USER MOD reduce.3.24.130724 H: found=0, std=0, add=906, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 904 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 76 GLN : amide:sc= 0.176 K(o=-0.25,f=-4.1!) USER MOD Set 1.2: A 77 ASN : amide:sc= -0.425 X(o=-0.25,f=-0.29) USER MOD Set 2.1: A 30 ASN : amide:sc= -2.13! C(o=-4.2!,f=-5.7!) USER MOD Set 2.2: A 33 SER OG : rot -165:sc= -2.06! USER MOD Single : A 1 GLY N :NH3+ -112:sc= 0.0284 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 51:sc= 0.588 USER MOD Single : A 5 SER OG : rot 180:sc=-0.00215 USER MOD Single : A 6 SER OG : rot 28:sc= 0.345! USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.062 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 66:sc= 1.22 USER MOD Single : A 24 ASN : amide:sc= -2.36 X(o=-2.4,f=-1.9) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -1.89 K(o=-1.9,f=-0.86) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 140:sc= -0.59 (180deg=-2.53!) USER MOD Single : A 45 THR OG1 : rot 59:sc= 0.572 USER MOD Single : A 46 LYS NZ :NH3+ -131:sc=-0.00428 (180deg=-0.785) USER MOD Single : A 47 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 HIS : no HD1:sc= -6.46! K(o=-6.5!,f=-4.7) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.09) USER MOD Single : A 63 SER OG : rot 180:sc= -0.19 USER MOD Single : A 67 SER OG : rot 29:sc= 0.953 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.0888 K(o=-0.089,f=-2!) USER MOD Single : A 88 HIS : no HD1:sc= -2.37 K(o=-2.4,f=-2.9!) USER MOD Single : A 89 ASN : amide:sc= -2.27 K(o=-2.3,f=0.23!) USER MOD Single : A 91 THR OG1 : rot 32:sc= 0.156 USER MOD Single : A 92 CYS SG : rot 36:sc= 0.828 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 170:sc= -0.734 USER MOD Single : A 108 SER OG : rot 130:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= -2.52! K(o=-2.5!,f=-0.9) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -22.154 14.098 -22.652 1.00 0.00 N ATOM 2 CA GLY A 1 -21.527 15.381 -22.394 1.00 0.00 C ATOM 3 C GLY A 1 -20.095 15.240 -21.917 1.00 0.00 C ATOM 4 O GLY A 1 -19.739 14.246 -21.284 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.324 13.994 -23.673 1.00 0.00 H new ATOM 0 H2 GLY A 1 -21.529 13.334 -22.325 1.00 0.00 H new ATOM 0 H3 GLY A 1 -23.060 14.046 -22.143 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.546 15.981 -23.304 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -22.105 15.920 -21.644 1.00 0.00 H new ATOM 8 N SER A 2 -19.271 16.237 -22.222 1.00 0.00 N ATOM 9 CA SER A 2 -17.868 16.218 -21.825 1.00 0.00 C ATOM 10 C SER A 2 -17.658 17.000 -20.532 1.00 0.00 C ATOM 11 O SER A 2 -17.003 16.524 -19.605 1.00 0.00 O ATOM 12 CB SER A 2 -16.993 16.803 -22.936 1.00 0.00 C ATOM 13 OG SER A 2 -17.138 16.069 -24.139 1.00 0.00 O ATOM 0 H SER A 2 -19.551 17.068 -22.743 1.00 0.00 H new ATOM 0 HA SER A 2 -17.579 15.181 -21.653 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.265 17.845 -23.107 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.949 16.793 -22.624 1.00 0.00 H new ATOM 0 HG SER A 2 -16.570 16.464 -24.833 1.00 0.00 H new ATOM 19 N SER A 3 -18.220 18.203 -20.478 1.00 0.00 N ATOM 20 CA SER A 3 -18.092 19.054 -19.301 1.00 0.00 C ATOM 21 C SER A 3 -18.721 18.391 -18.080 1.00 0.00 C ATOM 22 O SER A 3 -19.902 18.584 -17.793 1.00 0.00 O ATOM 23 CB SER A 3 -18.750 20.412 -19.553 1.00 0.00 C ATOM 24 OG SER A 3 -20.106 20.258 -19.936 1.00 0.00 O ATOM 0 H SER A 3 -18.768 18.610 -21.235 1.00 0.00 H new ATOM 0 HA SER A 3 -17.030 19.203 -19.105 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.690 21.022 -18.651 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.206 20.944 -20.334 1.00 0.00 H new ATOM 0 HG SER A 3 -20.565 19.680 -19.291 1.00 0.00 H new ATOM 30 N GLY A 4 -17.922 17.605 -17.363 1.00 0.00 N ATOM 31 CA GLY A 4 -18.417 16.924 -16.181 1.00 0.00 C ATOM 32 C GLY A 4 -18.200 17.728 -14.915 1.00 0.00 C ATOM 33 O GLY A 4 -17.062 17.990 -14.526 1.00 0.00 O ATOM 0 H GLY A 4 -16.941 17.428 -17.580 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.481 16.722 -16.301 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.918 15.960 -16.085 1.00 0.00 H new ATOM 37 N SER A 5 -19.294 18.122 -14.270 1.00 0.00 N ATOM 38 CA SER A 5 -19.217 18.905 -13.043 1.00 0.00 C ATOM 39 C SER A 5 -19.828 18.142 -11.872 1.00 0.00 C ATOM 40 O SER A 5 -20.404 17.068 -12.049 1.00 0.00 O ATOM 41 CB SER A 5 -19.934 20.245 -13.223 1.00 0.00 C ATOM 42 OG SER A 5 -19.542 21.171 -12.225 1.00 0.00 O ATOM 0 H SER A 5 -20.244 17.912 -14.577 1.00 0.00 H new ATOM 0 HA SER A 5 -18.165 19.090 -12.824 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.709 20.652 -14.209 1.00 0.00 H new ATOM 0 HB3 SER A 5 -21.012 20.093 -13.179 1.00 0.00 H new ATOM 0 HG SER A 5 -20.013 22.019 -12.363 1.00 0.00 H new ATOM 48 N SER A 6 -19.699 18.705 -10.675 1.00 0.00 N ATOM 49 CA SER A 6 -20.234 18.076 -9.473 1.00 0.00 C ATOM 50 C SER A 6 -21.616 17.486 -9.738 1.00 0.00 C ATOM 51 O SER A 6 -22.518 18.176 -10.212 1.00 0.00 O ATOM 52 CB SER A 6 -20.312 19.092 -8.332 1.00 0.00 C ATOM 53 OG SER A 6 -21.366 20.016 -8.543 1.00 0.00 O ATOM 0 H SER A 6 -19.229 19.595 -10.512 1.00 0.00 H new ATOM 0 HA SER A 6 -19.561 17.268 -9.186 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.465 18.571 -7.387 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.366 19.627 -8.252 1.00 0.00 H new ATOM 0 HG SER A 6 -22.067 19.595 -9.083 1.00 0.00 H new ATOM 59 N GLY A 7 -21.774 16.202 -9.429 1.00 0.00 N ATOM 60 CA GLY A 7 -23.047 15.539 -9.640 1.00 0.00 C ATOM 61 C GLY A 7 -23.455 14.677 -8.462 1.00 0.00 C ATOM 62 O GLY A 7 -24.489 14.916 -7.839 1.00 0.00 O ATOM 0 H GLY A 7 -21.042 15.610 -9.036 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -23.817 16.288 -9.822 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.987 14.920 -10.535 1.00 0.00 H new ATOM 66 N TRP A 8 -22.642 13.673 -8.157 1.00 0.00 N ATOM 67 CA TRP A 8 -22.925 12.771 -7.046 1.00 0.00 C ATOM 68 C TRP A 8 -22.271 13.268 -5.761 1.00 0.00 C ATOM 69 O TRP A 8 -21.292 14.015 -5.801 1.00 0.00 O ATOM 70 CB TRP A 8 -22.433 11.359 -7.370 1.00 0.00 C ATOM 71 CG TRP A 8 -23.379 10.585 -8.236 1.00 0.00 C ATOM 72 CD1 TRP A 8 -24.266 9.629 -7.830 1.00 0.00 C ATOM 73 CD2 TRP A 8 -23.532 10.700 -9.655 1.00 0.00 C ATOM 74 NE1 TRP A 8 -24.961 9.142 -8.912 1.00 0.00 N ATOM 75 CE2 TRP A 8 -24.529 9.784 -10.043 1.00 0.00 C ATOM 76 CE3 TRP A 8 -22.925 11.489 -10.636 1.00 0.00 C ATOM 77 CZ2 TRP A 8 -24.930 9.636 -11.368 1.00 0.00 C ATOM 78 CZ3 TRP A 8 -23.323 11.341 -11.951 1.00 0.00 C ATOM 79 CH2 TRP A 8 -24.319 10.422 -12.307 1.00 0.00 C ATOM 0 H TRP A 8 -21.782 13.462 -8.663 1.00 0.00 H new ATOM 0 HA TRP A 8 -24.004 12.747 -6.896 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -21.466 11.424 -7.869 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -22.275 10.814 -6.439 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -24.402 9.303 -6.809 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -25.681 8.420 -8.878 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -22.158 12.202 -10.371 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -25.696 8.926 -11.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -22.859 11.944 -12.717 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -24.610 10.332 -13.343 1.00 0.00 H new ATOM 90 N ILE A 9 -22.817 12.849 -4.624 1.00 0.00 N ATOM 91 CA ILE A 9 -22.284 13.252 -3.329 1.00 0.00 C ATOM 92 C ILE A 9 -22.157 12.056 -2.391 1.00 0.00 C ATOM 93 O ILE A 9 -23.121 11.320 -2.171 1.00 0.00 O ATOM 94 CB ILE A 9 -23.172 14.320 -2.663 1.00 0.00 C ATOM 95 CG1 ILE A 9 -23.179 15.602 -3.498 1.00 0.00 C ATOM 96 CG2 ILE A 9 -22.687 14.605 -1.249 1.00 0.00 C ATOM 97 CD1 ILE A 9 -24.092 16.676 -2.949 1.00 0.00 C ATOM 0 H ILE A 9 -23.627 12.231 -4.574 1.00 0.00 H new ATOM 0 HA ILE A 9 -21.296 13.675 -3.512 1.00 0.00 H new ATOM 0 HB ILE A 9 -24.192 13.940 -2.607 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -22.164 15.994 -3.555 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -23.486 15.361 -4.516 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -23.324 15.362 -0.791 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -22.729 13.690 -0.659 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -21.660 14.968 -1.283 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -24.046 17.556 -3.591 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -25.115 16.302 -2.918 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -23.773 16.945 -1.942 1.00 0.00 H new ATOM 109 N LEU A 10 -20.963 11.868 -1.840 1.00 0.00 N ATOM 110 CA LEU A 10 -20.710 10.762 -0.923 1.00 0.00 C ATOM 111 C LEU A 10 -20.990 11.173 0.518 1.00 0.00 C ATOM 112 O LEU A 10 -20.466 12.177 1.001 1.00 0.00 O ATOM 113 CB LEU A 10 -19.262 10.285 -1.057 1.00 0.00 C ATOM 114 CG LEU A 10 -18.785 9.287 -0.001 1.00 0.00 C ATOM 115 CD1 LEU A 10 -19.588 7.998 -0.083 1.00 0.00 C ATOM 116 CD2 LEU A 10 -17.299 9.003 -0.169 1.00 0.00 C ATOM 0 H LEU A 10 -20.155 12.467 -2.012 1.00 0.00 H new ATOM 0 HA LEU A 10 -21.382 9.945 -1.184 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -19.140 9.830 -2.040 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -18.609 11.157 -1.026 1.00 0.00 H new ATOM 0 HG LEU A 10 -18.942 9.727 0.984 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -19.234 7.300 0.676 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -20.643 8.215 0.087 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -19.463 7.554 -1.071 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -16.976 8.291 0.591 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -17.118 8.584 -1.159 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -16.737 9.930 -0.059 1.00 0.00 H new ATOM 128 N ALA A 11 -21.819 10.391 1.201 1.00 0.00 N ATOM 129 CA ALA A 11 -22.166 10.672 2.589 1.00 0.00 C ATOM 130 C ALA A 11 -21.208 9.972 3.547 1.00 0.00 C ATOM 131 O ALA A 11 -21.230 8.748 3.677 1.00 0.00 O ATOM 132 CB ALA A 11 -23.601 10.248 2.870 1.00 0.00 C ATOM 0 H ALA A 11 -22.263 9.557 0.816 1.00 0.00 H new ATOM 0 HA ALA A 11 -22.078 11.746 2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -23.847 10.463 3.910 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -24.278 10.798 2.216 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -23.707 9.179 2.686 1.00 0.00 H new ATOM 138 N SER A 12 -20.368 10.756 4.214 1.00 0.00 N ATOM 139 CA SER A 12 -19.399 10.211 5.157 1.00 0.00 C ATOM 140 C SER A 12 -19.259 11.116 6.377 1.00 0.00 C ATOM 141 O SER A 12 -19.874 12.180 6.450 1.00 0.00 O ATOM 142 CB SER A 12 -18.039 10.035 4.479 1.00 0.00 C ATOM 143 OG SER A 12 -17.508 11.284 4.071 1.00 0.00 O ATOM 0 H SER A 12 -20.339 11.771 4.119 1.00 0.00 H new ATOM 0 HA SER A 12 -19.760 9.238 5.489 1.00 0.00 H new ATOM 0 HB2 SER A 12 -17.347 9.549 5.166 1.00 0.00 H new ATOM 0 HB3 SER A 12 -18.142 9.380 3.614 1.00 0.00 H new ATOM 0 HG SER A 12 -16.638 11.145 3.642 1.00 0.00 H new ATOM 149 N THR A 13 -18.443 10.686 7.335 1.00 0.00 N ATOM 150 CA THR A 13 -18.222 11.456 8.553 1.00 0.00 C ATOM 151 C THR A 13 -16.740 11.751 8.754 1.00 0.00 C ATOM 152 O THR A 13 -15.879 11.096 8.166 1.00 0.00 O ATOM 153 CB THR A 13 -18.759 10.714 9.791 1.00 0.00 C ATOM 154 OG1 THR A 13 -18.626 11.541 10.953 1.00 0.00 O ATOM 155 CG2 THR A 13 -18.012 9.406 10.005 1.00 0.00 C ATOM 0 H THR A 13 -17.924 9.809 7.291 1.00 0.00 H new ATOM 0 HA THR A 13 -18.764 12.394 8.438 1.00 0.00 H new ATOM 0 HB THR A 13 -19.812 10.489 9.624 1.00 0.00 H new ATOM 0 HG1 THR A 13 -18.971 11.063 11.736 1.00 0.00 H new ATOM 0 HG21 THR A 13 -18.409 8.900 10.885 1.00 0.00 H new ATOM 0 HG22 THR A 13 -18.139 8.767 9.131 1.00 0.00 H new ATOM 0 HG23 THR A 13 -16.952 9.612 10.153 1.00 0.00 H new ATOM 163 N THR A 14 -16.447 12.743 9.590 1.00 0.00 N ATOM 164 CA THR A 14 -15.069 13.126 9.869 1.00 0.00 C ATOM 165 C THR A 14 -14.592 12.538 11.191 1.00 0.00 C ATOM 166 O THR A 14 -13.398 12.543 11.488 1.00 0.00 O ATOM 167 CB THR A 14 -14.910 14.658 9.914 1.00 0.00 C ATOM 168 OG1 THR A 14 -15.623 15.257 8.826 1.00 0.00 O ATOM 169 CG2 THR A 14 -13.442 15.051 9.842 1.00 0.00 C ATOM 0 H THR A 14 -17.147 13.296 10.086 1.00 0.00 H new ATOM 0 HA THR A 14 -14.460 12.729 9.057 1.00 0.00 H new ATOM 0 HB THR A 14 -15.321 15.017 10.858 1.00 0.00 H new ATOM 0 HG1 THR A 14 -15.518 16.231 8.863 1.00 0.00 H new ATOM 0 HG21 THR A 14 -13.354 16.137 9.875 1.00 0.00 H new ATOM 0 HG22 THR A 14 -12.907 14.618 10.687 1.00 0.00 H new ATOM 0 HG23 THR A 14 -13.011 14.680 8.912 1.00 0.00 H new ATOM 177 N GLU A 15 -15.533 12.032 11.982 1.00 0.00 N ATOM 178 CA GLU A 15 -15.206 11.440 13.274 1.00 0.00 C ATOM 179 C GLU A 15 -15.364 9.922 13.233 1.00 0.00 C ATOM 180 O GLU A 15 -16.451 9.407 12.973 1.00 0.00 O ATOM 181 CB GLU A 15 -16.099 12.027 14.370 1.00 0.00 C ATOM 182 CG GLU A 15 -15.552 13.306 14.980 1.00 0.00 C ATOM 183 CD GLU A 15 -15.596 14.477 14.017 1.00 0.00 C ATOM 184 OE1 GLU A 15 -16.710 14.945 13.702 1.00 0.00 O ATOM 185 OE2 GLU A 15 -14.516 14.925 13.578 1.00 0.00 O ATOM 0 H GLU A 15 -16.526 12.020 11.751 1.00 0.00 H new ATOM 0 HA GLU A 15 -14.165 11.674 13.499 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.087 12.226 13.954 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -16.228 11.285 15.158 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -16.126 13.553 15.873 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -14.523 13.141 15.299 1.00 0.00 H new ATOM 192 N GLY A 16 -14.270 9.212 13.492 1.00 0.00 N ATOM 193 CA GLY A 16 -14.308 7.761 13.479 1.00 0.00 C ATOM 194 C GLY A 16 -13.207 7.161 12.627 1.00 0.00 C ATOM 195 O GLY A 16 -12.160 6.768 13.141 1.00 0.00 O ATOM 0 H GLY A 16 -13.359 9.615 13.710 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -14.217 7.389 14.499 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -15.276 7.429 13.103 1.00 0.00 H new ATOM 199 N ALA A 17 -13.444 7.087 11.322 1.00 0.00 N ATOM 200 CA ALA A 17 -12.464 6.530 10.397 1.00 0.00 C ATOM 201 C ALA A 17 -11.279 7.473 10.220 1.00 0.00 C ATOM 202 O ALA A 17 -11.395 8.690 10.369 1.00 0.00 O ATOM 203 CB ALA A 17 -13.114 6.238 9.053 1.00 0.00 C ATOM 0 H ALA A 17 -14.307 7.406 10.881 1.00 0.00 H new ATOM 0 HA ALA A 17 -12.092 5.596 10.819 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.371 5.823 8.372 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -13.923 5.521 9.188 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -13.514 7.161 8.634 1.00 0.00 H new ATOM 209 N PRO A 18 -10.110 6.901 9.896 1.00 0.00 N ATOM 210 CA PRO A 18 -8.880 7.673 9.692 1.00 0.00 C ATOM 211 C PRO A 18 -8.930 8.518 8.424 1.00 0.00 C ATOM 212 O PRO A 18 -8.554 8.060 7.345 1.00 0.00 O ATOM 213 CB PRO A 18 -7.800 6.594 9.573 1.00 0.00 C ATOM 214 CG PRO A 18 -8.525 5.384 9.095 1.00 0.00 C ATOM 215 CD PRO A 18 -9.899 5.456 9.703 1.00 0.00 C ATOM 0 HA PRO A 18 -8.706 8.383 10.500 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.020 6.891 8.872 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -7.315 6.412 10.532 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.581 5.367 8.007 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.010 4.474 9.402 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -10.653 5.024 9.045 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -9.950 4.913 10.647 1.00 0.00 H new ATOM 223 N SER A 19 -9.397 9.755 8.561 1.00 0.00 N ATOM 224 CA SER A 19 -9.499 10.664 7.425 1.00 0.00 C ATOM 225 C SER A 19 -8.139 11.270 7.090 1.00 0.00 C ATOM 226 O SER A 19 -8.027 12.469 6.833 1.00 0.00 O ATOM 227 CB SER A 19 -10.506 11.777 7.724 1.00 0.00 C ATOM 228 OG SER A 19 -9.883 12.865 8.384 1.00 0.00 O ATOM 0 H SER A 19 -9.711 10.151 9.447 1.00 0.00 H new ATOM 0 HA SER A 19 -9.845 10.092 6.564 1.00 0.00 H new ATOM 0 HB2 SER A 19 -10.958 12.122 6.794 1.00 0.00 H new ATOM 0 HB3 SER A 19 -11.312 11.385 8.344 1.00 0.00 H new ATOM 0 HG SER A 19 -9.242 13.292 7.778 1.00 0.00 H new ATOM 234 N VAL A 20 -7.107 10.432 7.096 1.00 0.00 N ATOM 235 CA VAL A 20 -5.755 10.883 6.792 1.00 0.00 C ATOM 236 C VAL A 20 -4.860 9.712 6.402 1.00 0.00 C ATOM 237 O VAL A 20 -5.219 8.551 6.596 1.00 0.00 O ATOM 238 CB VAL A 20 -5.126 11.619 7.990 1.00 0.00 C ATOM 239 CG1 VAL A 20 -5.774 12.981 8.180 1.00 0.00 C ATOM 240 CG2 VAL A 20 -5.247 10.780 9.253 1.00 0.00 C ATOM 0 H VAL A 20 -7.182 9.437 7.308 1.00 0.00 H new ATOM 0 HA VAL A 20 -5.833 11.573 5.952 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.067 11.774 7.784 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -5.317 13.486 9.031 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.630 13.581 7.282 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.841 12.854 8.364 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -4.798 11.315 10.090 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.299 10.592 9.466 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.731 9.831 9.110 1.00 0.00 H new ATOM 250 N ALA A 21 -3.691 10.025 5.851 1.00 0.00 N ATOM 251 CA ALA A 21 -2.743 8.999 5.436 1.00 0.00 C ATOM 252 C ALA A 21 -1.506 9.001 6.328 1.00 0.00 C ATOM 253 O ALA A 21 -1.282 9.920 7.117 1.00 0.00 O ATOM 254 CB ALA A 21 -2.347 9.203 3.981 1.00 0.00 C ATOM 0 H ALA A 21 -3.378 10.981 5.682 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.229 8.029 5.536 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.639 8.429 3.685 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -3.234 9.143 3.351 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.884 10.183 3.864 1.00 0.00 H new ATOM 260 N PRO A 22 -0.684 7.949 6.203 1.00 0.00 N ATOM 261 CA PRO A 22 0.545 7.807 6.991 1.00 0.00 C ATOM 262 C PRO A 22 1.614 8.815 6.585 1.00 0.00 C ATOM 263 O PRO A 22 1.542 9.413 5.510 1.00 0.00 O ATOM 264 CB PRO A 22 1.006 6.382 6.674 1.00 0.00 C ATOM 265 CG PRO A 22 0.422 6.083 5.336 1.00 0.00 C ATOM 266 CD PRO A 22 -0.889 6.818 5.283 1.00 0.00 C ATOM 0 HA PRO A 22 0.372 7.988 8.052 1.00 0.00 H new ATOM 0 HB2 PRO A 22 2.094 6.313 6.656 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.654 5.676 7.426 1.00 0.00 H new ATOM 0 HG2 PRO A 22 1.087 6.413 4.538 1.00 0.00 H new ATOM 0 HG3 PRO A 22 0.274 5.011 5.205 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -1.118 7.158 4.273 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -1.717 6.186 5.602 1.00 0.00 H new ATOM 274 N LEU A 23 2.605 9.000 7.449 1.00 0.00 N ATOM 275 CA LEU A 23 3.691 9.937 7.180 1.00 0.00 C ATOM 276 C LEU A 23 4.980 9.194 6.843 1.00 0.00 C ATOM 277 O LEU A 23 4.991 7.969 6.733 1.00 0.00 O ATOM 278 CB LEU A 23 3.915 10.848 8.388 1.00 0.00 C ATOM 279 CG LEU A 23 2.682 11.148 9.241 1.00 0.00 C ATOM 280 CD1 LEU A 23 2.470 10.055 10.276 1.00 0.00 C ATOM 281 CD2 LEU A 23 2.817 12.505 9.916 1.00 0.00 C ATOM 0 H LEU A 23 2.680 8.514 8.342 1.00 0.00 H new ATOM 0 HA LEU A 23 3.409 10.546 6.321 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.671 10.392 9.027 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.325 11.793 8.033 1.00 0.00 H new ATOM 0 HG LEU A 23 1.810 11.175 8.587 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.588 10.286 10.874 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.327 9.099 9.772 1.00 0.00 H new ATOM 0 HD13 LEU A 23 3.343 9.995 10.926 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.930 12.701 10.519 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.699 12.507 10.557 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.919 13.280 9.157 1.00 0.00 H new ATOM 293 N ASN A 24 6.064 9.945 6.682 1.00 0.00 N ATOM 294 CA ASN A 24 7.360 9.358 6.359 1.00 0.00 C ATOM 295 C ASN A 24 7.216 8.277 5.291 1.00 0.00 C ATOM 296 O ASN A 24 7.950 7.289 5.290 1.00 0.00 O ATOM 297 CB ASN A 24 8.002 8.767 7.616 1.00 0.00 C ATOM 298 CG ASN A 24 8.882 9.767 8.340 1.00 0.00 C ATOM 299 OD1 ASN A 24 10.062 9.512 8.583 1.00 0.00 O ATOM 300 ND2 ASN A 24 8.310 10.913 8.691 1.00 0.00 N ATOM 0 H ASN A 24 6.071 10.961 6.770 1.00 0.00 H new ATOM 0 HA ASN A 24 8.002 10.147 5.968 1.00 0.00 H new ATOM 0 HB2 ASN A 24 7.220 8.420 8.291 1.00 0.00 H new ATOM 0 HB3 ASN A 24 8.597 7.896 7.342 1.00 0.00 H new ATOM 0 HD21 ASN A 24 8.852 11.624 9.182 1.00 0.00 H new ATOM 0 HD22 ASN A 24 7.329 11.082 8.469 1.00 0.00 H new ATOM 307 N VAL A 25 6.266 8.474 4.383 1.00 0.00 N ATOM 308 CA VAL A 25 6.026 7.518 3.308 1.00 0.00 C ATOM 309 C VAL A 25 7.197 7.484 2.332 1.00 0.00 C ATOM 310 O VAL A 25 7.464 8.460 1.631 1.00 0.00 O ATOM 311 CB VAL A 25 4.737 7.854 2.535 1.00 0.00 C ATOM 312 CG1 VAL A 25 4.627 6.998 1.283 1.00 0.00 C ATOM 313 CG2 VAL A 25 3.518 7.668 3.426 1.00 0.00 C ATOM 0 H VAL A 25 5.650 9.287 4.370 1.00 0.00 H new ATOM 0 HA VAL A 25 5.916 6.539 3.774 1.00 0.00 H new ATOM 0 HB VAL A 25 4.779 8.899 2.229 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.710 7.249 0.750 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.485 7.185 0.638 1.00 0.00 H new ATOM 0 HG13 VAL A 25 4.607 5.945 1.563 1.00 0.00 H new ATOM 0 HG21 VAL A 25 2.616 7.910 2.864 1.00 0.00 H new ATOM 0 HG22 VAL A 25 3.469 6.633 3.764 1.00 0.00 H new ATOM 0 HG23 VAL A 25 3.595 8.328 4.290 1.00 0.00 H new ATOM 323 N THR A 26 7.893 6.352 2.291 1.00 0.00 N ATOM 324 CA THR A 26 9.036 6.190 1.402 1.00 0.00 C ATOM 325 C THR A 26 9.135 4.758 0.889 1.00 0.00 C ATOM 326 O THR A 26 8.595 3.832 1.495 1.00 0.00 O ATOM 327 CB THR A 26 10.354 6.563 2.107 1.00 0.00 C ATOM 328 OG1 THR A 26 10.423 5.924 3.386 1.00 0.00 O ATOM 329 CG2 THR A 26 10.468 8.070 2.280 1.00 0.00 C ATOM 0 H THR A 26 7.685 5.534 2.863 1.00 0.00 H new ATOM 0 HA THR A 26 8.879 6.865 0.560 1.00 0.00 H new ATOM 0 HB THR A 26 11.182 6.221 1.486 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.264 6.165 3.827 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.407 8.309 2.780 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.445 8.551 1.302 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.634 8.431 2.882 1.00 0.00 H new ATOM 337 N VAL A 27 9.829 4.582 -0.231 1.00 0.00 N ATOM 338 CA VAL A 27 10.000 3.261 -0.825 1.00 0.00 C ATOM 339 C VAL A 27 11.436 3.051 -1.293 1.00 0.00 C ATOM 340 O VAL A 27 11.967 3.840 -2.074 1.00 0.00 O ATOM 341 CB VAL A 27 9.047 3.054 -2.018 1.00 0.00 C ATOM 342 CG1 VAL A 27 9.170 1.638 -2.560 1.00 0.00 C ATOM 343 CG2 VAL A 27 7.613 3.356 -1.611 1.00 0.00 C ATOM 0 H VAL A 27 10.282 5.337 -0.745 1.00 0.00 H new ATOM 0 HA VAL A 27 9.763 2.532 -0.050 1.00 0.00 H new ATOM 0 HB VAL A 27 9.329 3.746 -2.811 1.00 0.00 H new ATOM 0 HG11 VAL A 27 8.490 1.510 -3.402 1.00 0.00 H new ATOM 0 HG12 VAL A 27 10.194 1.463 -2.891 1.00 0.00 H new ATOM 0 HG13 VAL A 27 8.915 0.925 -1.776 1.00 0.00 H new ATOM 0 HG21 VAL A 27 6.953 3.205 -2.465 1.00 0.00 H new ATOM 0 HG22 VAL A 27 7.317 2.690 -0.801 1.00 0.00 H new ATOM 0 HG23 VAL A 27 7.540 4.390 -1.275 1.00 0.00 H new ATOM 353 N PHE A 28 12.059 1.980 -0.811 1.00 0.00 N ATOM 354 CA PHE A 28 13.434 1.666 -1.180 1.00 0.00 C ATOM 355 C PHE A 28 13.479 0.512 -2.177 1.00 0.00 C ATOM 356 O PHE A 28 12.803 -0.502 -2.003 1.00 0.00 O ATOM 357 CB PHE A 28 14.249 1.310 0.065 1.00 0.00 C ATOM 358 CG PHE A 28 14.853 2.504 0.748 1.00 0.00 C ATOM 359 CD1 PHE A 28 14.063 3.363 1.496 1.00 0.00 C ATOM 360 CD2 PHE A 28 16.209 2.768 0.641 1.00 0.00 C ATOM 361 CE1 PHE A 28 14.615 4.463 2.126 1.00 0.00 C ATOM 362 CE2 PHE A 28 16.766 3.866 1.269 1.00 0.00 C ATOM 363 CZ PHE A 28 15.968 4.715 2.011 1.00 0.00 C ATOM 0 H PHE A 28 11.633 1.316 -0.164 1.00 0.00 H new ATOM 0 HA PHE A 28 13.868 2.548 -1.651 1.00 0.00 H new ATOM 0 HB2 PHE A 28 13.607 0.784 0.771 1.00 0.00 H new ATOM 0 HB3 PHE A 28 15.045 0.621 -0.217 1.00 0.00 H new ATOM 0 HD1 PHE A 28 13.004 3.171 1.588 1.00 0.00 H new ATOM 0 HD2 PHE A 28 16.837 2.109 0.061 1.00 0.00 H new ATOM 0 HE1 PHE A 28 13.989 5.124 2.707 1.00 0.00 H new ATOM 0 HE2 PHE A 28 17.825 4.060 1.180 1.00 0.00 H new ATOM 0 HZ PHE A 28 16.402 5.575 2.500 1.00 0.00 H new ATOM 373 N LEU A 29 14.281 0.675 -3.224 1.00 0.00 N ATOM 374 CA LEU A 29 14.415 -0.352 -4.252 1.00 0.00 C ATOM 375 C LEU A 29 15.738 -1.098 -4.106 1.00 0.00 C ATOM 376 O LEU A 29 16.787 -0.488 -3.904 1.00 0.00 O ATOM 377 CB LEU A 29 14.321 0.276 -5.644 1.00 0.00 C ATOM 378 CG LEU A 29 14.887 -0.556 -6.795 1.00 0.00 C ATOM 379 CD1 LEU A 29 13.883 -1.612 -7.234 1.00 0.00 C ATOM 380 CD2 LEU A 29 15.266 0.340 -7.965 1.00 0.00 C ATOM 0 H LEU A 29 14.848 1.508 -3.383 1.00 0.00 H new ATOM 0 HA LEU A 29 13.601 -1.066 -4.127 1.00 0.00 H new ATOM 0 HB2 LEU A 29 13.273 0.487 -5.856 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.841 1.234 -5.624 1.00 0.00 H new ATOM 0 HG LEU A 29 15.787 -1.062 -6.444 1.00 0.00 H new ATOM 0 HD11 LEU A 29 14.303 -2.195 -8.054 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.660 -2.273 -6.396 1.00 0.00 H new ATOM 0 HD13 LEU A 29 12.966 -1.126 -7.567 1.00 0.00 H new ATOM 0 HD21 LEU A 29 15.667 -0.269 -8.775 1.00 0.00 H new ATOM 0 HD22 LEU A 29 14.383 0.874 -8.316 1.00 0.00 H new ATOM 0 HD23 LEU A 29 16.020 1.058 -7.644 1.00 0.00 H new ATOM 392 N ASN A 30 15.679 -2.422 -4.213 1.00 0.00 N ATOM 393 CA ASN A 30 16.873 -3.251 -4.095 1.00 0.00 C ATOM 394 C ASN A 30 17.367 -3.692 -5.469 1.00 0.00 C ATOM 395 O ASN A 30 16.639 -4.338 -6.223 1.00 0.00 O ATOM 396 CB ASN A 30 16.583 -4.478 -3.227 1.00 0.00 C ATOM 397 CG ASN A 30 17.850 -5.138 -2.718 1.00 0.00 C ATOM 398 OD1 ASN A 30 18.901 -5.062 -3.353 1.00 0.00 O ATOM 399 ND2 ASN A 30 17.754 -5.791 -1.565 1.00 0.00 N ATOM 0 H ASN A 30 14.818 -2.943 -4.381 1.00 0.00 H new ATOM 0 HA ASN A 30 17.654 -2.655 -3.622 1.00 0.00 H new ATOM 0 HB2 ASN A 30 15.965 -4.182 -2.379 1.00 0.00 H new ATOM 0 HB3 ASN A 30 16.007 -5.201 -3.805 1.00 0.00 H new ATOM 0 HD21 ASN A 30 18.573 -6.255 -1.172 1.00 0.00 H new ATOM 0 HD22 ASN A 30 16.862 -5.828 -1.073 1.00 0.00 H new ATOM 406 N GLU A 31 18.609 -3.339 -5.787 1.00 0.00 N ATOM 407 CA GLU A 31 19.199 -3.698 -7.071 1.00 0.00 C ATOM 408 C GLU A 31 19.706 -5.137 -7.053 1.00 0.00 C ATOM 409 O GLU A 31 19.663 -5.834 -8.067 1.00 0.00 O ATOM 410 CB GLU A 31 20.347 -2.746 -7.413 1.00 0.00 C ATOM 411 CG GLU A 31 19.890 -1.446 -8.053 1.00 0.00 C ATOM 412 CD GLU A 31 20.995 -0.410 -8.123 1.00 0.00 C ATOM 413 OE1 GLU A 31 21.429 0.069 -7.054 1.00 0.00 O ATOM 414 OE2 GLU A 31 21.426 -0.079 -9.247 1.00 0.00 O ATOM 0 H GLU A 31 19.225 -2.805 -5.174 1.00 0.00 H new ATOM 0 HA GLU A 31 18.426 -3.613 -7.834 1.00 0.00 H new ATOM 0 HB2 GLU A 31 20.902 -2.518 -6.503 1.00 0.00 H new ATOM 0 HB3 GLU A 31 21.037 -3.251 -8.089 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.524 -1.650 -9.059 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.053 -1.041 -7.485 1.00 0.00 H new ATOM 421 N SER A 32 20.185 -5.576 -5.893 1.00 0.00 N ATOM 422 CA SER A 32 20.704 -6.930 -5.744 1.00 0.00 C ATOM 423 C SER A 32 19.570 -7.924 -5.513 1.00 0.00 C ATOM 424 O SER A 32 19.743 -9.131 -5.682 1.00 0.00 O ATOM 425 CB SER A 32 21.696 -6.993 -4.581 1.00 0.00 C ATOM 426 OG SER A 32 22.825 -6.172 -4.828 1.00 0.00 O ATOM 0 H SER A 32 20.224 -5.013 -5.043 1.00 0.00 H new ATOM 0 HA SER A 32 21.218 -7.199 -6.667 1.00 0.00 H new ATOM 0 HB2 SER A 32 21.204 -6.674 -3.662 1.00 0.00 H new ATOM 0 HB3 SER A 32 22.018 -8.023 -4.429 1.00 0.00 H new ATOM 0 HG SER A 32 23.443 -6.228 -4.069 1.00 0.00 H new ATOM 432 N SER A 33 18.408 -7.407 -5.127 1.00 0.00 N ATOM 433 CA SER A 33 17.245 -8.248 -4.869 1.00 0.00 C ATOM 434 C SER A 33 16.055 -7.804 -5.715 1.00 0.00 C ATOM 435 O SER A 33 15.958 -6.641 -6.108 1.00 0.00 O ATOM 436 CB SER A 33 16.875 -8.204 -3.386 1.00 0.00 C ATOM 437 OG SER A 33 18.031 -8.075 -2.576 1.00 0.00 O ATOM 0 H SER A 33 18.247 -6.410 -4.986 1.00 0.00 H new ATOM 0 HA SER A 33 17.501 -9.272 -5.141 1.00 0.00 H new ATOM 0 HB2 SER A 33 16.202 -7.367 -3.201 1.00 0.00 H new ATOM 0 HB3 SER A 33 16.337 -9.112 -3.115 1.00 0.00 H new ATOM 0 HG SER A 33 17.804 -8.285 -1.646 1.00 0.00 H new ATOM 443 N ASP A 34 15.152 -8.738 -5.991 1.00 0.00 N ATOM 444 CA ASP A 34 13.967 -8.444 -6.789 1.00 0.00 C ATOM 445 C ASP A 34 12.780 -8.104 -5.893 1.00 0.00 C ATOM 446 O ASP A 34 11.705 -8.688 -6.023 1.00 0.00 O ATOM 447 CB ASP A 34 13.621 -9.634 -7.685 1.00 0.00 C ATOM 448 CG ASP A 34 14.678 -9.889 -8.742 1.00 0.00 C ATOM 449 OD1 ASP A 34 15.833 -9.456 -8.544 1.00 0.00 O ATOM 450 OD2 ASP A 34 14.350 -10.521 -9.768 1.00 0.00 O ATOM 0 H ASP A 34 15.218 -9.705 -5.674 1.00 0.00 H new ATOM 0 HA ASP A 34 14.186 -7.579 -7.416 1.00 0.00 H new ATOM 0 HB2 ASP A 34 13.504 -10.526 -7.070 1.00 0.00 H new ATOM 0 HB3 ASP A 34 12.662 -9.453 -8.170 1.00 0.00 H new ATOM 455 N ASN A 35 12.983 -7.156 -4.984 1.00 0.00 N ATOM 456 CA ASN A 35 11.930 -6.739 -4.066 1.00 0.00 C ATOM 457 C ASN A 35 12.066 -5.261 -3.716 1.00 0.00 C ATOM 458 O ASN A 35 13.149 -4.684 -3.820 1.00 0.00 O ATOM 459 CB ASN A 35 11.974 -7.583 -2.790 1.00 0.00 C ATOM 460 CG ASN A 35 13.391 -7.846 -2.320 1.00 0.00 C ATOM 461 OD1 ASN A 35 13.828 -8.995 -2.244 1.00 0.00 O ATOM 462 ND2 ASN A 35 14.116 -6.781 -2.001 1.00 0.00 N ATOM 0 H ASN A 35 13.867 -6.662 -4.864 1.00 0.00 H new ATOM 0 HA ASN A 35 10.971 -6.889 -4.561 1.00 0.00 H new ATOM 0 HB2 ASN A 35 11.421 -7.073 -2.001 1.00 0.00 H new ATOM 0 HB3 ASN A 35 11.471 -8.533 -2.969 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.076 -6.896 -1.678 1.00 0.00 H new ATOM 0 HD22 ASN A 35 13.713 -5.847 -2.079 1.00 0.00 H new ATOM 469 N VAL A 36 10.960 -4.652 -3.301 1.00 0.00 N ATOM 470 CA VAL A 36 10.956 -3.241 -2.934 1.00 0.00 C ATOM 471 C VAL A 36 10.532 -3.052 -1.482 1.00 0.00 C ATOM 472 O VAL A 36 9.490 -3.553 -1.058 1.00 0.00 O ATOM 473 CB VAL A 36 10.015 -2.427 -3.842 1.00 0.00 C ATOM 474 CG1 VAL A 36 10.237 -0.936 -3.643 1.00 0.00 C ATOM 475 CG2 VAL A 36 10.215 -2.815 -5.299 1.00 0.00 C ATOM 0 H VAL A 36 10.055 -5.114 -3.211 1.00 0.00 H new ATOM 0 HA VAL A 36 11.976 -2.878 -3.062 1.00 0.00 H new ATOM 0 HB VAL A 36 8.985 -2.655 -3.567 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.563 -0.378 -4.293 1.00 0.00 H new ATOM 0 HG12 VAL A 36 10.038 -0.674 -2.604 1.00 0.00 H new ATOM 0 HG13 VAL A 36 11.269 -0.686 -3.889 1.00 0.00 H new ATOM 0 HG21 VAL A 36 9.542 -2.230 -5.927 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.247 -2.617 -5.590 1.00 0.00 H new ATOM 0 HG23 VAL A 36 9.999 -3.876 -5.426 1.00 0.00 H new ATOM 485 N ASP A 37 11.345 -2.325 -0.724 1.00 0.00 N ATOM 486 CA ASP A 37 11.054 -2.067 0.682 1.00 0.00 C ATOM 487 C ASP A 37 10.209 -0.807 0.840 1.00 0.00 C ATOM 488 O ASP A 37 10.279 0.106 0.016 1.00 0.00 O ATOM 489 CB ASP A 37 12.353 -1.928 1.477 1.00 0.00 C ATOM 490 CG ASP A 37 13.031 -3.263 1.716 1.00 0.00 C ATOM 491 OD1 ASP A 37 12.920 -4.150 0.845 1.00 0.00 O ATOM 492 OD2 ASP A 37 13.674 -3.419 2.775 1.00 0.00 O ATOM 0 H ASP A 37 12.211 -1.904 -1.059 1.00 0.00 H new ATOM 0 HA ASP A 37 10.488 -2.913 1.071 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.035 -1.268 0.941 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.140 -1.455 2.436 1.00 0.00 H new ATOM 497 N ILE A 38 9.411 -0.765 1.902 1.00 0.00 N ATOM 498 CA ILE A 38 8.553 0.383 2.167 1.00 0.00 C ATOM 499 C ILE A 38 8.538 0.727 3.652 1.00 0.00 C ATOM 500 O ILE A 38 8.458 -0.158 4.504 1.00 0.00 O ATOM 501 CB ILE A 38 7.109 0.127 1.696 1.00 0.00 C ATOM 502 CG1 ILE A 38 7.096 -0.301 0.228 1.00 0.00 C ATOM 503 CG2 ILE A 38 6.257 1.371 1.899 1.00 0.00 C ATOM 504 CD1 ILE A 38 7.201 -1.798 0.033 1.00 0.00 C ATOM 0 H ILE A 38 9.341 -1.513 2.592 1.00 0.00 H new ATOM 0 HA ILE A 38 8.966 1.222 1.607 1.00 0.00 H new ATOM 0 HB ILE A 38 6.686 -0.681 2.293 1.00 0.00 H new ATOM 0 HG12 ILE A 38 6.176 0.054 -0.237 1.00 0.00 H new ATOM 0 HG13 ILE A 38 7.923 0.184 -0.291 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.239 1.174 1.561 1.00 0.00 H new ATOM 0 HG22 ILE A 38 6.244 1.634 2.957 1.00 0.00 H new ATOM 0 HG23 ILE A 38 6.676 2.197 1.325 1.00 0.00 H new ATOM 0 HD11 ILE A 38 7.186 -2.028 -1.032 1.00 0.00 H new ATOM 0 HD12 ILE A 38 8.134 -2.157 0.468 1.00 0.00 H new ATOM 0 HD13 ILE A 38 6.360 -2.289 0.522 1.00 0.00 H new ATOM 516 N ARG A 39 8.615 2.019 3.955 1.00 0.00 N ATOM 517 CA ARG A 39 8.610 2.480 5.338 1.00 0.00 C ATOM 518 C ARG A 39 7.699 3.693 5.503 1.00 0.00 C ATOM 519 O ARG A 39 7.770 4.645 4.726 1.00 0.00 O ATOM 520 CB ARG A 39 10.030 2.831 5.786 1.00 0.00 C ATOM 521 CG ARG A 39 10.099 3.424 7.184 1.00 0.00 C ATOM 522 CD ARG A 39 9.966 4.938 7.154 1.00 0.00 C ATOM 523 NE ARG A 39 10.236 5.537 8.458 1.00 0.00 N ATOM 524 CZ ARG A 39 11.457 5.810 8.903 1.00 0.00 C ATOM 525 NH1 ARG A 39 12.516 5.540 8.152 1.00 0.00 N ATOM 526 NH2 ARG A 39 11.622 6.356 10.101 1.00 0.00 N ATOM 0 H ARG A 39 8.682 2.764 3.262 1.00 0.00 H new ATOM 0 HA ARG A 39 8.228 1.672 5.963 1.00 0.00 H new ATOM 0 HB2 ARG A 39 10.645 1.932 5.751 1.00 0.00 H new ATOM 0 HB3 ARG A 39 10.460 3.540 5.078 1.00 0.00 H new ATOM 0 HG2 ARG A 39 9.306 3.000 7.800 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.045 3.150 7.650 1.00 0.00 H new ATOM 0 HD2 ARG A 39 10.656 5.348 6.417 1.00 0.00 H new ATOM 0 HD3 ARG A 39 8.960 5.207 6.833 1.00 0.00 H new ATOM 0 HE ARG A 39 9.443 5.758 9.060 1.00 0.00 H new ATOM 0 HH11 ARG A 39 12.394 5.122 7.230 1.00 0.00 H new ATOM 0 HH12 ARG A 39 13.453 5.751 8.496 1.00 0.00 H new ATOM 0 HH21 ARG A 39 10.810 6.567 10.682 1.00 0.00 H new ATOM 0 HH22 ARG A 39 12.561 6.565 10.441 1.00 0.00 H new ATOM 540 N TRP A 40 6.846 3.651 6.520 1.00 0.00 N ATOM 541 CA TRP A 40 5.920 4.747 6.786 1.00 0.00 C ATOM 542 C TRP A 40 5.813 5.016 8.283 1.00 0.00 C ATOM 543 O TRP A 40 6.496 4.383 9.087 1.00 0.00 O ATOM 544 CB TRP A 40 4.539 4.426 6.212 1.00 0.00 C ATOM 545 CG TRP A 40 3.936 3.176 6.779 1.00 0.00 C ATOM 546 CD1 TRP A 40 2.950 3.096 7.719 1.00 0.00 C ATOM 547 CD2 TRP A 40 4.283 1.829 6.441 1.00 0.00 C ATOM 548 NE1 TRP A 40 2.662 1.779 7.987 1.00 0.00 N ATOM 549 CE2 TRP A 40 3.465 0.982 7.215 1.00 0.00 C ATOM 550 CE3 TRP A 40 5.202 1.255 5.559 1.00 0.00 C ATOM 551 CZ2 TRP A 40 3.543 -0.406 7.133 1.00 0.00 C ATOM 552 CZ3 TRP A 40 5.278 -0.123 5.479 1.00 0.00 C ATOM 553 CH2 TRP A 40 4.452 -0.940 6.261 1.00 0.00 C ATOM 0 H TRP A 40 6.776 2.871 7.174 1.00 0.00 H new ATOM 0 HA TRP A 40 6.307 5.643 6.301 1.00 0.00 H new ATOM 0 HB2 TRP A 40 3.869 5.264 6.405 1.00 0.00 H new ATOM 0 HB3 TRP A 40 4.618 4.324 5.130 1.00 0.00 H new ATOM 0 HD1 TRP A 40 2.467 3.943 8.184 1.00 0.00 H new ATOM 0 HE1 TRP A 40 1.963 1.449 8.653 1.00 0.00 H new ATOM 0 HE3 TRP A 40 5.842 1.877 4.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 2.909 -1.038 7.736 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 5.986 -0.577 4.802 1.00 0.00 H new ATOM 0 HH2 TRP A 40 4.534 -2.013 6.174 1.00 0.00 H new ATOM 564 N MET A 41 4.951 5.959 8.649 1.00 0.00 N ATOM 565 CA MET A 41 4.754 6.311 10.051 1.00 0.00 C ATOM 566 C MET A 41 3.268 6.365 10.394 1.00 0.00 C ATOM 567 O MET A 41 2.417 6.429 9.507 1.00 0.00 O ATOM 568 CB MET A 41 5.409 7.659 10.358 1.00 0.00 C ATOM 569 CG MET A 41 6.873 7.547 10.751 1.00 0.00 C ATOM 570 SD MET A 41 7.617 9.147 11.122 1.00 0.00 S ATOM 571 CE MET A 41 7.798 9.032 12.900 1.00 0.00 C ATOM 0 H MET A 41 4.378 6.493 7.995 1.00 0.00 H new ATOM 0 HA MET A 41 5.223 5.540 10.662 1.00 0.00 H new ATOM 0 HB2 MET A 41 5.324 8.303 9.482 1.00 0.00 H new ATOM 0 HB3 MET A 41 4.861 8.145 11.165 1.00 0.00 H new ATOM 0 HG2 MET A 41 6.963 6.898 11.622 1.00 0.00 H new ATOM 0 HG3 MET A 41 7.427 7.072 9.941 1.00 0.00 H new ATOM 0 HE1 MET A 41 8.247 9.950 13.280 1.00 0.00 H new ATOM 0 HE2 MET A 41 6.819 8.890 13.357 1.00 0.00 H new ATOM 0 HE3 MET A 41 8.439 8.186 13.146 1.00 0.00 H new ATOM 581 N LYS A 42 2.963 6.337 11.687 1.00 0.00 N ATOM 582 CA LYS A 42 1.580 6.383 12.148 1.00 0.00 C ATOM 583 C LYS A 42 1.027 7.802 12.068 1.00 0.00 C ATOM 584 O LYS A 42 1.665 8.767 12.490 1.00 0.00 O ATOM 585 CB LYS A 42 1.483 5.867 13.586 1.00 0.00 C ATOM 586 CG LYS A 42 0.152 5.211 13.908 1.00 0.00 C ATOM 587 CD LYS A 42 0.048 4.854 15.381 1.00 0.00 C ATOM 588 CE LYS A 42 0.743 3.536 15.686 1.00 0.00 C ATOM 589 NZ LYS A 42 2.222 3.695 15.764 1.00 0.00 N ATOM 0 H LYS A 42 3.655 6.283 12.434 1.00 0.00 H new ATOM 0 HA LYS A 42 0.985 5.742 11.497 1.00 0.00 H new ATOM 0 HB2 LYS A 42 2.284 5.149 13.760 1.00 0.00 H new ATOM 0 HB3 LYS A 42 1.645 6.698 14.273 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -0.661 5.884 13.638 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.034 4.311 13.305 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.492 5.648 15.981 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -1.002 4.788 15.667 1.00 0.00 H new ATOM 0 HE2 LYS A 42 0.370 3.138 16.630 1.00 0.00 H new ATOM 0 HE3 LYS A 42 0.496 2.808 14.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 2.592 3.118 16.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 2.652 3.384 14.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 2.455 4.695 15.931 1.00 0.00 H new ATOM 603 N PRO A 43 -0.187 7.935 11.515 1.00 0.00 N ATOM 604 CA PRO A 43 -0.853 9.232 11.368 1.00 0.00 C ATOM 605 C PRO A 43 -1.293 9.813 12.708 1.00 0.00 C ATOM 606 O PRO A 43 -1.321 9.127 13.730 1.00 0.00 O ATOM 607 CB PRO A 43 -2.072 8.910 10.500 1.00 0.00 C ATOM 608 CG PRO A 43 -2.344 7.467 10.751 1.00 0.00 C ATOM 609 CD PRO A 43 -1.004 6.828 10.990 1.00 0.00 C ATOM 0 HA PRO A 43 -0.191 9.982 10.936 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -2.927 9.528 10.774 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -1.868 9.097 9.446 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -2.997 7.337 11.614 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -2.847 7.011 9.899 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -1.072 6.006 11.702 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -0.584 6.419 10.071 1.00 0.00 H new ATOM 617 N PRO A 44 -1.644 11.107 12.706 1.00 0.00 N ATOM 618 CA PRO A 44 -2.089 11.808 13.914 1.00 0.00 C ATOM 619 C PRO A 44 -3.460 11.336 14.386 1.00 0.00 C ATOM 620 O PRO A 44 -4.034 11.896 15.321 1.00 0.00 O ATOM 621 CB PRO A 44 -2.151 13.273 13.472 1.00 0.00 C ATOM 622 CG PRO A 44 -2.361 13.215 11.999 1.00 0.00 C ATOM 623 CD PRO A 44 -1.634 11.986 11.525 1.00 0.00 C ATOM 0 HA PRO A 44 -1.421 11.631 14.757 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -2.965 13.802 13.967 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -1.230 13.801 13.720 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -3.423 13.158 11.758 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -1.972 14.110 11.514 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -2.137 11.524 10.676 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -0.618 12.218 11.206 1.00 0.00 H new ATOM 631 N THR A 45 -3.981 10.301 13.735 1.00 0.00 N ATOM 632 CA THR A 45 -5.285 9.753 14.088 1.00 0.00 C ATOM 633 C THR A 45 -5.255 9.109 15.469 1.00 0.00 C ATOM 634 O THR A 45 -5.303 7.886 15.596 1.00 0.00 O ATOM 635 CB THR A 45 -5.753 8.709 13.057 1.00 0.00 C ATOM 636 OG1 THR A 45 -4.860 7.589 13.053 1.00 0.00 O ATOM 637 CG2 THR A 45 -5.819 9.316 11.663 1.00 0.00 C ATOM 0 H THR A 45 -3.520 9.825 12.960 1.00 0.00 H new ATOM 0 HA THR A 45 -5.987 10.587 14.094 1.00 0.00 H new ATOM 0 HB THR A 45 -6.752 8.376 13.339 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.836 7.187 13.946 1.00 0.00 H new ATOM 0 HG21 THR A 45 -6.152 8.560 10.952 1.00 0.00 H new ATOM 0 HG22 THR A 45 -6.522 10.149 11.662 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.831 9.674 11.375 1.00 0.00 H new ATOM 645 N LYS A 46 -5.177 9.941 16.502 1.00 0.00 N ATOM 646 CA LYS A 46 -5.143 9.453 17.876 1.00 0.00 C ATOM 647 C LYS A 46 -6.121 10.229 18.753 1.00 0.00 C ATOM 648 O LYS A 46 -6.181 10.021 19.965 1.00 0.00 O ATOM 649 CB LYS A 46 -3.728 9.569 18.446 1.00 0.00 C ATOM 650 CG LYS A 46 -3.113 10.947 18.270 1.00 0.00 C ATOM 651 CD LYS A 46 -3.838 11.992 19.102 1.00 0.00 C ATOM 652 CE LYS A 46 -3.026 13.272 19.219 1.00 0.00 C ATOM 653 NZ LYS A 46 -3.493 14.124 20.348 1.00 0.00 N ATOM 0 H LYS A 46 -5.136 10.956 16.414 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.440 8.404 17.870 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.752 9.324 19.508 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.089 8.830 17.962 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -2.062 10.917 18.558 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -3.148 11.230 17.218 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -4.804 12.213 18.649 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.036 11.593 20.097 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.975 13.023 19.363 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.096 13.833 18.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.625 15.100 20.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -4.396 13.757 20.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.785 14.111 21.109 1.00 0.00 H new ATOM 667 N GLN A 47 -6.884 11.123 18.133 1.00 0.00 N ATOM 668 CA GLN A 47 -7.859 11.929 18.858 1.00 0.00 C ATOM 669 C GLN A 47 -9.263 11.351 18.708 1.00 0.00 C ATOM 670 O GLN A 47 -9.890 11.486 17.658 1.00 0.00 O ATOM 671 CB GLN A 47 -7.833 13.373 18.355 1.00 0.00 C ATOM 672 CG GLN A 47 -6.870 14.267 19.120 1.00 0.00 C ATOM 673 CD GLN A 47 -6.763 15.656 18.523 1.00 0.00 C ATOM 674 OE1 GLN A 47 -7.276 15.917 17.434 1.00 0.00 O ATOM 675 NE2 GLN A 47 -6.094 16.556 19.234 1.00 0.00 N ATOM 0 H GLN A 47 -6.846 11.308 17.131 1.00 0.00 H new ATOM 0 HA GLN A 47 -7.591 11.915 19.914 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -7.559 13.377 17.300 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -8.837 13.791 18.425 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -7.199 14.346 20.156 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -5.883 13.804 19.133 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -5.685 16.296 20.132 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -5.989 17.508 18.883 1.00 0.00 H new ATOM 684 N GLN A 48 -9.748 10.706 19.765 1.00 0.00 N ATOM 685 CA GLN A 48 -11.077 10.107 19.749 1.00 0.00 C ATOM 686 C GLN A 48 -11.353 9.431 18.410 1.00 0.00 C ATOM 687 O GLN A 48 -12.473 9.475 17.901 1.00 0.00 O ATOM 688 CB GLN A 48 -12.142 11.169 20.027 1.00 0.00 C ATOM 689 CG GLN A 48 -13.480 10.591 20.458 1.00 0.00 C ATOM 690 CD GLN A 48 -14.641 11.517 20.155 1.00 0.00 C ATOM 691 OE1 GLN A 48 -14.714 12.631 20.675 1.00 0.00 O ATOM 692 NE2 GLN A 48 -15.556 11.061 19.308 1.00 0.00 N ATOM 0 H GLN A 48 -9.241 10.585 20.642 1.00 0.00 H new ATOM 0 HA GLN A 48 -11.116 9.350 20.532 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -11.779 11.841 20.804 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -12.287 11.769 19.129 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -13.639 9.638 19.953 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -13.455 10.385 21.528 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -15.456 10.131 18.901 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -16.359 11.640 19.065 1.00 0.00 H new ATOM 701 N ASP A 49 -10.326 8.806 17.845 1.00 0.00 N ATOM 702 CA ASP A 49 -10.459 8.120 16.565 1.00 0.00 C ATOM 703 C ASP A 49 -10.693 6.627 16.771 1.00 0.00 C ATOM 704 O ASP A 49 -11.521 6.019 16.094 1.00 0.00 O ATOM 705 CB ASP A 49 -9.208 8.340 15.713 1.00 0.00 C ATOM 706 CG ASP A 49 -9.016 9.795 15.332 1.00 0.00 C ATOM 707 OD1 ASP A 49 -9.724 10.267 14.418 1.00 0.00 O ATOM 708 OD2 ASP A 49 -8.157 10.461 15.947 1.00 0.00 O ATOM 0 H ASP A 49 -9.392 8.760 18.253 1.00 0.00 H new ATOM 0 HA ASP A 49 -11.322 8.536 16.045 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -8.333 7.992 16.262 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -9.277 7.736 14.808 1.00 0.00 H new ATOM 713 N GLY A 50 -9.957 6.041 17.711 1.00 0.00 N ATOM 714 CA GLY A 50 -10.098 4.624 17.989 1.00 0.00 C ATOM 715 C GLY A 50 -8.761 3.930 18.159 1.00 0.00 C ATOM 716 O GLY A 50 -7.947 4.334 18.988 1.00 0.00 O ATOM 0 H GLY A 50 -9.265 6.523 18.285 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -10.690 4.492 18.895 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -10.649 4.151 17.176 1.00 0.00 H new ATOM 720 N GLU A 51 -8.536 2.881 17.373 1.00 0.00 N ATOM 721 CA GLU A 51 -7.289 2.129 17.444 1.00 0.00 C ATOM 722 C GLU A 51 -6.938 1.529 16.085 1.00 0.00 C ATOM 723 O GLU A 51 -7.773 0.895 15.439 1.00 0.00 O ATOM 724 CB GLU A 51 -7.396 1.019 18.492 1.00 0.00 C ATOM 725 CG GLU A 51 -8.214 -0.176 18.031 1.00 0.00 C ATOM 726 CD GLU A 51 -8.256 -1.287 19.062 1.00 0.00 C ATOM 727 OE1 GLU A 51 -7.180 -1.664 19.572 1.00 0.00 O ATOM 728 OE2 GLU A 51 -9.364 -1.779 19.360 1.00 0.00 O ATOM 0 H GLU A 51 -9.200 2.534 16.681 1.00 0.00 H new ATOM 0 HA GLU A 51 -6.495 2.817 17.734 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.394 0.682 18.756 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -7.844 1.428 19.398 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.231 0.148 17.810 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.794 -0.563 17.103 1.00 0.00 H new ATOM 735 N LEU A 52 -5.697 1.735 15.658 1.00 0.00 N ATOM 736 CA LEU A 52 -5.234 1.216 14.376 1.00 0.00 C ATOM 737 C LEU A 52 -5.262 -0.309 14.364 1.00 0.00 C ATOM 738 O LEU A 52 -4.995 -0.954 15.378 1.00 0.00 O ATOM 739 CB LEU A 52 -3.817 1.713 14.084 1.00 0.00 C ATOM 740 CG LEU A 52 -3.350 1.594 12.632 1.00 0.00 C ATOM 741 CD1 LEU A 52 -3.691 2.857 11.857 1.00 0.00 C ATOM 742 CD2 LEU A 52 -1.854 1.318 12.575 1.00 0.00 C ATOM 0 H LEU A 52 -4.994 2.257 16.180 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.908 1.580 13.600 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -3.752 2.760 14.381 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -3.122 1.159 14.715 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.872 0.757 12.169 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -3.351 2.754 10.826 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -4.770 3.012 11.870 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.196 3.712 12.318 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.538 1.236 11.535 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.315 2.135 13.055 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.636 0.385 13.095 1.00 0.00 H new ATOM 754 N VAL A 53 -5.585 -0.881 13.208 1.00 0.00 N ATOM 755 CA VAL A 53 -5.645 -2.331 13.063 1.00 0.00 C ATOM 756 C VAL A 53 -4.632 -2.822 12.034 1.00 0.00 C ATOM 757 O VAL A 53 -4.025 -3.879 12.201 1.00 0.00 O ATOM 758 CB VAL A 53 -7.052 -2.795 12.644 1.00 0.00 C ATOM 759 CG1 VAL A 53 -8.084 -2.374 13.679 1.00 0.00 C ATOM 760 CG2 VAL A 53 -7.407 -2.246 11.270 1.00 0.00 C ATOM 0 H VAL A 53 -5.809 -0.363 12.359 1.00 0.00 H new ATOM 0 HA VAL A 53 -5.405 -2.757 14.037 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.054 -3.883 12.586 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.072 -2.711 13.365 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.837 -2.821 14.642 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.084 -1.288 13.772 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.405 -2.584 10.990 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.387 -1.157 11.297 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.684 -2.604 10.537 1.00 0.00 H new ATOM 770 N GLY A 54 -4.454 -2.046 10.969 1.00 0.00 N ATOM 771 CA GLY A 54 -3.513 -2.419 9.929 1.00 0.00 C ATOM 772 C GLY A 54 -3.333 -1.327 8.893 1.00 0.00 C ATOM 773 O GLY A 54 -3.678 -0.170 9.133 1.00 0.00 O ATOM 0 H GLY A 54 -4.944 -1.166 10.808 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -2.548 -2.649 10.381 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.860 -3.328 9.438 1.00 0.00 H new ATOM 777 N TYR A 55 -2.790 -1.694 7.737 1.00 0.00 N ATOM 778 CA TYR A 55 -2.560 -0.737 6.662 1.00 0.00 C ATOM 779 C TYR A 55 -2.930 -1.338 5.309 1.00 0.00 C ATOM 780 O TYR A 55 -3.063 -2.554 5.173 1.00 0.00 O ATOM 781 CB TYR A 55 -1.097 -0.292 6.651 1.00 0.00 C ATOM 782 CG TYR A 55 -0.748 0.671 7.764 1.00 0.00 C ATOM 783 CD1 TYR A 55 -0.997 2.031 7.636 1.00 0.00 C ATOM 784 CD2 TYR A 55 -0.171 0.219 8.944 1.00 0.00 C ATOM 785 CE1 TYR A 55 -0.680 2.914 8.650 1.00 0.00 C ATOM 786 CE2 TYR A 55 0.149 1.094 9.964 1.00 0.00 C ATOM 787 CZ TYR A 55 -0.107 2.441 9.812 1.00 0.00 C ATOM 788 OH TYR A 55 0.209 3.317 10.825 1.00 0.00 O ATOM 0 H TYR A 55 -2.501 -2.648 7.521 1.00 0.00 H new ATOM 0 HA TYR A 55 -3.196 0.130 6.840 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -0.458 -1.172 6.729 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -0.876 0.178 5.693 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -1.446 2.405 6.728 1.00 0.00 H new ATOM 0 HD2 TYR A 55 0.031 -0.835 9.066 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -0.880 3.969 8.533 1.00 0.00 H new ATOM 0 HE2 TYR A 55 0.597 0.726 10.875 1.00 0.00 H new ATOM 0 HH TYR A 55 0.604 2.823 11.574 1.00 0.00 H new ATOM 798 N ARG A 56 -3.095 -0.475 4.312 1.00 0.00 N ATOM 799 CA ARG A 56 -3.451 -0.919 2.969 1.00 0.00 C ATOM 800 C ARG A 56 -2.465 -0.377 1.938 1.00 0.00 C ATOM 801 O ARG A 56 -2.512 0.801 1.580 1.00 0.00 O ATOM 802 CB ARG A 56 -4.870 -0.469 2.620 1.00 0.00 C ATOM 803 CG ARG A 56 -5.523 -1.304 1.530 1.00 0.00 C ATOM 804 CD ARG A 56 -7.013 -1.018 1.426 1.00 0.00 C ATOM 805 NE ARG A 56 -7.775 -1.700 2.469 1.00 0.00 N ATOM 806 CZ ARG A 56 -9.096 -1.835 2.444 1.00 0.00 C ATOM 807 NH1 ARG A 56 -9.798 -1.339 1.434 1.00 0.00 N ATOM 808 NH2 ARG A 56 -9.718 -2.469 3.430 1.00 0.00 N ATOM 0 H ARG A 56 -2.988 0.535 4.408 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.408 -2.008 2.950 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.487 -0.512 3.518 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -4.844 0.573 2.301 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.044 -1.095 0.574 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -5.368 -2.362 1.739 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.182 0.056 1.498 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.375 -1.333 0.447 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.265 -2.094 3.260 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.323 -0.852 0.674 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.812 -1.444 1.418 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -9.182 -2.853 4.208 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -10.733 -2.572 3.410 1.00 0.00 H new ATOM 822 N ILE A 57 -1.575 -1.242 1.466 1.00 0.00 N ATOM 823 CA ILE A 57 -0.579 -0.850 0.477 1.00 0.00 C ATOM 824 C ILE A 57 -0.996 -1.283 -0.925 1.00 0.00 C ATOM 825 O ILE A 57 -1.099 -2.476 -1.212 1.00 0.00 O ATOM 826 CB ILE A 57 0.802 -1.452 0.798 1.00 0.00 C ATOM 827 CG1 ILE A 57 1.213 -1.103 2.230 1.00 0.00 C ATOM 828 CG2 ILE A 57 1.841 -0.952 -0.194 1.00 0.00 C ATOM 829 CD1 ILE A 57 2.383 -1.917 2.738 1.00 0.00 C ATOM 0 H ILE A 57 -1.523 -2.220 1.752 1.00 0.00 H new ATOM 0 HA ILE A 57 -0.510 0.237 0.514 1.00 0.00 H new ATOM 0 HB ILE A 57 0.739 -2.537 0.712 1.00 0.00 H new ATOM 0 HG12 ILE A 57 1.469 -0.045 2.278 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.360 -1.255 2.892 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.812 -1.386 0.046 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.552 -1.246 -1.203 1.00 0.00 H new ATOM 0 HG23 ILE A 57 1.905 0.135 -0.137 1.00 0.00 H new ATOM 0 HD11 ILE A 57 2.619 -1.616 3.759 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.124 -2.976 2.722 1.00 0.00 H new ATOM 0 HD13 ILE A 57 3.250 -1.746 2.099 1.00 0.00 H new ATOM 841 N SER A 58 -1.234 -0.306 -1.794 1.00 0.00 N ATOM 842 CA SER A 58 -1.642 -0.586 -3.166 1.00 0.00 C ATOM 843 C SER A 58 -0.508 -0.286 -4.142 1.00 0.00 C ATOM 844 O SER A 58 -0.212 0.874 -4.430 1.00 0.00 O ATOM 845 CB SER A 58 -2.877 0.239 -3.532 1.00 0.00 C ATOM 846 OG SER A 58 -3.364 -0.113 -4.815 1.00 0.00 O ATOM 0 H SER A 58 -1.151 0.686 -1.573 1.00 0.00 H new ATOM 0 HA SER A 58 -1.888 -1.646 -3.237 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.657 0.081 -2.788 1.00 0.00 H new ATOM 0 HB3 SER A 58 -2.628 1.300 -3.513 1.00 0.00 H new ATOM 0 HG SER A 58 -4.154 0.427 -5.025 1.00 0.00 H new ATOM 852 N HIS A 59 0.123 -1.341 -4.648 1.00 0.00 N ATOM 853 CA HIS A 59 1.225 -1.192 -5.592 1.00 0.00 C ATOM 854 C HIS A 59 0.835 -1.719 -6.970 1.00 0.00 C ATOM 855 O HIS A 59 0.713 -2.928 -7.171 1.00 0.00 O ATOM 856 CB HIS A 59 2.464 -1.928 -5.084 1.00 0.00 C ATOM 857 CG HIS A 59 2.214 -3.369 -4.761 1.00 0.00 C ATOM 858 ND1 HIS A 59 2.650 -4.406 -5.559 1.00 0.00 N ATOM 859 CD2 HIS A 59 1.570 -3.944 -3.718 1.00 0.00 C ATOM 860 CE1 HIS A 59 2.284 -5.556 -5.022 1.00 0.00 C ATOM 861 NE2 HIS A 59 1.627 -5.304 -3.904 1.00 0.00 N ATOM 0 H HIS A 59 -0.110 -2.308 -4.420 1.00 0.00 H new ATOM 0 HA HIS A 59 1.454 -0.130 -5.680 1.00 0.00 H new ATOM 0 HB2 HIS A 59 3.249 -1.864 -5.837 1.00 0.00 H new ATOM 0 HB3 HIS A 59 2.836 -1.424 -4.192 1.00 0.00 H new ATOM 0 HD2 HIS A 59 1.099 -3.429 -2.893 1.00 0.00 H new ATOM 0 HE1 HIS A 59 2.487 -6.536 -5.428 1.00 0.00 H new ATOM 0 HE2 HIS A 59 1.227 -6.005 -3.280 1.00 0.00 H new ATOM 870 N VAL A 60 0.639 -0.805 -7.915 1.00 0.00 N ATOM 871 CA VAL A 60 0.263 -1.178 -9.273 1.00 0.00 C ATOM 872 C VAL A 60 1.450 -1.065 -10.223 1.00 0.00 C ATOM 873 O VAL A 60 2.337 -0.235 -10.027 1.00 0.00 O ATOM 874 CB VAL A 60 -0.887 -0.298 -9.799 1.00 0.00 C ATOM 875 CG1 VAL A 60 -0.343 0.996 -10.386 1.00 0.00 C ATOM 876 CG2 VAL A 60 -1.709 -1.057 -10.830 1.00 0.00 C ATOM 0 H VAL A 60 0.734 0.199 -7.765 1.00 0.00 H new ATOM 0 HA VAL A 60 -0.071 -2.215 -9.235 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.539 -0.044 -8.963 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -1.169 1.605 -10.753 1.00 0.00 H new ATOM 0 HG12 VAL A 60 0.199 1.545 -9.616 1.00 0.00 H new ATOM 0 HG13 VAL A 60 0.332 0.766 -11.211 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.517 -0.421 -11.191 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.070 -1.342 -11.666 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.129 -1.953 -10.372 1.00 0.00 H new ATOM 886 N TRP A 61 1.460 -1.905 -11.252 1.00 0.00 N ATOM 887 CA TRP A 61 2.538 -1.899 -12.233 1.00 0.00 C ATOM 888 C TRP A 61 2.021 -1.492 -13.608 1.00 0.00 C ATOM 889 O TRP A 61 1.000 -1.999 -14.071 1.00 0.00 O ATOM 890 CB TRP A 61 3.194 -3.279 -12.309 1.00 0.00 C ATOM 891 CG TRP A 61 3.652 -3.793 -10.978 1.00 0.00 C ATOM 892 CD1 TRP A 61 2.869 -4.311 -9.986 1.00 0.00 C ATOM 893 CD2 TRP A 61 4.999 -3.837 -10.493 1.00 0.00 C ATOM 894 NE1 TRP A 61 3.648 -4.674 -8.913 1.00 0.00 N ATOM 895 CE2 TRP A 61 4.958 -4.394 -9.200 1.00 0.00 C ATOM 896 CE3 TRP A 61 6.235 -3.463 -11.026 1.00 0.00 C ATOM 897 CZ2 TRP A 61 6.106 -4.583 -8.435 1.00 0.00 C ATOM 898 CZ3 TRP A 61 7.373 -3.650 -10.265 1.00 0.00 C ATOM 899 CH2 TRP A 61 7.302 -4.207 -8.981 1.00 0.00 C ATOM 0 H TRP A 61 0.733 -2.599 -11.428 1.00 0.00 H new ATOM 0 HA TRP A 61 3.281 -1.168 -11.914 1.00 0.00 H new ATOM 0 HB2 TRP A 61 2.486 -3.987 -12.740 1.00 0.00 H new ATOM 0 HB3 TRP A 61 4.048 -3.231 -12.985 1.00 0.00 H new ATOM 0 HD1 TRP A 61 1.796 -4.419 -10.037 1.00 0.00 H new ATOM 0 HE1 TRP A 61 3.306 -5.085 -8.044 1.00 0.00 H new ATOM 0 HE3 TRP A 61 6.300 -3.035 -12.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 6.054 -5.012 -7.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 8.333 -3.362 -10.666 1.00 0.00 H new ATOM 0 HH2 TRP A 61 8.210 -4.342 -8.412 1.00 0.00 H new ATOM 910 N GLN A 62 2.732 -0.575 -14.256 1.00 0.00 N ATOM 911 CA GLN A 62 2.343 -0.101 -15.579 1.00 0.00 C ATOM 912 C GLN A 62 3.530 -0.123 -16.536 1.00 0.00 C ATOM 913 O GLN A 62 4.488 0.632 -16.370 1.00 0.00 O ATOM 914 CB GLN A 62 1.772 1.315 -15.488 1.00 0.00 C ATOM 915 CG GLN A 62 0.273 1.352 -15.235 1.00 0.00 C ATOM 916 CD GLN A 62 -0.377 2.616 -15.761 1.00 0.00 C ATOM 917 OE1 GLN A 62 0.180 3.708 -15.646 1.00 0.00 O ATOM 918 NE2 GLN A 62 -1.562 2.475 -16.343 1.00 0.00 N ATOM 0 H GLN A 62 3.580 -0.146 -13.887 1.00 0.00 H new ATOM 0 HA GLN A 62 1.575 -0.771 -15.967 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.280 1.852 -14.687 1.00 0.00 H new ATOM 0 HB3 GLN A 62 1.989 1.845 -16.415 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.192 0.486 -15.706 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.087 1.271 -14.164 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -1.987 1.551 -16.417 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -2.047 3.291 -16.716 1.00 0.00 H new ATOM 927 N SER A 63 3.460 -0.993 -17.538 1.00 0.00 N ATOM 928 CA SER A 63 4.531 -1.116 -18.520 1.00 0.00 C ATOM 929 C SER A 63 3.998 -0.906 -19.934 1.00 0.00 C ATOM 930 O SER A 63 2.797 -1.013 -20.179 1.00 0.00 O ATOM 931 CB SER A 63 5.195 -2.490 -18.412 1.00 0.00 C ATOM 932 OG SER A 63 5.696 -2.914 -19.667 1.00 0.00 O ATOM 0 H SER A 63 2.673 -1.623 -17.691 1.00 0.00 H new ATOM 0 HA SER A 63 5.272 -0.345 -18.311 1.00 0.00 H new ATOM 0 HB2 SER A 63 6.008 -2.448 -17.687 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.474 -3.218 -18.040 1.00 0.00 H new ATOM 0 HG SER A 63 6.117 -3.794 -19.571 1.00 0.00 H new ATOM 938 N ALA A 64 4.901 -0.607 -20.862 1.00 0.00 N ATOM 939 CA ALA A 64 4.524 -0.384 -22.252 1.00 0.00 C ATOM 940 C ALA A 64 3.943 -1.650 -22.873 1.00 0.00 C ATOM 941 O ALA A 64 4.678 -2.562 -23.250 1.00 0.00 O ATOM 942 CB ALA A 64 5.724 0.097 -23.054 1.00 0.00 C ATOM 0 H ALA A 64 5.900 -0.514 -20.676 1.00 0.00 H new ATOM 0 HA ALA A 64 3.754 0.387 -22.274 1.00 0.00 H new ATOM 0 HB1 ALA A 64 5.428 0.259 -24.090 1.00 0.00 H new ATOM 0 HB2 ALA A 64 6.093 1.031 -22.631 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.512 -0.655 -23.016 1.00 0.00 H new ATOM 948 N GLY A 65 2.619 -1.700 -22.976 1.00 0.00 N ATOM 949 CA GLY A 65 1.962 -2.859 -23.551 1.00 0.00 C ATOM 950 C GLY A 65 1.459 -3.824 -22.496 1.00 0.00 C ATOM 951 O GLY A 65 0.590 -4.653 -22.767 1.00 0.00 O ATOM 0 H GLY A 65 1.989 -0.958 -22.671 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.125 -2.530 -24.166 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.658 -3.377 -24.211 1.00 0.00 H new ATOM 955 N ILE A 66 2.006 -3.717 -21.290 1.00 0.00 N ATOM 956 CA ILE A 66 1.607 -4.587 -20.190 1.00 0.00 C ATOM 957 C ILE A 66 1.297 -3.779 -18.934 1.00 0.00 C ATOM 958 O ILE A 66 2.171 -3.110 -18.383 1.00 0.00 O ATOM 959 CB ILE A 66 2.701 -5.621 -19.865 1.00 0.00 C ATOM 960 CG1 ILE A 66 2.705 -6.737 -20.912 1.00 0.00 C ATOM 961 CG2 ILE A 66 2.491 -6.194 -18.472 1.00 0.00 C ATOM 962 CD1 ILE A 66 1.360 -7.406 -21.087 1.00 0.00 C ATOM 0 H ILE A 66 2.727 -3.037 -21.049 1.00 0.00 H new ATOM 0 HA ILE A 66 0.707 -5.111 -20.513 1.00 0.00 H new ATOM 0 HB ILE A 66 3.670 -5.123 -19.889 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.024 -6.325 -21.869 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.441 -7.489 -20.627 1.00 0.00 H new ATOM 0 HG21 ILE A 66 3.272 -6.923 -18.257 1.00 0.00 H new ATOM 0 HG22 ILE A 66 2.533 -5.390 -17.738 1.00 0.00 H new ATOM 0 HG23 ILE A 66 1.517 -6.680 -18.422 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.438 -8.186 -21.844 1.00 0.00 H new ATOM 0 HD12 ILE A 66 1.048 -7.848 -20.141 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.624 -6.666 -21.402 1.00 0.00 H new ATOM 974 N SER A 67 0.048 -3.848 -18.486 1.00 0.00 N ATOM 975 CA SER A 67 -0.379 -3.122 -17.296 1.00 0.00 C ATOM 976 C SER A 67 -1.007 -4.069 -16.278 1.00 0.00 C ATOM 977 O SER A 67 -2.115 -4.568 -16.478 1.00 0.00 O ATOM 978 CB SER A 67 -1.375 -2.024 -17.672 1.00 0.00 C ATOM 979 OG SER A 67 -2.573 -2.578 -18.188 1.00 0.00 O ATOM 0 H SER A 67 -0.687 -4.400 -18.929 1.00 0.00 H new ATOM 0 HA SER A 67 0.501 -2.664 -16.845 1.00 0.00 H new ATOM 0 HB2 SER A 67 -1.600 -1.416 -16.795 1.00 0.00 H new ATOM 0 HB3 SER A 67 -0.928 -1.361 -18.413 1.00 0.00 H new ATOM 0 HG SER A 67 -2.716 -3.467 -17.801 1.00 0.00 H new ATOM 985 N LYS A 68 -0.292 -4.311 -15.185 1.00 0.00 N ATOM 986 CA LYS A 68 -0.778 -5.197 -14.133 1.00 0.00 C ATOM 987 C LYS A 68 -1.005 -4.427 -12.836 1.00 0.00 C ATOM 988 O LYS A 68 -0.329 -3.435 -12.566 1.00 0.00 O ATOM 989 CB LYS A 68 0.217 -6.335 -13.896 1.00 0.00 C ATOM 990 CG LYS A 68 0.267 -7.344 -15.029 1.00 0.00 C ATOM 991 CD LYS A 68 0.868 -8.664 -14.574 1.00 0.00 C ATOM 992 CE LYS A 68 0.336 -9.830 -15.394 1.00 0.00 C ATOM 993 NZ LYS A 68 1.312 -10.953 -15.458 1.00 0.00 N ATOM 0 H LYS A 68 0.627 -3.906 -15.004 1.00 0.00 H new ATOM 0 HA LYS A 68 -1.730 -5.617 -14.457 1.00 0.00 H new ATOM 0 HB2 LYS A 68 1.212 -5.913 -13.752 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -0.047 -6.851 -12.973 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.740 -7.514 -15.411 1.00 0.00 H new ATOM 0 HG3 LYS A 68 0.856 -6.939 -15.852 1.00 0.00 H new ATOM 0 HD2 LYS A 68 1.954 -8.621 -14.663 1.00 0.00 H new ATOM 0 HD3 LYS A 68 0.640 -8.825 -13.520 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -0.598 -10.185 -14.958 1.00 0.00 H new ATOM 0 HE3 LYS A 68 0.107 -9.490 -16.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 0.913 -11.728 -16.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 2.194 -10.621 -15.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 1.511 -11.295 -14.496 1.00 0.00 H new ATOM 1007 N GLU A 69 -1.959 -4.892 -12.036 1.00 0.00 N ATOM 1008 CA GLU A 69 -2.273 -4.247 -10.766 1.00 0.00 C ATOM 1009 C GLU A 69 -2.157 -5.236 -9.610 1.00 0.00 C ATOM 1010 O GLU A 69 -2.613 -6.376 -9.704 1.00 0.00 O ATOM 1011 CB GLU A 69 -3.684 -3.655 -10.805 1.00 0.00 C ATOM 1012 CG GLU A 69 -4.781 -4.701 -10.906 1.00 0.00 C ATOM 1013 CD GLU A 69 -4.848 -5.346 -12.277 1.00 0.00 C ATOM 1014 OE1 GLU A 69 -4.605 -4.639 -13.278 1.00 0.00 O ATOM 1015 OE2 GLU A 69 -5.143 -6.557 -12.349 1.00 0.00 O ATOM 0 H GLU A 69 -2.528 -5.713 -12.244 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.553 -3.444 -10.608 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -3.844 -3.059 -9.906 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.761 -2.977 -11.655 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.613 -5.472 -10.154 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -5.741 -4.238 -10.679 1.00 0.00 H new ATOM 1022 N LEU A 70 -1.542 -4.791 -8.519 1.00 0.00 N ATOM 1023 CA LEU A 70 -1.364 -5.635 -7.343 1.00 0.00 C ATOM 1024 C LEU A 70 -1.811 -4.909 -6.078 1.00 0.00 C ATOM 1025 O LEU A 70 -1.868 -3.679 -6.043 1.00 0.00 O ATOM 1026 CB LEU A 70 0.100 -6.058 -7.212 1.00 0.00 C ATOM 1027 CG LEU A 70 0.489 -7.360 -7.915 1.00 0.00 C ATOM 1028 CD1 LEU A 70 -0.473 -8.477 -7.540 1.00 0.00 C ATOM 1029 CD2 LEU A 70 0.517 -7.162 -9.424 1.00 0.00 C ATOM 0 H LEU A 70 -1.158 -3.851 -8.425 1.00 0.00 H new ATOM 0 HA LEU A 70 -1.983 -6.524 -7.467 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.725 -5.256 -7.604 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.335 -6.157 -6.152 1.00 0.00 H new ATOM 0 HG LEU A 70 1.489 -7.644 -7.587 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.181 -9.395 -8.049 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.444 -8.635 -6.462 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -1.484 -8.202 -7.840 1.00 0.00 H new ATOM 0 HD21 LEU A 70 0.795 -8.098 -9.909 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -0.470 -6.854 -9.769 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.246 -6.392 -9.676 1.00 0.00 H new ATOM 1041 N LEU A 71 -2.124 -5.677 -5.041 1.00 0.00 N ATOM 1042 CA LEU A 71 -2.564 -5.107 -3.772 1.00 0.00 C ATOM 1043 C LEU A 71 -2.026 -5.917 -2.596 1.00 0.00 C ATOM 1044 O LEU A 71 -2.323 -7.102 -2.459 1.00 0.00 O ATOM 1045 CB LEU A 71 -4.091 -5.057 -3.715 1.00 0.00 C ATOM 1046 CG LEU A 71 -4.694 -4.045 -2.740 1.00 0.00 C ATOM 1047 CD1 LEU A 71 -4.045 -4.172 -1.370 1.00 0.00 C ATOM 1048 CD2 LEU A 71 -4.537 -2.629 -3.276 1.00 0.00 C ATOM 0 H LEU A 71 -2.081 -6.696 -5.053 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.171 -4.093 -3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.465 -4.835 -4.715 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.457 -6.049 -3.450 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.758 -4.258 -2.637 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.487 -3.444 -0.689 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.208 -5.177 -0.982 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -2.974 -3.986 -1.456 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.972 -1.922 -2.569 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.478 -2.405 -3.408 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.048 -2.544 -4.235 1.00 0.00 H new ATOM 1060 N GLU A 72 -1.234 -5.266 -1.749 1.00 0.00 N ATOM 1061 CA GLU A 72 -0.656 -5.926 -0.584 1.00 0.00 C ATOM 1062 C GLU A 72 -1.483 -5.642 0.667 1.00 0.00 C ATOM 1063 O GLU A 72 -2.187 -4.636 0.743 1.00 0.00 O ATOM 1064 CB GLU A 72 0.786 -5.463 -0.371 1.00 0.00 C ATOM 1065 CG GLU A 72 1.660 -6.493 0.325 1.00 0.00 C ATOM 1066 CD GLU A 72 1.836 -7.757 -0.493 1.00 0.00 C ATOM 1067 OE1 GLU A 72 2.414 -7.673 -1.597 1.00 0.00 O ATOM 1068 OE2 GLU A 72 1.396 -8.830 -0.029 1.00 0.00 O ATOM 0 H GLU A 72 -0.978 -4.283 -1.848 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.661 -7.001 -0.767 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.227 -5.219 -1.338 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.781 -4.546 0.218 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.638 -6.057 0.528 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.219 -6.747 1.289 1.00 0.00 H new ATOM 1075 N GLU A 73 -1.391 -6.538 1.645 1.00 0.00 N ATOM 1076 CA GLU A 73 -2.132 -6.385 2.892 1.00 0.00 C ATOM 1077 C GLU A 73 -1.206 -6.534 4.096 1.00 0.00 C ATOM 1078 O GLU A 73 -0.501 -7.534 4.231 1.00 0.00 O ATOM 1079 CB GLU A 73 -3.259 -7.416 2.971 1.00 0.00 C ATOM 1080 CG GLU A 73 -4.184 -7.401 1.765 1.00 0.00 C ATOM 1081 CD GLU A 73 -5.313 -6.399 1.908 1.00 0.00 C ATOM 1082 OE1 GLU A 73 -6.076 -6.501 2.891 1.00 0.00 O ATOM 1083 OE2 GLU A 73 -5.433 -5.513 1.037 1.00 0.00 O ATOM 0 H GLU A 73 -0.812 -7.376 1.598 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.563 -5.384 2.908 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -2.824 -8.410 3.072 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.846 -7.232 3.871 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -3.606 -7.166 0.871 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.603 -8.397 1.621 1.00 0.00 H new ATOM 1090 N VAL A 74 -1.213 -5.531 4.968 1.00 0.00 N ATOM 1091 CA VAL A 74 -0.375 -5.549 6.161 1.00 0.00 C ATOM 1092 C VAL A 74 -1.169 -5.136 7.396 1.00 0.00 C ATOM 1093 O VAL A 74 -2.153 -4.405 7.298 1.00 0.00 O ATOM 1094 CB VAL A 74 0.839 -4.614 6.008 1.00 0.00 C ATOM 1095 CG1 VAL A 74 2.002 -5.350 5.361 1.00 0.00 C ATOM 1096 CG2 VAL A 74 0.463 -3.380 5.202 1.00 0.00 C ATOM 0 H VAL A 74 -1.790 -4.695 4.871 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.022 -6.573 6.285 1.00 0.00 H new ATOM 0 HB VAL A 74 1.153 -4.290 7.000 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.851 -4.673 5.261 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.286 -6.199 5.983 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.704 -5.706 4.375 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.333 -2.731 5.104 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.122 -3.682 4.212 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.336 -2.842 5.712 1.00 0.00 H new ATOM 1106 N GLY A 75 -0.732 -5.610 8.559 1.00 0.00 N ATOM 1107 CA GLY A 75 -1.413 -5.280 9.797 1.00 0.00 C ATOM 1108 C GLY A 75 -0.753 -4.130 10.532 1.00 0.00 C ATOM 1109 O GLY A 75 0.138 -3.472 9.995 1.00 0.00 O ATOM 0 H GLY A 75 0.081 -6.216 8.666 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.450 -5.022 9.580 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.431 -6.158 10.443 1.00 0.00 H new ATOM 1113 N GLN A 76 -1.193 -3.886 11.762 1.00 0.00 N ATOM 1114 CA GLN A 76 -0.640 -2.805 12.570 1.00 0.00 C ATOM 1115 C GLN A 76 0.759 -3.156 13.065 1.00 0.00 C ATOM 1116 O GLN A 76 1.394 -2.372 13.769 1.00 0.00 O ATOM 1117 CB GLN A 76 -1.555 -2.510 13.760 1.00 0.00 C ATOM 1118 CG GLN A 76 -1.503 -3.573 14.846 1.00 0.00 C ATOM 1119 CD GLN A 76 -2.490 -4.699 14.609 1.00 0.00 C ATOM 1120 OE1 GLN A 76 -2.276 -5.557 13.752 1.00 0.00 O ATOM 1121 NE2 GLN A 76 -3.579 -4.702 15.369 1.00 0.00 N ATOM 0 H GLN A 76 -1.930 -4.421 12.221 1.00 0.00 H new ATOM 0 HA GLN A 76 -0.572 -1.916 11.943 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -1.278 -1.548 14.191 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -2.581 -2.416 13.404 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -0.495 -3.984 14.899 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -1.710 -3.111 15.811 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.716 -3.971 16.067 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -4.279 -5.435 15.255 1.00 0.00 H new ATOM 1130 N ASN A 77 1.234 -4.340 12.691 1.00 0.00 N ATOM 1131 CA ASN A 77 2.559 -4.795 13.097 1.00 0.00 C ATOM 1132 C ASN A 77 3.423 -5.109 11.880 1.00 0.00 C ATOM 1133 O ASN A 77 3.669 -6.272 11.564 1.00 0.00 O ATOM 1134 CB ASN A 77 2.444 -6.033 13.988 1.00 0.00 C ATOM 1135 CG ASN A 77 1.536 -7.092 13.393 1.00 0.00 C ATOM 1136 OD1 ASN A 77 1.987 -7.972 12.660 1.00 0.00 O ATOM 1137 ND2 ASN A 77 0.248 -7.011 13.707 1.00 0.00 N ATOM 0 H ASN A 77 0.721 -5.001 12.108 1.00 0.00 H new ATOM 0 HA ASN A 77 3.035 -3.992 13.660 1.00 0.00 H new ATOM 0 HB2 ASN A 77 3.436 -6.456 14.147 1.00 0.00 H new ATOM 0 HB3 ASN A 77 2.063 -5.739 14.966 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -0.411 -7.696 13.337 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -0.082 -6.264 14.319 1.00 0.00 H new ATOM 1144 N GLY A 78 3.881 -4.062 11.200 1.00 0.00 N ATOM 1145 CA GLY A 78 4.714 -4.247 10.025 1.00 0.00 C ATOM 1146 C GLY A 78 5.149 -2.932 9.410 1.00 0.00 C ATOM 1147 O GLY A 78 5.063 -2.748 8.196 1.00 0.00 O ATOM 0 H GLY A 78 3.690 -3.089 11.441 1.00 0.00 H new ATOM 0 HA2 GLY A 78 5.596 -4.827 10.296 1.00 0.00 H new ATOM 0 HA3 GLY A 78 4.166 -4.828 9.283 1.00 0.00 H new ATOM 1151 N SER A 79 5.616 -2.013 10.250 1.00 0.00 N ATOM 1152 CA SER A 79 6.061 -0.706 9.783 1.00 0.00 C ATOM 1153 C SER A 79 6.837 -0.832 8.476 1.00 0.00 C ATOM 1154 O SER A 79 6.809 0.067 7.635 1.00 0.00 O ATOM 1155 CB SER A 79 6.931 -0.030 10.844 1.00 0.00 C ATOM 1156 OG SER A 79 6.137 0.678 11.780 1.00 0.00 O ATOM 0 H SER A 79 5.696 -2.150 11.258 1.00 0.00 H new ATOM 0 HA SER A 79 5.179 -0.092 9.603 1.00 0.00 H new ATOM 0 HB2 SER A 79 7.527 -0.781 11.363 1.00 0.00 H new ATOM 0 HB3 SER A 79 7.630 0.655 10.363 1.00 0.00 H new ATOM 0 HG SER A 79 6.717 1.099 12.448 1.00 0.00 H new ATOM 1162 N ARG A 80 7.531 -1.953 8.313 1.00 0.00 N ATOM 1163 CA ARG A 80 8.318 -2.198 7.110 1.00 0.00 C ATOM 1164 C ARG A 80 7.666 -3.271 6.243 1.00 0.00 C ATOM 1165 O ARG A 80 7.384 -4.374 6.711 1.00 0.00 O ATOM 1166 CB ARG A 80 9.740 -2.621 7.481 1.00 0.00 C ATOM 1167 CG ARG A 80 10.626 -2.903 6.279 1.00 0.00 C ATOM 1168 CD ARG A 80 12.090 -2.634 6.590 1.00 0.00 C ATOM 1169 NE ARG A 80 12.669 -3.674 7.436 1.00 0.00 N ATOM 1170 CZ ARG A 80 13.975 -3.889 7.546 1.00 0.00 C ATOM 1171 NH1 ARG A 80 14.833 -3.141 6.867 1.00 0.00 N ATOM 1172 NH2 ARG A 80 14.425 -4.855 8.336 1.00 0.00 N ATOM 0 H ARG A 80 7.565 -2.707 8.999 1.00 0.00 H new ATOM 0 HA ARG A 80 8.360 -1.270 6.539 1.00 0.00 H new ATOM 0 HB2 ARG A 80 10.198 -1.836 8.083 1.00 0.00 H new ATOM 0 HB3 ARG A 80 9.693 -3.514 8.104 1.00 0.00 H new ATOM 0 HG2 ARG A 80 10.503 -3.941 5.971 1.00 0.00 H new ATOM 0 HG3 ARG A 80 10.311 -2.282 5.440 1.00 0.00 H new ATOM 0 HD2 ARG A 80 12.653 -2.569 5.659 1.00 0.00 H new ATOM 0 HD3 ARG A 80 12.184 -1.668 7.087 1.00 0.00 H new ATOM 0 HE ARG A 80 12.036 -4.268 7.972 1.00 0.00 H new ATOM 0 HH11 ARG A 80 14.491 -2.398 6.258 1.00 0.00 H new ATOM 0 HH12 ARG A 80 15.835 -3.309 6.954 1.00 0.00 H new ATOM 0 HH21 ARG A 80 13.768 -5.433 8.860 1.00 0.00 H new ATOM 0 HH22 ARG A 80 15.428 -5.019 8.420 1.00 0.00 H new ATOM 1186 N ALA A 81 7.429 -2.940 4.978 1.00 0.00 N ATOM 1187 CA ALA A 81 6.812 -3.875 4.046 1.00 0.00 C ATOM 1188 C ALA A 81 7.707 -4.113 2.834 1.00 0.00 C ATOM 1189 O ALA A 81 8.376 -3.197 2.355 1.00 0.00 O ATOM 1190 CB ALA A 81 5.450 -3.361 3.606 1.00 0.00 C ATOM 0 H ALA A 81 7.655 -2.031 4.575 1.00 0.00 H new ATOM 0 HA ALA A 81 6.680 -4.827 4.560 1.00 0.00 H new ATOM 0 HB1 ALA A 81 5.001 -4.070 2.910 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.804 -3.249 4.477 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.567 -2.395 3.115 1.00 0.00 H new ATOM 1196 N ARG A 82 7.714 -5.348 2.343 1.00 0.00 N ATOM 1197 CA ARG A 82 8.528 -5.706 1.188 1.00 0.00 C ATOM 1198 C ARG A 82 7.702 -6.468 0.155 1.00 0.00 C ATOM 1199 O ARG A 82 6.878 -7.312 0.506 1.00 0.00 O ATOM 1200 CB ARG A 82 9.725 -6.553 1.624 1.00 0.00 C ATOM 1201 CG ARG A 82 10.733 -6.801 0.514 1.00 0.00 C ATOM 1202 CD ARG A 82 11.590 -8.023 0.801 1.00 0.00 C ATOM 1203 NE ARG A 82 12.703 -7.713 1.695 1.00 0.00 N ATOM 1204 CZ ARG A 82 13.658 -8.582 2.007 1.00 0.00 C ATOM 1205 NH1 ARG A 82 13.636 -9.807 1.502 1.00 0.00 N ATOM 1206 NH2 ARG A 82 14.639 -8.225 2.828 1.00 0.00 N ATOM 0 H ARG A 82 7.165 -6.117 2.727 1.00 0.00 H new ATOM 0 HA ARG A 82 8.890 -4.785 0.731 1.00 0.00 H new ATOM 0 HB2 ARG A 82 10.227 -6.057 2.455 1.00 0.00 H new ATOM 0 HB3 ARG A 82 9.364 -7.512 1.996 1.00 0.00 H new ATOM 0 HG2 ARG A 82 10.208 -6.938 -0.431 1.00 0.00 H new ATOM 0 HG3 ARG A 82 11.373 -5.926 0.400 1.00 0.00 H new ATOM 0 HD2 ARG A 82 10.972 -8.802 1.248 1.00 0.00 H new ATOM 0 HD3 ARG A 82 11.978 -8.422 -0.136 1.00 0.00 H new ATOM 0 HE ARG A 82 12.749 -6.779 2.102 1.00 0.00 H new ATOM 0 HH11 ARG A 82 12.884 -10.085 0.871 1.00 0.00 H new ATOM 0 HH12 ARG A 82 14.371 -10.472 1.744 1.00 0.00 H new ATOM 0 HH21 ARG A 82 14.659 -7.283 3.219 1.00 0.00 H new ATOM 0 HH22 ARG A 82 15.372 -8.893 3.067 1.00 0.00 H new ATOM 1220 N ILE A 83 7.929 -6.162 -1.118 1.00 0.00 N ATOM 1221 CA ILE A 83 7.206 -6.818 -2.200 1.00 0.00 C ATOM 1222 C ILE A 83 8.165 -7.520 -3.155 1.00 0.00 C ATOM 1223 O ILE A 83 9.378 -7.318 -3.093 1.00 0.00 O ATOM 1224 CB ILE A 83 6.351 -5.814 -2.996 1.00 0.00 C ATOM 1225 CG1 ILE A 83 5.797 -4.733 -2.065 1.00 0.00 C ATOM 1226 CG2 ILE A 83 5.220 -6.534 -3.714 1.00 0.00 C ATOM 1227 CD1 ILE A 83 5.129 -3.590 -2.797 1.00 0.00 C ATOM 0 H ILE A 83 8.607 -5.465 -1.425 1.00 0.00 H new ATOM 0 HA ILE A 83 6.550 -7.556 -1.739 1.00 0.00 H new ATOM 0 HB ILE A 83 6.982 -5.334 -3.744 1.00 0.00 H new ATOM 0 HG12 ILE A 83 5.078 -5.186 -1.382 1.00 0.00 H new ATOM 0 HG13 ILE A 83 6.610 -4.338 -1.456 1.00 0.00 H new ATOM 0 HG21 ILE A 83 4.625 -5.811 -4.272 1.00 0.00 H new ATOM 0 HG22 ILE A 83 5.636 -7.270 -4.402 1.00 0.00 H new ATOM 0 HG23 ILE A 83 4.587 -7.038 -2.983 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.760 -2.862 -2.075 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.850 -3.111 -3.459 1.00 0.00 H new ATOM 0 HD13 ILE A 83 4.295 -3.973 -3.385 1.00 0.00 H new ATOM 1239 N SER A 84 7.613 -8.345 -4.039 1.00 0.00 N ATOM 1240 CA SER A 84 8.420 -9.080 -5.007 1.00 0.00 C ATOM 1241 C SER A 84 8.218 -8.526 -6.414 1.00 0.00 C ATOM 1242 O SER A 84 7.185 -8.755 -7.043 1.00 0.00 O ATOM 1243 CB SER A 84 8.062 -10.567 -4.976 1.00 0.00 C ATOM 1244 OG SER A 84 8.776 -11.242 -3.955 1.00 0.00 O ATOM 0 H SER A 84 6.611 -8.521 -4.105 1.00 0.00 H new ATOM 0 HA SER A 84 9.469 -8.960 -4.735 1.00 0.00 H new ATOM 0 HB2 SER A 84 6.991 -10.683 -4.813 1.00 0.00 H new ATOM 0 HB3 SER A 84 8.288 -11.019 -5.942 1.00 0.00 H new ATOM 0 HG SER A 84 8.528 -12.190 -3.955 1.00 0.00 H new ATOM 1250 N VAL A 85 9.214 -7.793 -6.903 1.00 0.00 N ATOM 1251 CA VAL A 85 9.149 -7.206 -8.236 1.00 0.00 C ATOM 1252 C VAL A 85 8.478 -8.156 -9.223 1.00 0.00 C ATOM 1253 O VAL A 85 9.094 -9.111 -9.696 1.00 0.00 O ATOM 1254 CB VAL A 85 10.551 -6.846 -8.760 1.00 0.00 C ATOM 1255 CG1 VAL A 85 10.468 -6.296 -10.176 1.00 0.00 C ATOM 1256 CG2 VAL A 85 11.227 -5.849 -7.831 1.00 0.00 C ATOM 0 H VAL A 85 10.076 -7.592 -6.395 1.00 0.00 H new ATOM 0 HA VAL A 85 8.556 -6.295 -8.152 1.00 0.00 H new ATOM 0 HB VAL A 85 11.155 -7.753 -8.784 1.00 0.00 H new ATOM 0 HG11 VAL A 85 11.469 -6.047 -10.529 1.00 0.00 H new ATOM 0 HG12 VAL A 85 10.028 -7.046 -10.833 1.00 0.00 H new ATOM 0 HG13 VAL A 85 9.848 -5.400 -10.182 1.00 0.00 H new ATOM 0 HG21 VAL A 85 12.217 -5.606 -8.217 1.00 0.00 H new ATOM 0 HG22 VAL A 85 10.627 -4.941 -7.773 1.00 0.00 H new ATOM 0 HG23 VAL A 85 11.322 -6.285 -6.837 1.00 0.00 H new ATOM 1266 N GLN A 86 7.213 -7.887 -9.528 1.00 0.00 N ATOM 1267 CA GLN A 86 6.459 -8.718 -10.459 1.00 0.00 C ATOM 1268 C GLN A 86 6.816 -8.381 -11.903 1.00 0.00 C ATOM 1269 O GLN A 86 6.779 -9.243 -12.780 1.00 0.00 O ATOM 1270 CB GLN A 86 4.957 -8.536 -10.236 1.00 0.00 C ATOM 1271 CG GLN A 86 4.508 -8.859 -8.820 1.00 0.00 C ATOM 1272 CD GLN A 86 4.259 -10.339 -8.610 1.00 0.00 C ATOM 1273 OE1 GLN A 86 4.135 -11.102 -9.569 1.00 0.00 O ATOM 1274 NE2 GLN A 86 4.185 -10.755 -7.351 1.00 0.00 N ATOM 0 H GLN A 86 6.689 -7.101 -9.144 1.00 0.00 H new ATOM 0 HA GLN A 86 6.723 -9.759 -10.273 1.00 0.00 H new ATOM 0 HB2 GLN A 86 4.686 -7.506 -10.468 1.00 0.00 H new ATOM 0 HB3 GLN A 86 4.415 -9.173 -10.934 1.00 0.00 H new ATOM 0 HG2 GLN A 86 5.267 -8.519 -8.116 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.596 -8.306 -8.597 1.00 0.00 H new ATOM 0 HE21 GLN A 86 4.294 -10.089 -6.586 1.00 0.00 H new ATOM 0 HE22 GLN A 86 4.020 -11.741 -7.149 1.00 0.00 H new ATOM 1283 N VAL A 87 7.160 -7.119 -12.142 1.00 0.00 N ATOM 1284 CA VAL A 87 7.524 -6.667 -13.480 1.00 0.00 C ATOM 1285 C VAL A 87 8.764 -5.781 -13.442 1.00 0.00 C ATOM 1286 O VAL A 87 8.967 -5.020 -12.496 1.00 0.00 O ATOM 1287 CB VAL A 87 6.371 -5.890 -14.143 1.00 0.00 C ATOM 1288 CG1 VAL A 87 6.880 -5.092 -15.333 1.00 0.00 C ATOM 1289 CG2 VAL A 87 5.261 -6.841 -14.564 1.00 0.00 C ATOM 0 H VAL A 87 7.194 -6.392 -11.427 1.00 0.00 H new ATOM 0 HA VAL A 87 7.736 -7.559 -14.069 1.00 0.00 H new ATOM 0 HB VAL A 87 5.962 -5.190 -13.415 1.00 0.00 H new ATOM 0 HG11 VAL A 87 6.051 -4.550 -15.789 1.00 0.00 H new ATOM 0 HG12 VAL A 87 7.637 -4.383 -14.999 1.00 0.00 H new ATOM 0 HG13 VAL A 87 7.316 -5.770 -16.066 1.00 0.00 H new ATOM 0 HG21 VAL A 87 4.455 -6.275 -15.031 1.00 0.00 H new ATOM 0 HG22 VAL A 87 5.654 -7.567 -15.276 1.00 0.00 H new ATOM 0 HG23 VAL A 87 4.878 -7.364 -13.688 1.00 0.00 H new ATOM 1299 N HIS A 88 9.591 -5.885 -14.478 1.00 0.00 N ATOM 1300 CA HIS A 88 10.812 -5.092 -14.564 1.00 0.00 C ATOM 1301 C HIS A 88 10.724 -4.081 -15.703 1.00 0.00 C ATOM 1302 O HIS A 88 10.021 -4.302 -16.689 1.00 0.00 O ATOM 1303 CB HIS A 88 12.023 -6.002 -14.767 1.00 0.00 C ATOM 1304 CG HIS A 88 12.590 -6.539 -13.488 1.00 0.00 C ATOM 1305 ND1 HIS A 88 12.708 -7.887 -13.224 1.00 0.00 N ATOM 1306 CD2 HIS A 88 13.074 -5.900 -12.398 1.00 0.00 C ATOM 1307 CE1 HIS A 88 13.239 -8.054 -12.026 1.00 0.00 C ATOM 1308 NE2 HIS A 88 13.471 -6.864 -11.504 1.00 0.00 N ATOM 0 H HIS A 88 9.438 -6.510 -15.269 1.00 0.00 H new ATOM 0 HA HIS A 88 10.929 -4.548 -13.627 1.00 0.00 H new ATOM 0 HB2 HIS A 88 11.737 -6.837 -15.407 1.00 0.00 H new ATOM 0 HB3 HIS A 88 12.799 -5.448 -15.295 1.00 0.00 H new ATOM 0 HD2 HIS A 88 13.136 -4.831 -12.257 1.00 0.00 H new ATOM 0 HE1 HIS A 88 13.448 -9.003 -11.554 1.00 0.00 H new ATOM 0 HE2 HIS A 88 13.879 -6.689 -10.586 1.00 0.00 H new ATOM 1317 N ASN A 89 11.441 -2.972 -15.561 1.00 0.00 N ATOM 1318 CA ASN A 89 11.443 -1.926 -16.578 1.00 0.00 C ATOM 1319 C ASN A 89 10.045 -1.341 -16.759 1.00 0.00 C ATOM 1320 O ASN A 89 9.612 -1.078 -17.880 1.00 0.00 O ATOM 1321 CB ASN A 89 11.952 -2.482 -17.909 1.00 0.00 C ATOM 1322 CG ASN A 89 12.296 -1.386 -18.899 1.00 0.00 C ATOM 1323 OD1 ASN A 89 11.411 -0.718 -19.435 1.00 0.00 O ATOM 1324 ND2 ASN A 89 13.587 -1.197 -19.147 1.00 0.00 N ATOM 0 H ASN A 89 12.029 -2.774 -14.751 1.00 0.00 H new ATOM 0 HA ASN A 89 12.110 -1.131 -16.245 1.00 0.00 H new ATOM 0 HB2 ASN A 89 12.835 -3.096 -17.730 1.00 0.00 H new ATOM 0 HB3 ASN A 89 11.193 -3.134 -18.342 1.00 0.00 H new ATOM 0 HD21 ASN A 89 13.880 -0.474 -19.805 1.00 0.00 H new ATOM 0 HD22 ASN A 89 14.286 -1.774 -18.680 1.00 0.00 H new ATOM 1331 N ALA A 90 9.345 -1.140 -15.647 1.00 0.00 N ATOM 1332 CA ALA A 90 7.999 -0.584 -15.682 1.00 0.00 C ATOM 1333 C ALA A 90 7.790 0.420 -14.554 1.00 0.00 C ATOM 1334 O ALA A 90 8.527 0.425 -13.567 1.00 0.00 O ATOM 1335 CB ALA A 90 6.965 -1.698 -15.598 1.00 0.00 C ATOM 0 H ALA A 90 9.689 -1.354 -14.711 1.00 0.00 H new ATOM 0 HA ALA A 90 7.875 -0.058 -16.629 1.00 0.00 H new ATOM 0 HB1 ALA A 90 5.964 -1.268 -15.625 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.092 -2.376 -16.442 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.098 -2.249 -14.667 1.00 0.00 H new ATOM 1341 N THR A 91 6.780 1.272 -14.706 1.00 0.00 N ATOM 1342 CA THR A 91 6.476 2.283 -13.701 1.00 0.00 C ATOM 1343 C THR A 91 5.443 1.772 -12.703 1.00 0.00 C ATOM 1344 O THR A 91 4.334 1.393 -13.082 1.00 0.00 O ATOM 1345 CB THR A 91 5.951 3.578 -14.348 1.00 0.00 C ATOM 1346 OG1 THR A 91 4.974 3.266 -15.347 1.00 0.00 O ATOM 1347 CG2 THR A 91 7.089 4.370 -14.974 1.00 0.00 C ATOM 0 H THR A 91 6.159 1.282 -15.515 1.00 0.00 H new ATOM 0 HA THR A 91 7.407 2.499 -13.178 1.00 0.00 H new ATOM 0 HB THR A 91 5.491 4.186 -13.569 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.484 2.459 -15.084 1.00 0.00 H new ATOM 0 HG21 THR A 91 6.694 5.280 -15.425 1.00 0.00 H new ATOM 0 HG22 THR A 91 7.816 4.632 -14.205 1.00 0.00 H new ATOM 0 HG23 THR A 91 7.574 3.766 -15.741 1.00 0.00 H new ATOM 1355 N CYS A 92 5.813 1.765 -11.427 1.00 0.00 N ATOM 1356 CA CYS A 92 4.917 1.300 -10.374 1.00 0.00 C ATOM 1357 C CYS A 92 4.530 2.446 -9.445 1.00 0.00 C ATOM 1358 O CYS A 92 5.334 3.337 -9.171 1.00 0.00 O ATOM 1359 CB CYS A 92 5.578 0.178 -9.572 1.00 0.00 C ATOM 1360 SG CYS A 92 4.544 -0.492 -8.249 1.00 0.00 S ATOM 0 H CYS A 92 6.727 2.076 -11.097 1.00 0.00 H new ATOM 0 HA CYS A 92 4.012 0.916 -10.844 1.00 0.00 H new ATOM 0 HB2 CYS A 92 5.848 -0.630 -10.252 1.00 0.00 H new ATOM 0 HB3 CYS A 92 6.505 0.553 -9.139 1.00 0.00 H new ATOM 0 HG CYS A 92 3.302 -0.502 -8.632 1.00 0.00 H new ATOM 1366 N THR A 93 3.291 2.417 -8.963 1.00 0.00 N ATOM 1367 CA THR A 93 2.795 3.454 -8.067 1.00 0.00 C ATOM 1368 C THR A 93 2.479 2.885 -6.689 1.00 0.00 C ATOM 1369 O THR A 93 1.602 2.033 -6.544 1.00 0.00 O ATOM 1370 CB THR A 93 1.532 4.129 -8.633 1.00 0.00 C ATOM 1371 OG1 THR A 93 1.617 4.209 -10.061 1.00 0.00 O ATOM 1372 CG2 THR A 93 1.357 5.524 -8.052 1.00 0.00 C ATOM 0 H THR A 93 2.613 1.686 -9.178 1.00 0.00 H new ATOM 0 HA THR A 93 3.586 4.198 -7.977 1.00 0.00 H new ATOM 0 HB THR A 93 0.668 3.525 -8.354 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.809 4.638 -10.413 1.00 0.00 H new ATOM 0 HG21 THR A 93 0.458 5.981 -8.467 1.00 0.00 H new ATOM 0 HG22 THR A 93 1.263 5.458 -6.968 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.224 6.135 -8.304 1.00 0.00 H new ATOM 1380 N VAL A 94 3.198 3.361 -5.677 1.00 0.00 N ATOM 1381 CA VAL A 94 2.992 2.901 -4.309 1.00 0.00 C ATOM 1382 C VAL A 94 2.111 3.870 -3.530 1.00 0.00 C ATOM 1383 O VAL A 94 2.229 5.087 -3.675 1.00 0.00 O ATOM 1384 CB VAL A 94 4.331 2.731 -3.567 1.00 0.00 C ATOM 1385 CG1 VAL A 94 4.129 1.961 -2.271 1.00 0.00 C ATOM 1386 CG2 VAL A 94 5.349 2.035 -4.457 1.00 0.00 C ATOM 0 H VAL A 94 3.929 4.065 -5.779 1.00 0.00 H new ATOM 0 HA VAL A 94 2.494 1.933 -4.372 1.00 0.00 H new ATOM 0 HB VAL A 94 4.716 3.720 -3.318 1.00 0.00 H new ATOM 0 HG11 VAL A 94 5.086 1.851 -1.760 1.00 0.00 H new ATOM 0 HG12 VAL A 94 3.436 2.505 -1.629 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.721 0.975 -2.493 1.00 0.00 H new ATOM 0 HG21 VAL A 94 6.289 1.923 -3.916 1.00 0.00 H new ATOM 0 HG22 VAL A 94 4.974 1.051 -4.739 1.00 0.00 H new ATOM 0 HG23 VAL A 94 5.515 2.631 -5.355 1.00 0.00 H new ATOM 1396 N ARG A 95 1.226 3.322 -2.703 1.00 0.00 N ATOM 1397 CA ARG A 95 0.324 4.138 -1.900 1.00 0.00 C ATOM 1398 C ARG A 95 -0.120 3.388 -0.648 1.00 0.00 C ATOM 1399 O ARG A 95 -0.665 2.287 -0.733 1.00 0.00 O ATOM 1400 CB ARG A 95 -0.900 4.545 -2.724 1.00 0.00 C ATOM 1401 CG ARG A 95 -0.574 5.478 -3.878 1.00 0.00 C ATOM 1402 CD ARG A 95 -1.834 6.076 -4.484 1.00 0.00 C ATOM 1403 NE ARG A 95 -2.409 7.115 -3.635 1.00 0.00 N ATOM 1404 CZ ARG A 95 -3.489 7.817 -3.962 1.00 0.00 C ATOM 1405 NH1 ARG A 95 -4.107 7.591 -5.113 1.00 0.00 N ATOM 1406 NH2 ARG A 95 -3.953 8.746 -3.136 1.00 0.00 N ATOM 0 H ARG A 95 1.115 2.317 -2.572 1.00 0.00 H new ATOM 0 HA ARG A 95 0.863 5.035 -1.593 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -1.378 3.648 -3.117 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.624 5.030 -2.069 1.00 0.00 H new ATOM 0 HG2 ARG A 95 0.078 6.278 -3.527 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -0.024 4.932 -4.645 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -1.602 6.495 -5.463 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -2.570 5.288 -4.641 1.00 0.00 H new ATOM 0 HE ARG A 95 -1.957 7.313 -2.742 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -3.754 6.877 -5.750 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -4.936 8.131 -5.362 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -3.481 8.922 -2.249 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -4.782 9.284 -3.388 1.00 0.00 H new ATOM 1420 N ILE A 96 0.119 3.990 0.513 1.00 0.00 N ATOM 1421 CA ILE A 96 -0.257 3.378 1.781 1.00 0.00 C ATOM 1422 C ILE A 96 -1.364 4.171 2.467 1.00 0.00 C ATOM 1423 O ILE A 96 -1.400 5.399 2.394 1.00 0.00 O ATOM 1424 CB ILE A 96 0.949 3.273 2.734 1.00 0.00 C ATOM 1425 CG1 ILE A 96 2.173 2.741 1.986 1.00 0.00 C ATOM 1426 CG2 ILE A 96 0.613 2.376 3.916 1.00 0.00 C ATOM 1427 CD1 ILE A 96 3.367 2.493 2.880 1.00 0.00 C ATOM 0 H ILE A 96 0.571 4.900 0.601 1.00 0.00 H new ATOM 0 HA ILE A 96 -0.619 2.375 1.553 1.00 0.00 H new ATOM 0 HB ILE A 96 1.182 4.268 3.112 1.00 0.00 H new ATOM 0 HG12 ILE A 96 1.906 1.811 1.484 1.00 0.00 H new ATOM 0 HG13 ILE A 96 2.452 3.453 1.210 1.00 0.00 H new ATOM 0 HG21 ILE A 96 1.475 2.312 4.580 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.234 2.793 4.460 1.00 0.00 H new ATOM 0 HG23 ILE A 96 0.358 1.380 3.556 1.00 0.00 H new ATOM 0 HD11 ILE A 96 4.197 2.117 2.282 1.00 0.00 H new ATOM 0 HD12 ILE A 96 3.660 3.425 3.362 1.00 0.00 H new ATOM 0 HD13 ILE A 96 3.105 1.758 3.641 1.00 0.00 H new ATOM 1439 N ALA A 97 -2.267 3.459 3.135 1.00 0.00 N ATOM 1440 CA ALA A 97 -3.374 4.096 3.838 1.00 0.00 C ATOM 1441 C ALA A 97 -3.610 3.444 5.196 1.00 0.00 C ATOM 1442 O ALA A 97 -3.582 2.220 5.320 1.00 0.00 O ATOM 1443 CB ALA A 97 -4.638 4.037 2.994 1.00 0.00 C ATOM 0 H ALA A 97 -2.253 2.441 3.204 1.00 0.00 H new ATOM 0 HA ALA A 97 -3.112 5.140 4.007 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.457 4.516 3.531 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -4.470 4.556 2.050 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.894 2.996 2.795 1.00 0.00 H new ATOM 1449 N ALA A 98 -3.842 4.269 6.211 1.00 0.00 N ATOM 1450 CA ALA A 98 -4.085 3.771 7.560 1.00 0.00 C ATOM 1451 C ALA A 98 -5.539 3.346 7.735 1.00 0.00 C ATOM 1452 O ALA A 98 -6.458 4.131 7.499 1.00 0.00 O ATOM 1453 CB ALA A 98 -3.715 4.830 8.588 1.00 0.00 C ATOM 0 H ALA A 98 -3.867 5.285 6.125 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.457 2.894 7.716 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -3.901 4.445 9.590 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -2.659 5.082 8.487 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -4.319 5.723 8.424 1.00 0.00 H new ATOM 1459 N VAL A 99 -5.740 2.100 8.150 1.00 0.00 N ATOM 1460 CA VAL A 99 -7.083 1.571 8.357 1.00 0.00 C ATOM 1461 C VAL A 99 -7.326 1.248 9.827 1.00 0.00 C ATOM 1462 O VAL A 99 -6.410 0.848 10.546 1.00 0.00 O ATOM 1463 CB VAL A 99 -7.322 0.301 7.517 1.00 0.00 C ATOM 1464 CG1 VAL A 99 -6.996 0.559 6.054 1.00 0.00 C ATOM 1465 CG2 VAL A 99 -6.499 -0.858 8.059 1.00 0.00 C ATOM 0 H VAL A 99 -4.990 1.438 8.350 1.00 0.00 H new ATOM 0 HA VAL A 99 -7.781 2.345 8.038 1.00 0.00 H new ATOM 0 HB VAL A 99 -8.376 0.033 7.587 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -7.171 -0.349 5.477 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -7.633 1.358 5.675 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -5.950 0.853 5.961 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -6.680 -1.747 7.454 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.440 -0.602 8.020 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -6.787 -1.057 9.091 1.00 0.00 H new ATOM 1475 N THR A 100 -8.568 1.424 10.268 1.00 0.00 N ATOM 1476 CA THR A 100 -8.932 1.152 11.653 1.00 0.00 C ATOM 1477 C THR A 100 -10.123 0.203 11.732 1.00 0.00 C ATOM 1478 O THR A 100 -10.623 -0.267 10.710 1.00 0.00 O ATOM 1479 CB THR A 100 -9.273 2.450 12.409 1.00 0.00 C ATOM 1480 OG1 THR A 100 -10.445 3.050 11.848 1.00 0.00 O ATOM 1481 CG2 THR A 100 -8.114 3.433 12.347 1.00 0.00 C ATOM 0 H THR A 100 -9.338 1.754 9.686 1.00 0.00 H new ATOM 0 HA THR A 100 -8.066 0.684 12.122 1.00 0.00 H new ATOM 0 HB THR A 100 -9.459 2.198 13.453 1.00 0.00 H new ATOM 0 HG1 THR A 100 -10.748 3.780 12.428 1.00 0.00 H new ATOM 0 HG21 THR A 100 -8.378 4.342 12.888 1.00 0.00 H new ATOM 0 HG22 THR A 100 -7.231 2.984 12.802 1.00 0.00 H new ATOM 0 HG23 THR A 100 -7.901 3.679 11.307 1.00 0.00 H new ATOM 1489 N ARG A 101 -10.572 -0.074 12.952 1.00 0.00 N ATOM 1490 CA ARG A 101 -11.704 -0.968 13.164 1.00 0.00 C ATOM 1491 C ARG A 101 -13.007 -0.311 12.716 1.00 0.00 C ATOM 1492 O ARG A 101 -14.068 -0.933 12.740 1.00 0.00 O ATOM 1493 CB ARG A 101 -11.801 -1.363 14.639 1.00 0.00 C ATOM 1494 CG ARG A 101 -10.944 -2.564 15.004 1.00 0.00 C ATOM 1495 CD ARG A 101 -11.539 -3.337 16.171 1.00 0.00 C ATOM 1496 NE ARG A 101 -11.457 -2.588 17.422 1.00 0.00 N ATOM 1497 CZ ARG A 101 -11.943 -3.031 18.576 1.00 0.00 C ATOM 1498 NH1 ARG A 101 -12.543 -4.211 18.638 1.00 0.00 N ATOM 1499 NH2 ARG A 101 -11.830 -2.291 19.672 1.00 0.00 N ATOM 0 H ARG A 101 -10.169 0.308 13.808 1.00 0.00 H new ATOM 0 HA ARG A 101 -11.544 -1.864 12.565 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -11.503 -0.514 15.254 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -12.841 -1.582 14.880 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -10.850 -3.222 14.140 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -9.939 -2.231 15.261 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -12.582 -3.572 15.957 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -11.015 -4.286 16.282 1.00 0.00 H new ATOM 0 HE ARG A 101 -11.002 -1.675 17.409 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -12.633 -4.782 17.798 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -12.915 -4.548 19.526 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -11.370 -1.382 19.628 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -12.203 -2.632 20.558 1.00 0.00 H new ATOM 1513 N GLY A 102 -12.918 0.952 12.310 1.00 0.00 N ATOM 1514 CA GLY A 102 -14.095 1.673 11.863 1.00 0.00 C ATOM 1515 C GLY A 102 -14.194 1.744 10.352 1.00 0.00 C ATOM 1516 O GLY A 102 -15.285 1.661 9.790 1.00 0.00 O ATOM 0 H GLY A 102 -12.051 1.489 12.283 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -14.987 1.188 12.260 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.074 2.684 12.270 1.00 0.00 H new ATOM 1520 N GLY A 103 -13.050 1.900 9.693 1.00 0.00 N ATOM 1521 CA GLY A 103 -13.034 1.982 8.244 1.00 0.00 C ATOM 1522 C GLY A 103 -11.633 2.136 7.687 1.00 0.00 C ATOM 1523 O GLY A 103 -10.649 1.969 8.408 1.00 0.00 O ATOM 0 H GLY A 103 -12.134 1.971 10.136 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -13.490 1.084 7.827 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -13.644 2.827 7.924 1.00 0.00 H new ATOM 1527 N VAL A 104 -11.541 2.454 6.400 1.00 0.00 N ATOM 1528 CA VAL A 104 -10.249 2.630 5.746 1.00 0.00 C ATOM 1529 C VAL A 104 -10.019 4.089 5.367 1.00 0.00 C ATOM 1530 O VAL A 104 -10.856 4.711 4.715 1.00 0.00 O ATOM 1531 CB VAL A 104 -10.137 1.758 4.481 1.00 0.00 C ATOM 1532 CG1 VAL A 104 -8.857 2.078 3.724 1.00 0.00 C ATOM 1533 CG2 VAL A 104 -10.198 0.282 4.844 1.00 0.00 C ATOM 0 H VAL A 104 -12.346 2.595 5.789 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.487 2.319 6.461 1.00 0.00 H new ATOM 0 HB VAL A 104 -10.982 1.983 3.830 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -8.795 1.453 2.833 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -8.861 3.128 3.431 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -7.997 1.883 4.365 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -10.117 -0.319 3.938 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -9.375 0.038 5.516 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -11.145 0.068 5.339 1.00 0.00 H new ATOM 1543 N GLY A 105 -8.877 4.629 5.781 1.00 0.00 N ATOM 1544 CA GLY A 105 -8.556 6.011 5.476 1.00 0.00 C ATOM 1545 C GLY A 105 -8.032 6.186 4.064 1.00 0.00 C ATOM 1546 O GLY A 105 -7.707 5.218 3.376 1.00 0.00 O ATOM 0 H GLY A 105 -8.168 4.134 6.322 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -9.446 6.626 5.609 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.811 6.373 6.184 1.00 0.00 H new ATOM 1550 N PRO A 106 -7.945 7.446 3.613 1.00 0.00 N ATOM 1551 CA PRO A 106 -7.457 7.774 2.270 1.00 0.00 C ATOM 1552 C PRO A 106 -5.963 7.512 2.115 1.00 0.00 C ATOM 1553 O PRO A 106 -5.189 7.703 3.053 1.00 0.00 O ATOM 1554 CB PRO A 106 -7.754 9.270 2.141 1.00 0.00 C ATOM 1555 CG PRO A 106 -7.776 9.775 3.543 1.00 0.00 C ATOM 1556 CD PRO A 106 -8.315 8.648 4.380 1.00 0.00 C ATOM 0 HA PRO A 106 -7.933 7.163 1.503 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.990 9.776 1.550 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -8.708 9.443 1.643 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -6.777 10.061 3.871 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -8.405 10.661 3.629 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -7.873 8.641 5.376 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -9.394 8.725 4.510 1.00 0.00 H new ATOM 1564 N PHE A 107 -5.564 7.072 0.926 1.00 0.00 N ATOM 1565 CA PHE A 107 -4.162 6.783 0.649 1.00 0.00 C ATOM 1566 C PHE A 107 -3.364 8.073 0.481 1.00 0.00 C ATOM 1567 O PHE A 107 -3.905 9.103 0.082 1.00 0.00 O ATOM 1568 CB PHE A 107 -4.036 5.924 -0.611 1.00 0.00 C ATOM 1569 CG PHE A 107 -4.522 4.515 -0.427 1.00 0.00 C ATOM 1570 CD1 PHE A 107 -5.856 4.257 -0.159 1.00 0.00 C ATOM 1571 CD2 PHE A 107 -3.643 3.448 -0.522 1.00 0.00 C ATOM 1572 CE1 PHE A 107 -6.305 2.961 0.012 1.00 0.00 C ATOM 1573 CE2 PHE A 107 -4.086 2.149 -0.352 1.00 0.00 C ATOM 1574 CZ PHE A 107 -5.420 1.906 -0.086 1.00 0.00 C ATOM 0 H PHE A 107 -6.192 6.908 0.139 1.00 0.00 H new ATOM 0 HA PHE A 107 -3.755 6.233 1.498 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -4.600 6.392 -1.418 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -2.992 5.902 -0.923 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -6.554 5.078 -0.083 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -2.600 3.633 -0.731 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -7.348 2.774 0.222 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -3.391 1.326 -0.427 1.00 0.00 H new ATOM 0 HZ PHE A 107 -5.770 0.893 0.045 1.00 0.00 H new ATOM 1584 N SER A 108 -2.073 8.006 0.790 1.00 0.00 N ATOM 1585 CA SER A 108 -1.199 9.169 0.678 1.00 0.00 C ATOM 1586 C SER A 108 -0.904 9.488 -0.785 1.00 0.00 C ATOM 1587 O SER A 108 -1.443 8.852 -1.691 1.00 0.00 O ATOM 1588 CB SER A 108 0.109 8.925 1.432 1.00 0.00 C ATOM 1589 OG SER A 108 0.929 7.997 0.744 1.00 0.00 O ATOM 0 H SER A 108 -1.609 7.160 1.120 1.00 0.00 H new ATOM 0 HA SER A 108 -1.712 10.022 1.122 1.00 0.00 H new ATOM 0 HB2 SER A 108 0.644 9.867 1.553 1.00 0.00 H new ATOM 0 HB3 SER A 108 -0.109 8.551 2.432 1.00 0.00 H new ATOM 0 HG SER A 108 1.833 8.364 0.654 1.00 0.00 H new ATOM 1595 N ASP A 109 -0.046 10.477 -1.006 1.00 0.00 N ATOM 1596 CA ASP A 109 0.323 10.881 -2.358 1.00 0.00 C ATOM 1597 C ASP A 109 0.961 9.722 -3.117 1.00 0.00 C ATOM 1598 O ASP A 109 1.729 8.934 -2.564 1.00 0.00 O ATOM 1599 CB ASP A 109 1.284 12.070 -2.314 1.00 0.00 C ATOM 1600 CG ASP A 109 2.194 12.124 -3.525 1.00 0.00 C ATOM 1601 OD1 ASP A 109 3.044 11.220 -3.669 1.00 0.00 O ATOM 1602 OD2 ASP A 109 2.058 13.070 -4.329 1.00 0.00 O ATOM 0 H ASP A 109 0.407 11.014 -0.267 1.00 0.00 H new ATOM 0 HA ASP A 109 -0.585 11.178 -2.882 1.00 0.00 H new ATOM 0 HB2 ASP A 109 0.710 12.995 -2.253 1.00 0.00 H new ATOM 0 HB3 ASP A 109 1.890 12.010 -1.410 1.00 0.00 H new ATOM 1607 N PRO A 110 0.638 9.614 -4.414 1.00 0.00 N ATOM 1608 CA PRO A 110 1.169 8.553 -5.276 1.00 0.00 C ATOM 1609 C PRO A 110 2.656 8.729 -5.561 1.00 0.00 C ATOM 1610 O PRO A 110 3.116 9.830 -5.862 1.00 0.00 O ATOM 1611 CB PRO A 110 0.356 8.704 -6.565 1.00 0.00 C ATOM 1612 CG PRO A 110 -0.071 10.131 -6.578 1.00 0.00 C ATOM 1613 CD PRO A 110 -0.271 10.517 -5.139 1.00 0.00 C ATOM 0 HA PRO A 110 1.082 7.570 -4.814 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.956 8.462 -7.442 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.503 8.033 -6.572 1.00 0.00 H new ATOM 0 HG2 PRO A 110 0.684 10.760 -7.049 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -0.992 10.258 -7.147 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -0.021 11.564 -4.965 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.306 10.381 -4.827 1.00 0.00 H new ATOM 1621 N VAL A 111 3.406 7.635 -5.464 1.00 0.00 N ATOM 1622 CA VAL A 111 4.842 7.667 -5.713 1.00 0.00 C ATOM 1623 C VAL A 111 5.211 6.805 -6.915 1.00 0.00 C ATOM 1624 O VAL A 111 5.052 5.585 -6.890 1.00 0.00 O ATOM 1625 CB VAL A 111 5.636 7.183 -4.485 1.00 0.00 C ATOM 1626 CG1 VAL A 111 5.644 5.664 -4.420 1.00 0.00 C ATOM 1627 CG2 VAL A 111 7.054 7.732 -4.518 1.00 0.00 C ATOM 0 H VAL A 111 3.042 6.715 -5.215 1.00 0.00 H new ATOM 0 HA VAL A 111 5.104 8.705 -5.920 1.00 0.00 H new ATOM 0 HB VAL A 111 5.147 7.558 -3.586 1.00 0.00 H new ATOM 0 HG11 VAL A 111 6.209 5.340 -3.546 1.00 0.00 H new ATOM 0 HG12 VAL A 111 4.620 5.298 -4.346 1.00 0.00 H new ATOM 0 HG13 VAL A 111 6.108 5.264 -5.321 1.00 0.00 H new ATOM 0 HG21 VAL A 111 7.601 7.380 -3.643 1.00 0.00 H new ATOM 0 HG22 VAL A 111 7.556 7.388 -5.422 1.00 0.00 H new ATOM 0 HG23 VAL A 111 7.023 8.822 -4.512 1.00 0.00 H new ATOM 1637 N LYS A 112 5.705 7.448 -7.968 1.00 0.00 N ATOM 1638 CA LYS A 112 6.099 6.741 -9.181 1.00 0.00 C ATOM 1639 C LYS A 112 7.563 6.319 -9.113 1.00 0.00 C ATOM 1640 O LYS A 112 8.464 7.153 -9.201 1.00 0.00 O ATOM 1641 CB LYS A 112 5.869 7.625 -10.409 1.00 0.00 C ATOM 1642 CG LYS A 112 6.532 7.099 -11.670 1.00 0.00 C ATOM 1643 CD LYS A 112 6.586 8.160 -12.756 1.00 0.00 C ATOM 1644 CE LYS A 112 7.842 9.010 -12.643 1.00 0.00 C ATOM 1645 NZ LYS A 112 7.955 9.985 -13.763 1.00 0.00 N ATOM 0 H LYS A 112 5.842 8.458 -8.006 1.00 0.00 H new ATOM 0 HA LYS A 112 5.484 5.845 -9.265 1.00 0.00 H new ATOM 0 HB2 LYS A 112 4.797 7.718 -10.584 1.00 0.00 H new ATOM 0 HB3 LYS A 112 6.246 8.626 -10.201 1.00 0.00 H new ATOM 0 HG2 LYS A 112 7.543 6.763 -11.438 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.984 6.231 -12.035 1.00 0.00 H new ATOM 0 HD2 LYS A 112 6.556 7.682 -13.735 1.00 0.00 H new ATOM 0 HD3 LYS A 112 5.706 8.799 -12.686 1.00 0.00 H new ATOM 0 HE2 LYS A 112 7.833 9.546 -11.694 1.00 0.00 H new ATOM 0 HE3 LYS A 112 8.719 8.363 -12.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 8.824 10.545 -13.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.989 9.472 -14.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 7.131 10.619 -13.755 1.00 0.00 H new ATOM 1659 N ILE A 113 7.793 5.019 -8.956 1.00 0.00 N ATOM 1660 CA ILE A 113 9.147 4.487 -8.879 1.00 0.00 C ATOM 1661 C ILE A 113 9.511 3.724 -10.148 1.00 0.00 C ATOM 1662 O ILE A 113 8.805 2.800 -10.554 1.00 0.00 O ATOM 1663 CB ILE A 113 9.318 3.554 -7.666 1.00 0.00 C ATOM 1664 CG1 ILE A 113 10.563 2.682 -7.836 1.00 0.00 C ATOM 1665 CG2 ILE A 113 8.079 2.689 -7.486 1.00 0.00 C ATOM 1666 CD1 ILE A 113 11.175 2.240 -6.525 1.00 0.00 C ATOM 0 H ILE A 113 7.058 4.315 -8.880 1.00 0.00 H new ATOM 0 HA ILE A 113 9.815 5.341 -8.767 1.00 0.00 H new ATOM 0 HB ILE A 113 9.445 4.164 -6.772 1.00 0.00 H new ATOM 0 HG12 ILE A 113 10.302 1.800 -8.421 1.00 0.00 H new ATOM 0 HG13 ILE A 113 11.309 3.235 -8.408 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.214 2.035 -6.625 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.210 3.327 -7.324 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.924 2.085 -8.380 1.00 0.00 H new ATOM 0 HD11 ILE A 113 12.053 1.625 -6.722 1.00 0.00 H new ATOM 0 HD12 ILE A 113 11.468 3.116 -5.946 1.00 0.00 H new ATOM 0 HD13 ILE A 113 10.445 1.659 -5.960 1.00 0.00 H new ATOM 1678 N PHE A 114 10.619 4.115 -10.770 1.00 0.00 N ATOM 1679 CA PHE A 114 11.078 3.467 -11.994 1.00 0.00 C ATOM 1680 C PHE A 114 11.792 2.156 -11.679 1.00 0.00 C ATOM 1681 O PHE A 114 12.839 2.147 -11.031 1.00 0.00 O ATOM 1682 CB PHE A 114 12.013 4.397 -12.769 1.00 0.00 C ATOM 1683 CG PHE A 114 12.895 3.679 -13.749 1.00 0.00 C ATOM 1684 CD1 PHE A 114 14.079 3.091 -13.335 1.00 0.00 C ATOM 1685 CD2 PHE A 114 12.541 3.594 -15.086 1.00 0.00 C ATOM 1686 CE1 PHE A 114 14.893 2.429 -14.235 1.00 0.00 C ATOM 1687 CE2 PHE A 114 13.351 2.933 -15.991 1.00 0.00 C ATOM 1688 CZ PHE A 114 14.529 2.351 -15.565 1.00 0.00 C ATOM 0 H PHE A 114 11.215 4.877 -10.447 1.00 0.00 H new ATOM 0 HA PHE A 114 10.205 3.247 -12.609 1.00 0.00 H new ATOM 0 HB2 PHE A 114 11.416 5.136 -13.303 1.00 0.00 H new ATOM 0 HB3 PHE A 114 12.638 4.943 -12.062 1.00 0.00 H new ATOM 0 HD1 PHE A 114 14.370 3.151 -12.297 1.00 0.00 H new ATOM 0 HD2 PHE A 114 11.622 4.049 -15.425 1.00 0.00 H new ATOM 0 HE1 PHE A 114 15.813 1.973 -13.899 1.00 0.00 H new ATOM 0 HE2 PHE A 114 13.063 2.872 -17.030 1.00 0.00 H new ATOM 0 HZ PHE A 114 15.164 1.836 -16.271 1.00 0.00 H new ATOM 1698 N ILE A 115 11.218 1.050 -12.143 1.00 0.00 N ATOM 1699 CA ILE A 115 11.800 -0.266 -11.912 1.00 0.00 C ATOM 1700 C ILE A 115 12.889 -0.573 -12.935 1.00 0.00 C ATOM 1701 O ILE A 115 12.626 -0.752 -14.124 1.00 0.00 O ATOM 1702 CB ILE A 115 10.730 -1.372 -11.971 1.00 0.00 C ATOM 1703 CG1 ILE A 115 9.460 -0.923 -11.245 1.00 0.00 C ATOM 1704 CG2 ILE A 115 11.266 -2.660 -11.364 1.00 0.00 C ATOM 1705 CD1 ILE A 115 9.541 -1.065 -9.741 1.00 0.00 C ATOM 0 H ILE A 115 10.351 1.040 -12.681 1.00 0.00 H new ATOM 0 HA ILE A 115 12.237 -0.247 -10.914 1.00 0.00 H new ATOM 0 HB ILE A 115 10.481 -1.561 -13.015 1.00 0.00 H new ATOM 0 HG12 ILE A 115 9.259 0.119 -11.493 1.00 0.00 H new ATOM 0 HG13 ILE A 115 8.616 -1.507 -11.612 1.00 0.00 H new ATOM 0 HG21 ILE A 115 10.498 -3.432 -11.413 1.00 0.00 H new ATOM 0 HG22 ILE A 115 12.145 -2.986 -11.920 1.00 0.00 H new ATOM 0 HG23 ILE A 115 11.539 -2.486 -10.323 1.00 0.00 H new ATOM 0 HD11 ILE A 115 8.606 -0.728 -9.293 1.00 0.00 H new ATOM 0 HD12 ILE A 115 9.711 -2.110 -9.483 1.00 0.00 H new ATOM 0 HD13 ILE A 115 10.364 -0.459 -9.362 1.00 0.00 H new ATOM 1717 N PRO A 116 14.143 -0.637 -12.463 1.00 0.00 N ATOM 1718 CA PRO A 116 15.297 -0.925 -13.319 1.00 0.00 C ATOM 1719 C PRO A 116 15.305 -2.367 -13.815 1.00 0.00 C ATOM 1720 O PRO A 116 15.272 -3.307 -13.021 1.00 0.00 O ATOM 1721 CB PRO A 116 16.494 -0.670 -12.399 1.00 0.00 C ATOM 1722 CG PRO A 116 15.965 -0.882 -11.022 1.00 0.00 C ATOM 1723 CD PRO A 116 14.530 -0.435 -11.056 1.00 0.00 C ATOM 0 HA PRO A 116 15.297 -0.314 -14.221 1.00 0.00 H new ATOM 0 HB2 PRO A 116 17.314 -1.354 -12.618 1.00 0.00 H new ATOM 0 HB3 PRO A 116 16.881 0.342 -12.523 1.00 0.00 H new ATOM 0 HG2 PRO A 116 16.040 -1.930 -10.732 1.00 0.00 H new ATOM 0 HG3 PRO A 116 16.535 -0.308 -10.292 1.00 0.00 H new ATOM 0 HD2 PRO A 116 13.910 -1.024 -10.380 1.00 0.00 H new ATOM 0 HD3 PRO A 116 14.427 0.608 -10.757 1.00 0.00 H new ATOM 1731 N ALA A 117 15.351 -2.534 -15.133 1.00 0.00 N ATOM 1732 CA ALA A 117 15.366 -3.862 -15.735 1.00 0.00 C ATOM 1733 C ALA A 117 16.316 -4.792 -14.987 1.00 0.00 C ATOM 1734 O ALA A 117 17.341 -4.358 -14.462 1.00 0.00 O ATOM 1735 CB ALA A 117 15.759 -3.772 -17.202 1.00 0.00 C ATOM 0 H ALA A 117 15.379 -1.766 -15.804 1.00 0.00 H new ATOM 0 HA ALA A 117 14.361 -4.278 -15.665 1.00 0.00 H new ATOM 0 HB1 ALA A 117 15.766 -4.771 -17.639 1.00 0.00 H new ATOM 0 HB2 ALA A 117 15.040 -3.149 -17.734 1.00 0.00 H new ATOM 0 HB3 ALA A 117 16.753 -3.332 -17.286 1.00 0.00 H new ATOM 1741 N HIS A 118 15.968 -6.074 -14.943 1.00 0.00 N ATOM 1742 CA HIS A 118 16.790 -7.066 -14.259 1.00 0.00 C ATOM 1743 C HIS A 118 18.205 -7.085 -14.829 1.00 0.00 C ATOM 1744 O HIS A 118 18.422 -7.511 -15.964 1.00 0.00 O ATOM 1745 CB HIS A 118 16.159 -8.454 -14.382 1.00 0.00 C ATOM 1746 CG HIS A 118 17.033 -9.557 -13.870 1.00 0.00 C ATOM 1747 ND1 HIS A 118 16.635 -10.438 -12.887 1.00 0.00 N ATOM 1748 CD2 HIS A 118 18.292 -9.919 -14.210 1.00 0.00 C ATOM 1749 CE1 HIS A 118 17.611 -11.294 -12.645 1.00 0.00 C ATOM 1750 NE2 HIS A 118 18.628 -11.001 -13.435 1.00 0.00 N ATOM 0 H HIS A 118 15.123 -6.450 -15.373 1.00 0.00 H new ATOM 0 HA HIS A 118 16.845 -6.792 -13.205 1.00 0.00 H new ATOM 0 HB2 HIS A 118 15.216 -8.465 -13.835 1.00 0.00 H new ATOM 0 HB3 HIS A 118 15.923 -8.645 -15.429 1.00 0.00 H new ATOM 0 HD2 HIS A 118 18.916 -9.445 -14.953 1.00 0.00 H new ATOM 0 HE1 HIS A 118 17.582 -12.097 -11.924 1.00 0.00 H new ATOM 0 HE2 HIS A 118 19.518 -11.498 -13.464 1.00 0.00 H new ATOM 1759 N SER A 119 19.164 -6.621 -14.035 1.00 0.00 N ATOM 1760 CA SER A 119 20.557 -6.580 -14.462 1.00 0.00 C ATOM 1761 C SER A 119 21.478 -7.102 -13.363 1.00 0.00 C ATOM 1762 O SER A 119 21.518 -6.557 -12.261 1.00 0.00 O ATOM 1763 CB SER A 119 20.955 -5.152 -14.842 1.00 0.00 C ATOM 1764 OG SER A 119 21.957 -5.151 -15.844 1.00 0.00 O ATOM 0 H SER A 119 19.002 -6.268 -13.092 1.00 0.00 H new ATOM 0 HA SER A 119 20.662 -7.223 -15.336 1.00 0.00 H new ATOM 0 HB2 SER A 119 20.079 -4.610 -15.199 1.00 0.00 H new ATOM 0 HB3 SER A 119 21.318 -4.625 -13.960 1.00 0.00 H new ATOM 0 HG SER A 119 22.192 -4.227 -16.070 1.00 0.00 H new ATOM 1770 N GLY A 120 22.217 -8.163 -13.673 1.00 0.00 N ATOM 1771 CA GLY A 120 23.127 -8.742 -12.702 1.00 0.00 C ATOM 1772 C GLY A 120 24.529 -8.915 -13.253 1.00 0.00 C ATOM 1773 O GLY A 120 24.904 -8.308 -14.256 1.00 0.00 O ATOM 0 H GLY A 120 22.202 -8.632 -14.579 1.00 0.00 H new ATOM 0 HA2 GLY A 120 23.163 -8.105 -11.818 1.00 0.00 H new ATOM 0 HA3 GLY A 120 22.744 -9.711 -12.382 1.00 0.00 H new ATOM 1777 N PRO A 121 25.330 -9.761 -12.588 1.00 0.00 N ATOM 1778 CA PRO A 121 26.711 -10.031 -12.998 1.00 0.00 C ATOM 1779 C PRO A 121 26.784 -10.828 -14.296 1.00 0.00 C ATOM 1780 O PRO A 121 27.493 -10.450 -15.229 1.00 0.00 O ATOM 1781 CB PRO A 121 27.273 -10.851 -11.835 1.00 0.00 C ATOM 1782 CG PRO A 121 26.081 -11.494 -11.213 1.00 0.00 C ATOM 1783 CD PRO A 121 24.949 -10.518 -11.384 1.00 0.00 C ATOM 0 HA PRO A 121 27.264 -9.113 -13.196 1.00 0.00 H new ATOM 0 HB2 PRO A 121 27.987 -11.596 -12.185 1.00 0.00 H new ATOM 0 HB3 PRO A 121 27.798 -10.217 -11.121 1.00 0.00 H new ATOM 0 HG2 PRO A 121 25.853 -12.444 -11.696 1.00 0.00 H new ATOM 0 HG3 PRO A 121 26.258 -11.706 -10.159 1.00 0.00 H new ATOM 0 HD2 PRO A 121 23.995 -11.028 -11.515 1.00 0.00 H new ATOM 0 HD3 PRO A 121 24.845 -9.867 -10.516 1.00 0.00 H new ATOM 1791 N SER A 122 26.047 -11.933 -14.350 1.00 0.00 N ATOM 1792 CA SER A 122 26.032 -12.785 -15.533 1.00 0.00 C ATOM 1793 C SER A 122 25.294 -12.105 -16.682 1.00 0.00 C ATOM 1794 O SER A 122 24.119 -11.758 -16.561 1.00 0.00 O ATOM 1795 CB SER A 122 25.373 -14.128 -15.212 1.00 0.00 C ATOM 1796 OG SER A 122 25.367 -14.977 -16.345 1.00 0.00 O ATOM 0 H SER A 122 25.452 -12.259 -13.588 1.00 0.00 H new ATOM 0 HA SER A 122 27.064 -12.959 -15.839 1.00 0.00 H new ATOM 0 HB2 SER A 122 25.907 -14.612 -14.394 1.00 0.00 H new ATOM 0 HB3 SER A 122 24.351 -13.963 -14.872 1.00 0.00 H new ATOM 0 HG SER A 122 24.942 -15.829 -16.113 1.00 0.00 H new ATOM 1802 N SER A 123 25.992 -11.919 -17.798 1.00 0.00 N ATOM 1803 CA SER A 123 25.406 -11.278 -18.969 1.00 0.00 C ATOM 1804 C SER A 123 24.842 -12.317 -19.932 1.00 0.00 C ATOM 1805 O SER A 123 25.364 -13.425 -20.043 1.00 0.00 O ATOM 1806 CB SER A 123 26.451 -10.419 -19.683 1.00 0.00 C ATOM 1807 OG SER A 123 27.607 -11.177 -19.997 1.00 0.00 O ATOM 0 H SER A 123 26.964 -12.203 -17.916 1.00 0.00 H new ATOM 0 HA SER A 123 24.590 -10.639 -18.632 1.00 0.00 H new ATOM 0 HB2 SER A 123 26.024 -10.006 -20.597 1.00 0.00 H new ATOM 0 HB3 SER A 123 26.726 -9.575 -19.050 1.00 0.00 H new ATOM 0 HG SER A 123 28.259 -10.605 -20.454 1.00 0.00 H new ATOM 1813 N GLY A 124 23.769 -11.950 -20.627 1.00 0.00 N ATOM 1814 CA GLY A 124 23.150 -12.861 -21.572 1.00 0.00 C ATOM 1815 C GLY A 124 21.674 -13.069 -21.295 1.00 0.00 C ATOM 1816 O GLY A 124 21.124 -12.490 -20.359 1.00 0.00 O ATOM 0 H GLY A 124 23.318 -11.038 -20.552 1.00 0.00 H new ATOM 0 HA2 GLY A 124 23.276 -12.472 -22.582 1.00 0.00 H new ATOM 0 HA3 GLY A 124 23.663 -13.822 -21.534 1.00 0.00 H new TER 1820 GLY A 124