USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1033 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 104 SER OG : rot -101:sc= 0.209 USER MOD Set 1.2: A 108 SER OG : rot 21:sc= 1.94 USER MOD Set 2.1: A 89 ASN : amide:sc= 0.99 K(o=3.1,f=-1!) USER MOD Set 2.2: A 94 ASN : amide:sc= 0.732 K(o=3.1,f=1.1) USER MOD Set 2.3: A 123 GLN : amide:sc= 1.36 K(o=3.1,f=-5.2!) USER MOD Set 3.1: A 59 ASN : amide:sc= -0.533 K(o=0.2,f=-3.9!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 139:sc= 0.732 (180deg=0.205) USER MOD Set 4.1: A 56 THR OG1 : rot 180:sc= 0.0698 USER MOD Set 4.2: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 28 LYS NZ :NH3+ 180:sc= 0.642 (180deg=-0.278) USER MOD Set 5.2: A 32 SER OG : rot -120:sc= 0.815 USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.112 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.0119 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 11 GLN : amide:sc= -1.61! K(o=-1.6!,f=-0.16) USER MOD Single : A 15 HIS : no HD1:sc=-0.00641 X(o=-0.0064,f=0) USER MOD Single : A 16 HIS : no HD1:sc= -0.382 K(o=-0.38,f=-3.6!) USER MOD Single : A 17 ASN : amide:sc= -1.99! K(o=-2!,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 169:sc=-0.00106 (180deg=-0.101) USER MOD Single : A 29 THR OG1 : rot 70:sc= 1.14 USER MOD Single : A 33 GLN : amide:sc= -1.53! K(o=-1.5!,f=-0.066) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= 0.0393 X(o=0.039,f=0) USER MOD Single : A 54 THR OG1 : rot 67:sc= 1.23 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -11:sc= 0.976 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 102:sc= 1.08 USER MOD Single : A 81 ASN : amide:sc= -0.696 K(o=-0.7,f=-5.1!) USER MOD Single : A 82 CYS SG : rot -84:sc= -2.82! USER MOD Single : A 85 THR OG1 : rot 94:sc= 1.26 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -8.82! C(o=-8.8!,f=-10!) USER MOD Single : A 91 GLN : amide:sc= 0.422 X(o=0.42,f=0) USER MOD Single : A 100 MET CE :methyl -148:sc= 0 (180deg=-0.511) USER MOD Single : A 102 THR OG1 : rot -130:sc= 1.28 USER MOD Single : A 106 ASN : amide:sc= 1.2 K(o=1.2,f=-0.039) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -150:sc= -2.11! USER MOD Single : A 113 GLN : amide:sc= -4.54! C(o=-4.5!,f=-8.1!) USER MOD Single : A 114 MET CE :methyl -163:sc= -0.0602 (180deg=-0.476) USER MOD Single : A 115 GLN : amide:sc= -5.87! K(o=-5.9!,f=-0.95) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 129 THR OG1 : rot 7:sc= 0.936 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -138:sc= 0.303 (180deg=-3.18!) USER MOD Single : A 138 LYS NZ :NH3+ 159:sc= 1.31 (180deg=1.16) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.750 10.769 1.636 1.00 0.00 N ATOM 2 CA PRO A 1 4.494 9.798 0.868 1.00 0.00 C ATOM 3 C PRO A 1 5.959 9.956 1.142 1.00 0.00 C ATOM 4 O PRO A 1 6.345 10.815 1.876 1.00 0.00 O ATOM 5 CB PRO A 1 4.205 10.050 -0.587 1.00 0.00 C ATOM 6 CG PRO A 1 2.886 10.782 -0.572 1.00 0.00 C ATOM 7 CD PRO A 1 2.542 11.107 0.887 1.00 0.00 C ATOM 0 H2 PRO A 1 4.314 11.603 1.798 1.00 0.00 H new ATOM 0 H3 PRO A 1 3.508 10.390 2.551 1.00 0.00 H new ATOM 0 HA PRO A 1 4.204 8.783 1.139 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.989 10.648 -1.053 1.00 0.00 H new ATOM 0 HB3 PRO A 1 4.139 9.118 -1.149 1.00 0.00 H new ATOM 0 HG2 PRO A 1 2.951 11.697 -1.161 1.00 0.00 H new ATOM 0 HG3 PRO A 1 2.104 10.169 -1.020 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.282 12.159 1.008 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.687 10.526 1.231 1.00 0.00 H new ATOM 17 N VAL A 2 6.752 9.111 0.599 1.00 0.00 N ATOM 18 CA VAL A 2 8.180 9.230 0.736 1.00 0.00 C ATOM 19 C VAL A 2 8.648 10.125 -0.390 1.00 0.00 C ATOM 20 O VAL A 2 8.096 10.064 -1.503 1.00 0.00 O ATOM 21 CB VAL A 2 8.901 7.847 0.625 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.411 7.968 0.850 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.316 6.840 1.589 1.00 0.00 C ATOM 0 H VAL A 2 6.444 8.312 0.044 1.00 0.00 H new ATOM 0 HA VAL A 2 8.419 9.635 1.719 1.00 0.00 H new ATOM 0 HB VAL A 2 8.737 7.493 -0.393 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.872 6.984 0.764 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.838 8.635 0.101 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.599 8.371 1.845 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.840 5.890 1.485 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.427 7.206 2.610 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.258 6.697 1.368 1.00 0.00 H new ATOM 33 N THR A 3 9.588 10.963 -0.118 1.00 0.00 N ATOM 34 CA THR A 3 10.124 11.816 -1.113 1.00 0.00 C ATOM 35 C THR A 3 11.597 11.988 -0.837 1.00 0.00 C ATOM 36 O THR A 3 12.016 12.393 0.289 1.00 0.00 O ATOM 37 CB THR A 3 9.348 13.188 -1.202 1.00 0.00 C ATOM 38 OG1 THR A 3 9.887 14.027 -2.237 1.00 0.00 O ATOM 39 CG2 THR A 3 9.347 13.943 0.130 1.00 0.00 C ATOM 0 H THR A 3 10.006 11.074 0.806 1.00 0.00 H new ATOM 0 HA THR A 3 9.998 11.364 -2.097 1.00 0.00 H new ATOM 0 HB THR A 3 8.315 12.940 -1.448 1.00 0.00 H new ATOM 0 HG1 THR A 3 9.386 14.869 -2.270 1.00 0.00 H new ATOM 0 HG21 THR A 3 8.801 14.880 0.017 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.866 13.332 0.894 1.00 0.00 H new ATOM 0 HG23 THR A 3 10.374 14.155 0.429 1.00 0.00 H new ATOM 47 N GLU A 4 12.407 11.606 -1.801 1.00 0.00 N ATOM 48 CA GLU A 4 13.801 11.675 -1.614 1.00 0.00 C ATOM 49 C GLU A 4 14.613 12.064 -2.822 1.00 0.00 C ATOM 50 O GLU A 4 14.081 12.426 -3.860 1.00 0.00 O ATOM 51 CB GLU A 4 14.373 10.513 -0.794 1.00 0.00 C ATOM 52 CG GLU A 4 14.146 9.106 -1.272 1.00 0.00 C ATOM 53 CD GLU A 4 14.699 8.130 -0.250 1.00 0.00 C ATOM 54 OE1 GLU A 4 14.287 8.203 0.933 1.00 0.00 O ATOM 55 OE2 GLU A 4 15.585 7.341 -0.582 1.00 0.00 O ATOM 0 H GLU A 4 12.107 11.250 -2.708 1.00 0.00 H new ATOM 0 HA GLU A 4 13.925 12.550 -0.977 1.00 0.00 H new ATOM 0 HB2 GLU A 4 15.449 10.664 -0.714 1.00 0.00 H new ATOM 0 HB3 GLU A 4 13.965 10.589 0.214 1.00 0.00 H new ATOM 0 HG2 GLU A 4 13.081 8.928 -1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 4 14.632 8.955 -2.236 1.00 0.00 H new ATOM 62 N THR A 5 15.850 12.052 -2.625 1.00 0.00 N ATOM 63 CA THR A 5 16.733 12.525 -3.631 1.00 0.00 C ATOM 64 C THR A 5 17.804 11.494 -3.790 1.00 0.00 C ATOM 65 O THR A 5 17.836 10.515 -3.023 1.00 0.00 O ATOM 66 CB THR A 5 17.330 13.937 -3.295 1.00 0.00 C ATOM 67 OG1 THR A 5 18.042 14.448 -4.435 1.00 0.00 O ATOM 68 CG2 THR A 5 18.286 13.892 -2.106 1.00 0.00 C ATOM 0 H THR A 5 16.301 11.720 -1.772 1.00 0.00 H new ATOM 0 HA THR A 5 16.190 12.666 -4.565 1.00 0.00 H new ATOM 0 HB THR A 5 16.493 14.585 -3.037 1.00 0.00 H new ATOM 0 HG1 THR A 5 18.411 15.330 -4.221 1.00 0.00 H new ATOM 0 HG21 THR A 5 18.673 14.892 -1.912 1.00 0.00 H new ATOM 0 HG22 THR A 5 17.755 13.532 -1.225 1.00 0.00 H new ATOM 0 HG23 THR A 5 19.114 13.220 -2.330 1.00 0.00 H new ATOM 76 N VAL A 6 18.625 11.644 -4.774 1.00 0.00 N ATOM 77 CA VAL A 6 19.661 10.715 -5.051 1.00 0.00 C ATOM 78 C VAL A 6 20.932 11.432 -5.334 1.00 0.00 C ATOM 79 O VAL A 6 20.943 12.463 -6.015 1.00 0.00 O ATOM 80 CB VAL A 6 19.286 9.776 -6.236 1.00 0.00 C ATOM 81 CG1 VAL A 6 18.307 8.708 -5.773 1.00 0.00 C ATOM 82 CG2 VAL A 6 18.643 10.581 -7.358 1.00 0.00 C ATOM 0 H VAL A 6 18.592 12.433 -5.420 1.00 0.00 H new ATOM 0 HA VAL A 6 19.796 10.091 -4.168 1.00 0.00 H new ATOM 0 HB VAL A 6 20.198 9.302 -6.599 1.00 0.00 H new ATOM 0 HG11 VAL A 6 18.053 8.059 -6.611 1.00 0.00 H new ATOM 0 HG12 VAL A 6 18.763 8.115 -4.980 1.00 0.00 H new ATOM 0 HG13 VAL A 6 17.402 9.183 -5.396 1.00 0.00 H new ATOM 0 HG21 VAL A 6 18.385 9.915 -8.182 1.00 0.00 H new ATOM 0 HG22 VAL A 6 17.740 11.066 -6.987 1.00 0.00 H new ATOM 0 HG23 VAL A 6 19.343 11.338 -7.710 1.00 0.00 H new ATOM 92 N ASP A 7 21.987 10.953 -4.750 1.00 0.00 N ATOM 93 CA ASP A 7 23.285 11.522 -4.995 1.00 0.00 C ATOM 94 C ASP A 7 23.932 10.777 -6.149 1.00 0.00 C ATOM 95 O ASP A 7 23.587 9.610 -6.396 1.00 0.00 O ATOM 96 CB ASP A 7 24.153 11.433 -3.738 1.00 0.00 C ATOM 97 CG ASP A 7 25.476 12.133 -3.902 1.00 0.00 C ATOM 98 OD1 ASP A 7 26.446 11.502 -4.367 1.00 0.00 O ATOM 99 OD2 ASP A 7 25.558 13.334 -3.618 1.00 0.00 O ATOM 0 H ASP A 7 21.979 10.168 -4.099 1.00 0.00 H new ATOM 0 HA ASP A 7 23.184 12.576 -5.254 1.00 0.00 H new ATOM 0 HB2 ASP A 7 23.615 11.871 -2.897 1.00 0.00 H new ATOM 0 HB3 ASP A 7 24.327 10.385 -3.494 1.00 0.00 H new ATOM 104 N GLY A 8 24.855 11.431 -6.841 1.00 0.00 N ATOM 105 CA GLY A 8 25.551 10.852 -7.974 1.00 0.00 C ATOM 106 C GLY A 8 26.355 9.604 -7.654 1.00 0.00 C ATOM 107 O GLY A 8 26.774 8.892 -8.571 1.00 0.00 O ATOM 0 H GLY A 8 25.142 12.386 -6.627 1.00 0.00 H new ATOM 0 HA2 GLY A 8 24.821 10.609 -8.746 1.00 0.00 H new ATOM 0 HA3 GLY A 8 26.221 11.602 -8.393 1.00 0.00 H new ATOM 111 N GLN A 9 26.606 9.338 -6.366 1.00 0.00 N ATOM 112 CA GLN A 9 27.279 8.096 -5.984 1.00 0.00 C ATOM 113 C GLN A 9 26.291 6.915 -6.105 1.00 0.00 C ATOM 114 O GLN A 9 26.688 5.750 -6.090 1.00 0.00 O ATOM 115 CB GLN A 9 27.888 8.176 -4.565 1.00 0.00 C ATOM 116 CG GLN A 9 26.877 8.199 -3.444 1.00 0.00 C ATOM 117 CD GLN A 9 27.530 8.318 -2.077 1.00 0.00 C ATOM 118 OE1 GLN A 9 28.572 8.948 -1.918 1.00 0.00 O ATOM 119 NE2 GLN A 9 26.973 7.661 -1.104 1.00 0.00 N ATOM 0 H GLN A 9 26.359 9.951 -5.589 1.00 0.00 H new ATOM 0 HA GLN A 9 28.113 7.935 -6.667 1.00 0.00 H new ATOM 0 HB2 GLN A 9 28.551 7.323 -4.420 1.00 0.00 H new ATOM 0 HB3 GLN A 9 28.504 9.073 -4.499 1.00 0.00 H new ATOM 0 HG2 GLN A 9 26.194 9.036 -3.591 1.00 0.00 H new ATOM 0 HG3 GLN A 9 26.278 7.289 -3.480 1.00 0.00 H new ATOM 0 HE21 GLN A 9 26.107 7.147 -1.266 1.00 0.00 H new ATOM 0 HE22 GLN A 9 27.402 7.660 -0.178 1.00 0.00 H new ATOM 128 N GLY A 10 25.003 7.245 -6.240 1.00 0.00 N ATOM 129 CA GLY A 10 23.980 6.242 -6.446 1.00 0.00 C ATOM 130 C GLY A 10 23.301 5.818 -5.168 1.00 0.00 C ATOM 131 O GLY A 10 23.083 4.629 -4.948 1.00 0.00 O ATOM 0 H GLY A 10 24.654 8.203 -6.209 1.00 0.00 H new ATOM 0 HA2 GLY A 10 23.232 6.631 -7.136 1.00 0.00 H new ATOM 0 HA3 GLY A 10 24.427 5.368 -6.920 1.00 0.00 H new ATOM 135 N GLN A 11 22.985 6.763 -4.303 1.00 0.00 N ATOM 136 CA GLN A 11 22.325 6.523 -3.050 1.00 0.00 C ATOM 137 C GLN A 11 21.042 7.330 -3.033 1.00 0.00 C ATOM 138 O GLN A 11 20.979 8.417 -3.629 1.00 0.00 O ATOM 139 CB GLN A 11 23.179 6.951 -1.859 1.00 0.00 C ATOM 140 CG GLN A 11 23.548 8.429 -1.881 1.00 0.00 C ATOM 141 CD GLN A 11 23.939 8.969 -0.541 1.00 0.00 C ATOM 142 OE1 GLN A 11 24.771 9.857 -0.441 1.00 0.00 O ATOM 143 NE2 GLN A 11 23.297 8.502 0.487 1.00 0.00 N ATOM 0 H GLN A 11 23.191 7.749 -4.466 1.00 0.00 H new ATOM 0 HA GLN A 11 22.137 5.453 -2.962 1.00 0.00 H new ATOM 0 HB2 GLN A 11 22.640 6.732 -0.937 1.00 0.00 H new ATOM 0 HB3 GLN A 11 24.092 6.356 -1.843 1.00 0.00 H new ATOM 0 HG2 GLN A 11 24.372 8.579 -2.578 1.00 0.00 H new ATOM 0 HG3 GLN A 11 22.701 9.001 -2.261 1.00 0.00 H new ATOM 0 HE21 GLN A 11 22.609 7.759 0.364 1.00 0.00 H new ATOM 0 HE22 GLN A 11 23.481 8.878 1.417 1.00 0.00 H new ATOM 152 N ALA A 12 20.071 6.834 -2.346 1.00 0.00 N ATOM 153 CA ALA A 12 18.787 7.466 -2.221 1.00 0.00 C ATOM 154 C ALA A 12 18.646 7.894 -0.776 1.00 0.00 C ATOM 155 O ALA A 12 18.962 7.107 0.128 1.00 0.00 O ATOM 156 CB ALA A 12 17.710 6.482 -2.615 1.00 0.00 C ATOM 0 H ALA A 12 20.143 5.952 -1.838 1.00 0.00 H new ATOM 0 HA ALA A 12 18.693 8.334 -2.873 1.00 0.00 H new ATOM 0 HB1 ALA A 12 16.733 6.956 -2.522 1.00 0.00 H new ATOM 0 HB2 ALA A 12 17.864 6.168 -3.647 1.00 0.00 H new ATOM 0 HB3 ALA A 12 17.755 5.612 -1.960 1.00 0.00 H new ATOM 162 N TRP A 13 18.261 9.126 -0.543 1.00 0.00 N ATOM 163 CA TRP A 13 18.245 9.661 0.804 1.00 0.00 C ATOM 164 C TRP A 13 17.431 10.934 0.905 1.00 0.00 C ATOM 165 O TRP A 13 17.532 11.774 0.019 1.00 0.00 O ATOM 166 CB TRP A 13 19.705 9.906 1.295 1.00 0.00 C ATOM 167 CG TRP A 13 20.584 10.786 0.397 1.00 0.00 C ATOM 168 CD1 TRP A 13 20.588 10.837 -0.968 1.00 0.00 C ATOM 169 CD2 TRP A 13 21.622 11.683 0.818 1.00 0.00 C ATOM 170 NE1 TRP A 13 21.510 11.706 -1.418 1.00 0.00 N ATOM 171 CE2 TRP A 13 22.172 12.251 -0.353 1.00 0.00 C ATOM 172 CE3 TRP A 13 22.131 12.075 2.057 1.00 0.00 C ATOM 173 CZ2 TRP A 13 23.206 13.184 -0.318 1.00 0.00 C ATOM 174 CZ3 TRP A 13 23.160 13.002 2.086 1.00 0.00 C ATOM 175 CH2 TRP A 13 23.683 13.547 0.906 1.00 0.00 C ATOM 0 H TRP A 13 17.955 9.778 -1.265 1.00 0.00 H new ATOM 0 HA TRP A 13 17.764 8.923 1.447 1.00 0.00 H new ATOM 0 HB2 TRP A 13 19.662 10.362 2.284 1.00 0.00 H new ATOM 0 HB3 TRP A 13 20.194 8.939 1.411 1.00 0.00 H new ATOM 0 HD1 TRP A 13 19.936 10.255 -1.603 1.00 0.00 H new ATOM 0 HE1 TRP A 13 21.687 11.924 -2.398 1.00 0.00 H new ATOM 0 HE3 TRP A 13 21.732 11.665 2.973 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 23.614 13.603 -1.226 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 23.567 13.311 3.037 1.00 0.00 H new ATOM 0 HH2 TRP A 13 24.482 14.271 0.968 1.00 0.00 H new ATOM 186 N ARG A 14 16.539 11.000 1.917 1.00 0.00 N ATOM 187 CA ARG A 14 15.799 12.221 2.322 1.00 0.00 C ATOM 188 C ARG A 14 14.759 11.927 3.426 1.00 0.00 C ATOM 189 O ARG A 14 15.126 11.412 4.484 1.00 0.00 O ATOM 190 CB ARG A 14 15.265 13.092 1.170 1.00 0.00 C ATOM 191 CG ARG A 14 14.768 14.487 1.555 1.00 0.00 C ATOM 192 CD ARG A 14 14.762 15.433 0.360 1.00 0.00 C ATOM 193 NE ARG A 14 14.133 14.848 -0.829 1.00 0.00 N ATOM 194 CZ ARG A 14 13.027 15.307 -1.432 1.00 0.00 C ATOM 195 NH1 ARG A 14 12.336 16.303 -0.893 1.00 0.00 N ATOM 196 NH2 ARG A 14 12.609 14.752 -2.577 1.00 0.00 N ATOM 0 H ARG A 14 16.306 10.189 2.490 1.00 0.00 H new ATOM 0 HA ARG A 14 16.554 12.869 2.766 1.00 0.00 H new ATOM 0 HB2 ARG A 14 16.056 13.202 0.428 1.00 0.00 H new ATOM 0 HB3 ARG A 14 14.447 12.558 0.687 1.00 0.00 H new ATOM 0 HG2 ARG A 14 13.761 14.414 1.966 1.00 0.00 H new ATOM 0 HG3 ARG A 14 15.404 14.896 2.340 1.00 0.00 H new ATOM 0 HD2 ARG A 14 14.235 16.348 0.630 1.00 0.00 H new ATOM 0 HD3 ARG A 14 15.788 15.714 0.121 1.00 0.00 H new ATOM 0 HE ARG A 14 14.575 14.021 -1.231 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.646 16.723 -0.016 1.00 0.00 H new ATOM 0 HH12 ARG A 14 11.495 16.649 -1.355 1.00 0.00 H new ATOM 0 HH21 ARG A 14 13.132 13.980 -2.990 1.00 0.00 H new ATOM 0 HH22 ARG A 14 11.768 15.101 -3.036 1.00 0.00 H new ATOM 210 N HIS A 15 13.469 12.232 3.202 1.00 0.00 N ATOM 211 CA HIS A 15 12.484 12.128 4.289 1.00 0.00 C ATOM 212 C HIS A 15 11.250 11.332 3.913 1.00 0.00 C ATOM 213 O HIS A 15 10.801 11.336 2.765 1.00 0.00 O ATOM 214 CB HIS A 15 11.980 13.522 4.735 1.00 0.00 C ATOM 215 CG HIS A 15 12.984 14.432 5.388 1.00 0.00 C ATOM 216 ND1 HIS A 15 13.192 14.483 6.748 1.00 0.00 N ATOM 217 CD2 HIS A 15 13.790 15.377 4.863 1.00 0.00 C ATOM 218 CE1 HIS A 15 14.077 15.424 7.019 1.00 0.00 C ATOM 219 NE2 HIS A 15 14.454 15.978 5.895 1.00 0.00 N ATOM 0 H HIS A 15 13.093 12.543 2.306 1.00 0.00 H new ATOM 0 HA HIS A 15 13.021 11.618 5.088 1.00 0.00 H new ATOM 0 HB2 HIS A 15 11.578 14.033 3.860 1.00 0.00 H new ATOM 0 HB3 HIS A 15 11.152 13.377 5.429 1.00 0.00 H new ATOM 0 HD2 HIS A 15 13.892 15.616 3.815 1.00 0.00 H new ATOM 0 HE1 HIS A 15 14.431 15.692 8.004 1.00 0.00 H new ATOM 0 HE2 HIS A 15 15.132 16.734 5.804 1.00 0.00 H new ATOM 228 N HIS A 16 10.710 10.652 4.901 1.00 0.00 N ATOM 229 CA HIS A 16 9.386 10.084 4.805 1.00 0.00 C ATOM 230 C HIS A 16 8.441 11.232 5.105 1.00 0.00 C ATOM 231 O HIS A 16 8.789 12.134 5.850 1.00 0.00 O ATOM 232 CB HIS A 16 9.165 8.946 5.865 1.00 0.00 C ATOM 233 CG HIS A 16 7.735 8.370 5.924 1.00 0.00 C ATOM 234 ND1 HIS A 16 6.877 8.580 6.986 1.00 0.00 N ATOM 235 CD2 HIS A 16 7.041 7.587 5.050 1.00 0.00 C ATOM 236 CE1 HIS A 16 5.734 7.962 6.765 1.00 0.00 C ATOM 237 NE2 HIS A 16 5.803 7.356 5.603 1.00 0.00 N ATOM 0 H HIS A 16 11.177 10.478 5.791 1.00 0.00 H new ATOM 0 HA HIS A 16 9.226 9.639 3.823 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.858 8.133 5.651 1.00 0.00 H new ATOM 0 HB3 HIS A 16 9.424 9.334 6.850 1.00 0.00 H new ATOM 0 HD2 HIS A 16 7.397 7.217 4.100 1.00 0.00 H new ATOM 0 HE1 HIS A 16 4.883 7.955 7.429 1.00 0.00 H new ATOM 0 HE2 HIS A 16 5.059 6.803 5.178 1.00 0.00 H new ATOM 246 N ASN A 17 7.309 11.230 4.516 1.00 0.00 N ATOM 247 CA ASN A 17 6.266 12.173 4.815 1.00 0.00 C ATOM 248 C ASN A 17 5.090 11.313 5.065 1.00 0.00 C ATOM 249 O ASN A 17 4.987 10.232 4.449 1.00 0.00 O ATOM 250 CB ASN A 17 5.967 13.120 3.621 1.00 0.00 C ATOM 251 CG ASN A 17 6.979 14.254 3.356 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.614 15.310 2.843 1.00 0.00 O ATOM 253 ND2 ASN A 17 8.224 14.071 3.701 1.00 0.00 N ATOM 0 H ASN A 17 7.059 10.559 3.789 1.00 0.00 H new ATOM 0 HA ASN A 17 6.537 12.821 5.649 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.893 12.514 2.718 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.988 13.571 3.783 1.00 0.00 H new ATOM 0 HD21 ASN A 17 8.910 14.810 3.546 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.511 13.189 4.126 1.00 0.00 H new ATOM 260 N GLY A 18 4.242 11.721 5.943 1.00 0.00 N ATOM 261 CA GLY A 18 3.093 10.940 6.277 1.00 0.00 C ATOM 262 C GLY A 18 2.090 10.894 5.160 1.00 0.00 C ATOM 263 O GLY A 18 2.314 11.461 4.069 1.00 0.00 O ATOM 0 H GLY A 18 4.321 12.602 6.451 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.405 9.925 6.524 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.622 11.354 7.168 1.00 0.00 H new ATOM 267 N PHE A 19 1.008 10.221 5.409 1.00 0.00 N ATOM 268 CA PHE A 19 -0.052 10.083 4.443 1.00 0.00 C ATOM 269 C PHE A 19 -0.633 11.425 4.088 1.00 0.00 C ATOM 270 O PHE A 19 -0.822 12.276 4.957 1.00 0.00 O ATOM 271 CB PHE A 19 -1.163 9.140 4.954 1.00 0.00 C ATOM 272 CG PHE A 19 -1.680 9.429 6.354 1.00 0.00 C ATOM 273 CD1 PHE A 19 -2.714 10.325 6.558 1.00 0.00 C ATOM 274 CD2 PHE A 19 -1.137 8.781 7.455 1.00 0.00 C ATOM 275 CE1 PHE A 19 -3.193 10.571 7.822 1.00 0.00 C ATOM 276 CE2 PHE A 19 -1.612 9.026 8.725 1.00 0.00 C ATOM 277 CZ PHE A 19 -2.643 9.922 8.912 1.00 0.00 C ATOM 0 H PHE A 19 0.829 9.746 6.294 1.00 0.00 H new ATOM 0 HA PHE A 19 0.381 9.641 3.546 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.002 9.187 4.260 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -0.786 8.118 4.930 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.150 10.837 5.713 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.332 8.075 7.314 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -4.001 11.273 7.965 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.177 8.517 9.573 1.00 0.00 H new ATOM 0 HZ PHE A 19 -3.019 10.116 9.906 1.00 0.00 H new ATOM 287 N ASP A 20 -0.873 11.640 2.812 1.00 0.00 N ATOM 288 CA ASP A 20 -1.553 12.829 2.386 1.00 0.00 C ATOM 289 C ASP A 20 -2.990 12.628 2.749 1.00 0.00 C ATOM 290 O ASP A 20 -3.632 11.716 2.226 1.00 0.00 O ATOM 291 CB ASP A 20 -1.434 13.005 0.866 1.00 0.00 C ATOM 292 CG ASP A 20 -2.187 14.217 0.375 1.00 0.00 C ATOM 293 OD1 ASP A 20 -1.614 15.328 0.362 1.00 0.00 O ATOM 294 OD2 ASP A 20 -3.350 14.087 -0.001 1.00 0.00 O ATOM 0 H ASP A 20 -0.606 11.005 2.059 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.126 13.715 2.856 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.383 13.097 0.593 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.816 12.114 0.367 1.00 0.00 H new ATOM 299 N PHE A 21 -3.495 13.391 3.673 1.00 0.00 N ATOM 300 CA PHE A 21 -4.831 13.127 4.105 1.00 0.00 C ATOM 301 C PHE A 21 -5.871 13.571 3.099 1.00 0.00 C ATOM 302 O PHE A 21 -6.913 12.996 3.040 1.00 0.00 O ATOM 303 CB PHE A 21 -5.146 13.638 5.506 1.00 0.00 C ATOM 304 CG PHE A 21 -6.356 12.949 6.053 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.306 11.588 6.284 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.536 13.625 6.292 1.00 0.00 C ATOM 307 CE1 PHE A 21 -7.403 10.903 6.742 1.00 0.00 C ATOM 308 CE2 PHE A 21 -8.651 12.951 6.762 1.00 0.00 C ATOM 309 CZ PHE A 21 -8.585 11.580 6.986 1.00 0.00 C ATOM 0 H PHE A 21 -3.022 14.173 4.127 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.886 12.040 4.169 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.293 13.466 6.163 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.314 14.715 5.478 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.386 11.053 6.101 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.590 14.688 6.111 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -7.344 9.838 6.912 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.568 13.488 6.954 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.451 11.047 7.348 1.00 0.00 H new ATOM 319 N ALA A 22 -5.568 14.578 2.309 1.00 0.00 N ATOM 320 CA ALA A 22 -6.464 15.046 1.256 1.00 0.00 C ATOM 321 C ALA A 22 -6.844 13.915 0.284 1.00 0.00 C ATOM 322 O ALA A 22 -8.014 13.764 -0.078 1.00 0.00 O ATOM 323 CB ALA A 22 -5.827 16.207 0.506 1.00 0.00 C ATOM 0 H ALA A 22 -4.694 15.101 2.373 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.385 15.389 1.728 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.503 16.549 -0.277 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.632 17.025 1.200 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.889 15.880 0.058 1.00 0.00 H new ATOM 329 N VAL A 23 -5.868 13.101 -0.091 1.00 0.00 N ATOM 330 CA VAL A 23 -6.112 11.999 -1.010 1.00 0.00 C ATOM 331 C VAL A 23 -6.901 10.870 -0.315 1.00 0.00 C ATOM 332 O VAL A 23 -7.820 10.291 -0.900 1.00 0.00 O ATOM 333 CB VAL A 23 -4.786 11.468 -1.675 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.877 10.732 -0.705 1.00 0.00 C ATOM 335 CG2 VAL A 23 -5.065 10.632 -2.913 1.00 0.00 C ATOM 0 H VAL A 23 -4.902 13.182 0.226 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.726 12.384 -1.824 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.241 12.358 -1.989 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.983 10.394 -1.229 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.591 11.402 0.105 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.404 9.871 -0.294 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -4.123 10.287 -3.339 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -5.677 9.772 -2.641 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.596 11.237 -3.648 1.00 0.00 H new ATOM 345 N ILE A 24 -6.567 10.585 0.946 1.00 0.00 N ATOM 346 CA ILE A 24 -7.321 9.584 1.716 1.00 0.00 C ATOM 347 C ILE A 24 -8.748 10.063 1.933 1.00 0.00 C ATOM 348 O ILE A 24 -9.672 9.303 1.869 1.00 0.00 O ATOM 349 CB ILE A 24 -6.682 9.274 3.100 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.237 8.810 2.926 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.493 8.208 3.854 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.566 8.357 4.206 1.00 0.00 C ATOM 0 H ILE A 24 -5.796 11.022 1.451 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.304 8.666 1.129 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.691 10.191 3.689 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -5.216 7.989 2.209 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.656 9.625 2.495 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.025 8.009 4.818 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.510 8.568 4.011 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.520 7.289 3.268 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.544 8.045 3.990 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.551 9.180 4.920 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.119 7.519 4.630 1.00 0.00 H new ATOM 364 N LYS A 25 -8.883 11.331 2.182 1.00 0.00 N ATOM 365 CA LYS A 25 -10.150 12.012 2.389 1.00 0.00 C ATOM 366 C LYS A 25 -11.009 11.928 1.131 1.00 0.00 C ATOM 367 O LYS A 25 -12.235 11.775 1.199 1.00 0.00 O ATOM 368 CB LYS A 25 -9.822 13.452 2.725 1.00 0.00 C ATOM 369 CG LYS A 25 -10.955 14.360 3.114 1.00 0.00 C ATOM 370 CD LYS A 25 -10.394 15.753 3.369 1.00 0.00 C ATOM 371 CE LYS A 25 -10.021 16.479 2.071 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.198 16.822 1.241 1.00 0.00 N ATOM 0 H LYS A 25 -8.082 11.959 2.252 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.719 11.550 3.196 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.101 13.449 3.542 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.323 13.891 1.861 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.703 14.392 2.322 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.453 13.983 4.007 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.130 16.344 3.914 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.512 15.676 4.005 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.477 17.392 2.315 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.345 15.851 1.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.909 17.467 0.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.596 15.955 0.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.917 17.285 1.833 1.00 0.00 H new ATOM 386 N GLU A 26 -10.365 12.021 -0.003 1.00 0.00 N ATOM 387 CA GLU A 26 -11.028 11.873 -1.280 1.00 0.00 C ATOM 388 C GLU A 26 -11.537 10.446 -1.411 1.00 0.00 C ATOM 389 O GLU A 26 -12.694 10.211 -1.794 1.00 0.00 O ATOM 390 CB GLU A 26 -10.057 12.186 -2.403 1.00 0.00 C ATOM 391 CG GLU A 26 -10.671 12.136 -3.772 1.00 0.00 C ATOM 392 CD GLU A 26 -9.671 12.404 -4.846 1.00 0.00 C ATOM 393 OE1 GLU A 26 -9.315 13.576 -5.047 1.00 0.00 O ATOM 394 OE2 GLU A 26 -9.243 11.463 -5.533 1.00 0.00 O ATOM 0 H GLU A 26 -9.363 12.202 -0.071 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.868 12.565 -1.342 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.637 13.179 -2.240 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.229 11.479 -2.361 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.120 11.156 -3.932 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.475 12.869 -3.835 1.00 0.00 H new ATOM 401 N LEU A 27 -10.678 9.506 -1.048 1.00 0.00 N ATOM 402 CA LEU A 27 -11.021 8.104 -1.093 1.00 0.00 C ATOM 403 C LEU A 27 -12.173 7.843 -0.109 1.00 0.00 C ATOM 404 O LEU A 27 -13.074 7.114 -0.404 1.00 0.00 O ATOM 405 CB LEU A 27 -9.793 7.213 -0.764 1.00 0.00 C ATOM 406 CG LEU A 27 -9.957 5.720 -0.996 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.273 5.450 -2.430 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.686 4.989 -0.608 1.00 0.00 C ATOM 0 H LEU A 27 -9.732 9.697 -0.717 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.340 7.844 -2.102 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.950 7.560 -1.361 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.529 7.369 0.282 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.780 5.362 -0.377 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.388 4.377 -2.581 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.200 5.956 -2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.462 5.820 -3.057 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.815 3.920 -0.778 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.856 5.356 -1.213 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.472 5.165 0.446 1.00 0.00 H new ATOM 420 N LYS A 28 -12.116 8.499 1.040 1.00 0.00 N ATOM 421 CA LYS A 28 -13.125 8.438 2.104 1.00 0.00 C ATOM 422 C LYS A 28 -14.471 8.924 1.610 1.00 0.00 C ATOM 423 O LYS A 28 -15.513 8.338 1.936 1.00 0.00 O ATOM 424 CB LYS A 28 -12.650 9.266 3.317 1.00 0.00 C ATOM 425 CG LYS A 28 -13.635 9.354 4.468 1.00 0.00 C ATOM 426 CD LYS A 28 -13.978 7.987 4.996 1.00 0.00 C ATOM 427 CE LYS A 28 -14.967 8.061 6.132 1.00 0.00 C ATOM 428 NZ LYS A 28 -16.232 8.726 5.729 1.00 0.00 N ATOM 0 H LYS A 28 -11.337 9.115 1.273 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.248 7.399 2.411 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.720 8.835 3.688 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.420 10.276 2.979 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -13.210 9.960 5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -14.543 9.857 4.135 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -14.392 7.379 4.192 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -13.070 7.489 5.336 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.185 7.054 6.489 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.522 8.605 6.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -16.883 8.755 6.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -16.029 9.696 5.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -16.672 8.193 4.951 1.00 0.00 H new ATOM 442 N THR A 29 -14.442 9.976 0.812 1.00 0.00 N ATOM 443 CA THR A 29 -15.623 10.504 0.192 1.00 0.00 C ATOM 444 C THR A 29 -16.286 9.402 -0.649 1.00 0.00 C ATOM 445 O THR A 29 -17.473 9.116 -0.499 1.00 0.00 O ATOM 446 CB THR A 29 -15.269 11.726 -0.694 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.581 12.714 0.109 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.528 12.349 -1.279 1.00 0.00 C ATOM 0 H THR A 29 -13.589 10.484 0.580 1.00 0.00 H new ATOM 0 HA THR A 29 -16.319 10.837 0.962 1.00 0.00 H new ATOM 0 HB THR A 29 -14.630 11.391 -1.511 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.687 12.384 0.339 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.257 13.205 -1.897 1.00 0.00 H new ATOM 0 HG22 THR A 29 -17.049 11.611 -1.889 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.181 12.678 -0.470 1.00 0.00 H new ATOM 456 N ALA A 30 -15.486 8.722 -1.439 1.00 0.00 N ATOM 457 CA ALA A 30 -15.967 7.669 -2.285 1.00 0.00 C ATOM 458 C ALA A 30 -16.335 6.423 -1.479 1.00 0.00 C ATOM 459 O ALA A 30 -17.207 5.703 -1.847 1.00 0.00 O ATOM 460 CB ALA A 30 -14.940 7.353 -3.339 1.00 0.00 C ATOM 0 H ALA A 30 -14.482 8.889 -1.508 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.879 8.010 -2.774 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.310 6.552 -3.979 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -14.752 8.242 -3.941 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -14.013 7.036 -2.861 1.00 0.00 H new ATOM 466 N ALA A 31 -15.631 6.188 -0.417 1.00 0.00 N ATOM 467 CA ALA A 31 -15.861 5.046 0.460 1.00 0.00 C ATOM 468 C ALA A 31 -17.305 5.029 0.977 1.00 0.00 C ATOM 469 O ALA A 31 -18.008 4.023 0.881 1.00 0.00 O ATOM 470 CB ALA A 31 -14.917 5.137 1.646 1.00 0.00 C ATOM 0 H ALA A 31 -14.862 6.786 -0.115 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.683 4.132 -0.107 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.082 4.287 2.308 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.886 5.127 1.292 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.105 6.062 2.190 1.00 0.00 H new ATOM 476 N SER A 32 -17.743 6.155 1.489 1.00 0.00 N ATOM 477 CA SER A 32 -19.048 6.248 2.083 1.00 0.00 C ATOM 478 C SER A 32 -20.150 6.470 1.017 1.00 0.00 C ATOM 479 O SER A 32 -21.313 6.117 1.225 1.00 0.00 O ATOM 480 CB SER A 32 -19.023 7.390 3.102 1.00 0.00 C ATOM 481 OG SER A 32 -17.963 7.191 4.048 1.00 0.00 O ATOM 0 H SER A 32 -17.208 7.023 1.504 1.00 0.00 H new ATOM 0 HA SER A 32 -19.291 5.309 2.579 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.887 8.342 2.588 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.979 7.443 3.623 1.00 0.00 H new ATOM 0 HG SER A 32 -18.338 7.128 4.951 1.00 0.00 H new ATOM 487 N GLN A 33 -19.777 7.054 -0.111 1.00 0.00 N ATOM 488 CA GLN A 33 -20.722 7.381 -1.172 1.00 0.00 C ATOM 489 C GLN A 33 -20.814 6.284 -2.250 1.00 0.00 C ATOM 490 O GLN A 33 -21.857 5.672 -2.460 1.00 0.00 O ATOM 491 CB GLN A 33 -20.311 8.713 -1.805 1.00 0.00 C ATOM 492 CG GLN A 33 -20.486 9.902 -0.891 1.00 0.00 C ATOM 493 CD GLN A 33 -21.933 10.314 -0.731 1.00 0.00 C ATOM 494 OE1 GLN A 33 -22.347 10.797 0.317 1.00 0.00 O ATOM 495 NE2 GLN A 33 -22.704 10.173 -1.769 1.00 0.00 N ATOM 0 H GLN A 33 -18.813 7.315 -0.318 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.714 7.458 -0.726 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.267 8.652 -2.111 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.899 8.872 -2.709 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -20.071 9.665 0.088 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.915 10.743 -1.284 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -22.333 9.768 -2.629 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -23.679 10.468 -1.723 1.00 0.00 H new ATOM 504 N TYR A 34 -19.683 6.059 -2.879 1.00 0.00 N ATOM 505 CA TYR A 34 -19.490 5.224 -4.069 1.00 0.00 C ATOM 506 C TYR A 34 -19.296 3.741 -3.760 1.00 0.00 C ATOM 507 O TYR A 34 -19.875 2.863 -4.441 1.00 0.00 O ATOM 508 CB TYR A 34 -18.289 5.812 -4.874 1.00 0.00 C ATOM 509 CG TYR A 34 -18.676 7.065 -5.604 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.831 8.246 -4.920 1.00 0.00 C ATOM 511 CD2 TYR A 34 -18.946 7.053 -6.957 1.00 0.00 C ATOM 512 CE1 TYR A 34 -19.251 9.386 -5.546 1.00 0.00 C ATOM 513 CE2 TYR A 34 -19.355 8.200 -7.602 1.00 0.00 C ATOM 514 CZ TYR A 34 -19.508 9.365 -6.885 1.00 0.00 C ATOM 515 OH TYR A 34 -19.935 10.511 -7.511 1.00 0.00 O ATOM 0 H TYR A 34 -18.808 6.477 -2.561 1.00 0.00 H new ATOM 0 HA TYR A 34 -20.403 5.254 -4.664 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -17.464 6.026 -4.194 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.930 5.070 -5.587 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -18.616 8.274 -3.862 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -18.836 6.136 -7.516 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -19.379 10.299 -4.983 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -19.554 8.185 -8.663 1.00 0.00 H new ATOM 0 HH TYR A 34 -20.073 10.331 -8.464 1.00 0.00 H new ATOM 525 N GLY A 35 -18.569 3.463 -2.709 1.00 0.00 N ATOM 526 CA GLY A 35 -18.205 2.094 -2.397 1.00 0.00 C ATOM 527 C GLY A 35 -17.018 1.683 -3.255 1.00 0.00 C ATOM 528 O GLY A 35 -16.828 2.240 -4.342 1.00 0.00 O ATOM 0 H GLY A 35 -18.215 4.160 -2.053 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.953 2.004 -1.340 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -19.049 1.430 -2.581 1.00 0.00 H new ATOM 532 N ALA A 36 -16.252 0.687 -2.840 1.00 0.00 N ATOM 533 CA ALA A 36 -15.037 0.368 -3.563 1.00 0.00 C ATOM 534 C ALA A 36 -15.287 -0.601 -4.696 1.00 0.00 C ATOM 535 O ALA A 36 -15.245 -1.786 -4.522 1.00 0.00 O ATOM 536 CB ALA A 36 -13.899 -0.070 -2.657 1.00 0.00 C ATOM 0 H ALA A 36 -16.444 0.101 -2.028 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.702 1.300 -4.018 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -13.019 -0.294 -3.260 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.664 0.730 -1.955 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.196 -0.961 -2.104 1.00 0.00 H new ATOM 542 N THR A 37 -15.508 -0.054 -5.865 1.00 0.00 N ATOM 543 CA THR A 37 -15.897 -0.799 -7.057 1.00 0.00 C ATOM 544 C THR A 37 -16.135 0.193 -8.183 1.00 0.00 C ATOM 545 O THR A 37 -15.830 -0.090 -9.333 1.00 0.00 O ATOM 546 CB THR A 37 -17.163 -1.687 -6.839 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.551 -2.355 -8.050 1.00 0.00 O ATOM 548 CG2 THR A 37 -18.314 -0.868 -6.318 1.00 0.00 C ATOM 0 H THR A 37 -15.422 0.949 -6.028 1.00 0.00 H new ATOM 0 HA THR A 37 -15.088 -1.486 -7.306 1.00 0.00 H new ATOM 0 HB THR A 37 -16.902 -2.442 -6.097 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.345 -2.904 -7.881 1.00 0.00 H new ATOM 0 HG21 THR A 37 -19.183 -1.511 -6.175 1.00 0.00 H new ATOM 0 HG22 THR A 37 -18.037 -0.415 -5.366 1.00 0.00 H new ATOM 0 HG23 THR A 37 -18.557 -0.084 -7.035 1.00 0.00 H new ATOM 556 N ALA A 38 -16.680 1.360 -7.827 1.00 0.00 N ATOM 557 CA ALA A 38 -16.849 2.448 -8.771 1.00 0.00 C ATOM 558 C ALA A 38 -15.476 2.874 -9.266 1.00 0.00 C ATOM 559 O ALA A 38 -14.554 3.007 -8.454 1.00 0.00 O ATOM 560 CB ALA A 38 -17.555 3.617 -8.101 1.00 0.00 C ATOM 0 H ALA A 38 -17.011 1.568 -6.885 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.459 2.120 -9.612 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.677 4.428 -8.819 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.535 3.296 -7.747 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.960 3.966 -7.257 1.00 0.00 H new ATOM 566 N PRO A 39 -15.313 3.089 -10.592 1.00 0.00 N ATOM 567 CA PRO A 39 -14.026 3.448 -11.216 1.00 0.00 C ATOM 568 C PRO A 39 -13.287 4.576 -10.500 1.00 0.00 C ATOM 569 O PRO A 39 -12.066 4.595 -10.465 1.00 0.00 O ATOM 570 CB PRO A 39 -14.404 3.875 -12.643 1.00 0.00 C ATOM 571 CG PRO A 39 -15.897 3.898 -12.683 1.00 0.00 C ATOM 572 CD PRO A 39 -16.376 2.986 -11.596 1.00 0.00 C ATOM 0 HA PRO A 39 -13.335 2.606 -11.176 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.992 4.856 -12.879 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.005 3.176 -13.378 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.272 4.910 -12.531 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -16.262 3.566 -13.655 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.340 3.303 -11.198 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.499 1.963 -11.951 1.00 0.00 H new ATOM 580 N TYR A 40 -14.041 5.487 -9.910 1.00 0.00 N ATOM 581 CA TYR A 40 -13.482 6.595 -9.183 1.00 0.00 C ATOM 582 C TYR A 40 -12.601 6.103 -7.997 1.00 0.00 C ATOM 583 O TYR A 40 -11.372 6.240 -8.026 1.00 0.00 O ATOM 584 CB TYR A 40 -14.629 7.504 -8.705 1.00 0.00 C ATOM 585 CG TYR A 40 -14.220 8.737 -7.926 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.596 9.805 -8.553 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.462 8.834 -6.569 1.00 0.00 C ATOM 588 CE1 TYR A 40 -13.224 10.933 -7.849 1.00 0.00 C ATOM 589 CE2 TYR A 40 -14.095 9.958 -5.857 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.476 11.002 -6.506 1.00 0.00 C ATOM 591 OH TYR A 40 -13.113 12.121 -5.804 1.00 0.00 O ATOM 0 H TYR A 40 -15.061 5.472 -9.926 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.826 7.168 -9.838 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.201 7.823 -9.577 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.300 6.912 -8.083 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.397 9.753 -9.613 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.947 8.016 -6.057 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.738 11.754 -8.354 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.292 10.018 -4.797 1.00 0.00 H new ATOM 0 HH TYR A 40 -13.363 12.012 -4.863 1.00 0.00 H new ATOM 601 N THR A 41 -13.233 5.514 -6.966 1.00 0.00 N ATOM 602 CA THR A 41 -12.580 5.059 -5.750 1.00 0.00 C ATOM 603 C THR A 41 -11.303 4.212 -5.956 1.00 0.00 C ATOM 604 O THR A 41 -10.271 4.524 -5.372 1.00 0.00 O ATOM 605 CB THR A 41 -13.593 4.371 -4.798 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.984 4.029 -3.558 1.00 0.00 O ATOM 607 CG2 THR A 41 -14.171 3.134 -5.415 1.00 0.00 C ATOM 0 H THR A 41 -14.238 5.342 -6.967 1.00 0.00 H new ATOM 0 HA THR A 41 -12.210 5.967 -5.273 1.00 0.00 H new ATOM 0 HB THR A 41 -14.394 5.088 -4.620 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.645 3.598 -2.977 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.877 2.677 -4.721 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.688 3.395 -6.338 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.370 2.428 -5.635 1.00 0.00 H new ATOM 615 N LEU A 42 -11.333 3.187 -6.787 1.00 0.00 N ATOM 616 CA LEU A 42 -10.138 2.383 -6.933 1.00 0.00 C ATOM 617 C LEU A 42 -9.046 3.033 -7.735 1.00 0.00 C ATOM 618 O LEU A 42 -7.895 2.725 -7.536 1.00 0.00 O ATOM 619 CB LEU A 42 -10.320 0.860 -7.220 1.00 0.00 C ATOM 620 CG LEU A 42 -11.358 0.384 -8.256 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.744 0.422 -7.674 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.285 1.186 -9.553 1.00 0.00 C ATOM 0 H LEU A 42 -12.135 2.901 -7.349 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.779 2.363 -5.904 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.350 0.472 -7.532 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.565 0.380 -6.273 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.117 -0.649 -8.508 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.462 0.082 -8.421 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.791 -0.231 -6.803 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.986 1.442 -7.376 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.034 0.815 -10.253 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.475 2.238 -9.341 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.293 1.078 -9.992 1.00 0.00 H new ATOM 634 N ALA A 43 -9.400 3.995 -8.584 1.00 0.00 N ATOM 635 CA ALA A 43 -8.401 4.775 -9.287 1.00 0.00 C ATOM 636 C ALA A 43 -7.614 5.579 -8.272 1.00 0.00 C ATOM 637 O ALA A 43 -6.418 5.827 -8.431 1.00 0.00 O ATOM 638 CB ALA A 43 -9.031 5.687 -10.327 1.00 0.00 C ATOM 0 H ALA A 43 -10.365 4.247 -8.797 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.735 4.100 -9.824 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.251 6.255 -10.833 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.574 5.086 -11.057 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.721 6.374 -9.838 1.00 0.00 H new ATOM 644 N ILE A 44 -8.293 5.924 -7.198 1.00 0.00 N ATOM 645 CA ILE A 44 -7.699 6.642 -6.091 1.00 0.00 C ATOM 646 C ILE A 44 -6.822 5.662 -5.253 1.00 0.00 C ATOM 647 O ILE A 44 -5.735 6.031 -4.800 1.00 0.00 O ATOM 648 CB ILE A 44 -8.794 7.261 -5.202 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.749 8.119 -6.034 1.00 0.00 C ATOM 650 CG2 ILE A 44 -8.186 8.095 -4.083 1.00 0.00 C ATOM 651 CD1 ILE A 44 -11.028 8.472 -5.304 1.00 0.00 C ATOM 0 H ILE A 44 -9.282 5.712 -7.068 1.00 0.00 H new ATOM 0 HA ILE A 44 -7.076 7.447 -6.480 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.357 6.442 -4.755 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -9.240 9.038 -6.326 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.998 7.587 -6.952 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.982 8.519 -3.472 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.550 7.463 -3.463 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.590 8.900 -4.512 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.660 9.081 -5.951 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.558 7.558 -5.036 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.788 9.031 -4.400 1.00 0.00 H new ATOM 663 N VAL A 45 -7.290 4.403 -5.096 1.00 0.00 N ATOM 664 CA VAL A 45 -6.523 3.343 -4.388 1.00 0.00 C ATOM 665 C VAL A 45 -5.215 3.076 -5.170 1.00 0.00 C ATOM 666 O VAL A 45 -4.123 2.941 -4.597 1.00 0.00 O ATOM 667 CB VAL A 45 -7.353 1.988 -4.239 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.566 0.899 -3.501 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.669 2.208 -3.508 1.00 0.00 C ATOM 0 H VAL A 45 -8.195 4.092 -5.449 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.307 3.694 -3.379 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.551 1.656 -5.258 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.175 -0.002 -3.426 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.652 0.675 -4.051 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.311 1.249 -2.501 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.203 1.261 -3.428 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.470 2.598 -2.510 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.278 2.922 -4.062 1.00 0.00 H new ATOM 679 N GLU A 46 -5.328 3.056 -6.481 1.00 0.00 N ATOM 680 CA GLU A 46 -4.179 2.865 -7.335 1.00 0.00 C ATOM 681 C GLU A 46 -3.314 4.114 -7.341 1.00 0.00 C ATOM 682 O GLU A 46 -2.112 4.041 -7.551 1.00 0.00 O ATOM 683 CB GLU A 46 -4.608 2.516 -8.760 1.00 0.00 C ATOM 684 CG GLU A 46 -5.571 1.347 -8.832 1.00 0.00 C ATOM 685 CD GLU A 46 -5.770 0.847 -10.221 1.00 0.00 C ATOM 686 OE1 GLU A 46 -4.961 0.026 -10.684 1.00 0.00 O ATOM 687 OE2 GLU A 46 -6.736 1.245 -10.882 1.00 0.00 O ATOM 0 H GLU A 46 -6.211 3.171 -6.979 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.598 2.032 -6.939 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.075 3.390 -9.215 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.722 2.284 -9.351 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.197 0.535 -8.209 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.533 1.649 -8.418 1.00 0.00 H new ATOM 694 N SER A 47 -3.925 5.253 -7.082 1.00 0.00 N ATOM 695 CA SER A 47 -3.224 6.513 -7.087 1.00 0.00 C ATOM 696 C SER A 47 -2.342 6.632 -5.850 1.00 0.00 C ATOM 697 O SER A 47 -1.157 6.951 -5.963 1.00 0.00 O ATOM 698 CB SER A 47 -4.202 7.688 -7.177 1.00 0.00 C ATOM 699 OG SER A 47 -3.534 8.898 -7.465 1.00 0.00 O ATOM 0 H SER A 47 -4.919 5.327 -6.863 1.00 0.00 H new ATOM 0 HA SER A 47 -2.586 6.546 -7.970 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.943 7.487 -7.951 1.00 0.00 H new ATOM 0 HB3 SER A 47 -4.743 7.785 -6.236 1.00 0.00 H new ATOM 0 HG SER A 47 -4.186 9.627 -7.517 1.00 0.00 H new ATOM 705 N VAL A 48 -2.903 6.343 -4.670 1.00 0.00 N ATOM 706 CA VAL A 48 -2.125 6.381 -3.431 1.00 0.00 C ATOM 707 C VAL A 48 -0.980 5.411 -3.493 1.00 0.00 C ATOM 708 O VAL A 48 0.117 5.694 -3.024 1.00 0.00 O ATOM 709 CB VAL A 48 -2.965 6.117 -2.154 1.00 0.00 C ATOM 710 CG1 VAL A 48 -3.865 7.294 -1.859 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.806 4.872 -2.291 1.00 0.00 C ATOM 0 H VAL A 48 -3.882 6.083 -4.549 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.749 7.401 -3.353 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.265 5.975 -1.331 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.447 7.091 -0.960 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.258 8.186 -1.705 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.540 7.455 -2.699 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.381 4.719 -1.378 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.488 4.984 -3.134 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.158 4.012 -2.460 1.00 0.00 H new ATOM 721 N ALA A 49 -1.224 4.315 -4.156 1.00 0.00 N ATOM 722 CA ALA A 49 -0.255 3.268 -4.311 1.00 0.00 C ATOM 723 C ALA A 49 0.857 3.641 -5.295 1.00 0.00 C ATOM 724 O ALA A 49 1.920 3.061 -5.277 1.00 0.00 O ATOM 725 CB ALA A 49 -0.964 2.023 -4.759 1.00 0.00 C ATOM 0 H ALA A 49 -2.116 4.122 -4.611 1.00 0.00 H new ATOM 0 HA ALA A 49 0.231 3.102 -3.350 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.241 1.217 -4.882 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.704 1.736 -4.011 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.463 2.211 -5.710 1.00 0.00 H new ATOM 731 N ASP A 50 0.628 4.653 -6.100 1.00 0.00 N ATOM 732 CA ASP A 50 1.587 5.032 -7.154 1.00 0.00 C ATOM 733 C ASP A 50 2.578 6.063 -6.612 1.00 0.00 C ATOM 734 O ASP A 50 3.396 6.660 -7.336 1.00 0.00 O ATOM 735 CB ASP A 50 0.819 5.548 -8.371 1.00 0.00 C ATOM 736 CG ASP A 50 1.652 5.646 -9.621 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.137 4.593 -10.107 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.778 6.757 -10.188 1.00 0.00 O ATOM 0 H ASP A 50 -0.207 5.237 -6.059 1.00 0.00 H new ATOM 0 HA ASP A 50 2.167 4.164 -7.468 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.027 4.888 -8.561 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.410 6.532 -8.140 1.00 0.00 H new ATOM 743 N ASN A 51 2.497 6.230 -5.323 1.00 0.00 N ATOM 744 CA ASN A 51 3.353 7.102 -4.546 1.00 0.00 C ATOM 745 C ASN A 51 4.338 6.234 -3.821 1.00 0.00 C ATOM 746 O ASN A 51 4.065 5.076 -3.608 1.00 0.00 O ATOM 747 CB ASN A 51 2.541 7.842 -3.466 1.00 0.00 C ATOM 748 CG ASN A 51 1.710 9.007 -3.943 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.165 10.158 -3.960 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.495 8.741 -4.309 1.00 0.00 N ATOM 0 H ASN A 51 1.804 5.744 -4.753 1.00 0.00 H new ATOM 0 HA ASN A 51 3.828 7.822 -5.212 1.00 0.00 H new ATOM 0 HB2 ASN A 51 1.879 7.124 -2.982 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.232 8.203 -2.704 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -0.119 9.492 -4.624 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.153 7.780 -4.282 1.00 0.00 H new ATOM 757 N TRP A 52 5.476 6.766 -3.446 1.00 0.00 N ATOM 758 CA TRP A 52 6.370 5.996 -2.598 1.00 0.00 C ATOM 759 C TRP A 52 5.794 5.981 -1.211 1.00 0.00 C ATOM 760 O TRP A 52 5.577 7.042 -0.618 1.00 0.00 O ATOM 761 CB TRP A 52 7.772 6.588 -2.494 1.00 0.00 C ATOM 762 CG TRP A 52 8.657 6.499 -3.684 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.574 5.657 -4.756 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.829 7.264 -3.858 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.637 5.878 -5.596 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.426 6.869 -5.058 1.00 0.00 C ATOM 767 CE3 TRP A 52 10.421 8.260 -3.102 1.00 0.00 C ATOM 768 CZ2 TRP A 52 11.612 7.447 -5.513 1.00 0.00 C ATOM 769 CZ3 TRP A 52 11.575 8.827 -3.541 1.00 0.00 C ATOM 770 CH2 TRP A 52 12.167 8.432 -4.725 1.00 0.00 C ATOM 0 H TRP A 52 5.803 7.698 -3.701 1.00 0.00 H new ATOM 0 HA TRP A 52 6.457 5.005 -3.043 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.671 7.641 -2.231 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.280 6.099 -1.663 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.792 4.929 -4.918 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.813 5.389 -6.474 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.971 8.583 -2.175 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 12.073 7.137 -6.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 12.040 9.603 -2.951 1.00 0.00 H new ATOM 0 HH2 TRP A 52 13.085 8.906 -5.040 1.00 0.00 H new ATOM 781 N LEU A 53 5.519 4.835 -0.704 1.00 0.00 N ATOM 782 CA LEU A 53 5.018 4.719 0.630 1.00 0.00 C ATOM 783 C LEU A 53 5.354 3.344 1.168 1.00 0.00 C ATOM 784 O LEU A 53 5.899 2.513 0.443 1.00 0.00 O ATOM 785 CB LEU A 53 3.485 5.086 0.756 1.00 0.00 C ATOM 786 CG LEU A 53 2.392 4.129 0.175 1.00 0.00 C ATOM 787 CD1 LEU A 53 1.002 4.744 0.303 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.642 3.762 -1.271 1.00 0.00 C ATOM 0 H LEU A 53 5.632 3.948 -1.195 1.00 0.00 H new ATOM 0 HA LEU A 53 5.515 5.463 1.253 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.270 5.214 1.817 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.346 6.058 0.283 1.00 0.00 H new ATOM 0 HG LEU A 53 2.448 3.216 0.767 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.261 4.058 -0.108 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.781 4.929 1.354 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.969 5.685 -0.245 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.852 3.097 -1.619 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.650 4.666 -1.880 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.605 3.258 -1.357 1.00 0.00 H new ATOM 800 N THR A 54 5.039 3.110 2.398 1.00 0.00 N ATOM 801 CA THR A 54 5.390 1.881 3.050 1.00 0.00 C ATOM 802 C THR A 54 4.120 1.166 3.530 1.00 0.00 C ATOM 803 O THR A 54 3.065 1.799 3.590 1.00 0.00 O ATOM 804 CB THR A 54 6.407 2.156 4.208 1.00 0.00 C ATOM 805 OG1 THR A 54 6.479 3.570 4.501 1.00 0.00 O ATOM 806 CG2 THR A 54 7.787 1.678 3.821 1.00 0.00 C ATOM 0 H THR A 54 4.528 3.767 2.988 1.00 0.00 H new ATOM 0 HA THR A 54 5.888 1.214 2.346 1.00 0.00 H new ATOM 0 HB THR A 54 6.059 1.616 5.089 1.00 0.00 H new ATOM 0 HG1 THR A 54 5.624 3.871 4.874 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.483 1.876 4.636 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.758 0.607 3.621 1.00 0.00 H new ATOM 0 HG23 THR A 54 8.117 2.206 2.926 1.00 0.00 H new ATOM 814 N PRO A 55 4.170 -0.170 3.841 1.00 0.00 N ATOM 815 CA PRO A 55 2.988 -0.931 4.310 1.00 0.00 C ATOM 816 C PRO A 55 2.297 -0.269 5.516 1.00 0.00 C ATOM 817 O PRO A 55 1.090 -0.370 5.677 1.00 0.00 O ATOM 818 CB PRO A 55 3.572 -2.289 4.708 1.00 0.00 C ATOM 819 CG PRO A 55 4.769 -2.432 3.838 1.00 0.00 C ATOM 820 CD PRO A 55 5.358 -1.054 3.720 1.00 0.00 C ATOM 0 HA PRO A 55 2.217 -0.991 3.542 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.840 -2.314 5.764 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.858 -3.095 4.541 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.487 -3.128 4.272 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.496 -2.825 2.859 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.088 -0.859 4.506 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.870 -0.914 2.768 1.00 0.00 H new ATOM 828 N THR A 56 3.075 0.408 6.340 1.00 0.00 N ATOM 829 CA THR A 56 2.579 1.138 7.483 1.00 0.00 C ATOM 830 C THR A 56 1.593 2.256 7.019 1.00 0.00 C ATOM 831 O THR A 56 0.490 2.407 7.574 1.00 0.00 O ATOM 832 CB THR A 56 3.786 1.741 8.201 1.00 0.00 C ATOM 833 OG1 THR A 56 4.848 0.755 8.193 1.00 0.00 O ATOM 834 CG2 THR A 56 3.441 2.114 9.640 1.00 0.00 C ATOM 0 H THR A 56 4.087 0.465 6.228 1.00 0.00 H new ATOM 0 HA THR A 56 2.032 0.479 8.157 1.00 0.00 H new ATOM 0 HB THR A 56 4.096 2.651 7.688 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.636 1.119 8.647 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.319 2.540 10.126 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.633 2.846 9.642 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.124 1.222 10.181 1.00 0.00 H new ATOM 842 N ASP A 57 1.988 2.986 5.955 1.00 0.00 N ATOM 843 CA ASP A 57 1.161 4.041 5.343 1.00 0.00 C ATOM 844 C ASP A 57 -0.092 3.430 4.774 1.00 0.00 C ATOM 845 O ASP A 57 -1.190 3.946 4.955 1.00 0.00 O ATOM 846 CB ASP A 57 1.906 4.772 4.192 1.00 0.00 C ATOM 847 CG ASP A 57 3.208 5.408 4.592 1.00 0.00 C ATOM 848 OD1 ASP A 57 4.213 4.705 4.667 1.00 0.00 O ATOM 849 OD2 ASP A 57 3.261 6.633 4.827 1.00 0.00 O ATOM 0 H ASP A 57 2.891 2.858 5.497 1.00 0.00 H new ATOM 0 HA ASP A 57 0.929 4.765 6.125 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.097 4.059 3.390 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.251 5.542 3.785 1.00 0.00 H new ATOM 854 N TRP A 58 0.087 2.314 4.092 1.00 0.00 N ATOM 855 CA TRP A 58 -1.018 1.572 3.505 1.00 0.00 C ATOM 856 C TRP A 58 -2.022 1.163 4.559 1.00 0.00 C ATOM 857 O TRP A 58 -3.194 1.491 4.475 1.00 0.00 O ATOM 858 CB TRP A 58 -0.531 0.304 2.805 1.00 0.00 C ATOM 859 CG TRP A 58 0.043 0.460 1.433 1.00 0.00 C ATOM 860 CD1 TRP A 58 1.278 0.926 1.085 1.00 0.00 C ATOM 861 CD2 TRP A 58 -0.594 0.070 0.212 1.00 0.00 C ATOM 862 NE1 TRP A 58 1.428 0.860 -0.279 1.00 0.00 N ATOM 863 CE2 TRP A 58 0.307 0.331 -0.827 1.00 0.00 C ATOM 864 CE3 TRP A 58 -1.844 -0.474 -0.104 1.00 0.00 C ATOM 865 CZ2 TRP A 58 0.016 0.059 -2.153 1.00 0.00 C ATOM 866 CZ3 TRP A 58 -2.133 -0.744 -1.427 1.00 0.00 C ATOM 867 CH2 TRP A 58 -1.205 -0.484 -2.436 1.00 0.00 C ATOM 0 H TRP A 58 1.002 1.895 3.928 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.486 2.238 2.780 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.225 -0.162 3.437 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.368 -0.391 2.744 1.00 0.00 H new ATOM 0 HD1 TRP A 58 2.023 1.291 1.776 1.00 0.00 H new ATOM 0 HE1 TRP A 58 2.253 1.162 -0.798 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -2.568 -0.678 0.671 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 0.729 0.269 -2.936 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -3.094 -1.164 -1.685 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -1.457 -0.716 -3.460 1.00 0.00 H new ATOM 878 N ASN A 59 -1.562 0.462 5.560 1.00 0.00 N ATOM 879 CA ASN A 59 -2.445 -0.088 6.576 1.00 0.00 C ATOM 880 C ASN A 59 -3.221 0.981 7.338 1.00 0.00 C ATOM 881 O ASN A 59 -4.411 0.811 7.625 1.00 0.00 O ATOM 882 CB ASN A 59 -1.713 -1.068 7.505 1.00 0.00 C ATOM 883 CG ASN A 59 -1.282 -2.339 6.767 1.00 0.00 C ATOM 884 OD1 ASN A 59 -1.930 -2.759 5.798 1.00 0.00 O ATOM 885 ND2 ASN A 59 -0.213 -2.961 7.206 1.00 0.00 N ATOM 0 H ASN A 59 -0.574 0.252 5.702 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.200 -0.667 6.043 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.836 -0.580 7.930 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.364 -1.334 8.338 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.105 -3.815 6.747 1.00 0.00 H new ATOM 0 HD22 ASN A 59 0.300 -2.591 8.006 1.00 0.00 H new ATOM 892 N THR A 60 -2.605 2.109 7.566 1.00 0.00 N ATOM 893 CA THR A 60 -3.292 3.177 8.246 1.00 0.00 C ATOM 894 C THR A 60 -4.281 3.842 7.273 1.00 0.00 C ATOM 895 O THR A 60 -5.248 4.442 7.693 1.00 0.00 O ATOM 896 CB THR A 60 -2.335 4.214 8.942 1.00 0.00 C ATOM 897 OG1 THR A 60 -3.069 5.017 9.873 1.00 0.00 O ATOM 898 CG2 THR A 60 -1.653 5.145 7.944 1.00 0.00 C ATOM 0 H THR A 60 -1.643 2.313 7.296 1.00 0.00 H new ATOM 0 HA THR A 60 -3.846 2.739 9.076 1.00 0.00 H new ATOM 0 HB THR A 60 -1.567 3.631 9.450 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.463 5.658 10.301 1.00 0.00 H new ATOM 0 HG21 THR A 60 -1.005 5.839 8.479 1.00 0.00 H new ATOM 0 HG22 THR A 60 -1.057 4.557 7.246 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.409 5.705 7.394 1.00 0.00 H new ATOM 906 N LEU A 61 -4.031 3.693 5.968 1.00 0.00 N ATOM 907 CA LEU A 61 -4.886 4.250 4.940 1.00 0.00 C ATOM 908 C LEU A 61 -6.200 3.526 4.914 1.00 0.00 C ATOM 909 O LEU A 61 -7.245 4.157 5.047 1.00 0.00 O ATOM 910 CB LEU A 61 -4.151 4.259 3.578 1.00 0.00 C ATOM 911 CG LEU A 61 -4.846 4.909 2.376 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.805 5.262 1.346 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.862 3.966 1.728 1.00 0.00 C ATOM 0 H LEU A 61 -3.227 3.181 5.605 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.115 5.291 5.167 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.195 4.763 3.721 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.930 3.225 3.314 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.374 5.794 2.731 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.287 5.725 0.485 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.087 5.959 1.778 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.287 4.358 1.028 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -6.332 4.465 0.880 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.354 3.065 1.383 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.625 3.695 2.458 1.00 0.00 H new ATOM 925 N VAL A 62 -6.165 2.191 4.811 1.00 0.00 N ATOM 926 CA VAL A 62 -7.414 1.406 4.812 1.00 0.00 C ATOM 927 C VAL A 62 -8.195 1.695 6.099 1.00 0.00 C ATOM 928 O VAL A 62 -9.421 1.842 6.096 1.00 0.00 O ATOM 929 CB VAL A 62 -7.171 -0.141 4.624 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.357 -0.752 5.738 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.478 -0.888 4.464 1.00 0.00 C ATOM 0 H VAL A 62 -5.311 1.640 4.728 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.003 1.718 3.949 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.589 -0.242 3.708 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.225 -1.818 5.550 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.381 -0.268 5.783 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.876 -0.612 6.686 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.276 -1.951 4.336 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -9.093 -0.739 5.352 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -9.007 -0.512 3.589 1.00 0.00 H new ATOM 941 N ARG A 63 -7.437 1.880 7.158 1.00 0.00 N ATOM 942 CA ARG A 63 -7.989 2.216 8.479 1.00 0.00 C ATOM 943 C ARG A 63 -8.630 3.599 8.508 1.00 0.00 C ATOM 944 O ARG A 63 -9.647 3.807 9.172 1.00 0.00 O ATOM 945 CB ARG A 63 -6.930 2.092 9.574 1.00 0.00 C ATOM 946 CG ARG A 63 -6.460 0.665 9.804 1.00 0.00 C ATOM 947 CD ARG A 63 -7.631 -0.195 10.129 1.00 0.00 C ATOM 948 NE ARG A 63 -7.265 -1.561 10.519 1.00 0.00 N ATOM 949 CZ ARG A 63 -8.113 -2.604 10.512 1.00 0.00 C ATOM 950 NH1 ARG A 63 -9.289 -2.514 9.888 1.00 0.00 N ATOM 951 NH2 ARG A 63 -7.754 -3.755 11.067 1.00 0.00 N ATOM 0 H ARG A 63 -6.420 1.805 7.141 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.777 1.489 8.677 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.072 2.711 9.310 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.334 2.488 10.506 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.955 0.289 8.914 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.736 0.636 10.618 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.196 0.266 10.939 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.292 -0.238 9.263 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.304 -1.731 10.815 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.549 -1.650 9.412 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.928 -3.309 9.887 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.835 -3.848 11.499 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.397 -4.546 11.062 1.00 0.00 H new ATOM 965 N ALA A 64 -8.038 4.528 7.803 1.00 0.00 N ATOM 966 CA ALA A 64 -8.522 5.898 7.722 1.00 0.00 C ATOM 967 C ALA A 64 -9.534 6.098 6.607 1.00 0.00 C ATOM 968 O ALA A 64 -10.048 7.211 6.424 1.00 0.00 O ATOM 969 CB ALA A 64 -7.360 6.857 7.536 1.00 0.00 C ATOM 0 H ALA A 64 -7.193 4.360 7.258 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.030 6.107 8.664 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.737 7.878 7.477 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -6.678 6.770 8.382 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -6.830 6.612 6.616 1.00 0.00 H new ATOM 975 N VAL A 65 -9.856 5.060 5.902 1.00 0.00 N ATOM 976 CA VAL A 65 -10.774 5.243 4.826 1.00 0.00 C ATOM 977 C VAL A 65 -12.062 4.395 4.921 1.00 0.00 C ATOM 978 O VAL A 65 -13.114 4.914 5.287 1.00 0.00 O ATOM 979 CB VAL A 65 -10.094 5.220 3.420 1.00 0.00 C ATOM 980 CG1 VAL A 65 -9.480 3.883 3.030 1.00 0.00 C ATOM 981 CG2 VAL A 65 -11.035 5.700 2.389 1.00 0.00 C ATOM 0 H VAL A 65 -9.512 4.110 6.044 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.136 6.264 4.950 1.00 0.00 H new ATOM 0 HB VAL A 65 -9.246 5.902 3.489 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -9.032 3.963 2.040 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.713 3.610 3.754 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -10.255 3.117 3.016 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -10.548 5.679 1.414 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.914 5.055 2.370 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -11.339 6.721 2.621 1.00 0.00 H new ATOM 991 N LEU A 66 -11.990 3.119 4.625 1.00 0.00 N ATOM 992 CA LEU A 66 -13.164 2.262 4.647 1.00 0.00 C ATOM 993 C LEU A 66 -13.375 1.696 6.038 1.00 0.00 C ATOM 994 O LEU A 66 -12.613 2.000 6.969 1.00 0.00 O ATOM 995 CB LEU A 66 -13.021 1.104 3.616 1.00 0.00 C ATOM 996 CG LEU A 66 -13.416 1.333 2.129 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.886 1.548 1.985 1.00 0.00 C ATOM 998 CD2 LEU A 66 -12.670 2.476 1.510 1.00 0.00 C ATOM 0 H LEU A 66 -11.126 2.643 4.364 1.00 0.00 H new ATOM 0 HA LEU A 66 -14.031 2.863 4.373 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.979 0.785 3.629 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.615 0.267 3.984 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.137 0.425 1.595 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -15.130 1.705 0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.420 0.672 2.354 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -15.184 2.424 2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.982 2.594 0.472 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.886 3.392 2.060 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.599 2.274 1.547 1.00 0.00 H new ATOM 1010 N SER A 67 -14.401 0.917 6.184 1.00 0.00 N ATOM 1011 CA SER A 67 -14.707 0.240 7.420 1.00 0.00 C ATOM 1012 C SER A 67 -15.629 -0.943 7.119 1.00 0.00 C ATOM 1013 O SER A 67 -16.745 -0.753 6.623 1.00 0.00 O ATOM 1014 CB SER A 67 -15.404 1.200 8.417 1.00 0.00 C ATOM 1015 OG SER A 67 -14.577 2.318 8.753 1.00 0.00 O ATOM 0 H SER A 67 -15.067 0.725 5.436 1.00 0.00 H new ATOM 0 HA SER A 67 -13.779 -0.109 7.873 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.338 1.557 7.983 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.662 0.655 9.325 1.00 0.00 H new ATOM 0 HG SER A 67 -13.666 2.161 8.427 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.159 -2.141 7.352 1.00 0.00 N ATOM 1022 CA GLY A 68 -15.989 -3.306 7.206 1.00 0.00 C ATOM 1023 C GLY A 68 -15.650 -4.097 5.972 1.00 0.00 C ATOM 1024 O GLY A 68 -14.834 -5.034 6.027 1.00 0.00 O ATOM 0 H GLY A 68 -14.201 -2.335 7.645 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.877 -3.942 8.084 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.035 -3.001 7.164 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.266 -3.707 4.853 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.077 -4.388 3.586 1.00 0.00 C ATOM 1030 C GLY A 69 -14.625 -4.484 3.169 1.00 0.00 C ATOM 1031 O GLY A 69 -14.192 -5.518 2.646 1.00 0.00 O ATOM 0 H GLY A 69 -16.905 -2.913 4.808 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.495 -5.392 3.655 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.636 -3.862 2.812 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.883 -3.409 3.388 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.456 -3.344 3.077 1.00 0.00 C ATOM 1037 C ASP A 70 -11.718 -4.516 3.634 1.00 0.00 C ATOM 1038 O ASP A 70 -11.009 -5.189 2.906 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.813 -2.064 3.616 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.986 -1.900 5.116 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.070 -1.547 5.532 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -11.053 -2.201 5.891 1.00 0.00 O ATOM 0 H ASP A 70 -14.254 -2.548 3.790 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.385 -3.352 1.989 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.750 -2.069 3.377 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.249 -1.203 3.109 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.935 -4.787 4.902 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.248 -5.823 5.583 1.00 0.00 C ATOM 1049 C HIS A 71 -11.467 -7.129 4.851 1.00 0.00 C ATOM 1050 O HIS A 71 -10.522 -7.750 4.381 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.707 -5.902 7.051 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.962 -6.912 7.891 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -11.589 -7.840 8.672 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.634 -7.104 8.094 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -10.702 -8.554 9.317 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.508 -8.130 8.983 1.00 0.00 N ATOM 0 H HIS A 71 -12.604 -4.280 5.481 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.179 -5.611 5.596 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.595 -4.918 7.506 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.769 -6.144 7.073 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.828 -6.548 7.637 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.917 -9.356 10.007 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -8.627 -8.507 9.332 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.707 -7.460 4.635 1.00 0.00 N ATOM 1066 CA LEU A 72 -13.032 -8.695 3.989 1.00 0.00 C ATOM 1067 C LEU A 72 -12.456 -8.861 2.562 1.00 0.00 C ATOM 1068 O LEU A 72 -11.677 -9.784 2.334 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.507 -9.138 4.219 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.646 -8.123 3.984 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.996 -7.980 2.521 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.878 -8.502 4.793 1.00 0.00 C ATOM 0 H LEU A 72 -13.510 -6.889 4.898 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.465 -9.463 4.515 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.695 -9.997 3.575 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.587 -9.488 5.248 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.284 -7.153 4.324 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.802 -7.255 2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.121 -7.637 1.969 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.318 -8.944 2.128 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.669 -7.774 4.613 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.221 -9.492 4.492 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.628 -8.512 5.854 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.721 -7.966 1.648 1.00 0.00 N ATOM 1085 CA LEU A 73 -12.149 -8.155 0.310 1.00 0.00 C ATOM 1086 C LEU A 73 -10.758 -7.563 0.126 1.00 0.00 C ATOM 1087 O LEU A 73 -9.810 -8.325 -0.168 1.00 0.00 O ATOM 1088 CB LEU A 73 -13.086 -7.805 -0.835 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.955 -8.962 -1.399 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.090 -10.115 -1.862 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.997 -9.445 -0.410 1.00 0.00 C ATOM 0 H LEU A 73 -13.297 -7.134 1.777 1.00 0.00 H new ATOM 0 HA LEU A 73 -12.015 -9.235 0.255 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.752 -7.010 -0.499 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.490 -7.397 -1.651 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.491 -8.557 -2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.724 -10.911 -2.252 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.415 -9.772 -2.646 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.508 -10.493 -1.022 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.575 -10.254 -0.857 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.503 -9.807 0.491 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.663 -8.622 -0.152 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.616 -6.225 0.320 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.326 -5.549 0.201 1.00 0.00 C ATOM 1105 C TRP A 74 -8.271 -6.292 1.049 1.00 0.00 C ATOM 1106 O TRP A 74 -7.168 -6.568 0.637 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.387 -4.081 0.748 1.00 0.00 C ATOM 1108 CG TRP A 74 -10.062 -2.914 -0.022 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -11.017 -2.902 -1.011 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.740 -1.549 0.204 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.336 -1.598 -1.358 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.575 -0.747 -0.591 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.833 -0.961 1.034 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.524 0.649 -0.560 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.754 0.452 1.088 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.622 1.235 0.297 1.00 0.00 C ATOM 0 H TRP A 74 -11.390 -5.605 0.559 1.00 0.00 H new ATOM 0 HA TRP A 74 -9.068 -5.541 -0.858 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.878 -4.134 1.720 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.356 -3.776 0.928 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.456 -3.783 -1.455 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -12.019 -1.318 -2.062 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -8.180 -1.567 1.645 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.170 1.246 -1.187 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -8.031 0.929 1.733 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.577 2.312 0.366 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.642 -6.598 2.224 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.711 -7.095 3.190 1.00 0.00 C ATOM 1129 C LYS A 75 -7.478 -8.564 3.221 1.00 0.00 C ATOM 1130 O LYS A 75 -6.334 -8.965 3.422 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.907 -6.454 4.520 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.905 -4.953 4.376 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.521 -4.423 4.076 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.731 -4.363 5.378 1.00 0.00 C ATOM 1135 NZ LYS A 75 -4.392 -3.797 5.242 1.00 0.00 N ATOM 0 H LYS A 75 -9.601 -6.517 2.561 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.739 -6.769 2.819 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.850 -6.784 4.956 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.115 -6.763 5.202 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.587 -4.663 3.577 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -8.278 -4.499 5.294 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -6.016 -5.068 3.357 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.585 -3.432 3.626 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -6.291 -3.772 6.102 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.647 -5.370 5.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -4.195 -3.173 6.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.691 -4.565 5.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.335 -3.249 4.360 1.00 0.00 H new ATOM 1149 N SER A 76 -8.510 -9.400 3.024 1.00 0.00 N ATOM 1150 CA SER A 76 -8.226 -10.817 3.027 1.00 0.00 C ATOM 1151 C SER A 76 -7.300 -11.134 1.872 1.00 0.00 C ATOM 1152 O SER A 76 -6.353 -11.929 2.019 1.00 0.00 O ATOM 1153 CB SER A 76 -9.477 -11.660 2.972 1.00 0.00 C ATOM 1154 OG SER A 76 -10.375 -11.330 4.051 1.00 0.00 O ATOM 0 H SER A 76 -9.482 -9.131 2.871 1.00 0.00 H new ATOM 0 HA SER A 76 -7.739 -11.067 3.970 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.980 -11.508 2.017 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.210 -12.715 3.027 1.00 0.00 H new ATOM 0 HG SER A 76 -11.103 -10.769 3.711 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.503 -10.436 0.749 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.627 -10.605 -0.369 1.00 0.00 C ATOM 1162 C GLU A 77 -5.279 -10.019 -0.113 1.00 0.00 C ATOM 1163 O GLU A 77 -4.306 -10.585 -0.572 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.180 -10.072 -1.681 1.00 0.00 C ATOM 1165 CG GLU A 77 -7.728 -11.120 -2.611 1.00 0.00 C ATOM 1166 CD GLU A 77 -9.061 -11.661 -2.212 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -9.149 -12.503 -1.311 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -10.058 -11.279 -2.846 1.00 0.00 O ATOM 0 H GLU A 77 -8.258 -9.765 0.610 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.536 -11.685 -0.482 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.970 -9.354 -1.460 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.389 -9.527 -2.197 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -7.806 -10.695 -3.612 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -7.017 -11.944 -2.669 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.199 -8.917 0.660 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.918 -8.276 0.904 1.00 0.00 C ATOM 1177 C PHE A 78 -2.968 -9.263 1.536 1.00 0.00 C ATOM 1178 O PHE A 78 -1.824 -9.373 1.138 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.089 -7.037 1.800 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.803 -6.354 2.186 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.966 -5.805 1.226 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.448 -6.250 3.515 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.795 -5.167 1.589 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.284 -5.618 3.891 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.451 -5.073 2.929 1.00 0.00 C ATOM 0 H PHE A 78 -5.996 -8.470 1.112 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.503 -7.945 -0.048 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.725 -6.318 1.284 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.614 -7.333 2.708 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.233 -5.877 0.182 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.093 -6.671 4.272 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.151 -4.744 0.833 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.021 -5.547 4.936 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.463 -4.577 3.221 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.471 -10.008 2.481 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.689 -10.997 3.168 1.00 0.00 C ATOM 1197 C PHE A 79 -2.290 -12.147 2.255 1.00 0.00 C ATOM 1198 O PHE A 79 -1.102 -12.469 2.131 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.449 -11.499 4.384 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.486 -10.498 5.499 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.374 -10.296 6.299 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.614 -9.745 5.731 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.394 -9.355 7.312 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.645 -8.808 6.736 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.532 -8.608 7.529 1.00 0.00 C ATOM 0 H PHE A 79 -4.439 -9.946 2.797 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.763 -10.527 3.497 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.469 -11.749 4.092 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.986 -12.418 4.742 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.481 -10.880 6.130 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.488 -9.892 5.114 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.521 -9.206 7.931 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.540 -8.228 6.906 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.553 -7.869 8.316 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.261 -12.708 1.577 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.035 -13.876 0.748 1.00 0.00 C ATOM 1217 C GLU A 80 -2.111 -13.579 -0.436 1.00 0.00 C ATOM 1218 O GLU A 80 -1.161 -14.322 -0.683 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.358 -14.451 0.243 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.367 -14.768 1.330 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.876 -15.787 2.338 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -4.239 -15.406 3.338 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -5.182 -16.983 2.180 1.00 0.00 O ATOM 0 H GLU A 80 -4.225 -12.374 1.581 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.540 -14.615 1.378 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.805 -13.741 -0.453 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.152 -15.362 -0.319 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.625 -13.847 1.853 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.282 -15.139 0.868 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.342 -12.475 -1.133 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.577 -12.209 -2.330 1.00 0.00 C ATOM 1232 C ASN A 81 -0.181 -11.727 -2.046 1.00 0.00 C ATOM 1233 O ASN A 81 0.732 -12.062 -2.799 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.295 -11.342 -3.385 1.00 0.00 C ATOM 1235 CG ASN A 81 -2.597 -9.899 -2.992 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -1.913 -9.280 -2.183 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -3.605 -9.346 -3.604 1.00 0.00 N ATOM 0 H ASN A 81 -3.037 -11.768 -0.893 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.484 -13.189 -2.798 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.684 -11.329 -4.288 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -3.235 -11.829 -3.643 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -3.844 -8.372 -3.416 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.155 -9.886 -4.272 1.00 0.00 H new ATOM 1244 N CYS A 82 0.021 -10.966 -0.968 1.00 0.00 N ATOM 1245 CA CYS A 82 1.360 -10.521 -0.667 1.00 0.00 C ATOM 1246 C CYS A 82 2.224 -11.707 -0.286 1.00 0.00 C ATOM 1247 O CYS A 82 3.303 -11.864 -0.787 1.00 0.00 O ATOM 1248 CB CYS A 82 1.417 -9.409 0.413 1.00 0.00 C ATOM 1249 SG CYS A 82 0.803 -9.854 2.060 1.00 0.00 S ATOM 0 H CYS A 82 -0.703 -10.660 -0.318 1.00 0.00 H new ATOM 0 HA CYS A 82 1.754 -10.062 -1.574 1.00 0.00 H new ATOM 0 HB2 CYS A 82 2.452 -9.081 0.511 1.00 0.00 H new ATOM 0 HB3 CYS A 82 0.844 -8.554 0.054 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.489 -9.717 2.093 1.00 0.00 H new ATOM 1255 N ARG A 83 1.687 -12.601 0.505 1.00 0.00 N ATOM 1256 CA ARG A 83 2.448 -13.749 0.972 1.00 0.00 C ATOM 1257 C ARG A 83 2.608 -14.783 -0.107 1.00 0.00 C ATOM 1258 O ARG A 83 3.570 -15.549 -0.102 1.00 0.00 O ATOM 1259 CB ARG A 83 1.822 -14.295 2.213 1.00 0.00 C ATOM 1260 CG ARG A 83 1.856 -13.251 3.268 1.00 0.00 C ATOM 1261 CD ARG A 83 1.201 -13.658 4.520 1.00 0.00 C ATOM 1262 NE ARG A 83 1.440 -12.654 5.533 1.00 0.00 N ATOM 1263 CZ ARG A 83 0.714 -12.505 6.633 1.00 0.00 C ATOM 1264 NH1 ARG A 83 -0.408 -13.192 6.788 1.00 0.00 N ATOM 1265 NH2 ARG A 83 1.097 -11.651 7.554 1.00 0.00 N ATOM 0 H ARG A 83 0.726 -12.563 0.843 1.00 0.00 H new ATOM 0 HA ARG A 83 3.459 -13.429 1.224 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.794 -14.597 2.015 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.357 -15.184 2.545 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.894 -12.992 3.478 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.373 -12.350 2.891 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.130 -13.782 4.360 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.588 -14.622 4.849 1.00 0.00 H new ATOM 0 HE ARG A 83 2.222 -12.015 5.392 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -0.715 -13.837 6.060 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -0.964 -13.076 7.635 1.00 0.00 H new ATOM 0 HH21 ARG A 83 1.949 -11.106 7.422 1.00 0.00 H new ATOM 0 HH22 ARG A 83 0.542 -11.532 8.402 1.00 0.00 H new ATOM 1279 N ASP A 84 1.682 -14.780 -1.041 1.00 0.00 N ATOM 1280 CA ASP A 84 1.767 -15.612 -2.223 1.00 0.00 C ATOM 1281 C ASP A 84 2.964 -15.156 -3.007 1.00 0.00 C ATOM 1282 O ASP A 84 3.909 -15.883 -3.216 1.00 0.00 O ATOM 1283 CB ASP A 84 0.547 -15.402 -3.096 1.00 0.00 C ATOM 1284 CG ASP A 84 0.403 -16.467 -4.148 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.216 -17.505 -3.862 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.902 -16.292 -5.276 1.00 0.00 O ATOM 0 H ASP A 84 0.845 -14.198 -1.002 1.00 0.00 H new ATOM 0 HA ASP A 84 1.836 -16.660 -1.932 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.346 -15.390 -2.471 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.612 -14.426 -3.578 1.00 0.00 H new ATOM 1291 N THR A 85 2.951 -13.896 -3.302 1.00 0.00 N ATOM 1292 CA THR A 85 3.966 -13.246 -4.082 1.00 0.00 C ATOM 1293 C THR A 85 5.337 -13.335 -3.343 1.00 0.00 C ATOM 1294 O THR A 85 6.408 -13.472 -3.952 1.00 0.00 O ATOM 1295 CB THR A 85 3.514 -11.783 -4.287 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.237 -11.765 -4.961 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.517 -10.945 -5.054 1.00 0.00 C ATOM 0 H THR A 85 2.209 -13.265 -2.998 1.00 0.00 H new ATOM 0 HA THR A 85 4.098 -13.725 -5.052 1.00 0.00 H new ATOM 0 HB THR A 85 3.431 -11.334 -3.297 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.517 -11.723 -4.297 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.136 -9.929 -5.162 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.462 -10.922 -4.512 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.675 -11.380 -6.041 1.00 0.00 H new ATOM 1305 N ALA A 86 5.265 -13.351 -2.044 1.00 0.00 N ATOM 1306 CA ALA A 86 6.431 -13.450 -1.214 1.00 0.00 C ATOM 1307 C ALA A 86 7.049 -14.827 -1.250 1.00 0.00 C ATOM 1308 O ALA A 86 8.247 -14.938 -1.466 1.00 0.00 O ATOM 1309 CB ALA A 86 6.126 -13.045 0.198 1.00 0.00 C ATOM 0 H ALA A 86 4.388 -13.295 -1.526 1.00 0.00 H new ATOM 0 HA ALA A 86 7.165 -12.756 -1.624 1.00 0.00 H new ATOM 0 HB1 ALA A 86 7.028 -13.130 0.804 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.775 -12.013 0.213 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.353 -13.697 0.605 1.00 0.00 H new ATOM 1315 N LYS A 87 6.244 -15.886 -1.079 1.00 0.00 N ATOM 1316 CA LYS A 87 6.785 -17.252 -1.119 1.00 0.00 C ATOM 1317 C LYS A 87 7.332 -17.566 -2.501 1.00 0.00 C ATOM 1318 O LYS A 87 8.246 -18.378 -2.658 1.00 0.00 O ATOM 1319 CB LYS A 87 5.770 -18.320 -0.658 1.00 0.00 C ATOM 1320 CG LYS A 87 4.499 -18.413 -1.473 1.00 0.00 C ATOM 1321 CD LYS A 87 3.609 -19.562 -1.027 1.00 0.00 C ATOM 1322 CE LYS A 87 3.162 -19.413 0.416 1.00 0.00 C ATOM 1323 NZ LYS A 87 2.364 -20.577 0.858 1.00 0.00 N ATOM 0 H LYS A 87 5.239 -15.827 -0.915 1.00 0.00 H new ATOM 0 HA LYS A 87 7.604 -17.290 -0.401 1.00 0.00 H new ATOM 0 HB2 LYS A 87 6.262 -19.293 -0.674 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.501 -18.116 0.378 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.948 -17.476 -1.390 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.753 -18.541 -2.525 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.733 -19.613 -1.674 1.00 0.00 H new ATOM 0 HD3 LYS A 87 4.147 -20.503 -1.144 1.00 0.00 H new ATOM 0 HE2 LYS A 87 4.035 -19.304 1.059 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.571 -18.503 0.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 2.074 -20.444 1.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.519 -20.666 0.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 2.937 -21.441 0.778 1.00 0.00 H new ATOM 1337 N ARG A 88 6.792 -16.889 -3.490 1.00 0.00 N ATOM 1338 CA ARG A 88 7.259 -17.012 -4.867 1.00 0.00 C ATOM 1339 C ARG A 88 8.625 -16.322 -4.996 1.00 0.00 C ATOM 1340 O ARG A 88 9.527 -16.835 -5.650 1.00 0.00 O ATOM 1341 CB ARG A 88 6.234 -16.431 -5.868 1.00 0.00 C ATOM 1342 CG ARG A 88 5.005 -17.319 -6.221 1.00 0.00 C ATOM 1343 CD ARG A 88 4.429 -18.060 -5.024 1.00 0.00 C ATOM 1344 NE ARG A 88 3.002 -18.421 -5.149 1.00 0.00 N ATOM 1345 CZ ARG A 88 2.477 -19.597 -4.787 1.00 0.00 C ATOM 1346 NH1 ARG A 88 3.241 -20.677 -4.658 1.00 0.00 N ATOM 1347 NH2 ARG A 88 1.178 -19.693 -4.583 1.00 0.00 N ATOM 0 H ARG A 88 6.017 -16.236 -3.370 1.00 0.00 H new ATOM 0 HA ARG A 88 7.368 -18.068 -5.113 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.865 -15.488 -5.465 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.760 -16.198 -6.794 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.228 -16.693 -6.659 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.297 -18.044 -6.981 1.00 0.00 H new ATOM 0 HD2 ARG A 88 5.007 -18.970 -4.865 1.00 0.00 H new ATOM 0 HD3 ARG A 88 4.557 -17.442 -4.135 1.00 0.00 H new ATOM 0 HE ARG A 88 2.370 -17.722 -5.540 1.00 0.00 H new ATOM 0 HH11 ARG A 88 4.244 -20.617 -4.836 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.825 -21.566 -4.381 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.581 -18.874 -4.701 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.770 -20.586 -4.307 1.00 0.00 H new ATOM 1361 N ASN A 89 8.800 -15.191 -4.291 1.00 0.00 N ATOM 1362 CA ASN A 89 10.066 -14.468 -4.307 1.00 0.00 C ATOM 1363 C ASN A 89 11.112 -15.210 -3.524 1.00 0.00 C ATOM 1364 O ASN A 89 12.286 -15.151 -3.855 1.00 0.00 O ATOM 1365 CB ASN A 89 9.949 -12.999 -3.789 1.00 0.00 C ATOM 1366 CG ASN A 89 9.315 -12.048 -4.809 1.00 0.00 C ATOM 1367 OD1 ASN A 89 9.428 -12.265 -6.011 1.00 0.00 O ATOM 1368 ND2 ASN A 89 8.708 -10.963 -4.356 1.00 0.00 N ATOM 0 H ASN A 89 8.079 -14.766 -3.708 1.00 0.00 H new ATOM 0 HA ASN A 89 10.365 -14.408 -5.353 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.355 -12.989 -2.875 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.942 -12.632 -3.528 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.321 -10.284 -5.011 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.627 -10.806 -3.351 1.00 0.00 H new ATOM 1375 N GLN A 90 10.688 -15.927 -2.470 1.00 0.00 N ATOM 1376 CA GLN A 90 11.626 -16.687 -1.649 1.00 0.00 C ATOM 1377 C GLN A 90 12.175 -17.881 -2.409 1.00 0.00 C ATOM 1378 O GLN A 90 13.380 -18.055 -2.492 1.00 0.00 O ATOM 1379 CB GLN A 90 10.989 -17.164 -0.328 1.00 0.00 C ATOM 1380 CG GLN A 90 10.204 -16.138 0.531 1.00 0.00 C ATOM 1381 CD GLN A 90 10.853 -14.771 0.741 1.00 0.00 C ATOM 1382 OE1 GLN A 90 10.736 -14.191 1.813 1.00 0.00 O ATOM 1383 NE2 GLN A 90 11.356 -14.183 -0.295 1.00 0.00 N ATOM 0 H GLN A 90 9.714 -15.992 -2.175 1.00 0.00 H new ATOM 0 HA GLN A 90 12.444 -16.009 -1.406 1.00 0.00 H new ATOM 0 HB2 GLN A 90 10.312 -17.985 -0.565 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.784 -17.576 0.293 1.00 0.00 H new ATOM 0 HG2 GLN A 90 9.230 -15.983 0.068 1.00 0.00 H new ATOM 0 HG3 GLN A 90 10.025 -16.582 1.510 1.00 0.00 H new ATOM 0 HE21 GLN A 90 11.442 -14.689 -1.177 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.666 -13.213 -0.231 1.00 0.00 H new ATOM 1392 N GLN A 91 11.289 -18.686 -2.984 1.00 0.00 N ATOM 1393 CA GLN A 91 11.706 -19.896 -3.728 1.00 0.00 C ATOM 1394 C GLN A 91 12.513 -19.557 -4.982 1.00 0.00 C ATOM 1395 O GLN A 91 13.327 -20.359 -5.434 1.00 0.00 O ATOM 1396 CB GLN A 91 10.505 -20.778 -4.074 1.00 0.00 C ATOM 1397 CG GLN A 91 9.464 -20.099 -4.938 1.00 0.00 C ATOM 1398 CD GLN A 91 8.223 -20.924 -5.101 1.00 0.00 C ATOM 1399 OE1 GLN A 91 8.086 -21.701 -6.042 1.00 0.00 O ATOM 1400 NE2 GLN A 91 7.329 -20.778 -4.177 1.00 0.00 N ATOM 0 H GLN A 91 10.281 -18.535 -2.957 1.00 0.00 H new ATOM 0 HA GLN A 91 12.363 -20.460 -3.066 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.861 -21.671 -4.588 1.00 0.00 H new ATOM 0 HB3 GLN A 91 10.033 -21.109 -3.149 1.00 0.00 H new ATOM 0 HG2 GLN A 91 9.201 -19.138 -4.496 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.890 -19.893 -5.920 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.487 -20.120 -3.414 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.466 -21.321 -4.212 1.00 0.00 H new ATOM 1409 N ALA A 92 12.284 -18.390 -5.542 1.00 0.00 N ATOM 1410 CA ALA A 92 13.039 -17.950 -6.695 1.00 0.00 C ATOM 1411 C ALA A 92 14.353 -17.337 -6.230 1.00 0.00 C ATOM 1412 O ALA A 92 15.379 -17.454 -6.886 1.00 0.00 O ATOM 1413 CB ALA A 92 12.228 -16.927 -7.487 1.00 0.00 C ATOM 0 H ALA A 92 11.580 -17.727 -5.217 1.00 0.00 H new ATOM 0 HA ALA A 92 13.250 -18.802 -7.342 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.802 -16.600 -8.354 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.295 -17.382 -7.820 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.007 -16.068 -6.853 1.00 0.00 H new ATOM 1419 N GLY A 93 14.310 -16.735 -5.056 1.00 0.00 N ATOM 1420 CA GLY A 93 15.460 -16.046 -4.514 1.00 0.00 C ATOM 1421 C GLY A 93 15.660 -14.751 -5.263 1.00 0.00 C ATOM 1422 O GLY A 93 16.755 -14.441 -5.749 1.00 0.00 O ATOM 0 H GLY A 93 13.484 -16.711 -4.458 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.313 -15.847 -3.452 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.348 -16.672 -4.601 1.00 0.00 H new ATOM 1426 N ASN A 94 14.560 -14.019 -5.393 1.00 0.00 N ATOM 1427 CA ASN A 94 14.506 -12.768 -6.150 1.00 0.00 C ATOM 1428 C ASN A 94 15.403 -11.735 -5.534 1.00 0.00 C ATOM 1429 O ASN A 94 16.081 -10.989 -6.216 1.00 0.00 O ATOM 1430 CB ASN A 94 13.080 -12.192 -6.127 1.00 0.00 C ATOM 1431 CG ASN A 94 12.761 -11.388 -7.379 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.642 -10.789 -7.994 1.00 0.00 O ATOM 1433 ND2 ASN A 94 11.506 -11.345 -7.748 1.00 0.00 N ATOM 0 H ASN A 94 13.668 -14.278 -4.972 1.00 0.00 H new ATOM 0 HA ASN A 94 14.822 -12.993 -7.169 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.363 -13.007 -6.029 1.00 0.00 H new ATOM 0 HB3 ASN A 94 12.962 -11.556 -5.250 1.00 0.00 H new ATOM 0 HD21 ASN A 94 11.234 -10.803 -8.568 1.00 0.00 H new ATOM 0 HD22 ASN A 94 10.800 -11.854 -7.216 1.00 0.00 H new ATOM 1440 N GLY A 95 15.432 -11.735 -4.242 1.00 0.00 N ATOM 1441 CA GLY A 95 16.092 -10.690 -3.514 1.00 0.00 C ATOM 1442 C GLY A 95 15.060 -9.894 -2.773 1.00 0.00 C ATOM 1443 O GLY A 95 15.368 -8.939 -2.048 1.00 0.00 O ATOM 0 H GLY A 95 15.003 -12.453 -3.659 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.815 -11.114 -2.817 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.647 -10.047 -4.197 1.00 0.00 H new ATOM 1447 N TRP A 96 13.805 -10.281 -2.975 1.00 0.00 N ATOM 1448 CA TRP A 96 12.697 -9.678 -2.285 1.00 0.00 C ATOM 1449 C TRP A 96 12.077 -10.653 -1.360 1.00 0.00 C ATOM 1450 O TRP A 96 12.123 -11.857 -1.616 1.00 0.00 O ATOM 1451 CB TRP A 96 11.697 -9.020 -3.226 1.00 0.00 C ATOM 1452 CG TRP A 96 12.332 -7.854 -3.860 1.00 0.00 C ATOM 1453 CD1 TRP A 96 12.904 -6.820 -3.202 1.00 0.00 C ATOM 1454 CD2 TRP A 96 12.494 -7.592 -5.247 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.436 -5.942 -4.078 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.193 -6.384 -5.358 1.00 0.00 C ATOM 1457 CE3 TRP A 96 12.126 -8.259 -6.407 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 13.529 -5.835 -6.587 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 12.458 -7.710 -7.619 1.00 0.00 C ATOM 1460 CH2 TRP A 96 13.153 -6.516 -7.699 1.00 0.00 C ATOM 0 H TRP A 96 13.539 -11.022 -3.624 1.00 0.00 H new ATOM 0 HA TRP A 96 13.085 -8.856 -1.683 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.371 -9.731 -3.986 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.808 -8.712 -2.675 1.00 0.00 H new ATOM 0 HD1 TRP A 96 12.931 -6.712 -2.128 1.00 0.00 H new ATOM 0 HE1 TRP A 96 13.937 -5.089 -3.831 1.00 0.00 H new ATOM 0 HE3 TRP A 96 11.588 -9.194 -6.356 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 14.069 -4.902 -6.656 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 12.172 -8.219 -8.528 1.00 0.00 H new ATOM 0 HH2 TRP A 96 13.402 -6.116 -8.671 1.00 0.00 H new ATOM 1471 N ASP A 97 11.495 -10.177 -0.298 1.00 0.00 N ATOM 1472 CA ASP A 97 11.062 -11.091 0.729 1.00 0.00 C ATOM 1473 C ASP A 97 9.771 -10.761 1.370 1.00 0.00 C ATOM 1474 O ASP A 97 9.271 -9.639 1.292 1.00 0.00 O ATOM 1475 CB ASP A 97 12.137 -11.338 1.801 1.00 0.00 C ATOM 1476 CG ASP A 97 12.510 -10.121 2.619 1.00 0.00 C ATOM 1477 OD1 ASP A 97 11.744 -9.717 3.525 1.00 0.00 O ATOM 1478 OD2 ASP A 97 13.604 -9.586 2.408 1.00 0.00 O ATOM 0 H ASP A 97 11.311 -9.190 -0.118 1.00 0.00 H new ATOM 0 HA ASP A 97 10.895 -12.015 0.175 1.00 0.00 H new ATOM 0 HB2 ASP A 97 11.784 -12.118 2.476 1.00 0.00 H new ATOM 0 HB3 ASP A 97 13.034 -11.720 1.314 1.00 0.00 H new ATOM 1483 N PHE A 98 9.260 -11.791 1.990 1.00 0.00 N ATOM 1484 CA PHE A 98 8.055 -11.831 2.765 1.00 0.00 C ATOM 1485 C PHE A 98 7.992 -10.772 3.878 1.00 0.00 C ATOM 1486 O PHE A 98 6.937 -10.357 4.228 1.00 0.00 O ATOM 1487 CB PHE A 98 7.906 -13.296 3.288 1.00 0.00 C ATOM 1488 CG PHE A 98 6.915 -13.554 4.400 1.00 0.00 C ATOM 1489 CD1 PHE A 98 7.269 -13.368 5.731 1.00 0.00 C ATOM 1490 CD2 PHE A 98 5.644 -14.011 4.116 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.374 -13.625 6.743 1.00 0.00 C ATOM 1492 CE2 PHE A 98 4.747 -14.267 5.138 1.00 0.00 C ATOM 1493 CZ PHE A 98 5.114 -14.073 6.444 1.00 0.00 C ATOM 0 H PHE A 98 9.719 -12.701 1.961 1.00 0.00 H new ATOM 0 HA PHE A 98 7.204 -11.564 2.139 1.00 0.00 H new ATOM 0 HB2 PHE A 98 7.631 -13.926 2.442 1.00 0.00 H new ATOM 0 HB3 PHE A 98 8.886 -13.630 3.629 1.00 0.00 H new ATOM 0 HD1 PHE A 98 8.261 -13.017 5.974 1.00 0.00 H new ATOM 0 HD2 PHE A 98 5.348 -14.170 3.090 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.664 -13.474 7.772 1.00 0.00 H new ATOM 0 HE2 PHE A 98 3.754 -14.621 4.905 1.00 0.00 H new ATOM 0 HZ PHE A 98 4.410 -14.273 7.238 1.00 0.00 H new ATOM 1503 N ASP A 99 9.101 -10.354 4.444 1.00 0.00 N ATOM 1504 CA ASP A 99 9.023 -9.307 5.484 1.00 0.00 C ATOM 1505 C ASP A 99 9.082 -7.915 4.935 1.00 0.00 C ATOM 1506 O ASP A 99 8.653 -6.956 5.589 1.00 0.00 O ATOM 1507 CB ASP A 99 9.977 -9.513 6.638 1.00 0.00 C ATOM 1508 CG ASP A 99 9.382 -10.440 7.656 1.00 0.00 C ATOM 1509 OD1 ASP A 99 8.629 -9.954 8.535 1.00 0.00 O ATOM 1510 OD2 ASP A 99 9.644 -11.658 7.611 1.00 0.00 O ATOM 0 H ASP A 99 10.038 -10.693 4.227 1.00 0.00 H new ATOM 0 HA ASP A 99 8.025 -9.424 5.907 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.918 -9.923 6.270 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.207 -8.554 7.102 1.00 0.00 H new ATOM 1515 N MET A 100 9.677 -7.768 3.781 1.00 0.00 N ATOM 1516 CA MET A 100 9.642 -6.474 3.110 1.00 0.00 C ATOM 1517 C MET A 100 8.256 -6.278 2.551 1.00 0.00 C ATOM 1518 O MET A 100 7.603 -5.259 2.777 1.00 0.00 O ATOM 1519 CB MET A 100 10.660 -6.355 1.948 1.00 0.00 C ATOM 1520 CG MET A 100 12.104 -6.600 2.311 1.00 0.00 C ATOM 1521 SD MET A 100 13.215 -6.333 0.908 1.00 0.00 S ATOM 1522 CE MET A 100 14.806 -6.619 1.683 1.00 0.00 C ATOM 0 H MET A 100 10.183 -8.503 3.287 1.00 0.00 H new ATOM 0 HA MET A 100 9.908 -5.715 3.846 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.376 -7.062 1.168 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.577 -5.356 1.519 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.389 -5.938 3.129 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.218 -7.622 2.673 1.00 0.00 H new ATOM 0 HE1 MET A 100 15.560 -5.991 1.208 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.744 -6.373 2.743 1.00 0.00 H new ATOM 0 HE3 MET A 100 15.083 -7.667 1.570 1.00 0.00 H new ATOM 1532 N LEU A 101 7.827 -7.286 1.856 1.00 0.00 N ATOM 1533 CA LEU A 101 6.587 -7.305 1.154 1.00 0.00 C ATOM 1534 C LEU A 101 5.574 -8.143 1.906 1.00 0.00 C ATOM 1535 O LEU A 101 5.691 -9.343 1.913 1.00 0.00 O ATOM 1536 CB LEU A 101 6.864 -7.826 -0.288 1.00 0.00 C ATOM 1537 CG LEU A 101 5.690 -8.154 -1.235 1.00 0.00 C ATOM 1538 CD1 LEU A 101 6.162 -8.011 -2.668 1.00 0.00 C ATOM 1539 CD2 LEU A 101 5.256 -9.596 -1.034 1.00 0.00 C ATOM 0 H LEU A 101 8.356 -8.153 1.760 1.00 0.00 H new ATOM 0 HA LEU A 101 6.154 -6.307 1.081 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.483 -7.081 -0.787 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.466 -8.730 -0.195 1.00 0.00 H new ATOM 0 HG LEU A 101 4.862 -7.477 -1.025 1.00 0.00 H new ATOM 0 HD11 LEU A 101 5.340 -8.241 -3.346 1.00 0.00 H new ATOM 0 HD12 LEU A 101 6.500 -6.989 -2.840 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.986 -8.701 -2.850 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.427 -9.823 -1.704 1.00 0.00 H new ATOM 0 HD22 LEU A 101 6.092 -10.261 -1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.937 -9.740 -0.002 1.00 0.00 H new ATOM 1551 N THR A 102 4.647 -7.461 2.579 1.00 0.00 N ATOM 1552 CA THR A 102 3.491 -8.039 3.317 1.00 0.00 C ATOM 1553 C THR A 102 2.845 -6.981 4.169 1.00 0.00 C ATOM 1554 O THR A 102 3.210 -5.804 4.123 1.00 0.00 O ATOM 1555 CB THR A 102 3.855 -9.163 4.333 1.00 0.00 C ATOM 1556 OG1 THR A 102 5.027 -8.853 5.071 1.00 0.00 O ATOM 1557 CG2 THR A 102 3.877 -10.562 3.760 1.00 0.00 C ATOM 0 H THR A 102 4.670 -6.443 2.636 1.00 0.00 H new ATOM 0 HA THR A 102 2.857 -8.443 2.528 1.00 0.00 H new ATOM 0 HB THR A 102 3.021 -9.183 5.035 1.00 0.00 H new ATOM 0 HG1 THR A 102 5.640 -9.617 5.047 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.140 -11.272 4.544 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.892 -10.808 3.363 1.00 0.00 H new ATOM 0 HG23 THR A 102 4.615 -10.616 2.959 1.00 0.00 H new ATOM 1565 N GLY A 103 1.880 -7.439 4.961 1.00 0.00 N ATOM 1566 CA GLY A 103 1.338 -6.678 6.050 1.00 0.00 C ATOM 1567 C GLY A 103 1.964 -7.212 7.324 1.00 0.00 C ATOM 1568 O GLY A 103 1.276 -7.457 8.321 1.00 0.00 O ATOM 0 H GLY A 103 1.457 -8.361 4.852 1.00 0.00 H new ATOM 0 HA2 GLY A 103 1.560 -5.618 5.927 1.00 0.00 H new ATOM 0 HA3 GLY A 103 0.253 -6.774 6.085 1.00 0.00 H new ATOM 1572 N SER A 104 3.261 -7.480 7.198 1.00 0.00 N ATOM 1573 CA SER A 104 4.147 -7.997 8.237 1.00 0.00 C ATOM 1574 C SER A 104 4.105 -9.527 8.311 1.00 0.00 C ATOM 1575 O SER A 104 3.416 -10.192 7.505 1.00 0.00 O ATOM 1576 CB SER A 104 3.919 -7.327 9.601 1.00 0.00 C ATOM 1577 OG SER A 104 3.943 -5.895 9.493 1.00 0.00 O ATOM 0 H SER A 104 3.751 -7.333 6.315 1.00 0.00 H new ATOM 0 HA SER A 104 5.162 -7.727 7.946 1.00 0.00 H new ATOM 0 HB2 SER A 104 2.960 -7.646 10.009 1.00 0.00 H new ATOM 0 HB3 SER A 104 4.688 -7.653 10.301 1.00 0.00 H new ATOM 0 HG SER A 104 4.811 -5.558 9.799 1.00 0.00 H new ATOM 1583 N GLY A 105 4.850 -10.086 9.251 1.00 0.00 N ATOM 1584 CA GLY A 105 4.949 -11.507 9.373 1.00 0.00 C ATOM 1585 C GLY A 105 5.901 -11.881 10.465 1.00 0.00 C ATOM 1586 O GLY A 105 5.492 -12.455 11.478 1.00 0.00 O ATOM 0 H GLY A 105 5.393 -9.562 9.938 1.00 0.00 H new ATOM 0 HA2 GLY A 105 3.966 -11.928 9.582 1.00 0.00 H new ATOM 0 HA3 GLY A 105 5.285 -11.935 8.429 1.00 0.00 H new ATOM 1590 N ASN A 106 7.162 -11.533 10.298 1.00 0.00 N ATOM 1591 CA ASN A 106 8.152 -11.823 11.314 1.00 0.00 C ATOM 1592 C ASN A 106 8.625 -10.539 11.944 1.00 0.00 C ATOM 1593 O ASN A 106 8.742 -10.436 13.164 1.00 0.00 O ATOM 1594 CB ASN A 106 9.357 -12.593 10.752 1.00 0.00 C ATOM 1595 CG ASN A 106 8.987 -13.933 10.144 1.00 0.00 C ATOM 1596 OD1 ASN A 106 8.856 -14.941 10.839 1.00 0.00 O ATOM 1597 ND2 ASN A 106 8.893 -13.980 8.854 1.00 0.00 N ATOM 0 H ASN A 106 7.523 -11.052 9.474 1.00 0.00 H new ATOM 0 HA ASN A 106 7.675 -12.458 12.061 1.00 0.00 H new ATOM 0 HB2 ASN A 106 9.848 -11.982 9.994 1.00 0.00 H new ATOM 0 HB3 ASN A 106 10.081 -12.753 11.551 1.00 0.00 H new ATOM 0 HD21 ASN A 106 8.706 -14.868 8.388 1.00 0.00 H new ATOM 0 HD22 ASN A 106 9.006 -13.129 8.303 1.00 0.00 H new ATOM 1604 N TYR A 107 8.900 -9.557 11.115 1.00 0.00 N ATOM 1605 CA TYR A 107 9.336 -8.274 11.613 1.00 0.00 C ATOM 1606 C TYR A 107 8.884 -7.087 10.763 1.00 0.00 C ATOM 1607 O TYR A 107 8.733 -5.991 11.296 1.00 0.00 O ATOM 1608 CB TYR A 107 10.861 -8.233 11.877 1.00 0.00 C ATOM 1609 CG TYR A 107 11.741 -8.593 10.699 1.00 0.00 C ATOM 1610 CD1 TYR A 107 12.106 -7.645 9.751 1.00 0.00 C ATOM 1611 CD2 TYR A 107 12.220 -9.883 10.546 1.00 0.00 C ATOM 1612 CE1 TYR A 107 12.909 -7.977 8.690 1.00 0.00 C ATOM 1613 CE2 TYR A 107 13.031 -10.221 9.490 1.00 0.00 C ATOM 1614 CZ TYR A 107 13.371 -9.262 8.561 1.00 0.00 C ATOM 1615 OH TYR A 107 14.200 -9.582 7.509 1.00 0.00 O ATOM 0 H TYR A 107 8.830 -9.622 10.099 1.00 0.00 H new ATOM 0 HA TYR A 107 8.828 -8.162 12.571 1.00 0.00 H new ATOM 0 HB2 TYR A 107 11.126 -7.230 12.212 1.00 0.00 H new ATOM 0 HB3 TYR A 107 11.088 -8.914 12.698 1.00 0.00 H new ATOM 0 HD1 TYR A 107 11.751 -6.630 9.851 1.00 0.00 H new ATOM 0 HD2 TYR A 107 11.951 -10.638 11.270 1.00 0.00 H new ATOM 0 HE1 TYR A 107 13.177 -7.229 7.958 1.00 0.00 H new ATOM 0 HE2 TYR A 107 13.399 -11.231 9.389 1.00 0.00 H new ATOM 0 HH TYR A 107 14.441 -10.531 7.559 1.00 0.00 H new ATOM 1625 N SER A 108 8.635 -7.305 9.460 1.00 0.00 N ATOM 1626 CA SER A 108 8.327 -6.230 8.492 1.00 0.00 C ATOM 1627 C SER A 108 9.453 -5.205 8.356 1.00 0.00 C ATOM 1628 O SER A 108 10.348 -5.106 9.208 1.00 0.00 O ATOM 1629 CB SER A 108 6.926 -5.564 8.667 1.00 0.00 C ATOM 1630 OG SER A 108 6.642 -5.154 10.004 1.00 0.00 O ATOM 0 H SER A 108 8.641 -8.236 9.043 1.00 0.00 H new ATOM 0 HA SER A 108 8.260 -6.752 7.537 1.00 0.00 H new ATOM 0 HB2 SER A 108 6.863 -4.696 8.010 1.00 0.00 H new ATOM 0 HB3 SER A 108 6.158 -6.266 8.342 1.00 0.00 H new ATOM 0 HG SER A 108 7.480 -5.064 10.504 1.00 0.00 H new ATOM 1636 N SER A 109 9.415 -4.450 7.306 1.00 0.00 N ATOM 1637 CA SER A 109 10.465 -3.535 7.069 1.00 0.00 C ATOM 1638 C SER A 109 10.026 -2.252 6.356 1.00 0.00 C ATOM 1639 O SER A 109 9.883 -2.212 5.127 1.00 0.00 O ATOM 1640 CB SER A 109 11.631 -4.245 6.372 1.00 0.00 C ATOM 1641 OG SER A 109 11.152 -5.149 5.391 1.00 0.00 O ATOM 0 H SER A 109 8.671 -4.454 6.608 1.00 0.00 H new ATOM 0 HA SER A 109 10.812 -3.182 8.040 1.00 0.00 H new ATOM 0 HB2 SER A 109 12.286 -3.508 5.906 1.00 0.00 H new ATOM 0 HB3 SER A 109 12.229 -4.782 7.108 1.00 0.00 H new ATOM 0 HG SER A 109 11.780 -5.896 5.300 1.00 0.00 H new ATOM 1647 N THR A 110 9.795 -1.217 7.149 1.00 0.00 N ATOM 1648 CA THR A 110 9.526 0.124 6.658 1.00 0.00 C ATOM 1649 C THR A 110 10.830 0.615 6.024 1.00 0.00 C ATOM 1650 O THR A 110 10.854 1.382 5.047 1.00 0.00 O ATOM 1651 CB THR A 110 9.141 1.035 7.864 1.00 0.00 C ATOM 1652 OG1 THR A 110 8.076 0.401 8.592 1.00 0.00 O ATOM 1653 CG2 THR A 110 8.688 2.428 7.405 1.00 0.00 C ATOM 0 H THR A 110 9.789 -1.287 8.167 1.00 0.00 H new ATOM 0 HA THR A 110 8.709 0.143 5.937 1.00 0.00 H new ATOM 0 HB THR A 110 10.020 1.166 8.494 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.823 0.961 9.355 1.00 0.00 H new ATOM 0 HG21 THR A 110 8.429 3.031 8.275 1.00 0.00 H new ATOM 0 HG22 THR A 110 9.496 2.911 6.856 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.817 2.332 6.757 1.00 0.00 H new ATOM 1661 N ASP A 111 11.904 0.089 6.583 1.00 0.00 N ATOM 1662 CA ASP A 111 13.266 0.333 6.161 1.00 0.00 C ATOM 1663 C ASP A 111 13.433 -0.012 4.679 1.00 0.00 C ATOM 1664 O ASP A 111 13.602 0.885 3.819 1.00 0.00 O ATOM 1665 CB ASP A 111 14.190 -0.568 7.019 1.00 0.00 C ATOM 1666 CG ASP A 111 15.678 -0.450 6.707 1.00 0.00 C ATOM 1667 OD1 ASP A 111 16.349 0.418 7.315 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.196 -1.239 5.882 1.00 0.00 O ATOM 0 H ASP A 111 11.846 -0.547 7.378 1.00 0.00 H new ATOM 0 HA ASP A 111 13.521 1.385 6.293 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.034 -0.325 8.070 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.887 -1.606 6.883 1.00 0.00 H new ATOM 1673 N ALA A 112 13.262 -1.303 4.380 1.00 0.00 N ATOM 1674 CA ALA A 112 13.472 -1.891 3.057 1.00 0.00 C ATOM 1675 C ALA A 112 12.747 -1.156 1.955 1.00 0.00 C ATOM 1676 O ALA A 112 13.324 -0.898 0.891 1.00 0.00 O ATOM 1677 CB ALA A 112 13.058 -3.328 3.064 1.00 0.00 C ATOM 0 H ALA A 112 12.964 -1.988 5.075 1.00 0.00 H new ATOM 0 HA ALA A 112 14.538 -1.806 2.845 1.00 0.00 H new ATOM 0 HB1 ALA A 112 13.218 -3.758 2.075 1.00 0.00 H new ATOM 0 HB2 ALA A 112 13.652 -3.874 3.797 1.00 0.00 H new ATOM 0 HB3 ALA A 112 12.002 -3.401 3.325 1.00 0.00 H new ATOM 1683 N GLN A 113 11.509 -0.788 2.203 1.00 0.00 N ATOM 1684 CA GLN A 113 10.766 -0.103 1.194 1.00 0.00 C ATOM 1685 C GLN A 113 11.224 1.312 0.987 1.00 0.00 C ATOM 1686 O GLN A 113 11.136 1.809 -0.120 1.00 0.00 O ATOM 1687 CB GLN A 113 9.249 -0.217 1.334 1.00 0.00 C ATOM 1688 CG GLN A 113 8.609 -1.189 0.344 1.00 0.00 C ATOM 1689 CD GLN A 113 8.620 -0.707 -1.125 1.00 0.00 C ATOM 1690 OE1 GLN A 113 7.751 -1.053 -1.893 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.594 0.088 -1.518 1.00 0.00 N ATOM 0 H GLN A 113 11.012 -0.952 3.079 1.00 0.00 H new ATOM 0 HA GLN A 113 10.999 -0.642 0.276 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.010 -0.537 2.348 1.00 0.00 H new ATOM 0 HB3 GLN A 113 8.806 0.770 1.198 1.00 0.00 H new ATOM 0 HG2 GLN A 113 9.130 -2.144 0.404 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.577 -1.369 0.646 1.00 0.00 H new ATOM 0 HE21 GLN A 113 10.319 0.371 -0.859 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.623 0.421 -2.482 1.00 0.00 H new ATOM 1700 N MET A 114 11.732 1.955 2.018 1.00 0.00 N ATOM 1701 CA MET A 114 12.271 3.295 1.863 1.00 0.00 C ATOM 1702 C MET A 114 13.428 3.333 0.880 1.00 0.00 C ATOM 1703 O MET A 114 13.522 4.258 0.097 1.00 0.00 O ATOM 1704 CB MET A 114 12.668 3.909 3.212 1.00 0.00 C ATOM 1705 CG MET A 114 13.551 5.139 3.075 1.00 0.00 C ATOM 1706 SD MET A 114 13.927 5.938 4.654 1.00 0.00 S ATOM 1707 CE MET A 114 12.298 6.523 5.131 1.00 0.00 C ATOM 0 H MET A 114 11.784 1.578 2.964 1.00 0.00 H new ATOM 0 HA MET A 114 11.471 3.907 1.446 1.00 0.00 H new ATOM 0 HB2 MET A 114 11.765 4.177 3.761 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.191 3.159 3.805 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.485 4.854 2.590 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.059 5.859 2.421 1.00 0.00 H new ATOM 0 HE1 MET A 114 12.397 7.281 5.908 1.00 0.00 H new ATOM 0 HE2 MET A 114 11.798 6.955 4.264 1.00 0.00 H new ATOM 0 HE3 MET A 114 11.709 5.689 5.512 1.00 0.00 H new ATOM 1717 N GLN A 115 14.309 2.321 0.904 1.00 0.00 N ATOM 1718 CA GLN A 115 15.424 2.334 -0.110 1.00 0.00 C ATOM 1719 C GLN A 115 14.889 2.274 -1.521 1.00 0.00 C ATOM 1720 O GLN A 115 15.517 2.790 -2.455 1.00 0.00 O ATOM 1721 CB GLN A 115 16.539 1.272 0.084 1.00 0.00 C ATOM 1722 CG GLN A 115 17.381 1.489 1.324 1.00 0.00 C ATOM 1723 CD GLN A 115 16.611 1.246 2.560 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.817 1.895 3.577 1.00 0.00 O ATOM 1725 NE2 GLN A 115 15.755 0.280 2.506 1.00 0.00 N ATOM 0 H GLN A 115 14.297 1.533 1.551 1.00 0.00 H new ATOM 0 HA GLN A 115 15.915 3.291 0.068 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.082 0.284 0.135 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.189 1.277 -0.791 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.245 0.825 1.298 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.764 2.510 1.329 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.618 -0.232 1.635 1.00 0.00 H new ATOM 0 HE22 GLN A 115 15.216 0.029 3.335 1.00 0.00 H new ATOM 1734 N TYR A 116 13.746 1.601 -1.682 1.00 0.00 N ATOM 1735 CA TYR A 116 13.009 1.572 -2.911 1.00 0.00 C ATOM 1736 C TYR A 116 13.670 0.761 -4.010 1.00 0.00 C ATOM 1737 O TYR A 116 14.534 1.237 -4.745 1.00 0.00 O ATOM 1738 CB TYR A 116 12.554 2.987 -3.386 1.00 0.00 C ATOM 1739 CG TYR A 116 12.032 3.029 -4.803 1.00 0.00 C ATOM 1740 CD1 TYR A 116 10.815 2.458 -5.150 1.00 0.00 C ATOM 1741 CD2 TYR A 116 12.787 3.612 -5.803 1.00 0.00 C ATOM 1742 CE1 TYR A 116 10.377 2.476 -6.451 1.00 0.00 C ATOM 1743 CE2 TYR A 116 12.358 3.627 -7.102 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.156 3.062 -7.424 1.00 0.00 C ATOM 1745 OH TYR A 116 10.727 3.077 -8.726 1.00 0.00 O ATOM 0 H TYR A 116 13.314 1.056 -0.936 1.00 0.00 H new ATOM 0 HA TYR A 116 12.095 1.027 -2.673 1.00 0.00 H new ATOM 0 HB2 TYR A 116 11.777 3.350 -2.714 1.00 0.00 H new ATOM 0 HB3 TYR A 116 13.396 3.674 -3.301 1.00 0.00 H new ATOM 0 HD1 TYR A 116 10.206 1.994 -4.388 1.00 0.00 H new ATOM 0 HD2 TYR A 116 13.735 4.065 -5.554 1.00 0.00 H new ATOM 0 HE1 TYR A 116 9.427 2.033 -6.710 1.00 0.00 H new ATOM 0 HE2 TYR A 116 12.966 4.083 -7.869 1.00 0.00 H new ATOM 0 HH TYR A 116 11.393 3.529 -9.285 1.00 0.00 H new ATOM 1755 N ASP A 117 13.298 -0.484 -4.086 1.00 0.00 N ATOM 1756 CA ASP A 117 13.645 -1.277 -5.229 1.00 0.00 C ATOM 1757 C ASP A 117 12.454 -1.223 -6.146 1.00 0.00 C ATOM 1758 O ASP A 117 11.323 -1.452 -5.678 1.00 0.00 O ATOM 1759 CB ASP A 117 13.893 -2.747 -4.914 1.00 0.00 C ATOM 1760 CG ASP A 117 15.117 -3.080 -4.085 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.233 -2.627 -4.417 1.00 0.00 O ATOM 1762 OD2 ASP A 117 14.974 -3.872 -3.119 1.00 0.00 O ATOM 0 H ASP A 117 12.756 -0.971 -3.372 1.00 0.00 H new ATOM 0 HA ASP A 117 14.569 -0.878 -5.647 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.017 -3.134 -4.393 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.967 -3.287 -5.858 1.00 0.00 H new ATOM 1767 N PRO A 118 12.647 -0.938 -7.434 1.00 0.00 N ATOM 1768 CA PRO A 118 11.551 -0.845 -8.422 1.00 0.00 C ATOM 1769 C PRO A 118 10.683 -2.112 -8.502 1.00 0.00 C ATOM 1770 O PRO A 118 9.514 -2.027 -8.843 1.00 0.00 O ATOM 1771 CB PRO A 118 12.284 -0.627 -9.747 1.00 0.00 C ATOM 1772 CG PRO A 118 13.564 -0.004 -9.359 1.00 0.00 C ATOM 1773 CD PRO A 118 13.950 -0.643 -8.064 1.00 0.00 C ATOM 0 HA PRO A 118 10.852 -0.052 -8.156 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.443 -1.568 -10.273 1.00 0.00 H new ATOM 0 HB3 PRO A 118 11.714 0.019 -10.415 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.327 -0.170 -10.120 1.00 0.00 H new ATOM 0 HG3 PRO A 118 13.456 1.075 -9.246 1.00 0.00 H new ATOM 0 HD2 PRO A 118 14.536 -1.549 -8.220 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.553 0.025 -7.449 1.00 0.00 H new ATOM 1781 N GLY A 119 11.221 -3.251 -8.057 1.00 0.00 N ATOM 1782 CA GLY A 119 10.505 -4.509 -8.195 1.00 0.00 C ATOM 1783 C GLY A 119 9.791 -4.873 -6.898 1.00 0.00 C ATOM 1784 O GLY A 119 8.791 -5.584 -6.905 1.00 0.00 O ATOM 0 H GLY A 119 12.134 -3.322 -7.607 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.780 -4.432 -9.005 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.203 -5.302 -8.466 1.00 0.00 H new ATOM 1788 N LEU A 120 10.312 -4.364 -5.802 1.00 0.00 N ATOM 1789 CA LEU A 120 9.705 -4.574 -4.503 1.00 0.00 C ATOM 1790 C LEU A 120 8.437 -3.761 -4.490 1.00 0.00 C ATOM 1791 O LEU A 120 7.346 -4.272 -4.237 1.00 0.00 O ATOM 1792 CB LEU A 120 10.663 -4.086 -3.402 1.00 0.00 C ATOM 1793 CG LEU A 120 10.165 -4.189 -1.958 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.837 -5.626 -1.597 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.194 -3.609 -0.996 1.00 0.00 C ATOM 0 H LEU A 120 11.160 -3.798 -5.784 1.00 0.00 H new ATOM 0 HA LEU A 120 9.495 -5.628 -4.322 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.590 -4.653 -3.483 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.909 -3.043 -3.603 1.00 0.00 H new ATOM 0 HG LEU A 120 9.248 -3.606 -1.872 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.486 -5.671 -0.566 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.059 -6.000 -2.262 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.731 -6.241 -1.703 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.823 -3.691 0.026 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.130 -4.161 -1.088 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.366 -2.560 -1.237 1.00 0.00 H new ATOM 1807 N PHE A 121 8.610 -2.503 -4.881 1.00 0.00 N ATOM 1808 CA PHE A 121 7.544 -1.535 -4.965 1.00 0.00 C ATOM 1809 C PHE A 121 6.473 -1.993 -5.963 1.00 0.00 C ATOM 1810 O PHE A 121 5.289 -1.963 -5.656 1.00 0.00 O ATOM 1811 CB PHE A 121 8.142 -0.168 -5.362 1.00 0.00 C ATOM 1812 CG PHE A 121 7.148 0.956 -5.483 1.00 0.00 C ATOM 1813 CD1 PHE A 121 6.537 1.485 -4.354 1.00 0.00 C ATOM 1814 CD2 PHE A 121 6.843 1.494 -6.721 1.00 0.00 C ATOM 1815 CE1 PHE A 121 5.638 2.528 -4.465 1.00 0.00 C ATOM 1816 CE2 PHE A 121 5.949 2.532 -6.837 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.345 3.053 -5.715 1.00 0.00 C ATOM 0 H PHE A 121 9.519 -2.128 -5.153 1.00 0.00 H new ATOM 0 HA PHE A 121 7.055 -1.439 -3.995 1.00 0.00 H new ATOM 0 HB2 PHE A 121 8.893 0.111 -4.623 1.00 0.00 H new ATOM 0 HB3 PHE A 121 8.659 -0.279 -6.315 1.00 0.00 H new ATOM 0 HD1 PHE A 121 6.767 1.078 -3.381 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.313 1.093 -7.607 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.165 2.933 -3.582 1.00 0.00 H new ATOM 0 HE2 PHE A 121 5.720 2.940 -7.811 1.00 0.00 H new ATOM 0 HZ PHE A 121 4.644 3.869 -5.808 1.00 0.00 H new ATOM 1827 N ALA A 122 6.914 -2.465 -7.138 1.00 0.00 N ATOM 1828 CA ALA A 122 6.009 -2.940 -8.200 1.00 0.00 C ATOM 1829 C ALA A 122 5.091 -4.037 -7.700 1.00 0.00 C ATOM 1830 O ALA A 122 3.874 -4.003 -7.928 1.00 0.00 O ATOM 1831 CB ALA A 122 6.811 -3.462 -9.385 1.00 0.00 C ATOM 0 H ALA A 122 7.903 -2.529 -7.380 1.00 0.00 H new ATOM 0 HA ALA A 122 5.399 -2.091 -8.511 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.129 -3.809 -10.161 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.436 -2.662 -9.782 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.443 -4.289 -9.061 1.00 0.00 H new ATOM 1837 N GLN A 123 5.663 -4.985 -6.984 1.00 0.00 N ATOM 1838 CA GLN A 123 4.913 -6.109 -6.497 1.00 0.00 C ATOM 1839 C GLN A 123 3.995 -5.714 -5.369 1.00 0.00 C ATOM 1840 O GLN A 123 2.845 -6.119 -5.351 1.00 0.00 O ATOM 1841 CB GLN A 123 5.832 -7.256 -6.103 1.00 0.00 C ATOM 1842 CG GLN A 123 6.527 -7.895 -7.293 1.00 0.00 C ATOM 1843 CD GLN A 123 7.606 -8.877 -6.901 1.00 0.00 C ATOM 1844 OE1 GLN A 123 7.358 -10.061 -6.723 1.00 0.00 O ATOM 1845 NE2 GLN A 123 8.812 -8.387 -6.766 1.00 0.00 N ATOM 0 H GLN A 123 6.651 -4.992 -6.729 1.00 0.00 H new ATOM 0 HA GLN A 123 4.282 -6.464 -7.312 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.584 -6.889 -5.404 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.252 -8.015 -5.577 1.00 0.00 H new ATOM 0 HG2 GLN A 123 5.785 -8.407 -7.906 1.00 0.00 H new ATOM 0 HG3 GLN A 123 6.966 -7.112 -7.912 1.00 0.00 H new ATOM 0 HE21 GLN A 123 8.979 -7.393 -6.923 1.00 0.00 H new ATOM 0 HE22 GLN A 123 9.585 -8.999 -6.504 1.00 0.00 H new ATOM 1854 N ILE A 124 4.487 -4.901 -4.444 1.00 0.00 N ATOM 1855 CA ILE A 124 3.657 -4.464 -3.337 1.00 0.00 C ATOM 1856 C ILE A 124 2.468 -3.647 -3.843 1.00 0.00 C ATOM 1857 O ILE A 124 1.323 -3.934 -3.493 1.00 0.00 O ATOM 1858 CB ILE A 124 4.456 -3.661 -2.265 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.538 -4.560 -1.652 1.00 0.00 C ATOM 1860 CG2 ILE A 124 3.509 -3.129 -1.178 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.440 -3.879 -0.652 1.00 0.00 C ATOM 0 H ILE A 124 5.440 -4.538 -4.439 1.00 0.00 H new ATOM 0 HA ILE A 124 3.288 -5.365 -2.847 1.00 0.00 H new ATOM 0 HB ILE A 124 4.936 -2.806 -2.741 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.053 -5.406 -1.165 1.00 0.00 H new ATOM 0 HG13 ILE A 124 6.152 -4.964 -2.457 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.082 -2.571 -0.438 1.00 0.00 H new ATOM 0 HG22 ILE A 124 2.766 -2.473 -1.632 1.00 0.00 H new ATOM 0 HG23 ILE A 124 3.006 -3.965 -0.693 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.171 -4.594 -0.275 1.00 0.00 H new ATOM 0 HD12 ILE A 124 6.959 -3.051 -1.135 1.00 0.00 H new ATOM 0 HD13 ILE A 124 5.843 -3.499 0.177 1.00 0.00 H new ATOM 1873 N GLN A 125 2.750 -2.691 -4.720 1.00 0.00 N ATOM 1874 CA GLN A 125 1.748 -1.771 -5.241 1.00 0.00 C ATOM 1875 C GLN A 125 0.597 -2.512 -5.913 1.00 0.00 C ATOM 1876 O GLN A 125 -0.557 -2.408 -5.481 1.00 0.00 O ATOM 1877 CB GLN A 125 2.370 -0.822 -6.262 1.00 0.00 C ATOM 1878 CG GLN A 125 1.444 0.301 -6.671 1.00 0.00 C ATOM 1879 CD GLN A 125 1.994 1.163 -7.781 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.196 1.295 -7.935 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.124 1.782 -8.536 1.00 0.00 N ATOM 0 H GLN A 125 3.686 -2.532 -5.092 1.00 0.00 H new ATOM 0 HA GLN A 125 1.362 -1.210 -4.390 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.283 -0.398 -5.845 1.00 0.00 H new ATOM 0 HB3 GLN A 125 2.657 -1.389 -7.148 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.491 -0.122 -6.989 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.240 0.927 -5.803 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.125 1.648 -8.378 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.444 2.399 -9.283 1.00 0.00 H new ATOM 1890 N ALA A 126 0.931 -3.286 -6.939 1.00 0.00 N ATOM 1891 CA ALA A 126 -0.061 -3.971 -7.757 1.00 0.00 C ATOM 1892 C ALA A 126 -0.868 -4.983 -6.956 1.00 0.00 C ATOM 1893 O ALA A 126 -2.098 -5.029 -7.064 1.00 0.00 O ATOM 1894 CB ALA A 126 0.610 -4.652 -8.941 1.00 0.00 C ATOM 0 H ALA A 126 1.895 -3.456 -7.226 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.757 -3.216 -8.121 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -0.143 -5.160 -9.543 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.119 -3.905 -9.550 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.336 -5.380 -8.579 1.00 0.00 H new ATOM 1900 N ALA A 127 -0.193 -5.707 -6.085 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.820 -6.803 -5.361 1.00 0.00 C ATOM 1902 C ALA A 127 -1.734 -6.258 -4.309 1.00 0.00 C ATOM 1903 O ALA A 127 -2.868 -6.727 -4.128 1.00 0.00 O ATOM 1904 CB ALA A 127 0.217 -7.723 -4.728 1.00 0.00 C ATOM 0 H ALA A 127 0.791 -5.558 -5.859 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.395 -7.393 -6.075 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -0.288 -8.529 -4.196 1.00 0.00 H new ATOM 0 HB2 ALA A 127 0.853 -8.144 -5.506 1.00 0.00 H new ATOM 0 HB3 ALA A 127 0.829 -7.154 -4.028 1.00 0.00 H new ATOM 1910 N ALA A 128 -1.286 -5.228 -3.645 1.00 0.00 N ATOM 1911 CA ALA A 128 -2.057 -4.652 -2.641 1.00 0.00 C ATOM 1912 C ALA A 128 -3.277 -3.974 -3.231 1.00 0.00 C ATOM 1913 O ALA A 128 -4.307 -4.170 -2.739 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.238 -3.779 -1.741 1.00 0.00 C ATOM 0 H ALA A 128 -0.380 -4.786 -3.802 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.435 -5.439 -1.989 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.878 -3.349 -0.971 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.455 -4.374 -1.271 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.784 -2.978 -2.325 1.00 0.00 H new ATOM 1920 N THR A 129 -3.171 -3.252 -4.351 1.00 0.00 N ATOM 1921 CA THR A 129 -4.397 -2.677 -4.981 1.00 0.00 C ATOM 1922 C THR A 129 -5.401 -3.805 -5.388 1.00 0.00 C ATOM 1923 O THR A 129 -6.658 -3.693 -5.218 1.00 0.00 O ATOM 1924 CB THR A 129 -4.041 -1.815 -6.229 1.00 0.00 C ATOM 1925 OG1 THR A 129 -3.149 -2.532 -7.116 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.386 -0.505 -5.825 1.00 0.00 C ATOM 0 H THR A 129 -2.296 -3.049 -4.835 1.00 0.00 H new ATOM 0 HA THR A 129 -4.870 -2.035 -4.238 1.00 0.00 H new ATOM 0 HB THR A 129 -4.976 -1.602 -6.748 1.00 0.00 H new ATOM 0 HG1 THR A 129 -3.039 -3.452 -6.796 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.150 0.074 -6.718 1.00 0.00 H new ATOM 0 HG22 THR A 129 -4.069 0.064 -5.194 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.469 -0.712 -5.273 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.800 -4.948 -5.725 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.526 -6.086 -6.291 1.00 0.00 C ATOM 1936 C LYS A 130 -6.346 -6.707 -5.199 1.00 0.00 C ATOM 1937 O LYS A 130 -7.284 -7.423 -5.443 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.549 -7.112 -6.877 1.00 0.00 C ATOM 1939 CG LYS A 130 -5.009 -7.742 -8.183 1.00 0.00 C ATOM 1940 CD LYS A 130 -4.981 -6.701 -9.298 1.00 0.00 C ATOM 1941 CE LYS A 130 -5.424 -7.261 -10.646 1.00 0.00 C ATOM 1942 NZ LYS A 130 -6.855 -7.619 -10.683 1.00 0.00 N ATOM 0 H LYS A 130 -3.799 -5.110 -5.614 1.00 0.00 H new ATOM 0 HA LYS A 130 -6.174 -5.748 -7.100 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.587 -6.627 -7.041 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -4.387 -7.902 -6.144 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -4.362 -8.581 -8.440 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -6.017 -8.140 -8.070 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -5.629 -5.868 -9.026 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.971 -6.302 -9.390 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -5.220 -6.525 -11.423 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -4.829 -8.144 -10.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -7.095 -7.993 -11.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -7.051 -8.343 -9.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -7.429 -6.774 -10.490 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.912 -6.453 -4.001 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.588 -6.744 -2.799 1.00 0.00 C ATOM 1958 C ALA A 131 -7.550 -5.615 -2.510 1.00 0.00 C ATOM 1959 O ALA A 131 -8.768 -5.815 -2.577 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.527 -6.851 -1.745 1.00 0.00 C ATOM 0 H ALA A 131 -5.010 -6.005 -3.841 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.165 -7.668 -2.842 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.990 -7.077 -0.784 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.831 -7.648 -2.009 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.987 -5.907 -1.675 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.992 -4.402 -2.368 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.662 -3.164 -1.904 1.00 0.00 C ATOM 1968 C TRP A 132 -8.650 -2.579 -2.920 1.00 0.00 C ATOM 1969 O TRP A 132 -8.864 -1.376 -2.990 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.664 -2.059 -1.461 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.764 -2.473 -0.336 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.291 -3.689 -0.166 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.253 -1.706 0.777 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.443 -3.761 0.811 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.398 -2.586 1.458 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.380 -0.385 1.262 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.683 -2.223 2.559 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.670 -0.050 2.370 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.827 -0.973 3.000 1.00 0.00 C ATOM 0 H TRP A 132 -6.008 -4.244 -2.584 1.00 0.00 H new ATOM 0 HA TRP A 132 -8.230 -3.489 -1.032 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -6.052 -1.771 -2.316 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.226 -1.175 -1.158 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.578 -4.534 -0.774 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.893 -4.586 1.052 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -6.019 0.333 0.769 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -3.025 -2.921 3.056 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.757 0.948 2.773 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.274 -0.662 3.874 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.197 -3.409 -3.727 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.297 -3.025 -4.542 1.00 0.00 C ATOM 1992 C ARG A 133 -11.672 -3.729 -4.271 1.00 0.00 C ATOM 1993 O ARG A 133 -12.681 -3.046 -4.230 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.932 -2.983 -6.047 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.119 -2.751 -6.998 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.916 -4.008 -7.232 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.400 -3.800 -7.107 1.00 0.00 N ATOM 1998 CZ ARG A 133 -14.310 -4.600 -7.678 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.976 -5.325 -8.727 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.563 -4.634 -7.229 1.00 0.00 N ATOM 0 H ARG A 133 -8.897 -4.377 -3.845 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.492 -2.005 -4.210 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.199 -2.192 -6.206 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.450 -3.923 -6.315 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.770 -1.982 -6.582 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.750 -2.374 -7.952 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.692 -4.393 -8.227 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.601 -4.769 -6.518 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.732 -3.007 -6.558 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -13.028 -5.275 -9.100 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -14.665 -5.936 -9.165 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.839 -4.047 -6.442 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -16.247 -5.247 -7.672 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.690 -5.070 -4.095 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.948 -5.924 -4.327 1.00 0.00 C ATOM 2016 C LYS A 134 -14.261 -5.697 -3.554 1.00 0.00 C ATOM 2017 O LYS A 134 -14.919 -6.665 -3.191 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.737 -7.432 -4.497 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.999 -7.846 -5.754 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.582 -7.446 -5.681 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.917 -8.122 -4.529 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.562 -9.521 -4.853 1.00 0.00 N ATOM 0 H LYS A 134 -10.876 -5.607 -3.798 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.130 -5.428 -5.281 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -12.187 -7.805 -3.633 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.711 -7.921 -4.490 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -12.071 -8.926 -5.885 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.467 -7.387 -6.625 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.074 -7.708 -6.609 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.507 -6.364 -5.571 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.017 -7.572 -4.253 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -10.580 -8.105 -3.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -9.783 -10.132 -4.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -10.107 -9.835 -5.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.546 -9.581 -5.065 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.664 -4.517 -3.315 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.924 -4.322 -2.599 1.00 0.00 C ATOM 2038 C LEU A 135 -17.080 -4.156 -3.578 1.00 0.00 C ATOM 2039 O LEU A 135 -16.853 -3.955 -4.786 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.841 -3.137 -1.626 1.00 0.00 C ATOM 2041 CG LEU A 135 -15.191 -3.387 -0.244 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.955 -4.232 -0.356 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.801 -2.062 0.371 1.00 0.00 C ATOM 0 H LEU A 135 -14.175 -3.663 -3.585 1.00 0.00 H new ATOM 0 HA LEU A 135 -16.112 -5.215 -2.003 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.287 -2.337 -2.118 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.853 -2.768 -1.459 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.920 -3.911 0.374 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.528 -4.385 0.635 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -14.212 -5.197 -0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.226 -3.728 -0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.343 -2.234 1.345 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.090 -1.554 -0.280 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.689 -1.442 0.492 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.321 -4.336 -3.120 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.477 -4.057 -3.928 1.00 0.00 C ATOM 2057 C PRO A 136 -19.851 -2.578 -3.813 1.00 0.00 C ATOM 2058 O PRO A 136 -19.184 -1.806 -3.080 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.587 -4.936 -3.309 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.928 -5.680 -2.184 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.708 -4.893 -1.826 1.00 0.00 C ATOM 0 HA PRO A 136 -19.315 -4.265 -4.986 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -21.414 -4.326 -2.945 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -21.000 -5.624 -4.046 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.599 -5.769 -1.330 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.663 -6.693 -2.488 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.924 -4.115 -1.094 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.926 -5.522 -1.401 1.00 0.00 H new ATOM 2069 N VAL A 137 -20.898 -2.185 -4.510 1.00 0.00 N ATOM 2070 CA VAL A 137 -21.391 -0.808 -4.496 1.00 0.00 C ATOM 2071 C VAL A 137 -21.843 -0.427 -3.080 1.00 0.00 C ATOM 2072 O VAL A 137 -22.377 -1.276 -2.345 1.00 0.00 O ATOM 2073 CB VAL A 137 -22.574 -0.629 -5.512 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -23.134 0.797 -5.498 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -22.121 -0.991 -6.913 1.00 0.00 C ATOM 0 H VAL A 137 -21.439 -2.810 -5.108 1.00 0.00 H new ATOM 0 HA VAL A 137 -20.579 -0.147 -4.800 1.00 0.00 H new ATOM 0 HB VAL A 137 -23.373 -1.302 -5.201 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -23.950 0.874 -6.216 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -23.505 1.033 -4.500 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -22.346 1.500 -5.767 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -22.951 -0.863 -7.608 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -21.297 -0.342 -7.208 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -21.790 -2.029 -6.931 1.00 0.00 H new ATOM 2085 N LYS A 138 -21.599 0.820 -2.681 1.00 0.00 N ATOM 2086 CA LYS A 138 -22.014 1.258 -1.374 1.00 0.00 C ATOM 2087 C LYS A 138 -23.512 1.356 -1.321 1.00 0.00 C ATOM 2088 O LYS A 138 -24.141 2.165 -2.018 1.00 0.00 O ATOM 2089 CB LYS A 138 -21.324 2.554 -0.934 1.00 0.00 C ATOM 2090 CG LYS A 138 -21.656 3.009 0.496 1.00 0.00 C ATOM 2091 CD LYS A 138 -21.575 1.865 1.530 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.205 1.202 1.614 1.00 0.00 C ATOM 2093 NZ LYS A 138 -20.268 -0.004 2.460 1.00 0.00 N ATOM 0 H LYS A 138 -21.123 1.526 -3.242 1.00 0.00 H new ATOM 0 HA LYS A 138 -21.694 0.508 -0.650 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -20.245 2.420 -1.016 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -21.600 3.349 -1.626 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.968 3.803 0.787 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -22.659 3.435 0.512 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -21.838 2.257 2.512 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -22.319 1.109 1.279 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -19.861 0.935 0.615 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -19.479 1.904 2.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.467 -0.628 2.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -20.221 0.272 3.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -21.160 -0.507 2.281 1.00 0.00 H new ATOM 2107 N GLY A 139 -24.055 0.510 -0.518 1.00 0.00 N ATOM 2108 CA GLY A 139 -25.453 0.339 -0.376 1.00 0.00 C ATOM 2109 C GLY A 139 -25.640 -1.056 0.092 1.00 0.00 C ATOM 2110 O GLY A 139 -26.510 -1.342 0.895 1.00 0.00 O ATOM 0 H GLY A 139 -23.510 -0.108 0.083 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -25.864 1.051 0.340 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -25.966 0.507 -1.323 1.00 0.00 H new ATOM 2114 N ASP A 140 -24.699 -1.891 -0.377 1.00 0.00 N ATOM 2115 CA ASP A 140 -24.523 -3.303 -0.024 1.00 0.00 C ATOM 2116 C ASP A 140 -25.830 -4.050 0.070 1.00 0.00 C ATOM 2117 O ASP A 140 -26.293 -4.564 -0.965 1.00 0.00 O ATOM 2118 CB ASP A 140 -23.702 -3.450 1.271 1.00 0.00 C ATOM 2119 CG ASP A 140 -22.345 -2.751 1.219 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -22.289 -1.498 1.403 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -21.301 -3.432 1.052 1.00 0.00 O ATOM 2122 OXT ASP A 140 -26.416 -4.139 1.187 1.00 0.00 O ATOM 0 H ASP A 140 -24.002 -1.577 -1.052 1.00 0.00 H new ATOM 0 HA ASP A 140 -23.964 -3.762 -0.840 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -24.278 -3.046 2.104 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -23.548 -4.510 1.475 1.00 0.00 H new TER 2127 ASP A 140