM 0 HA PRO A 137 10.987 -8.629 1.875 1.00 0.00 H new ATOM 0 HB2 PRO A 137 12.933 -8.554 3.856 1.00 0.00 H new ATOM 0 HB3 PRO A 137 13.140 -9.559 2.436 1.00 0.00 H new ATOM 0 HG2 PRO A 137 14.277 -6.829 3.006 1.00 0.00 H new ATOM 0 HG3 PRO A 137 15.065 -8.221 2.291 1.00 0.00 H new ATOM 0 HD2 PRO A 137 14.132 -6.169 0.762 1.00 0.00 H new ATOM 0 HD3 PRO A 137 14.153 -7.817 0.167 1.00 0.00 H new ATOM 2200 N SER A 138 10.840 -7.451 4.344 1.00 0.00 N ATOM 2201 CA SER A 138 10.197 -6.650 5.380 1.00 0.00 C ATOM 2202 C SER A 138 11.178 -5.644 5.975 1.00 0.00 C ATOM 2203 O SER A 138 10.949 -4.436 5.930 1.00 0.00 O ATOM 2204 CB SER A 138 9.644 -7.554 6.484 1.00 0.00 C ATOM 2205 OG SER A 138 8.767 -6.840 7.336 1.00 0.00 O ATOM 0 H SER A 138 11.079 -8.400 4.632 1.00 0.00 H new ATOM 0 HA SER A 138 9.373 -6.102 4.922 1.00 0.00 H new ATOM 0 HB2 SER A 138 9.116 -8.397 6.038 1.00 0.00 H new ATOM 0 HB3 SER A 138 10.467 -7.966 7.067 1.00 0.00 H new ATOM 0 HG SER A 138 8.426 -7.440 8.032 1.00 0.00 H new ATOM 2211 N GLY A 139 12.272 -6.153 6.534 1.00 0.00 N ATOM 2212 CA GLY A 139 13.272 -5.286 7.131 1.00 0.00 C ATOM 2213 C GLY A 139 14.662 -5.543 6.585 1.00 0.00 C ATOM 2214 O GLY A 139 14.870 -6.418 5.744 1.00 0.00 O ATOM 0 H GLY A 139 12.484 -7.150 6.584 1.00 0.00 H new ATOM 0 HA2 GLY A 139 13.001 -4.246 6.951 1.00 0.00 H new ATOM 0 HA3 GLY A 139 13.277 -5.432 8.211 1.00 0.00 H new ATOM 2218 N PRO A 140 15.644 -4.768 7.068 1.00 0.00 N ATOM 2219 CA PRO A 140 17.039 -4.896 6.636 1.00 0.00 C ATOM 2220 C PRO A 140 17.682 -6.187 7.131 1.00 0.00 C ATOM 2221 O PRO A 140 18.863 -6.438 6.887 1.00 0.00 O ATOM 2222 CB PRO A 140 17.721 -3.682 7.271 1.00 0.00 C ATOM 2223 CG PRO A 140 16.879 -3.351 8.455 1.00 0.00 C ATOM 2224 CD PRO A 140 15.468 -3.705 8.073 1.00 0.00 C ATOM 0 HA PRO A 140 17.127 -4.932 5.550 1.00 0.00 H new ATOM 0 HB2 PRO A 140 18.745 -3.912 7.565 1.00 0.00 H new ATOM 0 HB3 PRO A 140 17.770 -2.846 6.574 1.00 0.00 H new ATOM 0 HG2 PRO A 140 17.199 -3.915 9.331 1.00 0.00 H new ATOM 0 HG3 PRO A 140 16.961 -2.294 8.709 1.00 0.00 H new ATOM 0 HD2 PRO A 140 14.895 -4.055 8.932 1.00 0.00 H new ATOM 0 HD3 PRO A 140 14.936 -2.847 7.662 1.00 0.00 H new ATOM 2232 N SER A 141 16.899 -7.004 7.828 1.00 0.00 N ATOM 2233 CA SER A 141 17.393 -8.268 8.360 1.00 0.00 C ATOM 2234 C SER A 141 16.911 -9.441 7.512 1.00 0.00 C ATOM 2235 O SER A 141 15.822 -9.401 6.940 1.00 0.00 O ATOM 2236 CB SER A 141 16.936 -8.450 9.809 1.00 0.00 C ATOM 2237 OG SER A 141 17.348 -7.359 10.614 1.00 0.00 O ATOM 0 H SER A 141 15.919 -6.813 8.037 1.00 0.00 H new ATOM 0 HA SER A 141 18.482 -8.244 8.330 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.850 -8.541 9.843 1.00 0.00 H new ATOM 0 HB3 SER A 141 17.346 -9.377 10.209 1.00 0.00 H new ATOM 0 HG SER A 141 17.042 -7.498 11.535 1.00 0.00 H new ATOM 2243 N SER A 142 17.731 -10.485 7.435 1.00 0.00 N ATOM 2244 CA SER A 142 17.390 -11.668 6.654 1.00 0.00 C ATOM 2245 C SER A 142 17.394 -12.917 7.530 1.00 0.00 C ATOM 2246 O SER A 142 16.494 -13.751 7.445 1.00 0.00 O ATOM 2247 CB SER A 142 18.375 -11.841 5.496 1.00 0.00 C ATOM 2248 OG SER A 142 17.774 -12.530 4.414 1.00 0.00 O ATOM 0 H SER A 142 18.635 -10.535 7.904 1.00 0.00 H new ATOM 0 HA SER A 142 16.386 -11.531 6.251 1.00 0.00 H new ATOM 0 HB2 SER A 142 18.722 -10.864 5.161 1.00 0.00 H new ATOM 0 HB3 SER A 142 19.252 -12.390 5.839 1.00 0.00 H new ATOM 0 HG SER A 142 18.423 -12.626 3.686 1.00 0.00 H new ATOM 2254 N GLY A 143 18.415 -13.038 8.373 1.00 0.00 N ATOM 2255 CA GLY A 143 18.518 -14.187 9.253 1.00 0.00 C ATOM 2256 C GLY A 143 19.956 -14.591 9.514 1.00 0.00 C ATOM 2257 O GLY A 143 20.446 -15.568 8.947 1.00 0.00 O ATOM 0 H GLY A 143 19.172 -12.361 8.462 1.00 0.00 H new ATOM 0 HA2 GLY A 143 18.030 -13.960 10.201 1.00 0.00 H new ATOM 0 HA3 GLY A 143 17.982 -15.028 8.812 1.00 0.00 H new TER 2261 GLY A 143