USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1330 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 143 TYR OH : rot 63:sc= 1.09 USER MOD Set 1.2: A 150 ASN : amide:sc= 0.511 K(o=1.6,f=-2) USER MOD Set 2.1: A 138 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 161 GLN : amide:sc= -0.893 K(o=-0.89,f=-1.9) USER MOD Set 3.1: A 27 TYR OH : rot 180:sc= 0.307 USER MOD Set 3.2: A 71 TYR OH : rot 67:sc= 1.76 USER MOD Set 4.1: A 8 THR OG1 : rot -34:sc= 0.759 USER MOD Set 4.2: A 9 THR OG1 : rot 100:sc= 1.18 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= 0 (180deg=-0.105) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 MET CE :methyl -173:sc= 0 (180deg=-0.00971) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 THR OG1 : rot -21:sc= 0.338 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 GLN : amide:sc= -0.317 K(o=-0.32,f=-1.7) USER MOD Single : A 23 HIS : no HD1:sc= -0.0873 X(o=-0.087,f=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc=-0.00408 X(o=-0.0041,f=-0.12) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN :FLIP amide:sc= -0.095 F(o=-0.94,f=-0.095) USER MOD Single : A 59 SER OG : rot 173:sc= 0.87 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 HIS : no HD1:sc= -0.882 K(o=-0.88,f=-1.5) USER MOD Single : A 73 MET CE :methyl -126:sc= -4.4! (180deg=-12.3!) USER MOD Single : A 76 LYS NZ :NH3+ -113:sc= -0.557 (180deg=-1.88!) USER MOD Single : A 78 SER OG : rot 180:sc= 0.0723 USER MOD Single : A 80 ASN : amide:sc= -2.25 K(o=-2.2,f=-9.5!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN :FLIP amide:sc= -0.0494 F(o=-0.57,f=-0.049) USER MOD Single : A 103 HIS : no HD1:sc= -3.37 K(o=-3.4,f=-4.6!) USER MOD Single : A 109 THR OG1 : rot 161:sc= -0.602 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= -0.14 K(o=-0.14,f=-5.2!) USER MOD Single : A 119 ASN : amide:sc= -0.046 K(o=-0.046,f=-1.2!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot -2:sc= 0.954 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.563 X(o=-0.56,f=-0.81) USER MOD Single : A 141 MET CE :methyl 172:sc= -0.449 (180deg=-0.822) USER MOD Single : A 142 THR OG1 : rot -117:sc= -0.652 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0366 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= 0.273 K(o=0.27,f=-4.9!) USER MOD Single : A 152 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl -162:sc= -0.0199 (180deg=-0.587) USER MOD Single : A 165 HIS : no HD1:sc= -0.322 X(o=-0.32,f=-0.11) USER MOD Single : A 166 HIS : no HE2:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 167 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 168 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 169 HIS : no HD1:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 170 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.418 -18.752 46.320 1.00 0.00 N ATOM 2 CA MET A 1 -6.609 -18.533 45.457 1.00 0.00 C ATOM 3 C MET A 1 -7.641 -17.654 46.156 1.00 0.00 C ATOM 4 O MET A 1 -8.417 -18.129 46.985 1.00 0.00 O ATOM 5 CB MET A 1 -7.220 -19.892 45.115 1.00 0.00 C ATOM 6 CG MET A 1 -6.265 -20.821 44.382 1.00 0.00 C ATOM 7 SD MET A 1 -7.119 -21.997 43.316 1.00 0.00 S ATOM 8 CE MET A 1 -5.767 -23.072 42.846 1.00 0.00 C ATOM 0 H1 MET A 1 -4.659 -19.190 45.760 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.088 -17.840 46.695 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.672 -19.379 47.110 1.00 0.00 H new ATOM 0 HA MET A 1 -6.301 -18.019 44.546 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.549 -20.375 46.035 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.107 -19.738 44.501 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.576 -20.227 43.782 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.665 -21.366 45.110 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.138 -23.854 42.184 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.003 -22.491 42.330 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.336 -23.526 43.738 1.00 0.00 H new ATOM 20 N ASN A 2 -7.643 -16.368 45.817 1.00 0.00 N ATOM 21 CA ASN A 2 -8.579 -15.422 46.412 1.00 0.00 C ATOM 22 C ASN A 2 -9.261 -14.581 45.337 1.00 0.00 C ATOM 23 O ASN A 2 -8.807 -14.529 44.195 1.00 0.00 O ATOM 24 CB ASN A 2 -7.853 -14.511 47.404 1.00 0.00 C ATOM 25 CG ASN A 2 -8.726 -14.129 48.584 1.00 0.00 C ATOM 26 OD1 ASN A 2 -8.967 -14.937 49.480 1.00 0.00 O ATOM 27 ND2 ASN A 2 -9.205 -12.890 48.589 1.00 0.00 N ATOM 0 H ASN A 2 -7.007 -15.958 45.133 1.00 0.00 H new ATOM 0 HA ASN A 2 -9.343 -15.990 46.942 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -6.957 -15.014 47.767 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -7.525 -13.607 46.890 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -9.798 -12.576 49.357 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -8.980 -12.253 47.825 1.00 0.00 H new ATOM 34 N ALA A 3 -10.353 -13.923 45.714 1.00 0.00 N ATOM 35 CA ALA A 3 -11.100 -13.084 44.783 1.00 0.00 C ATOM 36 C ALA A 3 -10.215 -11.994 44.184 1.00 0.00 C ATOM 37 O ALA A 3 -10.513 -11.457 43.118 1.00 0.00 O ATOM 38 CB ALA A 3 -12.300 -12.463 45.483 1.00 0.00 C ATOM 0 H ALA A 3 -10.740 -13.955 46.657 1.00 0.00 H new ATOM 0 HA ALA A 3 -11.450 -13.716 43.967 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -12.850 -11.839 44.778 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -12.953 -13.253 45.855 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -11.958 -11.852 46.318 1.00 0.00 H new ATOM 44 N ASP A 4 -9.123 -11.673 44.874 1.00 0.00 N ATOM 45 CA ASP A 4 -8.198 -10.648 44.404 1.00 0.00 C ATOM 46 C ASP A 4 -7.319 -11.192 43.284 1.00 0.00 C ATOM 47 O ASP A 4 -7.290 -10.644 42.181 1.00 0.00 O ATOM 48 CB ASP A 4 -7.327 -10.151 45.558 1.00 0.00 C ATOM 49 CG ASP A 4 -7.033 -8.667 45.462 1.00 0.00 C ATOM 50 OD1 ASP A 4 -6.651 -8.206 44.367 1.00 0.00 O ATOM 51 OD2 ASP A 4 -7.187 -7.964 46.484 1.00 0.00 O ATOM 0 H ASP A 4 -8.859 -12.107 45.758 1.00 0.00 H new ATOM 0 HA ASP A 4 -8.780 -9.813 44.015 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -7.828 -10.359 46.503 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -6.388 -10.705 45.566 1.00 0.00 H new ATOM 57 N GLU A 5 -6.606 -12.274 43.574 1.00 0.00 N ATOM 58 CA GLU A 5 -5.730 -12.897 42.590 1.00 0.00 C ATOM 59 C GLU A 5 -6.544 -13.564 41.486 1.00 0.00 C ATOM 60 O GLU A 5 -6.070 -13.722 40.361 1.00 0.00 O ATOM 61 CB GLU A 5 -4.822 -13.928 43.265 1.00 0.00 C ATOM 62 CG GLU A 5 -3.506 -13.349 43.757 1.00 0.00 C ATOM 63 CD GLU A 5 -2.441 -14.409 43.955 1.00 0.00 C ATOM 64 OE1 GLU A 5 -1.667 -14.658 43.006 1.00 0.00 O ATOM 65 OE2 GLU A 5 -2.378 -14.990 45.059 1.00 0.00 O ATOM 0 H GLU A 5 -6.618 -12.738 44.482 1.00 0.00 H new ATOM 0 HA GLU A 5 -5.113 -12.118 42.143 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -5.353 -14.371 44.108 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -4.614 -14.734 42.561 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -3.148 -12.609 43.041 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -3.673 -12.826 44.699 1.00 0.00 H new ATOM 73 N TRP A 6 -7.774 -13.951 41.814 1.00 0.00 N ATOM 74 CA TRP A 6 -8.653 -14.600 40.847 1.00 0.00 C ATOM 75 C TRP A 6 -8.995 -13.651 39.702 1.00 0.00 C ATOM 76 O TRP A 6 -8.998 -14.044 38.536 1.00 0.00 O ATOM 77 CB TRP A 6 -9.937 -15.076 41.530 1.00 0.00 C ATOM 78 CG TRP A 6 -9.870 -16.498 41.995 1.00 0.00 C ATOM 79 CD1 TRP A 6 -10.158 -16.966 43.245 1.00 0.00 C ATOM 80 CD2 TRP A 6 -9.491 -17.638 41.216 1.00 0.00 C ATOM 81 NE1 TRP A 6 -9.981 -18.329 43.291 1.00 0.00 N ATOM 82 CE2 TRP A 6 -9.572 -18.764 42.057 1.00 0.00 C ATOM 83 CE3 TRP A 6 -9.092 -17.818 39.888 1.00 0.00 C ATOM 84 CZ2 TRP A 6 -9.269 -20.049 41.614 1.00 0.00 C ATOM 85 CZ3 TRP A 6 -8.791 -19.093 39.449 1.00 0.00 C ATOM 86 CH2 TRP A 6 -8.881 -20.194 40.310 1.00 0.00 C ATOM 0 H TRP A 6 -8.183 -13.827 42.740 1.00 0.00 H new ATOM 0 HA TRP A 6 -8.127 -15.462 40.438 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -10.146 -14.432 42.384 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -10.771 -14.967 40.836 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -10.478 -16.355 44.076 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -10.130 -18.920 44.109 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -9.020 -16.975 39.217 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -9.338 -20.900 42.276 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -8.481 -19.243 38.425 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -8.639 -21.178 39.937 1.00 0.00 H new ATOM 97 N MET A 7 -9.282 -12.398 40.045 1.00 0.00 N ATOM 98 CA MET A 7 -9.625 -11.392 39.047 1.00 0.00 C ATOM 99 C MET A 7 -8.454 -11.141 38.102 1.00 0.00 C ATOM 100 O MET A 7 -8.626 -11.094 36.883 1.00 0.00 O ATOM 101 CB MET A 7 -10.035 -10.086 39.729 1.00 0.00 C ATOM 102 CG MET A 7 -10.457 -8.997 38.755 1.00 0.00 C ATOM 103 SD MET A 7 -9.955 -7.352 39.294 1.00 0.00 S ATOM 104 CE MET A 7 -10.603 -6.346 37.961 1.00 0.00 C ATOM 0 H MET A 7 -9.284 -12.056 41.006 1.00 0.00 H new ATOM 0 HA MET A 7 -10.465 -11.768 38.463 1.00 0.00 H new ATOM 0 HB2 MET A 7 -10.858 -10.287 40.415 1.00 0.00 H new ATOM 0 HB3 MET A 7 -9.201 -9.722 40.329 1.00 0.00 H new ATOM 0 HG2 MET A 7 -10.024 -9.202 37.776 1.00 0.00 H new ATOM 0 HG3 MET A 7 -11.540 -9.021 38.636 1.00 0.00 H new ATOM 0 HE1 MET A 7 -10.266 -5.317 38.085 1.00 0.00 H new ATOM 0 HE2 MET A 7 -10.245 -6.732 37.007 1.00 0.00 H new ATOM 0 HE3 MET A 7 -11.692 -6.376 37.979 1.00 0.00 H new ATOM 114 N THR A 8 -7.265 -10.980 38.672 1.00 0.00 N ATOM 115 CA THR A 8 -6.065 -10.732 37.880 1.00 0.00 C ATOM 116 C THR A 8 -5.800 -11.887 36.919 1.00 0.00 C ATOM 117 O THR A 8 -5.565 -11.675 35.729 1.00 0.00 O ATOM 118 CB THR A 8 -4.857 -10.530 38.796 1.00 0.00 C ATOM 119 OG1 THR A 8 -4.626 -11.684 39.583 1.00 0.00 O ATOM 120 CG2 THR A 8 -5.011 -9.355 39.739 1.00 0.00 C ATOM 0 H THR A 8 -7.106 -11.017 39.679 1.00 0.00 H new ATOM 0 HA THR A 8 -6.226 -9.826 37.296 1.00 0.00 H new ATOM 0 HB THR A 8 -4.018 -10.333 38.128 1.00 0.00 H new ATOM 0 HG1 THR A 8 -5.482 -12.110 39.798 1.00 0.00 H new ATOM 0 HG21 THR A 8 -4.120 -9.268 40.360 1.00 0.00 H new ATOM 0 HG22 THR A 8 -5.142 -8.440 39.162 1.00 0.00 H new ATOM 0 HG23 THR A 8 -5.883 -9.511 40.375 1.00 0.00 H new ATOM 128 N THR A 9 -5.840 -13.107 37.443 1.00 0.00 N ATOM 129 CA THR A 9 -5.603 -14.295 36.630 1.00 0.00 C ATOM 130 C THR A 9 -6.632 -14.402 35.510 1.00 0.00 C ATOM 131 O THR A 9 -6.297 -14.754 34.378 1.00 0.00 O ATOM 132 CB THR A 9 -5.650 -15.551 37.503 1.00 0.00 C ATOM 133 OG1 THR A 9 -5.029 -15.315 38.754 1.00 0.00 O ATOM 134 CG2 THR A 9 -4.968 -16.745 36.870 1.00 0.00 C ATOM 0 H THR A 9 -6.034 -13.300 38.426 1.00 0.00 H new ATOM 0 HA THR A 9 -4.613 -14.208 36.182 1.00 0.00 H new ATOM 0 HB THR A 9 -6.709 -15.780 37.624 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.715 -15.139 39.432 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.037 -17.601 37.541 1.00 0.00 H new ATOM 0 HG22 THR A 9 -5.456 -16.984 35.925 1.00 0.00 H new ATOM 0 HG23 THR A 9 -3.919 -16.511 36.688 1.00 0.00 H new ATOM 142 N PHE A 10 -7.885 -14.097 35.831 1.00 0.00 N ATOM 143 CA PHE A 10 -8.963 -14.158 34.850 1.00 0.00 C ATOM 144 C PHE A 10 -8.837 -13.028 33.833 1.00 0.00 C ATOM 145 O PHE A 10 -9.187 -13.190 32.664 1.00 0.00 O ATOM 146 CB PHE A 10 -10.322 -14.084 35.548 1.00 0.00 C ATOM 147 CG PHE A 10 -10.910 -15.430 35.861 1.00 0.00 C ATOM 148 CD1 PHE A 10 -10.172 -16.381 36.549 1.00 0.00 C ATOM 149 CD2 PHE A 10 -12.201 -15.745 35.467 1.00 0.00 C ATOM 150 CE1 PHE A 10 -10.710 -17.620 36.837 1.00 0.00 C ATOM 151 CE2 PHE A 10 -12.745 -16.982 35.754 1.00 0.00 C ATOM 152 CZ PHE A 10 -11.999 -17.921 36.439 1.00 0.00 C ATOM 0 H PHE A 10 -8.179 -13.805 36.763 1.00 0.00 H new ATOM 0 HA PHE A 10 -8.886 -15.108 34.322 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -10.215 -13.519 36.474 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.017 -13.531 34.915 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.165 -16.150 36.863 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -12.788 -15.015 34.930 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.124 -18.353 37.372 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -13.753 -17.215 35.443 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.422 -18.889 36.663 1.00 0.00 H new ATOM 162 N ARG A 11 -8.336 -11.884 34.287 1.00 0.00 N ATOM 163 CA ARG A 11 -8.164 -10.726 33.416 1.00 0.00 C ATOM 164 C ARG A 11 -7.186 -11.035 32.287 1.00 0.00 C ATOM 165 O ARG A 11 -7.348 -10.556 31.165 1.00 0.00 O ATOM 166 CB ARG A 11 -7.668 -9.525 34.222 1.00 0.00 C ATOM 167 CG ARG A 11 -8.235 -8.197 33.748 1.00 0.00 C ATOM 168 CD ARG A 11 -8.179 -7.142 34.841 1.00 0.00 C ATOM 169 NE ARG A 11 -7.170 -6.122 34.566 1.00 0.00 N ATOM 170 CZ ARG A 11 -5.870 -6.280 34.809 1.00 0.00 C ATOM 171 NH1 ARG A 11 -5.418 -7.413 35.331 1.00 0.00 N ATOM 172 NH2 ARG A 11 -5.021 -5.301 34.528 1.00 0.00 N ATOM 0 H ARG A 11 -8.042 -11.734 35.252 1.00 0.00 H new ATOM 0 HA ARG A 11 -9.132 -10.485 32.977 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -7.930 -9.669 35.270 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -6.580 -9.486 34.168 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -7.675 -7.851 32.879 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -9.268 -8.335 33.428 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -9.156 -6.669 34.938 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -7.960 -7.620 35.796 1.00 0.00 H new ATOM 0 HE ARG A 11 -7.479 -5.237 34.164 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -6.067 -8.169 35.548 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -4.421 -7.528 35.515 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -5.364 -4.428 34.126 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -4.025 -5.421 34.714 1.00 0.00 H new ATOM 186 N GLU A 12 -6.173 -11.839 32.592 1.00 0.00 N ATOM 187 CA GLU A 12 -5.169 -12.210 31.603 1.00 0.00 C ATOM 188 C GLU A 12 -5.788 -13.044 30.486 1.00 0.00 C ATOM 189 O GLU A 12 -5.349 -12.984 29.337 1.00 0.00 O ATOM 190 CB GLU A 12 -4.033 -12.992 32.266 1.00 0.00 C ATOM 191 CG GLU A 12 -2.860 -13.266 31.340 1.00 0.00 C ATOM 192 CD GLU A 12 -1.796 -14.131 31.987 1.00 0.00 C ATOM 193 OE1 GLU A 12 -0.606 -13.755 31.924 1.00 0.00 O ATOM 194 OE2 GLU A 12 -2.152 -15.184 32.556 1.00 0.00 O ATOM 0 H GLU A 12 -6.026 -12.246 33.516 1.00 0.00 H new ATOM 0 HA GLU A 12 -4.767 -11.294 31.170 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.678 -12.435 33.133 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.423 -13.941 32.634 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -3.222 -13.757 30.437 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -2.416 -12.319 31.032 1.00 0.00 H new ATOM 202 N ASN A 13 -6.810 -13.820 30.829 1.00 0.00 N ATOM 203 CA ASN A 13 -7.490 -14.666 29.856 1.00 0.00 C ATOM 204 C ASN A 13 -8.418 -13.839 28.971 1.00 0.00 C ATOM 205 O ASN A 13 -8.337 -13.896 27.744 1.00 0.00 O ATOM 206 CB ASN A 13 -8.288 -15.760 30.567 1.00 0.00 C ATOM 207 CG ASN A 13 -8.591 -16.936 29.660 1.00 0.00 C ATOM 208 OD1 ASN A 13 -9.708 -17.079 29.163 1.00 0.00 O ATOM 209 ND2 ASN A 13 -7.594 -17.786 29.439 1.00 0.00 N ATOM 0 H ASN A 13 -7.186 -13.881 31.775 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.732 -15.131 29.225 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -7.728 -16.109 31.435 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -9.223 -15.341 30.938 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -7.739 -18.596 28.836 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -6.684 -17.628 29.872 1.00 0.00 H new ATOM 216 N ILE A 14 -9.301 -13.072 29.602 1.00 0.00 N ATOM 217 CA ILE A 14 -10.246 -12.234 28.872 1.00 0.00 C ATOM 218 C ILE A 14 -9.515 -11.224 27.992 1.00 0.00 C ATOM 219 O ILE A 14 -9.973 -10.895 26.897 1.00 0.00 O ATOM 220 CB ILE A 14 -11.188 -11.482 29.834 1.00 0.00 C ATOM 221 CG1 ILE A 14 -12.237 -10.694 29.047 1.00 0.00 C ATOM 222 CG2 ILE A 14 -10.394 -10.557 30.744 1.00 0.00 C ATOM 223 CD1 ILE A 14 -13.603 -10.685 29.698 1.00 0.00 C ATOM 0 H ILE A 14 -9.382 -13.013 30.617 1.00 0.00 H new ATOM 0 HA ILE A 14 -10.840 -12.896 28.242 1.00 0.00 H new ATOM 0 HB ILE A 14 -11.703 -12.214 30.456 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -11.894 -9.666 28.928 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -12.323 -11.119 28.047 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -11.075 -10.035 31.416 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -9.685 -11.143 31.329 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -9.852 -9.830 30.140 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -14.295 -10.108 29.084 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -13.968 -11.708 29.792 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -13.532 -10.233 30.687 1.00 0.00 H new ATOM 235 N ALA A 15 -8.379 -10.736 28.478 1.00 0.00 N ATOM 236 CA ALA A 15 -7.586 -9.764 27.735 1.00 0.00 C ATOM 237 C ALA A 15 -6.887 -10.416 26.548 1.00 0.00 C ATOM 238 O ALA A 15 -6.737 -9.805 25.490 1.00 0.00 O ATOM 239 CB ALA A 15 -6.568 -9.103 28.653 1.00 0.00 C ATOM 0 H ALA A 15 -7.987 -10.997 29.383 1.00 0.00 H new ATOM 0 HA ALA A 15 -8.261 -9.000 27.349 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.982 -8.379 28.086 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -7.087 -8.593 29.465 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.904 -9.862 29.067 1.00 0.00 H new ATOM 245 N GLN A 16 -6.458 -11.662 26.731 1.00 0.00 N ATOM 246 CA GLN A 16 -5.774 -12.397 25.675 1.00 0.00 C ATOM 247 C GLN A 16 -6.737 -12.748 24.544 1.00 0.00 C ATOM 248 O GLN A 16 -6.366 -12.723 23.370 1.00 0.00 O ATOM 249 CB GLN A 16 -5.145 -13.672 26.239 1.00 0.00 C ATOM 250 CG GLN A 16 -4.144 -14.324 25.299 1.00 0.00 C ATOM 251 CD GLN A 16 -3.189 -15.256 26.019 1.00 0.00 C ATOM 252 OE1 GLN A 16 -2.203 -14.817 26.609 1.00 0.00 O ATOM 253 NE2 GLN A 16 -3.479 -16.551 25.973 1.00 0.00 N ATOM 0 H GLN A 16 -6.573 -12.182 27.601 1.00 0.00 H new ATOM 0 HA GLN A 16 -4.987 -11.759 25.273 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -4.647 -13.436 27.180 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -5.936 -14.387 26.467 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.681 -14.882 24.532 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -3.573 -13.549 24.788 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -4.308 -16.871 25.472 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.873 -17.226 26.439 1.00 0.00 H new ATOM 262 N THR A 17 -7.973 -13.073 24.906 1.00 0.00 N ATOM 263 CA THR A 17 -8.989 -13.429 23.924 1.00 0.00 C ATOM 264 C THR A 17 -9.481 -12.193 23.178 1.00 0.00 C ATOM 265 O THR A 17 -9.739 -12.243 21.975 1.00 0.00 O ATOM 266 CB THR A 17 -10.166 -14.129 24.606 1.00 0.00 C ATOM 267 OG1 THR A 17 -10.755 -13.285 25.578 1.00 0.00 O ATOM 268 CG2 THR A 17 -9.778 -15.420 25.291 1.00 0.00 C ATOM 0 H THR A 17 -8.295 -13.097 25.873 1.00 0.00 H new ATOM 0 HA THR A 17 -8.538 -14.111 23.203 1.00 0.00 H new ATOM 0 HB THR A 17 -10.869 -14.360 23.806 1.00 0.00 H new ATOM 0 HG1 THR A 17 -10.111 -12.597 25.847 1.00 0.00 H new ATOM 0 HG21 THR A 17 -10.659 -15.865 25.754 1.00 0.00 H new ATOM 0 HG22 THR A 17 -9.366 -16.112 24.557 1.00 0.00 H new ATOM 0 HG23 THR A 17 -9.030 -15.215 26.057 1.00 0.00 H new ATOM 276 N TRP A 18 -9.607 -11.084 23.899 1.00 0.00 N ATOM 277 CA TRP A 18 -10.068 -9.834 23.306 1.00 0.00 C ATOM 278 C TRP A 18 -9.126 -9.380 22.195 1.00 0.00 C ATOM 279 O TRP A 18 -9.554 -9.133 21.067 1.00 0.00 O ATOM 280 CB TRP A 18 -10.177 -8.746 24.377 1.00 0.00 C ATOM 281 CG TRP A 18 -11.587 -8.475 24.807 1.00 0.00 C ATOM 282 CD1 TRP A 18 -12.448 -9.354 25.396 1.00 0.00 C ATOM 283 CD2 TRP A 18 -12.299 -7.239 24.677 1.00 0.00 C ATOM 284 NE1 TRP A 18 -13.652 -8.740 25.642 1.00 0.00 N ATOM 285 CE2 TRP A 18 -13.586 -7.441 25.210 1.00 0.00 C ATOM 286 CE3 TRP A 18 -11.973 -5.980 24.164 1.00 0.00 C ATOM 287 CZ2 TRP A 18 -14.546 -6.433 25.243 1.00 0.00 C ATOM 288 CZ3 TRP A 18 -12.926 -4.980 24.197 1.00 0.00 C ATOM 289 CH2 TRP A 18 -14.199 -5.211 24.735 1.00 0.00 C ATOM 0 H TRP A 18 -9.396 -11.025 24.895 1.00 0.00 H new ATOM 0 HA TRP A 18 -11.054 -10.007 22.874 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -9.590 -9.042 25.246 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -9.738 -7.825 23.995 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -12.217 -10.382 25.634 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -14.464 -9.180 26.076 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -10.994 -5.792 23.749 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -15.529 -6.609 25.655 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -12.686 -4.004 23.802 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -14.921 -4.408 24.749 1.00 0.00 H new ATOM 300 N GLN A 19 -7.843 -9.273 22.522 1.00 0.00 N ATOM 301 CA GLN A 19 -6.840 -8.849 21.551 1.00 0.00 C ATOM 302 C GLN A 19 -6.552 -9.959 20.546 1.00 0.00 C ATOM 303 O GLN A 19 -6.874 -9.838 19.364 1.00 0.00 O ATOM 304 CB GLN A 19 -5.549 -8.443 22.264 1.00 0.00 C ATOM 305 CG GLN A 19 -5.733 -7.303 23.252 1.00 0.00 C ATOM 306 CD GLN A 19 -4.416 -6.696 23.692 1.00 0.00 C ATOM 307 OE1 GLN A 19 -3.726 -7.238 24.556 1.00 0.00 O ATOM 308 NE2 GLN A 19 -4.059 -5.563 23.098 1.00 0.00 N ATOM 0 H GLN A 19 -7.473 -9.474 23.451 1.00 0.00 H new ATOM 0 HA GLN A 19 -7.235 -7.988 21.011 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -5.147 -9.308 22.791 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -4.809 -8.151 21.519 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.352 -6.529 22.797 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.271 -7.668 24.127 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -4.661 -5.148 22.387 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -3.183 -5.108 23.353 1.00 0.00 H new ATOM 317 N GLN A 20 -5.944 -11.039 21.023 1.00 0.00 N ATOM 318 CA GLN A 20 -5.613 -12.172 20.165 1.00 0.00 C ATOM 319 C GLN A 20 -4.676 -11.744 19.037 1.00 0.00 C ATOM 320 O GLN A 20 -5.124 -11.398 17.944 1.00 0.00 O ATOM 321 CB GLN A 20 -6.886 -12.785 19.580 1.00 0.00 C ATOM 322 CG GLN A 20 -6.838 -14.302 19.475 1.00 0.00 C ATOM 323 CD GLN A 20 -5.944 -14.779 18.347 1.00 0.00 C ATOM 324 OE1 GLN A 20 -4.722 -14.650 18.411 1.00 0.00 O ATOM 325 NE2 GLN A 20 -6.551 -15.333 17.304 1.00 0.00 N ATOM 0 H GLN A 20 -5.670 -11.155 21.999 1.00 0.00 H new ATOM 0 HA GLN A 20 -5.104 -12.920 20.773 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -7.735 -12.499 20.200 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -7.059 -12.366 18.589 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -6.481 -14.717 20.417 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -7.847 -14.684 19.321 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -7.567 -15.420 17.292 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -6.001 -15.671 16.514 1.00 0.00 H new ATOM 334 N PRO A 21 -3.355 -11.762 19.290 1.00 0.00 N ATOM 335 CA PRO A 21 -2.355 -11.374 18.291 1.00 0.00 C ATOM 336 C PRO A 21 -2.248 -12.385 17.154 1.00 0.00 C ATOM 337 O PRO A 21 -2.492 -13.577 17.345 1.00 0.00 O ATOM 338 CB PRO A 21 -1.052 -11.329 19.091 1.00 0.00 C ATOM 339 CG PRO A 21 -1.274 -12.262 20.230 1.00 0.00 C ATOM 340 CD PRO A 21 -2.736 -12.161 20.567 1.00 0.00 C ATOM 0 HA PRO A 21 -2.607 -10.430 17.808 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -0.203 -11.642 18.483 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -0.838 -10.320 19.442 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -1.006 -13.283 19.957 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -0.656 -11.988 21.085 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -3.132 -13.111 20.926 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -2.918 -11.424 21.349 1.00 0.00 H new ATOM 348 N GLU A 22 -1.883 -11.900 15.972 1.00 0.00 N ATOM 349 CA GLU A 22 -1.743 -12.762 14.803 1.00 0.00 C ATOM 350 C GLU A 22 -0.512 -12.378 13.989 1.00 0.00 C ATOM 351 O GLU A 22 0.488 -13.096 13.980 1.00 0.00 O ATOM 352 CB GLU A 22 -2.995 -12.677 13.928 1.00 0.00 C ATOM 353 CG GLU A 22 -4.067 -13.688 14.300 1.00 0.00 C ATOM 354 CD GLU A 22 -5.331 -13.526 13.477 1.00 0.00 C ATOM 355 OE1 GLU A 22 -6.213 -12.744 13.888 1.00 0.00 O ATOM 356 OE2 GLU A 22 -5.436 -14.183 12.419 1.00 0.00 O ATOM 0 H GLU A 22 -1.679 -10.916 15.798 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.621 -13.788 15.151 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.413 -11.673 14.003 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -2.711 -12.828 12.886 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.675 -14.696 14.162 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -4.310 -13.582 15.357 1.00 0.00 H new ATOM 364 N HIS A 23 -0.592 -11.242 13.305 1.00 0.00 N ATOM 365 CA HIS A 23 0.515 -10.761 12.487 1.00 0.00 C ATOM 366 C HIS A 23 0.824 -9.299 12.793 1.00 0.00 C ATOM 367 O HIS A 23 -0.083 -8.501 13.034 1.00 0.00 O ATOM 368 CB HIS A 23 0.189 -10.926 11.002 1.00 0.00 C ATOM 369 CG HIS A 23 -0.238 -12.312 10.632 1.00 0.00 C ATOM 370 ND1 HIS A 23 0.650 -13.353 10.460 1.00 0.00 N ATOM 371 CD2 HIS A 23 -1.469 -12.829 10.402 1.00 0.00 C ATOM 372 CE1 HIS A 23 -0.015 -14.449 10.139 1.00 0.00 C ATOM 373 NE2 HIS A 23 -1.302 -14.158 10.098 1.00 0.00 N ATOM 0 H HIS A 23 -1.413 -10.637 13.301 1.00 0.00 H new ATOM 0 HA HIS A 23 1.396 -11.357 12.727 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -0.603 -10.227 10.733 1.00 0.00 H new ATOM 0 HB3 HIS A 23 1.066 -10.656 10.414 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -2.407 -12.296 10.449 1.00 0.00 H new ATOM 0 HE1 HIS A 23 0.420 -15.418 9.943 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -2.051 -14.814 9.876 1.00 0.00 H new ATOM 382 N TYR A 24 2.107 -8.955 12.781 1.00 0.00 N ATOM 383 CA TYR A 24 2.535 -7.588 13.057 1.00 0.00 C ATOM 384 C TYR A 24 3.085 -6.926 11.796 1.00 0.00 C ATOM 385 O TYR A 24 4.127 -7.325 11.278 1.00 0.00 O ATOM 386 CB TYR A 24 3.596 -7.577 14.161 1.00 0.00 C ATOM 387 CG TYR A 24 3.264 -6.651 15.310 1.00 0.00 C ATOM 388 CD1 TYR A 24 3.580 -5.299 15.251 1.00 0.00 C ATOM 389 CD2 TYR A 24 2.634 -7.129 16.452 1.00 0.00 C ATOM 390 CE1 TYR A 24 3.278 -4.450 16.300 1.00 0.00 C ATOM 391 CE2 TYR A 24 2.329 -6.286 17.503 1.00 0.00 C ATOM 392 CZ TYR A 24 2.653 -4.949 17.423 1.00 0.00 C ATOM 393 OH TYR A 24 2.350 -4.106 18.468 1.00 0.00 O ATOM 0 H TYR A 24 2.869 -9.604 12.583 1.00 0.00 H new ATOM 0 HA TYR A 24 1.667 -7.021 13.393 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.719 -8.590 14.545 1.00 0.00 H new ATOM 0 HB3 TYR A 24 4.553 -7.281 13.731 1.00 0.00 H new ATOM 0 HD1 TYR A 24 4.069 -4.905 14.372 1.00 0.00 H new ATOM 0 HD2 TYR A 24 2.379 -8.176 16.519 1.00 0.00 H new ATOM 0 HE1 TYR A 24 3.530 -3.402 16.240 1.00 0.00 H new ATOM 0 HE2 TYR A 24 1.839 -6.673 18.384 1.00 0.00 H new ATOM 0 HH TYR A 24 1.911 -4.614 19.182 1.00 0.00 H new ATOM 403 N ASP A 25 2.374 -5.914 11.308 1.00 0.00 N ATOM 404 CA ASP A 25 2.790 -5.197 10.108 1.00 0.00 C ATOM 405 C ASP A 25 3.398 -3.845 10.464 1.00 0.00 C ATOM 406 O ASP A 25 2.803 -3.063 11.206 1.00 0.00 O ATOM 407 CB ASP A 25 1.600 -5.003 9.167 1.00 0.00 C ATOM 408 CG ASP A 25 1.461 -6.137 8.169 1.00 0.00 C ATOM 409 OD1 ASP A 25 0.805 -5.932 7.126 1.00 0.00 O ATOM 410 OD2 ASP A 25 2.007 -7.229 8.431 1.00 0.00 O ATOM 0 H ASP A 25 1.508 -5.572 11.725 1.00 0.00 H new ATOM 0 HA ASP A 25 3.550 -5.794 9.604 1.00 0.00 H new ATOM 0 HB2 ASP A 25 0.685 -4.925 9.754 1.00 0.00 H new ATOM 0 HB3 ASP A 25 1.715 -4.062 8.630 1.00 0.00 H new ATOM 416 N LEU A 26 4.584 -3.574 9.929 1.00 0.00 N ATOM 417 CA LEU A 26 5.271 -2.315 10.190 1.00 0.00 C ATOM 418 C LEU A 26 5.233 -1.411 8.962 1.00 0.00 C ATOM 419 O LEU A 26 5.661 -1.804 7.877 1.00 0.00 O ATOM 420 CB LEU A 26 6.722 -2.578 10.605 1.00 0.00 C ATOM 421 CG LEU A 26 7.157 -1.900 11.905 1.00 0.00 C ATOM 422 CD1 LEU A 26 6.906 -2.816 13.093 1.00 0.00 C ATOM 423 CD2 LEU A 26 8.624 -1.505 11.835 1.00 0.00 C ATOM 0 H LEU A 26 5.089 -4.210 9.312 1.00 0.00 H new ATOM 0 HA LEU A 26 4.755 -1.809 11.006 1.00 0.00 H new ATOM 0 HB2 LEU A 26 6.865 -3.654 10.709 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.380 -2.245 9.802 1.00 0.00 H new ATOM 0 HG LEU A 26 6.564 -0.995 12.037 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.221 -2.318 14.010 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.843 -3.050 13.154 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.474 -3.738 12.968 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.916 -1.024 12.768 1.00 0.00 H new ATOM 0 HD22 LEU A 26 9.233 -2.395 11.679 1.00 0.00 H new ATOM 0 HD23 LEU A 26 8.775 -0.812 11.007 1.00 0.00 H new ATOM 435 N TYR A 27 4.717 -0.199 9.141 1.00 0.00 N ATOM 436 CA TYR A 27 4.623 0.759 8.046 1.00 0.00 C ATOM 437 C TYR A 27 5.757 1.777 8.114 1.00 0.00 C ATOM 438 O TYR A 27 5.822 2.590 9.037 1.00 0.00 O ATOM 439 CB TYR A 27 3.272 1.478 8.085 1.00 0.00 C ATOM 440 CG TYR A 27 2.631 1.635 6.725 1.00 0.00 C ATOM 441 CD1 TYR A 27 2.580 0.571 5.833 1.00 0.00 C ATOM 442 CD2 TYR A 27 2.075 2.846 6.332 1.00 0.00 C ATOM 443 CE1 TYR A 27 1.995 0.709 4.589 1.00 0.00 C ATOM 444 CE2 TYR A 27 1.488 2.994 5.089 1.00 0.00 C ATOM 445 CZ TYR A 27 1.451 1.922 4.222 1.00 0.00 C ATOM 446 OH TYR A 27 0.868 2.064 2.983 1.00 0.00 O ATOM 0 H TYR A 27 4.358 0.142 10.033 1.00 0.00 H new ATOM 0 HA TYR A 27 4.708 0.211 7.108 1.00 0.00 H new ATOM 0 HB2 TYR A 27 2.594 0.925 8.735 1.00 0.00 H new ATOM 0 HB3 TYR A 27 3.407 2.464 8.530 1.00 0.00 H new ATOM 0 HD1 TYR A 27 3.005 -0.380 6.117 1.00 0.00 H new ATOM 0 HD2 TYR A 27 2.102 3.687 7.009 1.00 0.00 H new ATOM 0 HE1 TYR A 27 1.964 -0.128 3.908 1.00 0.00 H new ATOM 0 HE2 TYR A 27 1.061 3.943 4.799 1.00 0.00 H new ATOM 0 HH TYR A 27 0.533 2.979 2.882 1.00 0.00 H new ATOM 456 N ILE A 28 6.648 1.728 7.130 1.00 0.00 N ATOM 457 CA ILE A 28 7.780 2.645 7.077 1.00 0.00 C ATOM 458 C ILE A 28 8.013 3.146 5.652 1.00 0.00 C ATOM 459 O ILE A 28 7.979 2.366 4.700 1.00 0.00 O ATOM 460 CB ILE A 28 9.069 1.975 7.590 1.00 0.00 C ATOM 461 CG1 ILE A 28 8.814 1.293 8.935 1.00 0.00 C ATOM 462 CG2 ILE A 28 10.187 3.001 7.713 1.00 0.00 C ATOM 463 CD1 ILE A 28 9.925 0.356 9.357 1.00 0.00 C ATOM 0 H ILE A 28 6.608 1.063 6.358 1.00 0.00 H new ATOM 0 HA ILE A 28 7.536 3.489 7.722 1.00 0.00 H new ATOM 0 HB ILE A 28 9.377 1.216 6.871 1.00 0.00 H new ATOM 0 HG12 ILE A 28 8.683 2.057 9.702 1.00 0.00 H new ATOM 0 HG13 ILE A 28 7.880 0.734 8.879 1.00 0.00 H new ATOM 0 HG21 ILE A 28 11.091 2.512 8.077 1.00 0.00 H new ATOM 0 HG22 ILE A 28 10.382 3.445 6.737 1.00 0.00 H new ATOM 0 HG23 ILE A 28 9.889 3.781 8.414 1.00 0.00 H new ATOM 0 HD11 ILE A 28 9.677 -0.092 10.319 1.00 0.00 H new ATOM 0 HD12 ILE A 28 10.042 -0.429 8.610 1.00 0.00 H new ATOM 0 HD13 ILE A 28 10.857 0.914 9.446 1.00 0.00 H new ATOM 475 N PRO A 29 8.254 4.459 5.484 1.00 0.00 N ATOM 476 CA PRO A 29 8.491 5.052 4.163 1.00 0.00 C ATOM 477 C PRO A 29 9.848 4.662 3.588 1.00 0.00 C ATOM 478 O PRO A 29 10.614 3.931 4.217 1.00 0.00 O ATOM 479 CB PRO A 29 8.439 6.557 4.437 1.00 0.00 C ATOM 480 CG PRO A 29 8.832 6.695 5.866 1.00 0.00 C ATOM 481 CD PRO A 29 8.314 5.466 6.561 1.00 0.00 C ATOM 0 HA PRO A 29 7.762 4.713 3.427 1.00 0.00 H new ATOM 0 HB2 PRO A 29 9.121 7.102 3.784 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.441 6.957 4.260 1.00 0.00 H new ATOM 0 HG2 PRO A 29 9.915 6.773 5.967 1.00 0.00 H new ATOM 0 HG3 PRO A 29 8.406 7.598 6.302 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.977 5.152 7.367 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.333 5.639 7.004 1.00 0.00 H new ATOM 489 N ALA A 30 10.140 5.154 2.388 1.00 0.00 N ATOM 490 CA ALA A 30 11.404 4.855 1.728 1.00 0.00 C ATOM 491 C ALA A 30 12.558 5.607 2.384 1.00 0.00 C ATOM 492 O ALA A 30 12.393 6.738 2.843 1.00 0.00 O ATOM 493 CB ALA A 30 11.321 5.201 0.248 1.00 0.00 C ATOM 0 H ALA A 30 9.518 5.761 1.854 1.00 0.00 H new ATOM 0 HA ALA A 30 11.595 3.787 1.831 1.00 0.00 H new ATOM 0 HB1 ALA A 30 12.272 4.973 -0.233 1.00 0.00 H new ATOM 0 HB2 ALA A 30 10.529 4.616 -0.219 1.00 0.00 H new ATOM 0 HB3 ALA A 30 11.103 6.263 0.134 1.00 0.00 H new ATOM 499 N ILE A 31 13.724 4.972 2.427 1.00 0.00 N ATOM 500 CA ILE A 31 14.903 5.580 3.028 1.00 0.00 C ATOM 501 C ILE A 31 16.171 5.183 2.278 1.00 0.00 C ATOM 502 O ILE A 31 16.276 4.070 1.763 1.00 0.00 O ATOM 503 CB ILE A 31 15.051 5.177 4.508 1.00 0.00 C ATOM 504 CG1 ILE A 31 14.931 3.660 4.661 1.00 0.00 C ATOM 505 CG2 ILE A 31 14.005 5.885 5.356 1.00 0.00 C ATOM 506 CD1 ILE A 31 15.719 3.106 5.827 1.00 0.00 C ATOM 0 H ILE A 31 13.877 4.036 2.052 1.00 0.00 H new ATOM 0 HA ILE A 31 14.768 6.660 2.963 1.00 0.00 H new ATOM 0 HB ILE A 31 16.039 5.481 4.855 1.00 0.00 H new ATOM 0 HG12 ILE A 31 13.880 3.398 4.786 1.00 0.00 H new ATOM 0 HG13 ILE A 31 15.272 3.182 3.743 1.00 0.00 H new ATOM 0 HG21 ILE A 31 14.122 5.590 6.399 1.00 0.00 H new ATOM 0 HG22 ILE A 31 14.134 6.964 5.267 1.00 0.00 H new ATOM 0 HG23 ILE A 31 13.009 5.609 5.011 1.00 0.00 H new ATOM 0 HD11 ILE A 31 15.587 2.025 5.874 1.00 0.00 H new ATOM 0 HD12 ILE A 31 16.776 3.337 5.695 1.00 0.00 H new ATOM 0 HD13 ILE A 31 15.363 3.556 6.754 1.00 0.00 H new ATOM 518 N THR A 32 17.130 6.101 2.220 1.00 0.00 N ATOM 519 CA THR A 32 18.391 5.846 1.532 1.00 0.00 C ATOM 520 C THR A 32 19.534 6.616 2.187 1.00 0.00 C ATOM 521 O THR A 32 20.489 7.014 1.520 1.00 0.00 O ATOM 522 CB THR A 32 18.279 6.235 0.057 1.00 0.00 C ATOM 523 OG1 THR A 32 17.738 7.537 -0.079 1.00 0.00 O ATOM 524 CG2 THR A 32 17.411 5.291 -0.747 1.00 0.00 C ATOM 0 H THR A 32 17.059 7.027 2.641 1.00 0.00 H new ATOM 0 HA THR A 32 18.606 4.780 1.605 1.00 0.00 H new ATOM 0 HB THR A 32 19.296 6.188 -0.332 1.00 0.00 H new ATOM 0 HG1 THR A 32 17.676 7.768 -1.029 1.00 0.00 H new ATOM 0 HG21 THR A 32 17.374 5.625 -1.784 1.00 0.00 H new ATOM 0 HG22 THR A 32 17.830 4.286 -0.704 1.00 0.00 H new ATOM 0 HG23 THR A 32 16.403 5.282 -0.333 1.00 0.00 H new ATOM 532 N TRP A 33 19.430 6.820 3.496 1.00 0.00 N ATOM 533 CA TRP A 33 20.456 7.541 4.241 1.00 0.00 C ATOM 534 C TRP A 33 21.241 6.594 5.142 1.00 0.00 C ATOM 535 O TRP A 33 22.462 6.701 5.259 1.00 0.00 O ATOM 536 CB TRP A 33 19.823 8.653 5.079 1.00 0.00 C ATOM 537 CG TRP A 33 19.508 9.887 4.291 1.00 0.00 C ATOM 538 CD1 TRP A 33 18.420 10.096 3.494 1.00 0.00 C ATOM 539 CD2 TRP A 33 20.292 11.083 4.222 1.00 0.00 C ATOM 540 NE1 TRP A 33 18.478 11.349 2.934 1.00 0.00 N ATOM 541 CE2 TRP A 33 19.618 11.975 3.366 1.00 0.00 C ATOM 542 CE3 TRP A 33 21.498 11.489 4.802 1.00 0.00 C ATOM 543 CZ2 TRP A 33 20.110 13.246 3.076 1.00 0.00 C ATOM 544 CZ3 TRP A 33 21.985 12.750 4.514 1.00 0.00 C ATOM 545 CH2 TRP A 33 21.292 13.615 3.658 1.00 0.00 C ATOM 0 H TRP A 33 18.646 6.496 4.063 1.00 0.00 H new ATOM 0 HA TRP A 33 21.145 7.985 3.523 1.00 0.00 H new ATOM 0 HB2 TRP A 33 18.906 8.278 5.534 1.00 0.00 H new ATOM 0 HB3 TRP A 33 20.499 8.914 5.893 1.00 0.00 H new ATOM 0 HD1 TRP A 33 17.628 9.380 3.328 1.00 0.00 H new ATOM 0 HE1 TRP A 33 17.786 11.748 2.300 1.00 0.00 H new ATOM 0 HE3 TRP A 33 22.039 10.829 5.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 19.578 13.915 2.416 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 22.916 13.074 4.956 1.00 0.00 H new ATOM 0 HH2 TRP A 33 21.699 14.594 3.453 1.00 0.00 H new ATOM 556 N HIS A 34 20.533 5.665 5.776 1.00 0.00 N ATOM 557 CA HIS A 34 21.163 4.698 6.666 1.00 0.00 C ATOM 558 C HIS A 34 20.463 3.344 6.581 1.00 0.00 C ATOM 559 O HIS A 34 20.401 2.605 7.563 1.00 0.00 O ATOM 560 CB HIS A 34 21.138 5.208 8.108 1.00 0.00 C ATOM 561 CG HIS A 34 22.332 6.036 8.469 1.00 0.00 C ATOM 562 ND1 HIS A 34 23.624 5.558 8.420 1.00 0.00 N ATOM 563 CD2 HIS A 34 22.424 7.322 8.888 1.00 0.00 C ATOM 564 CE1 HIS A 34 24.459 6.511 8.792 1.00 0.00 C ATOM 565 NE2 HIS A 34 23.757 7.592 9.081 1.00 0.00 N ATOM 0 H HIS A 34 19.522 5.562 5.689 1.00 0.00 H new ATOM 0 HA HIS A 34 22.199 4.572 6.351 1.00 0.00 H new ATOM 0 HB2 HIS A 34 20.236 5.800 8.260 1.00 0.00 H new ATOM 0 HB3 HIS A 34 21.078 4.356 8.785 1.00 0.00 H new ATOM 0 HD2 HIS A 34 21.603 8.006 9.041 1.00 0.00 H new ATOM 0 HE1 HIS A 34 25.534 6.422 8.850 1.00 0.00 H new ATOM 0 HE2 HIS A 34 24.142 8.482 9.396 1.00 0.00 H new ATOM 574 N ALA A 35 19.939 3.028 5.401 1.00 0.00 N ATOM 575 CA ALA A 35 19.244 1.765 5.189 1.00 0.00 C ATOM 576 C ALA A 35 20.219 0.593 5.200 1.00 0.00 C ATOM 577 O ALA A 35 20.718 0.178 4.155 1.00 0.00 O ATOM 578 CB ALA A 35 18.474 1.801 3.877 1.00 0.00 C ATOM 0 H ALA A 35 19.983 3.629 4.578 1.00 0.00 H new ATOM 0 HA ALA A 35 18.539 1.624 6.008 1.00 0.00 H new ATOM 0 HB1 ALA A 35 17.959 0.851 3.731 1.00 0.00 H new ATOM 0 HB2 ALA A 35 17.743 2.609 3.906 1.00 0.00 H new ATOM 0 HB3 ALA A 35 19.167 1.969 3.053 1.00 0.00 H new ATOM 584 N ARG A 36 20.487 0.064 6.390 1.00 0.00 N ATOM 585 CA ARG A 36 21.404 -1.060 6.537 1.00 0.00 C ATOM 586 C ARG A 36 22.799 -0.695 6.040 1.00 0.00 C ATOM 587 O ARG A 36 23.189 -1.061 4.931 1.00 0.00 O ATOM 588 CB ARG A 36 20.880 -2.276 5.774 1.00 0.00 C ATOM 589 CG ARG A 36 19.959 -3.162 6.598 1.00 0.00 C ATOM 590 CD ARG A 36 19.032 -3.979 5.712 1.00 0.00 C ATOM 591 NE ARG A 36 17.705 -4.132 6.305 1.00 0.00 N ATOM 592 CZ ARG A 36 16.666 -4.666 5.667 1.00 0.00 C ATOM 593 NH1 ARG A 36 16.795 -5.100 4.419 1.00 0.00 N ATOM 594 NH2 ARG A 36 15.494 -4.770 6.279 1.00 0.00 N ATOM 0 H ARG A 36 20.082 0.396 7.266 1.00 0.00 H new ATOM 0 HA ARG A 36 21.469 -1.306 7.597 1.00 0.00 H new ATOM 0 HB2 ARG A 36 20.345 -1.935 4.888 1.00 0.00 H new ATOM 0 HB3 ARG A 36 21.726 -2.869 5.427 1.00 0.00 H new ATOM 0 HG2 ARG A 36 20.555 -3.832 7.218 1.00 0.00 H new ATOM 0 HG3 ARG A 36 19.367 -2.545 7.274 1.00 0.00 H new ATOM 0 HD2 ARG A 36 18.941 -3.496 4.739 1.00 0.00 H new ATOM 0 HD3 ARG A 36 19.468 -4.963 5.540 1.00 0.00 H new ATOM 0 HE ARG A 36 17.567 -3.811 7.263 1.00 0.00 H new ATOM 0 HH11 ARG A 36 17.694 -5.025 3.943 1.00 0.00 H new ATOM 0 HH12 ARG A 36 15.995 -5.508 3.936 1.00 0.00 H new ATOM 0 HH21 ARG A 36 15.389 -4.441 7.239 1.00 0.00 H new ATOM 0 HH22 ARG A 36 14.698 -5.179 5.790 1.00 0.00 H new ATOM 608 N PHE A 37 23.545 0.031 6.866 1.00 0.00 N ATOM 609 CA PHE A 37 24.897 0.446 6.508 1.00 0.00 C ATOM 610 C PHE A 37 25.755 0.636 7.756 1.00 0.00 C ATOM 611 O PHE A 37 25.806 1.726 8.325 1.00 0.00 O ATOM 612 CB PHE A 37 24.857 1.745 5.700 1.00 0.00 C ATOM 613 CG PHE A 37 24.434 1.551 4.272 1.00 0.00 C ATOM 614 CD1 PHE A 37 25.136 0.696 3.438 1.00 0.00 C ATOM 615 CD2 PHE A 37 23.333 2.222 3.765 1.00 0.00 C ATOM 616 CE1 PHE A 37 24.749 0.515 2.124 1.00 0.00 C ATOM 617 CE2 PHE A 37 22.942 2.045 2.451 1.00 0.00 C ATOM 618 CZ PHE A 37 23.651 1.191 1.629 1.00 0.00 C ATOM 0 H PHE A 37 23.237 0.344 7.787 1.00 0.00 H new ATOM 0 HA PHE A 37 25.343 -0.340 5.898 1.00 0.00 H new ATOM 0 HB2 PHE A 37 24.171 2.442 6.182 1.00 0.00 H new ATOM 0 HB3 PHE A 37 25.845 2.205 5.718 1.00 0.00 H new ATOM 0 HD1 PHE A 37 25.996 0.165 3.819 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.774 2.890 4.403 1.00 0.00 H new ATOM 0 HE1 PHE A 37 25.305 -0.155 1.484 1.00 0.00 H new ATOM 0 HE2 PHE A 37 22.082 2.574 2.067 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.348 1.052 0.602 1.00 0.00 H new ATOM 628 N ALA A 38 26.427 -0.431 8.173 1.00 0.00 N ATOM 629 CA ALA A 38 27.283 -0.382 9.352 1.00 0.00 C ATOM 630 C ALA A 38 28.569 0.387 9.064 1.00 0.00 C ATOM 631 O ALA A 38 29.058 0.397 7.934 1.00 0.00 O ATOM 632 CB ALA A 38 27.605 -1.789 9.831 1.00 0.00 C ATOM 0 H ALA A 38 26.395 -1.340 7.712 1.00 0.00 H new ATOM 0 HA ALA A 38 26.743 0.143 10.140 1.00 0.00 H new ATOM 0 HB1 ALA A 38 28.245 -1.736 10.712 1.00 0.00 H new ATOM 0 HB2 ALA A 38 26.680 -2.307 10.085 1.00 0.00 H new ATOM 0 HB3 ALA A 38 28.121 -2.333 9.040 1.00 0.00 H new ATOM 638 N TYR A 39 29.111 1.031 10.093 1.00 0.00 N ATOM 639 CA TYR A 39 30.340 1.802 9.949 1.00 0.00 C ATOM 640 C TYR A 39 31.343 1.435 11.036 1.00 0.00 C ATOM 641 O TYR A 39 31.038 1.504 12.226 1.00 0.00 O ATOM 642 CB TYR A 39 30.035 3.301 10.005 1.00 0.00 C ATOM 643 CG TYR A 39 31.065 4.155 9.301 1.00 0.00 C ATOM 644 CD1 TYR A 39 31.136 4.191 7.914 1.00 0.00 C ATOM 645 CD2 TYR A 39 31.965 4.928 10.024 1.00 0.00 C ATOM 646 CE1 TYR A 39 32.075 4.971 7.267 1.00 0.00 C ATOM 647 CE2 TYR A 39 32.908 5.711 9.384 1.00 0.00 C ATOM 648 CZ TYR A 39 32.959 5.729 8.007 1.00 0.00 C ATOM 649 OH TYR A 39 33.895 6.506 7.367 1.00 0.00 O ATOM 0 H TYR A 39 28.719 1.034 11.035 1.00 0.00 H new ATOM 0 HA TYR A 39 30.778 1.563 8.980 1.00 0.00 H new ATOM 0 HB2 TYR A 39 29.058 3.481 9.557 1.00 0.00 H new ATOM 0 HB3 TYR A 39 29.969 3.611 11.048 1.00 0.00 H new ATOM 0 HD1 TYR A 39 30.445 3.599 7.332 1.00 0.00 H new ATOM 0 HD2 TYR A 39 31.927 4.917 11.103 1.00 0.00 H new ATOM 0 HE1 TYR A 39 32.117 4.987 6.188 1.00 0.00 H new ATOM 0 HE2 TYR A 39 33.601 6.306 9.960 1.00 0.00 H new ATOM 0 HH TYR A 39 34.439 6.978 8.032 1.00 0.00 H new ATOM 659 N ASP A 40 32.544 1.045 10.620 1.00 0.00 N ATOM 660 CA ASP A 40 33.594 0.668 11.559 1.00 0.00 C ATOM 661 C ASP A 40 33.937 1.829 12.486 1.00 0.00 C ATOM 662 O ASP A 40 34.281 2.919 12.029 1.00 0.00 O ATOM 663 CB ASP A 40 34.845 0.215 10.804 1.00 0.00 C ATOM 664 CG ASP A 40 34.844 -1.275 10.525 1.00 0.00 C ATOM 665 OD1 ASP A 40 35.656 -1.995 11.144 1.00 0.00 O ATOM 666 OD2 ASP A 40 34.032 -1.722 9.688 1.00 0.00 O ATOM 0 H ASP A 40 32.814 0.982 9.638 1.00 0.00 H new ATOM 0 HA ASP A 40 33.225 -0.160 12.165 1.00 0.00 H new ATOM 0 HB2 ASP A 40 34.914 0.758 9.862 1.00 0.00 H new ATOM 0 HB3 ASP A 40 35.730 0.472 11.386 1.00 0.00 H new ATOM 672 N LYS A 41 33.840 1.588 13.790 1.00 0.00 N ATOM 673 CA LYS A 41 34.139 2.612 14.785 1.00 0.00 C ATOM 674 C LYS A 41 33.177 3.789 14.662 1.00 0.00 C ATOM 675 O LYS A 41 32.934 4.295 13.567 1.00 0.00 O ATOM 676 CB LYS A 41 35.583 3.098 14.636 1.00 0.00 C ATOM 677 CG LYS A 41 36.594 2.231 15.368 1.00 0.00 C ATOM 678 CD LYS A 41 36.779 0.888 14.680 1.00 0.00 C ATOM 679 CE LYS A 41 38.225 0.422 14.746 1.00 0.00 C ATOM 680 NZ LYS A 41 38.435 -0.586 15.821 1.00 0.00 N ATOM 0 H LYS A 41 33.556 0.690 14.183 1.00 0.00 H new ATOM 0 HA LYS A 41 34.016 2.167 15.772 1.00 0.00 H new ATOM 0 HB2 LYS A 41 35.841 3.127 13.577 1.00 0.00 H new ATOM 0 HB3 LYS A 41 35.654 4.119 15.010 1.00 0.00 H new ATOM 0 HG2 LYS A 41 37.551 2.750 15.418 1.00 0.00 H new ATOM 0 HG3 LYS A 41 36.263 2.073 16.394 1.00 0.00 H new ATOM 0 HD2 LYS A 41 36.135 0.145 15.150 1.00 0.00 H new ATOM 0 HD3 LYS A 41 36.468 0.966 13.638 1.00 0.00 H new ATOM 0 HE2 LYS A 41 38.513 -0.006 13.786 1.00 0.00 H new ATOM 0 HE3 LYS A 41 38.875 1.279 14.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 39.433 -0.878 15.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 38.185 -0.170 16.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 37.834 -1.415 15.641 1.00 0.00 H new ATOM 694 N GLU A 42 32.632 4.223 15.795 1.00 0.00 N ATOM 695 CA GLU A 42 31.696 5.341 15.814 1.00 0.00 C ATOM 696 C GLU A 42 30.469 5.037 14.960 1.00 0.00 C ATOM 697 O GLU A 42 30.357 5.507 13.827 1.00 0.00 O ATOM 698 CB GLU A 42 32.379 6.614 15.313 1.00 0.00 C ATOM 699 CG GLU A 42 33.476 7.120 16.236 1.00 0.00 C ATOM 700 CD GLU A 42 34.858 6.999 15.623 1.00 0.00 C ATOM 701 OE1 GLU A 42 35.139 7.722 14.644 1.00 0.00 O ATOM 702 OE2 GLU A 42 35.659 6.181 16.122 1.00 0.00 O ATOM 0 H GLU A 42 32.823 3.817 16.711 1.00 0.00 H new ATOM 0 HA GLU A 42 31.371 5.494 16.843 1.00 0.00 H new ATOM 0 HB2 GLU A 42 32.804 6.424 14.327 1.00 0.00 H new ATOM 0 HB3 GLU A 42 31.629 7.395 15.192 1.00 0.00 H new ATOM 0 HG2 GLU A 42 33.283 8.164 16.485 1.00 0.00 H new ATOM 0 HG3 GLU A 42 33.447 6.559 17.170 1.00 0.00 H new ATOM 710 N LYS A 43 29.552 4.248 15.510 1.00 0.00 N ATOM 711 CA LYS A 43 28.333 3.880 14.800 1.00 0.00 C ATOM 712 C LYS A 43 27.117 4.582 15.398 1.00 0.00 C ATOM 713 O LYS A 43 26.123 4.818 14.710 1.00 0.00 O ATOM 714 CB LYS A 43 28.134 2.363 14.840 1.00 0.00 C ATOM 715 CG LYS A 43 27.642 1.780 13.525 1.00 0.00 C ATOM 716 CD LYS A 43 26.735 0.581 13.752 1.00 0.00 C ATOM 717 CE LYS A 43 25.268 0.964 13.646 1.00 0.00 C ATOM 718 NZ LYS A 43 24.423 0.198 14.603 1.00 0.00 N ATOM 0 H LYS A 43 29.630 3.851 16.446 1.00 0.00 H new ATOM 0 HA LYS A 43 28.437 4.199 13.763 1.00 0.00 H new ATOM 0 HB2 LYS A 43 29.078 1.888 15.108 1.00 0.00 H new ATOM 0 HB3 LYS A 43 27.419 2.119 15.626 1.00 0.00 H new ATOM 0 HG2 LYS A 43 27.103 2.545 12.966 1.00 0.00 H new ATOM 0 HG3 LYS A 43 28.495 1.482 12.916 1.00 0.00 H new ATOM 0 HD2 LYS A 43 26.964 -0.193 13.020 1.00 0.00 H new ATOM 0 HD3 LYS A 43 26.931 0.156 14.737 1.00 0.00 H new ATOM 0 HE2 LYS A 43 25.157 2.031 13.838 1.00 0.00 H new ATOM 0 HE3 LYS A 43 24.919 0.785 12.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 23.430 0.489 14.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 24.509 -0.819 14.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 24.739 0.389 15.575 1.00 0.00 H new ATOM 732 N THR A 44 27.201 4.911 16.684 1.00 0.00 N ATOM 733 CA THR A 44 26.106 5.586 17.375 1.00 0.00 C ATOM 734 C THR A 44 25.713 6.874 16.658 1.00 0.00 C ATOM 735 O THR A 44 24.566 7.314 16.736 1.00 0.00 O ATOM 736 CB THR A 44 26.502 5.895 18.820 1.00 0.00 C ATOM 737 OG1 THR A 44 27.520 6.879 18.862 1.00 0.00 O ATOM 738 CG2 THR A 44 27.005 4.682 19.575 1.00 0.00 C ATOM 0 H THR A 44 28.015 4.721 17.268 1.00 0.00 H new ATOM 0 HA THR A 44 25.245 4.917 17.373 1.00 0.00 H new ATOM 0 HB THR A 44 25.590 6.250 19.300 1.00 0.00 H new ATOM 0 HG1 THR A 44 27.758 7.064 19.795 1.00 0.00 H new ATOM 0 HG21 THR A 44 27.269 4.970 20.593 1.00 0.00 H new ATOM 0 HG22 THR A 44 26.224 3.922 19.604 1.00 0.00 H new ATOM 0 HG23 THR A 44 27.885 4.280 19.072 1.00 0.00 H new ATOM 746 N ASP A 45 26.672 7.476 15.960 1.00 0.00 N ATOM 747 CA ASP A 45 26.422 8.714 15.230 1.00 0.00 C ATOM 748 C ASP A 45 26.022 9.835 16.183 1.00 0.00 C ATOM 749 O ASP A 45 26.103 9.687 17.402 1.00 0.00 O ATOM 750 CB ASP A 45 25.329 8.502 14.181 1.00 0.00 C ATOM 751 CG ASP A 45 25.618 9.242 12.888 1.00 0.00 C ATOM 752 OD1 ASP A 45 25.213 8.744 11.817 1.00 0.00 O ATOM 753 OD2 ASP A 45 26.248 10.318 12.949 1.00 0.00 O ATOM 0 H ASP A 45 27.627 7.127 15.885 1.00 0.00 H new ATOM 0 HA ASP A 45 27.345 9.003 14.726 1.00 0.00 H new ATOM 0 HB2 ASP A 45 25.231 7.437 13.973 1.00 0.00 H new ATOM 0 HB3 ASP A 45 24.373 8.838 14.583 1.00 0.00 H new ATOM 759 N ARG A 46 25.587 10.958 15.619 1.00 0.00 N ATOM 760 CA ARG A 46 25.173 12.105 16.419 1.00 0.00 C ATOM 761 C ARG A 46 23.662 12.303 16.348 1.00 0.00 C ATOM 762 O ARG A 46 22.958 12.151 17.347 1.00 0.00 O ATOM 763 CB ARG A 46 25.887 13.371 15.942 1.00 0.00 C ATOM 764 CG ARG A 46 25.925 14.477 16.984 1.00 0.00 C ATOM 765 CD ARG A 46 26.989 14.214 18.038 1.00 0.00 C ATOM 766 NE ARG A 46 27.131 15.335 18.963 1.00 0.00 N ATOM 767 CZ ARG A 46 27.935 15.323 20.024 1.00 0.00 C ATOM 768 NH1 ARG A 46 28.671 14.252 20.295 1.00 0.00 N ATOM 769 NH2 ARG A 46 28.006 16.385 20.815 1.00 0.00 N ATOM 0 H ARG A 46 25.512 11.098 14.611 1.00 0.00 H new ATOM 0 HA ARG A 46 25.447 11.910 17.456 1.00 0.00 H new ATOM 0 HB2 ARG A 46 26.908 13.117 15.657 1.00 0.00 H new ATOM 0 HB3 ARG A 46 25.389 13.744 15.047 1.00 0.00 H new ATOM 0 HG2 ARG A 46 26.123 15.431 16.496 1.00 0.00 H new ATOM 0 HG3 ARG A 46 24.950 14.560 17.463 1.00 0.00 H new ATOM 0 HD2 ARG A 46 26.732 13.314 18.596 1.00 0.00 H new ATOM 0 HD3 ARG A 46 27.945 14.024 17.549 1.00 0.00 H new ATOM 0 HE ARG A 46 26.582 16.176 18.786 1.00 0.00 H new ATOM 0 HH11 ARG A 46 28.622 13.433 19.689 1.00 0.00 H new ATOM 0 HH12 ARG A 46 29.285 14.248 21.109 1.00 0.00 H new ATOM 0 HH21 ARG A 46 27.444 17.212 20.611 1.00 0.00 H new ATOM 0 HH22 ARG A 46 28.622 16.375 21.628 1.00 0.00 H new ATOM 783 N TYR A 47 23.170 12.644 15.162 1.00 0.00 N ATOM 784 CA TYR A 47 21.742 12.864 14.962 1.00 0.00 C ATOM 785 C TYR A 47 21.111 11.703 14.199 1.00 0.00 C ATOM 786 O TYR A 47 21.810 10.908 13.570 1.00 0.00 O ATOM 787 CB TYR A 47 21.507 14.173 14.205 1.00 0.00 C ATOM 788 CG TYR A 47 21.386 15.381 15.107 1.00 0.00 C ATOM 789 CD1 TYR A 47 20.197 15.662 15.767 1.00 0.00 C ATOM 790 CD2 TYR A 47 22.461 16.241 15.297 1.00 0.00 C ATOM 791 CE1 TYR A 47 20.082 16.765 16.592 1.00 0.00 C ATOM 792 CE2 TYR A 47 22.354 17.345 16.121 1.00 0.00 C ATOM 793 CZ TYR A 47 21.163 17.604 16.765 1.00 0.00 C ATOM 794 OH TYR A 47 21.052 18.703 17.585 1.00 0.00 O ATOM 0 H TYR A 47 23.738 12.774 14.325 1.00 0.00 H new ATOM 0 HA TYR A 47 21.271 12.928 15.943 1.00 0.00 H new ATOM 0 HB2 TYR A 47 22.329 14.332 13.507 1.00 0.00 H new ATOM 0 HB3 TYR A 47 20.598 14.081 13.611 1.00 0.00 H new ATOM 0 HD1 TYR A 47 19.348 15.008 15.633 1.00 0.00 H new ATOM 0 HD2 TYR A 47 23.395 16.043 14.792 1.00 0.00 H new ATOM 0 HE1 TYR A 47 19.150 16.969 17.099 1.00 0.00 H new ATOM 0 HE2 TYR A 47 23.200 18.002 16.260 1.00 0.00 H new ATOM 0 HH TYR A 47 21.903 19.188 17.599 1.00 0.00 H new ATOM 804 N ASN A 48 19.786 11.612 14.261 1.00 0.00 N ATOM 805 CA ASN A 48 19.060 10.549 13.577 1.00 0.00 C ATOM 806 C ASN A 48 18.271 11.104 12.395 1.00 0.00 C ATOM 807 O ASN A 48 18.088 12.316 12.271 1.00 0.00 O ATOM 808 CB ASN A 48 18.114 9.842 14.550 1.00 0.00 C ATOM 809 CG ASN A 48 17.146 10.801 15.215 1.00 0.00 C ATOM 810 OD1 ASN A 48 16.104 11.189 14.489 1.00 0.00 O flip ATOM 811 ND2 ASN A 48 17.332 11.188 16.369 1.00 0.00 N flip ATOM 0 H ASN A 48 19.194 12.262 14.778 1.00 0.00 H new ATOM 0 HA ASN A 48 19.787 9.829 13.200 1.00 0.00 H new ATOM 0 HB2 ASN A 48 17.552 9.076 14.015 1.00 0.00 H new ATOM 0 HB3 ASN A 48 18.699 9.332 15.315 1.00 0.00 H new ATOM 0 HD21 ASN A 48 18.147 10.864 16.890 1.00 0.00 H new ATOM 0 HD22 ASN A 48 16.671 11.832 16.804 1.00 0.00 H new ATOM 818 N GLU A 49 17.804 10.210 11.529 1.00 0.00 N ATOM 819 CA GLU A 49 17.034 10.613 10.357 1.00 0.00 C ATOM 820 C GLU A 49 15.542 10.396 10.586 1.00 0.00 C ATOM 821 O GLU A 49 15.138 9.475 11.295 1.00 0.00 O ATOM 822 CB GLU A 49 17.491 9.826 9.127 1.00 0.00 C ATOM 823 CG GLU A 49 17.259 10.560 7.816 1.00 0.00 C ATOM 824 CD GLU A 49 18.227 11.709 7.612 1.00 0.00 C ATOM 825 OE1 GLU A 49 18.469 12.081 6.444 1.00 0.00 O ATOM 826 OE2 GLU A 49 18.743 12.237 8.619 1.00 0.00 O ATOM 0 H GLU A 49 17.945 9.204 11.616 1.00 0.00 H new ATOM 0 HA GLU A 49 17.207 11.676 10.187 1.00 0.00 H new ATOM 0 HB2 GLU A 49 18.553 9.600 9.224 1.00 0.00 H new ATOM 0 HB3 GLU A 49 16.963 8.873 9.099 1.00 0.00 H new ATOM 0 HG2 GLU A 49 17.355 9.857 6.988 1.00 0.00 H new ATOM 0 HG3 GLU A 49 16.238 10.941 7.793 1.00 0.00 H new ATOM 834 N ARG A 50 14.725 11.255 9.982 1.00 0.00 N ATOM 835 CA ARG A 50 13.277 11.157 10.120 1.00 0.00 C ATOM 836 C ARG A 50 12.585 11.415 8.782 1.00 0.00 C ATOM 837 O ARG A 50 12.152 12.532 8.503 1.00 0.00 O ATOM 838 CB ARG A 50 12.778 12.152 11.172 1.00 0.00 C ATOM 839 CG ARG A 50 12.098 11.489 12.361 1.00 0.00 C ATOM 840 CD ARG A 50 12.697 11.952 13.679 1.00 0.00 C ATOM 841 NE ARG A 50 12.784 13.409 13.761 1.00 0.00 N ATOM 842 CZ ARG A 50 12.976 14.078 14.895 1.00 0.00 C ATOM 843 NH1 ARG A 50 13.098 13.427 16.045 1.00 0.00 N ATOM 844 NH2 ARG A 50 13.045 15.402 14.879 1.00 0.00 N ATOM 0 H ARG A 50 15.042 12.025 9.393 1.00 0.00 H new ATOM 0 HA ARG A 50 13.032 10.145 10.444 1.00 0.00 H new ATOM 0 HB2 ARG A 50 13.621 12.744 11.529 1.00 0.00 H new ATOM 0 HB3 ARG A 50 12.078 12.844 10.703 1.00 0.00 H new ATOM 0 HG2 ARG A 50 11.032 11.717 12.345 1.00 0.00 H new ATOM 0 HG3 ARG A 50 12.193 10.406 12.278 1.00 0.00 H new ATOM 0 HD2 ARG A 50 12.090 11.578 14.504 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.692 11.523 13.795 1.00 0.00 H new ATOM 0 HE ARG A 50 12.692 13.944 12.898 1.00 0.00 H new ATOM 0 HH11 ARG A 50 13.045 12.409 16.063 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.245 13.945 16.911 1.00 0.00 H new ATOM 0 HH21 ARG A 50 12.951 15.907 13.998 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.192 15.916 15.748 1.00 0.00 H new ATOM 858 N PRO A 51 12.473 10.377 7.934 1.00 0.00 N ATOM 859 CA PRO A 51 11.831 10.496 6.620 1.00 0.00 C ATOM 860 C PRO A 51 10.409 11.037 6.720 1.00 0.00 C ATOM 861 O PRO A 51 10.107 12.116 6.210 1.00 0.00 O ATOM 862 CB PRO A 51 11.822 9.060 6.090 1.00 0.00 C ATOM 863 CG PRO A 51 12.916 8.370 6.830 1.00 0.00 C ATOM 864 CD PRO A 51 12.963 9.011 8.188 1.00 0.00 C ATOM 0 HA PRO A 51 12.359 11.196 5.972 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.860 8.579 6.269 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.996 9.035 5.014 1.00 0.00 H new ATOM 0 HG2 PRO A 51 12.720 7.301 6.909 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.869 8.482 6.312 1.00 0.00 H new ATOM 0 HD2 PRO A 51 12.332 8.484 8.904 1.00 0.00 H new ATOM 0 HD3 PRO A 51 13.974 9.015 8.596 1.00 0.00 H new ATOM 872 N TRP A 52 9.538 10.279 7.380 1.00 0.00 N ATOM 873 CA TRP A 52 8.146 10.683 7.546 1.00 0.00 C ATOM 874 C TRP A 52 7.515 9.975 8.741 1.00 0.00 C ATOM 875 O TRP A 52 6.313 9.711 8.756 1.00 0.00 O ATOM 876 CB TRP A 52 7.347 10.374 6.278 1.00 0.00 C ATOM 877 CG TRP A 52 7.798 11.160 5.085 1.00 0.00 C ATOM 878 CD1 TRP A 52 7.319 12.369 4.672 1.00 0.00 C ATOM 879 CD2 TRP A 52 8.817 10.789 4.149 1.00 0.00 C ATOM 880 NE1 TRP A 52 7.980 12.774 3.536 1.00 0.00 N ATOM 881 CE2 TRP A 52 8.904 11.822 3.196 1.00 0.00 C ATOM 882 CE3 TRP A 52 9.666 9.686 4.027 1.00 0.00 C ATOM 883 CZ2 TRP A 52 9.804 11.781 2.134 1.00 0.00 C ATOM 884 CZ3 TRP A 52 10.559 9.647 2.972 1.00 0.00 C ATOM 885 CH2 TRP A 52 10.623 10.689 2.039 1.00 0.00 C ATOM 0 H TRP A 52 9.771 9.383 7.808 1.00 0.00 H new ATOM 0 HA TRP A 52 8.125 11.758 7.727 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.430 9.310 6.055 1.00 0.00 H new ATOM 0 HB3 TRP A 52 6.293 10.580 6.462 1.00 0.00 H new ATOM 0 HD1 TRP A 52 6.536 12.926 5.165 1.00 0.00 H new ATOM 0 HE1 TRP A 52 7.810 13.643 3.029 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.626 8.879 4.743 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 9.854 12.582 1.411 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 11.218 8.798 2.866 1.00 0.00 H new ATOM 0 HH2 TRP A 52 11.333 10.630 1.228 1.00 0.00 H new ATOM 896 N GLY A 53 8.334 9.670 9.743 1.00 0.00 N ATOM 897 CA GLY A 53 7.837 8.996 10.928 1.00 0.00 C ATOM 898 C GLY A 53 7.633 7.510 10.708 1.00 0.00 C ATOM 899 O GLY A 53 8.516 6.824 10.192 1.00 0.00 O ATOM 0 H GLY A 53 9.333 9.878 9.755 1.00 0.00 H new ATOM 0 HA2 GLY A 53 8.539 9.146 11.748 1.00 0.00 H new ATOM 0 HA3 GLY A 53 6.892 9.448 11.230 1.00 0.00 H new ATOM 903 N GLY A 54 6.464 7.012 11.097 1.00 0.00 N ATOM 904 CA GLY A 54 6.166 5.602 10.931 1.00 0.00 C ATOM 905 C GLY A 54 4.870 5.198 11.604 1.00 0.00 C ATOM 906 O GLY A 54 4.154 6.042 12.145 1.00 0.00 O ATOM 0 H GLY A 54 5.718 7.560 11.524 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.107 5.369 9.868 1.00 0.00 H new ATOM 0 HA3 GLY A 54 6.984 5.011 11.342 1.00 0.00 H new ATOM 910 N GLY A 55 4.565 3.904 11.573 1.00 0.00 N ATOM 911 CA GLY A 55 3.346 3.415 12.189 1.00 0.00 C ATOM 912 C GLY A 55 3.323 1.903 12.310 1.00 0.00 C ATOM 913 O GLY A 55 4.300 1.233 11.976 1.00 0.00 O ATOM 0 H GLY A 55 5.140 3.186 11.132 1.00 0.00 H new ATOM 0 HA2 GLY A 55 3.241 3.857 13.180 1.00 0.00 H new ATOM 0 HA3 GLY A 55 2.489 3.742 11.601 1.00 0.00 H new ATOM 917 N PHE A 56 2.205 1.367 12.789 1.00 0.00 N ATOM 918 CA PHE A 56 2.058 -0.074 12.954 1.00 0.00 C ATOM 919 C PHE A 56 0.597 -0.490 12.821 1.00 0.00 C ATOM 920 O PHE A 56 -0.293 0.355 12.720 1.00 0.00 O ATOM 921 CB PHE A 56 2.604 -0.511 14.314 1.00 0.00 C ATOM 922 CG PHE A 56 3.932 0.102 14.655 1.00 0.00 C ATOM 923 CD1 PHE A 56 5.096 -0.360 14.063 1.00 0.00 C ATOM 924 CD2 PHE A 56 4.016 1.144 15.565 1.00 0.00 C ATOM 925 CE1 PHE A 56 6.319 0.203 14.375 1.00 0.00 C ATOM 926 CE2 PHE A 56 5.236 1.712 15.880 1.00 0.00 C ATOM 927 CZ PHE A 56 6.389 1.240 15.284 1.00 0.00 C ATOM 0 H PHE A 56 1.388 1.909 13.070 1.00 0.00 H new ATOM 0 HA PHE A 56 2.630 -0.565 12.167 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.882 -0.247 15.087 1.00 0.00 H new ATOM 0 HB3 PHE A 56 2.701 -1.597 14.325 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.047 -1.169 13.350 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.117 1.517 16.034 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.219 -0.168 13.908 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.288 2.523 16.591 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.344 1.681 15.529 1.00 0.00 H new ATOM 937 N GLY A 57 0.356 -1.797 12.825 1.00 0.00 N ATOM 938 CA GLY A 57 -0.999 -2.302 12.705 1.00 0.00 C ATOM 939 C GLY A 57 -1.047 -3.812 12.577 1.00 0.00 C ATOM 940 O GLY A 57 -0.010 -4.475 12.587 1.00 0.00 O ATOM 0 H GLY A 57 1.075 -2.515 12.909 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.576 -1.996 13.578 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.475 -1.852 11.834 1.00 0.00 H new ATOM 944 N LEU A 58 -2.254 -4.355 12.457 1.00 0.00 N ATOM 945 CA LEU A 58 -2.434 -5.796 12.328 1.00 0.00 C ATOM 946 C LEU A 58 -3.112 -6.145 11.007 1.00 0.00 C ATOM 947 O LEU A 58 -3.816 -5.322 10.424 1.00 0.00 O ATOM 948 CB LEU A 58 -3.261 -6.336 13.497 1.00 0.00 C ATOM 949 CG LEU A 58 -4.645 -5.704 13.655 1.00 0.00 C ATOM 950 CD1 LEU A 58 -5.683 -6.488 12.869 1.00 0.00 C ATOM 951 CD2 LEU A 58 -5.031 -5.630 15.125 1.00 0.00 C ATOM 0 H LEU A 58 -3.122 -3.819 12.446 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.448 -6.261 12.344 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.382 -7.412 13.371 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.701 -6.184 14.420 1.00 0.00 H new ATOM 0 HG LEU A 58 -4.608 -4.690 13.257 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -6.661 -6.023 12.994 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -5.414 -6.490 11.813 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -5.719 -7.514 13.236 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.018 -5.178 15.220 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -5.050 -6.635 15.547 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -4.302 -5.024 15.663 1.00 0.00 H new ATOM 963 N SER A 59 -2.896 -7.372 10.543 1.00 0.00 N ATOM 964 CA SER A 59 -3.487 -7.831 9.292 1.00 0.00 C ATOM 965 C SER A 59 -4.208 -9.161 9.489 1.00 0.00 C ATOM 966 O SER A 59 -3.773 -10.005 10.272 1.00 0.00 O ATOM 967 CB SER A 59 -2.408 -7.977 8.217 1.00 0.00 C ATOM 968 OG SER A 59 -1.821 -6.724 7.912 1.00 0.00 O ATOM 0 H SER A 59 -2.316 -8.066 11.015 1.00 0.00 H new ATOM 0 HA SER A 59 -4.215 -7.087 8.967 1.00 0.00 H new ATOM 0 HB2 SER A 59 -1.639 -8.669 8.561 1.00 0.00 H new ATOM 0 HB3 SER A 59 -2.844 -8.407 7.315 1.00 0.00 H new ATOM 0 HG SER A 59 -1.058 -6.858 7.312 1.00 0.00 H new ATOM 974 N ARG A 60 -5.314 -9.341 8.773 1.00 0.00 N ATOM 975 CA ARG A 60 -6.095 -10.568 8.870 1.00 0.00 C ATOM 976 C ARG A 60 -5.982 -11.391 7.591 1.00 0.00 C ATOM 977 O ARG A 60 -5.696 -10.857 6.520 1.00 0.00 O ATOM 978 CB ARG A 60 -7.563 -10.241 9.151 1.00 0.00 C ATOM 979 CG ARG A 60 -8.278 -11.308 9.965 1.00 0.00 C ATOM 980 CD ARG A 60 -9.725 -11.470 9.525 1.00 0.00 C ATOM 981 NE ARG A 60 -10.653 -10.808 10.439 1.00 0.00 N ATOM 982 CZ ARG A 60 -11.978 -10.898 10.344 1.00 0.00 C ATOM 983 NH1 ARG A 60 -12.533 -11.619 9.379 1.00 0.00 N ATOM 984 NH2 ARG A 60 -12.748 -10.264 11.217 1.00 0.00 N ATOM 0 H ARG A 60 -5.689 -8.653 8.120 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.695 -11.158 9.695 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -7.620 -9.291 9.683 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.085 -10.108 8.203 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -7.756 -12.259 9.859 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -8.246 -11.043 11.022 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -9.847 -11.058 8.523 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.969 -12.531 9.466 1.00 0.00 H new ATOM 0 HE ARG A 60 -10.263 -10.244 11.194 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -11.944 -12.108 8.705 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -13.549 -11.684 9.311 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -12.325 -9.708 11.960 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -13.763 -10.332 11.145 1.00 0.00 H new ATOM 998 N TRP A 61 -6.208 -12.695 7.711 1.00 0.00 N ATOM 999 CA TRP A 61 -6.131 -13.595 6.566 1.00 0.00 C ATOM 1000 C TRP A 61 -7.508 -14.156 6.222 1.00 0.00 C ATOM 1001 O TRP A 61 -8.166 -14.771 7.062 1.00 0.00 O ATOM 1002 CB TRP A 61 -5.160 -14.741 6.856 1.00 0.00 C ATOM 1003 CG TRP A 61 -4.425 -15.219 5.642 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -3.442 -14.556 4.965 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -4.612 -16.465 4.960 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -3.008 -15.313 3.903 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -3.711 -16.489 3.879 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -5.455 -17.563 5.160 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -3.629 -17.567 3.002 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 -5.373 -18.631 4.288 1.00 0.00 C ATOM 1011 CH2 TRP A 61 -4.466 -18.628 3.221 1.00 0.00 C ATOM 0 H TRP A 61 -6.446 -13.153 8.591 1.00 0.00 H new ATOM 0 HA TRP A 61 -5.766 -13.025 5.712 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -4.437 -14.415 7.604 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -5.713 -15.575 7.289 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -3.061 -13.580 5.226 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -2.281 -15.043 3.240 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.157 -17.576 5.981 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -2.930 -17.566 2.179 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -6.020 -19.484 4.432 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -4.426 -19.479 2.558 1.00 0.00 H new ATOM 1022 N ASP A 62 -7.938 -13.940 4.984 1.00 0.00 N ATOM 1023 CA ASP A 62 -9.237 -14.426 4.531 1.00 0.00 C ATOM 1024 C ASP A 62 -9.091 -15.739 3.768 1.00 0.00 C ATOM 1025 O ASP A 62 -8.434 -15.795 2.728 1.00 0.00 O ATOM 1026 CB ASP A 62 -9.916 -13.379 3.647 1.00 0.00 C ATOM 1027 CG ASP A 62 -11.409 -13.290 3.901 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -11.930 -12.158 3.985 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -12.056 -14.352 4.015 1.00 0.00 O ATOM 0 H ASP A 62 -7.407 -13.432 4.276 1.00 0.00 H new ATOM 0 HA ASP A 62 -9.857 -14.606 5.409 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -9.461 -12.405 3.827 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -9.742 -13.624 2.599 1.00 0.00 H new ATOM 1035 N GLU A 63 -9.709 -16.792 4.294 1.00 0.00 N ATOM 1036 CA GLU A 63 -9.651 -18.110 3.668 1.00 0.00 C ATOM 1037 C GLU A 63 -10.139 -18.062 2.223 1.00 0.00 C ATOM 1038 O GLU A 63 -9.793 -18.922 1.414 1.00 0.00 O ATOM 1039 CB GLU A 63 -10.490 -19.111 4.466 1.00 0.00 C ATOM 1040 CG GLU A 63 -11.944 -18.697 4.620 1.00 0.00 C ATOM 1041 CD GLU A 63 -12.254 -18.158 6.003 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -11.924 -16.984 6.270 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -12.827 -18.910 6.819 1.00 0.00 O ATOM 0 H GLU A 63 -10.257 -16.759 5.154 1.00 0.00 H new ATOM 0 HA GLU A 63 -8.609 -18.431 3.664 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.447 -20.083 3.974 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -10.049 -19.235 5.455 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.182 -17.937 3.876 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -12.585 -19.554 4.416 1.00 0.00 H new ATOM 1051 N LYS A 64 -10.944 -17.053 1.903 1.00 0.00 N ATOM 1052 CA LYS A 64 -11.475 -16.901 0.553 1.00 0.00 C ATOM 1053 C LYS A 64 -10.379 -16.485 -0.423 1.00 0.00 C ATOM 1054 O LYS A 64 -10.475 -16.738 -1.624 1.00 0.00 O ATOM 1055 CB LYS A 64 -12.606 -15.871 0.540 1.00 0.00 C ATOM 1056 CG LYS A 64 -13.970 -16.462 0.857 1.00 0.00 C ATOM 1057 CD LYS A 64 -15.083 -15.454 0.618 1.00 0.00 C ATOM 1058 CE LYS A 64 -15.691 -15.613 -0.766 1.00 0.00 C ATOM 1059 NZ LYS A 64 -16.035 -14.299 -1.377 1.00 0.00 N ATOM 0 H LYS A 64 -11.242 -16.330 2.558 1.00 0.00 H new ATOM 0 HA LYS A 64 -11.869 -17.866 0.235 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -12.381 -15.088 1.264 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.644 -15.397 -0.441 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -14.138 -17.344 0.239 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -13.993 -16.791 1.896 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -15.858 -15.580 1.374 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -14.690 -14.443 0.730 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -14.990 -16.141 -1.412 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.588 -16.228 -0.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -16.447 -14.452 -2.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -16.724 -13.806 -0.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -15.175 -13.721 -1.464 1.00 0.00 H new ATOM 1073 N GLY A 65 -9.335 -15.847 0.100 1.00 0.00 N ATOM 1074 CA GLY A 65 -8.238 -15.409 -0.743 1.00 0.00 C ATOM 1075 C GLY A 65 -8.021 -13.910 -0.683 1.00 0.00 C ATOM 1076 O GLY A 65 -7.783 -13.269 -1.706 1.00 0.00 O ATOM 0 H GLY A 65 -9.230 -15.626 1.090 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -7.324 -15.918 -0.437 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -8.437 -15.703 -1.774 1.00 0.00 H new ATOM 1080 N ASN A 66 -8.104 -13.349 0.520 1.00 0.00 N ATOM 1081 CA ASN A 66 -7.915 -11.915 0.708 1.00 0.00 C ATOM 1082 C ASN A 66 -6.953 -11.639 1.859 1.00 0.00 C ATOM 1083 O ASN A 66 -6.786 -12.468 2.754 1.00 0.00 O ATOM 1084 CB ASN A 66 -9.257 -11.233 0.973 1.00 0.00 C ATOM 1085 CG ASN A 66 -10.172 -11.269 -0.234 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -10.230 -10.317 -1.012 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -10.896 -12.371 -0.396 1.00 0.00 N ATOM 0 H ASN A 66 -8.301 -13.865 1.378 1.00 0.00 H new ATOM 0 HA ASN A 66 -7.484 -11.508 -0.206 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -9.750 -11.721 1.814 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -9.084 -10.197 1.263 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -11.531 -12.452 -1.190 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -10.817 -13.136 0.274 1.00 0.00 H new ATOM 1094 N TRP A 67 -6.322 -10.469 1.829 1.00 0.00 N ATOM 1095 CA TRP A 67 -5.377 -10.083 2.869 1.00 0.00 C ATOM 1096 C TRP A 67 -5.733 -8.719 3.451 1.00 0.00 C ATOM 1097 O TRP A 67 -5.379 -7.682 2.891 1.00 0.00 O ATOM 1098 CB TRP A 67 -3.954 -10.054 2.308 1.00 0.00 C ATOM 1099 CG TRP A 67 -2.925 -10.569 3.269 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -2.563 -11.872 3.460 1.00 0.00 C ATOM 1101 CD2 TRP A 67 -2.128 -9.793 4.170 1.00 0.00 C ATOM 1102 NE1 TRP A 67 -1.588 -11.953 4.426 1.00 0.00 N ATOM 1103 CE2 TRP A 67 -1.304 -10.690 4.876 1.00 0.00 C ATOM 1104 CE3 TRP A 67 -2.030 -8.427 4.449 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 -0.396 -10.265 5.842 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 -1.128 -8.006 5.407 1.00 0.00 C ATOM 1107 CH2 TRP A 67 -0.321 -8.922 6.094 1.00 0.00 C ATOM 0 H TRP A 67 -6.449 -9.772 1.095 1.00 0.00 H new ATOM 0 HA TRP A 67 -5.432 -10.823 3.667 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -3.919 -10.650 1.396 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -3.701 -9.031 2.031 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -2.981 -12.715 2.930 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -1.148 -12.813 4.754 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -2.648 -7.713 3.925 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 0.227 -10.970 6.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -1.044 -6.953 5.630 1.00 0.00 H new ATOM 0 HH2 TRP A 67 0.374 -8.561 6.837 1.00 0.00 H new ATOM 1118 N HIS A 68 -6.439 -8.728 4.577 1.00 0.00 N ATOM 1119 CA HIS A 68 -6.844 -7.491 5.234 1.00 0.00 C ATOM 1120 C HIS A 68 -5.634 -6.754 5.801 1.00 0.00 C ATOM 1121 O HIS A 68 -4.768 -7.358 6.433 1.00 0.00 O ATOM 1122 CB HIS A 68 -7.844 -7.787 6.353 1.00 0.00 C ATOM 1123 CG HIS A 68 -8.658 -6.597 6.759 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -8.098 -5.422 7.215 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -9.998 -6.404 6.776 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -9.058 -4.558 7.495 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -10.219 -5.130 7.237 1.00 0.00 N ATOM 0 H HIS A 68 -6.742 -9.578 5.053 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.320 -6.853 4.489 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -8.515 -8.582 6.028 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -7.304 -8.161 7.223 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -10.752 -7.119 6.482 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -8.917 -3.555 7.871 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -11.133 -4.695 7.360 1.00 0.00 H new ATOM 1136 N GLY A 69 -5.582 -5.446 5.568 1.00 0.00 N ATOM 1137 CA GLY A 69 -4.473 -4.650 6.061 1.00 0.00 C ATOM 1138 C GLY A 69 -4.934 -3.380 6.751 1.00 0.00 C ATOM 1139 O GLY A 69 -5.460 -2.471 6.108 1.00 0.00 O ATOM 0 H GLY A 69 -6.287 -4.924 5.047 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -3.884 -5.246 6.758 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -3.817 -4.391 5.230 1.00 0.00 H new ATOM 1143 N LEU A 70 -4.736 -3.318 8.064 1.00 0.00 N ATOM 1144 CA LEU A 70 -5.134 -2.150 8.842 1.00 0.00 C ATOM 1145 C LEU A 70 -3.989 -1.670 9.726 1.00 0.00 C ATOM 1146 O LEU A 70 -3.486 -2.413 10.569 1.00 0.00 O ATOM 1147 CB LEU A 70 -6.356 -2.479 9.704 1.00 0.00 C ATOM 1148 CG LEU A 70 -7.336 -1.322 9.905 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -8.710 -1.848 10.287 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -6.816 -0.362 10.964 1.00 0.00 C ATOM 0 H LEU A 70 -4.303 -4.062 8.611 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.392 -1.351 8.147 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.890 -3.312 9.248 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.012 -2.818 10.681 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.427 -0.779 8.964 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -9.394 -1.011 10.426 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -9.085 -2.496 9.494 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -8.637 -2.415 11.215 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.526 0.455 11.094 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -6.696 -0.893 11.909 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.853 0.040 10.649 1.00 0.00 H new ATOM 1162 N TYR A 71 -3.581 -0.420 9.528 1.00 0.00 N ATOM 1163 CA TYR A 71 -2.494 0.161 10.308 1.00 0.00 C ATOM 1164 C TYR A 71 -2.593 1.682 10.328 1.00 0.00 C ATOM 1165 O TYR A 71 -3.240 2.284 9.472 1.00 0.00 O ATOM 1166 CB TYR A 71 -1.141 -0.266 9.735 1.00 0.00 C ATOM 1167 CG TYR A 71 -1.050 -0.132 8.231 1.00 0.00 C ATOM 1168 CD1 TYR A 71 -1.133 1.113 7.620 1.00 0.00 C ATOM 1169 CD2 TYR A 71 -0.881 -1.249 7.424 1.00 0.00 C ATOM 1170 CE1 TYR A 71 -1.050 1.241 6.246 1.00 0.00 C ATOM 1171 CE2 TYR A 71 -0.797 -1.130 6.049 1.00 0.00 C ATOM 1172 CZ TYR A 71 -0.882 0.117 5.466 1.00 0.00 C ATOM 1173 OH TYR A 71 -0.799 0.239 4.098 1.00 0.00 O ATOM 0 H TYR A 71 -3.986 0.209 8.835 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.579 -0.205 11.331 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -0.356 0.336 10.193 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -0.950 -1.303 10.011 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -1.265 1.995 8.229 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -0.814 -2.227 7.878 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -1.116 2.216 5.786 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -0.666 -2.009 5.435 1.00 0.00 H new ATOM 0 HH TYR A 71 0.027 0.710 3.861 1.00 0.00 H new ATOM 1183 N ALA A 72 -1.946 2.299 11.313 1.00 0.00 N ATOM 1184 CA ALA A 72 -1.959 3.750 11.445 1.00 0.00 C ATOM 1185 C ALA A 72 -0.545 4.319 11.397 1.00 0.00 C ATOM 1186 O ALA A 72 0.332 3.891 12.146 1.00 0.00 O ATOM 1187 CB ALA A 72 -2.648 4.154 12.740 1.00 0.00 C ATOM 0 H ALA A 72 -1.406 1.815 12.031 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.517 4.162 10.604 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -2.651 5.241 12.827 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.674 3.787 12.736 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -2.113 3.724 13.586 1.00 0.00 H new ATOM 1193 N MET A 73 -0.332 5.286 10.511 1.00 0.00 N ATOM 1194 CA MET A 73 0.976 5.914 10.364 1.00 0.00 C ATOM 1195 C MET A 73 0.902 7.406 10.666 1.00 0.00 C ATOM 1196 O MET A 73 -0.094 8.063 10.359 1.00 0.00 O ATOM 1197 CB MET A 73 1.515 5.693 8.949 1.00 0.00 C ATOM 1198 CG MET A 73 3.026 5.820 8.847 1.00 0.00 C ATOM 1199 SD MET A 73 3.557 6.584 7.303 1.00 0.00 S ATOM 1200 CE MET A 73 4.032 5.139 6.356 1.00 0.00 C ATOM 0 H MET A 73 -1.048 5.652 9.884 1.00 0.00 H new ATOM 0 HA MET A 73 1.655 5.452 11.080 1.00 0.00 H new ATOM 0 HB2 MET A 73 1.218 4.702 8.607 1.00 0.00 H new ATOM 0 HB3 MET A 73 1.052 6.414 8.276 1.00 0.00 H new ATOM 0 HG2 MET A 73 3.394 6.411 9.686 1.00 0.00 H new ATOM 0 HG3 MET A 73 3.476 4.831 8.932 1.00 0.00 H new ATOM 0 HE1 MET A 73 5.053 5.260 5.995 1.00 0.00 H new ATOM 0 HE2 MET A 73 3.974 4.254 6.989 1.00 0.00 H new ATOM 0 HE3 MET A 73 3.358 5.023 5.507 1.00 0.00 H new ATOM 1210 N ALA A 74 1.962 7.936 11.267 1.00 0.00 N ATOM 1211 CA ALA A 74 2.019 9.352 11.611 1.00 0.00 C ATOM 1212 C ALA A 74 3.196 10.035 10.920 1.00 0.00 C ATOM 1213 O ALA A 74 4.293 9.483 10.854 1.00 0.00 O ATOM 1214 CB ALA A 74 2.116 9.526 13.119 1.00 0.00 C ATOM 0 H ALA A 74 2.794 7.406 11.526 1.00 0.00 H new ATOM 0 HA ALA A 74 1.101 9.824 11.262 1.00 0.00 H new ATOM 0 HB1 ALA A 74 2.158 10.588 13.361 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.242 9.080 13.594 1.00 0.00 H new ATOM 0 HB3 ALA A 74 3.018 9.035 13.485 1.00 0.00 H new ATOM 1220 N PHE A 75 2.957 11.238 10.408 1.00 0.00 N ATOM 1221 CA PHE A 75 3.999 11.994 9.722 1.00 0.00 C ATOM 1222 C PHE A 75 4.534 13.113 10.609 1.00 0.00 C ATOM 1223 O PHE A 75 3.778 13.759 11.335 1.00 0.00 O ATOM 1224 CB PHE A 75 3.457 12.578 8.416 1.00 0.00 C ATOM 1225 CG PHE A 75 2.327 13.547 8.614 1.00 0.00 C ATOM 1226 CD1 PHE A 75 2.579 14.896 8.799 1.00 0.00 C ATOM 1227 CD2 PHE A 75 1.013 13.107 8.613 1.00 0.00 C ATOM 1228 CE1 PHE A 75 1.541 15.791 8.981 1.00 0.00 C ATOM 1229 CE2 PHE A 75 -0.029 13.997 8.794 1.00 0.00 C ATOM 1230 CZ PHE A 75 0.235 15.341 8.978 1.00 0.00 C ATOM 0 H PHE A 75 2.054 11.709 10.455 1.00 0.00 H new ATOM 0 HA PHE A 75 4.819 11.312 9.496 1.00 0.00 H new ATOM 0 HB2 PHE A 75 4.268 13.081 7.889 1.00 0.00 H new ATOM 0 HB3 PHE A 75 3.118 11.763 7.776 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.598 15.253 8.801 1.00 0.00 H new ATOM 0 HD2 PHE A 75 0.801 12.058 8.469 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.751 16.841 9.125 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -1.049 13.642 8.792 1.00 0.00 H new ATOM 0 HZ PHE A 75 -0.578 16.038 9.119 1.00 0.00 H new ATOM 1240 N LYS A 76 5.843 13.337 10.545 1.00 0.00 N ATOM 1241 CA LYS A 76 6.481 14.378 11.342 1.00 0.00 C ATOM 1242 C LYS A 76 6.354 15.736 10.662 1.00 0.00 C ATOM 1243 O LYS A 76 6.837 15.930 9.545 1.00 0.00 O ATOM 1244 CB LYS A 76 7.956 14.043 11.569 1.00 0.00 C ATOM 1245 CG LYS A 76 8.507 14.582 12.880 1.00 0.00 C ATOM 1246 CD LYS A 76 9.305 15.858 12.667 1.00 0.00 C ATOM 1247 CE LYS A 76 10.654 15.570 12.028 1.00 0.00 C ATOM 1248 NZ LYS A 76 10.625 15.767 10.552 1.00 0.00 N ATOM 0 H LYS A 76 6.482 12.811 9.949 1.00 0.00 H new ATOM 0 HA LYS A 76 5.975 14.426 12.306 1.00 0.00 H new ATOM 0 HB2 LYS A 76 8.081 12.960 11.549 1.00 0.00 H new ATOM 0 HB3 LYS A 76 8.543 14.447 10.744 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.685 14.777 13.569 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.142 13.828 13.346 1.00 0.00 H new ATOM 0 HD2 LYS A 76 8.739 16.541 12.033 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.454 16.360 13.623 1.00 0.00 H new ATOM 0 HE2 LYS A 76 11.409 16.222 12.466 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.950 14.545 12.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 10.751 14.850 10.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.711 16.178 10.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 11.393 16.410 10.272 1.00 0.00 H new ATOM 1262 N ASP A 77 5.701 16.674 11.340 1.00 0.00 N ATOM 1263 CA ASP A 77 5.509 18.014 10.800 1.00 0.00 C ATOM 1264 C ASP A 77 6.850 18.711 10.579 1.00 0.00 C ATOM 1265 O ASP A 77 7.903 18.076 10.618 1.00 0.00 O ATOM 1266 CB ASP A 77 4.635 18.846 11.740 1.00 0.00 C ATOM 1267 CG ASP A 77 3.648 19.720 10.989 1.00 0.00 C ATOM 1268 OD1 ASP A 77 2.510 19.264 10.755 1.00 0.00 O ATOM 1269 OD2 ASP A 77 4.015 20.861 10.636 1.00 0.00 O ATOM 0 H ASP A 77 5.296 16.530 12.265 1.00 0.00 H new ATOM 0 HA ASP A 77 5.007 17.921 9.837 1.00 0.00 H new ATOM 0 HB2 ASP A 77 4.090 18.180 12.410 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.272 19.474 12.363 1.00 0.00 H new ATOM 1275 N SER A 78 6.800 20.018 10.344 1.00 0.00 N ATOM 1276 CA SER A 78 8.009 20.801 10.114 1.00 0.00 C ATOM 1277 C SER A 78 8.629 21.262 11.431 1.00 0.00 C ATOM 1278 O SER A 78 9.826 21.542 11.497 1.00 0.00 O ATOM 1279 CB SER A 78 7.695 22.013 9.236 1.00 0.00 C ATOM 1280 OG SER A 78 6.368 22.465 9.446 1.00 0.00 O ATOM 0 H SER A 78 5.935 20.558 10.308 1.00 0.00 H new ATOM 0 HA SER A 78 8.729 20.162 9.603 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.396 22.818 9.457 1.00 0.00 H new ATOM 0 HB3 SER A 78 7.832 21.751 8.187 1.00 0.00 H new ATOM 0 HG SER A 78 6.193 23.241 8.874 1.00 0.00 H new ATOM 1286 N TRP A 79 7.811 21.339 12.477 1.00 0.00 N ATOM 1287 CA TRP A 79 8.288 21.768 13.787 1.00 0.00 C ATOM 1288 C TRP A 79 7.513 21.071 14.898 1.00 0.00 C ATOM 1289 O TRP A 79 8.102 20.491 15.811 1.00 0.00 O ATOM 1290 CB TRP A 79 8.155 23.286 13.928 1.00 0.00 C ATOM 1291 CG TRP A 79 9.097 23.875 14.933 1.00 0.00 C ATOM 1292 CD1 TRP A 79 9.641 23.246 16.015 1.00 0.00 C ATOM 1293 CD2 TRP A 79 9.605 25.215 14.949 1.00 0.00 C ATOM 1294 NE1 TRP A 79 10.456 24.111 16.704 1.00 0.00 N ATOM 1295 CE2 TRP A 79 10.451 25.326 16.070 1.00 0.00 C ATOM 1296 CE3 TRP A 79 9.427 26.330 14.125 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 11.116 26.508 16.385 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 10.088 27.503 14.440 1.00 0.00 C ATOM 1299 CH2 TRP A 79 10.924 27.583 15.561 1.00 0.00 C ATOM 0 H TRP A 79 6.818 21.111 12.443 1.00 0.00 H new ATOM 0 HA TRP A 79 9.339 21.494 13.874 1.00 0.00 H new ATOM 0 HB2 TRP A 79 8.333 23.751 12.958 1.00 0.00 H new ATOM 0 HB3 TRP A 79 7.132 23.529 14.214 1.00 0.00 H new ATOM 0 HD1 TRP A 79 9.457 22.218 16.290 1.00 0.00 H new ATOM 0 HE1 TRP A 79 10.980 23.886 17.550 1.00 0.00 H new ATOM 0 HE3 TRP A 79 8.785 26.276 13.258 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 11.760 26.574 17.249 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 9.958 28.372 13.811 1.00 0.00 H new ATOM 0 HH2 TRP A 79 11.428 28.513 15.779 1.00 0.00 H new ATOM 1310 N ASN A 80 6.189 21.131 14.814 1.00 0.00 N ATOM 1311 CA ASN A 80 5.333 20.503 15.812 1.00 0.00 C ATOM 1312 C ASN A 80 5.491 18.987 15.784 1.00 0.00 C ATOM 1313 O ASN A 80 6.311 18.451 15.038 1.00 0.00 O ATOM 1314 CB ASN A 80 3.870 20.883 15.569 1.00 0.00 C ATOM 1315 CG ASN A 80 3.441 20.650 14.134 1.00 0.00 C ATOM 1316 OD1 ASN A 80 3.943 21.294 13.214 1.00 0.00 O ATOM 1317 ND2 ASN A 80 2.509 19.726 13.938 1.00 0.00 N ATOM 0 H ASN A 80 5.686 21.608 14.066 1.00 0.00 H new ATOM 0 HA ASN A 80 5.635 20.863 16.796 1.00 0.00 H new ATOM 0 HB2 ASN A 80 3.232 20.302 16.235 1.00 0.00 H new ATOM 0 HB3 ASN A 80 3.724 21.933 15.823 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.181 19.525 12.993 1.00 0.00 H new ATOM 0 HD22 ASN A 80 2.121 19.216 14.732 1.00 0.00 H new ATOM 1324 N LYS A 81 4.703 18.301 16.602 1.00 0.00 N ATOM 1325 CA LYS A 81 4.754 16.845 16.675 1.00 0.00 C ATOM 1326 C LYS A 81 4.144 16.214 15.429 1.00 0.00 C ATOM 1327 O LYS A 81 3.637 16.913 14.551 1.00 0.00 O ATOM 1328 CB LYS A 81 4.021 16.350 17.923 1.00 0.00 C ATOM 1329 CG LYS A 81 4.915 16.224 19.145 1.00 0.00 C ATOM 1330 CD LYS A 81 4.387 15.181 20.117 1.00 0.00 C ATOM 1331 CE LYS A 81 3.639 15.824 21.273 1.00 0.00 C ATOM 1332 NZ LYS A 81 2.240 16.177 20.902 1.00 0.00 N ATOM 0 H LYS A 81 4.019 18.730 17.226 1.00 0.00 H new ATOM 0 HA LYS A 81 5.801 16.547 16.734 1.00 0.00 H new ATOM 0 HB2 LYS A 81 3.204 17.035 18.150 1.00 0.00 H new ATOM 0 HB3 LYS A 81 3.573 15.380 17.710 1.00 0.00 H new ATOM 0 HG2 LYS A 81 5.924 15.954 18.833 1.00 0.00 H new ATOM 0 HG3 LYS A 81 4.984 17.189 19.647 1.00 0.00 H new ATOM 0 HD2 LYS A 81 3.724 14.494 19.591 1.00 0.00 H new ATOM 0 HD3 LYS A 81 5.217 14.589 20.504 1.00 0.00 H new ATOM 0 HE2 LYS A 81 3.628 15.141 22.123 1.00 0.00 H new ATOM 0 HE3 LYS A 81 4.167 16.722 21.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 1.764 16.613 21.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 2.250 16.848 20.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 1.728 15.317 20.621 1.00 0.00 H new ATOM 1346 N TRP A 82 4.195 14.888 15.358 1.00 0.00 N ATOM 1347 CA TRP A 82 3.646 14.161 14.219 1.00 0.00 C ATOM 1348 C TRP A 82 2.161 13.875 14.422 1.00 0.00 C ATOM 1349 O TRP A 82 1.712 13.642 15.544 1.00 0.00 O ATOM 1350 CB TRP A 82 4.405 12.851 14.009 1.00 0.00 C ATOM 1351 CG TRP A 82 4.531 12.031 15.256 1.00 0.00 C ATOM 1352 CD1 TRP A 82 3.660 11.080 15.705 1.00 0.00 C ATOM 1353 CD2 TRP A 82 5.593 12.088 16.217 1.00 0.00 C ATOM 1354 NE1 TRP A 82 4.114 10.544 16.886 1.00 0.00 N ATOM 1355 CE2 TRP A 82 5.298 11.146 17.221 1.00 0.00 C ATOM 1356 CE3 TRP A 82 6.763 12.844 16.326 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 6.131 10.941 18.317 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 7.590 12.640 17.415 1.00 0.00 C ATOM 1359 CH2 TRP A 82 7.270 11.694 18.398 1.00 0.00 C ATOM 0 H TRP A 82 4.611 14.295 16.076 1.00 0.00 H new ATOM 0 HA TRP A 82 3.760 14.784 13.332 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.895 12.263 13.246 1.00 0.00 H new ATOM 0 HB3 TRP A 82 5.401 13.074 13.627 1.00 0.00 H new ATOM 0 HD1 TRP A 82 2.747 10.791 15.205 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.646 9.816 17.426 1.00 0.00 H new ATOM 0 HE3 TRP A 82 7.017 13.575 15.573 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 5.887 10.213 19.077 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 8.497 13.219 17.510 1.00 0.00 H new ATOM 0 HH2 TRP A 82 7.936 11.557 19.237 1.00 0.00 H new ATOM 1370 N GLU A 83 1.404 13.896 13.330 1.00 0.00 N ATOM 1371 CA GLU A 83 -0.029 13.639 13.390 1.00 0.00 C ATOM 1372 C GLU A 83 -0.347 12.213 12.936 1.00 0.00 C ATOM 1373 O GLU A 83 0.036 11.809 11.838 1.00 0.00 O ATOM 1374 CB GLU A 83 -0.784 14.641 12.514 1.00 0.00 C ATOM 1375 CG GLU A 83 -2.295 14.526 12.621 1.00 0.00 C ATOM 1376 CD GLU A 83 -2.982 15.878 12.664 1.00 0.00 C ATOM 1377 OE1 GLU A 83 -2.453 16.831 12.054 1.00 0.00 O ATOM 1378 OE2 GLU A 83 -4.047 15.982 13.306 1.00 0.00 O ATOM 0 H GLU A 83 1.759 14.088 12.393 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.350 13.754 14.425 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.484 15.652 12.792 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.490 14.496 11.475 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.673 13.957 11.772 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.550 13.964 13.520 1.00 0.00 H new ATOM 1386 N PRO A 84 -1.052 11.427 13.772 1.00 0.00 N ATOM 1387 CA PRO A 84 -1.410 10.045 13.437 1.00 0.00 C ATOM 1388 C PRO A 84 -2.395 9.974 12.274 1.00 0.00 C ATOM 1389 O PRO A 84 -3.068 10.956 11.958 1.00 0.00 O ATOM 1390 CB PRO A 84 -2.064 9.506 14.719 1.00 0.00 C ATOM 1391 CG PRO A 84 -1.714 10.486 15.789 1.00 0.00 C ATOM 1392 CD PRO A 84 -1.551 11.810 15.102 1.00 0.00 C ATOM 0 HA PRO A 84 -0.539 9.471 13.121 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -3.144 9.422 14.603 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -1.691 8.511 14.961 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -2.497 10.533 16.546 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -0.795 10.195 16.299 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -2.494 12.352 15.039 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -0.847 12.455 15.628 1.00 0.00 H new ATOM 1400 N ILE A 85 -2.476 8.808 11.642 1.00 0.00 N ATOM 1401 CA ILE A 85 -3.378 8.612 10.515 1.00 0.00 C ATOM 1402 C ILE A 85 -3.908 7.182 10.478 1.00 0.00 C ATOM 1403 O ILE A 85 -3.250 6.253 10.944 1.00 0.00 O ATOM 1404 CB ILE A 85 -2.682 8.925 9.176 1.00 0.00 C ATOM 1405 CG1 ILE A 85 -1.968 10.275 9.251 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -3.693 8.915 8.039 1.00 0.00 C ATOM 1407 CD1 ILE A 85 -1.214 10.632 7.988 1.00 0.00 C ATOM 0 H ILE A 85 -1.928 7.985 11.892 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.210 9.302 10.652 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.938 8.153 8.980 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -2.702 11.054 9.459 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -1.271 10.262 10.089 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -3.187 9.138 7.100 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -4.159 7.932 7.976 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -4.458 9.668 8.226 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.733 11.602 8.113 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -0.456 9.874 7.790 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.909 10.678 7.150 1.00 0.00 H new ATOM 1419 N ALA A 86 -5.103 7.015 9.922 1.00 0.00 N ATOM 1420 CA ALA A 86 -5.723 5.698 9.824 1.00 0.00 C ATOM 1421 C ALA A 86 -5.650 5.159 8.400 1.00 0.00 C ATOM 1422 O ALA A 86 -5.699 5.920 7.434 1.00 0.00 O ATOM 1423 CB ALA A 86 -7.170 5.762 10.293 1.00 0.00 C ATOM 0 H ALA A 86 -5.662 7.774 9.532 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.171 5.015 10.470 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.622 4.773 10.215 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.202 6.095 11.330 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.724 6.464 9.670 1.00 0.00 H new ATOM 1429 N GLY A 87 -5.532 3.841 8.278 1.00 0.00 N ATOM 1430 CA GLY A 87 -5.455 3.221 6.968 1.00 0.00 C ATOM 1431 C GLY A 87 -6.009 1.810 6.962 1.00 0.00 C ATOM 1432 O GLY A 87 -5.755 1.032 7.883 1.00 0.00 O ATOM 0 H GLY A 87 -5.488 3.191 9.063 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.006 3.828 6.249 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.416 3.202 6.639 1.00 0.00 H new ATOM 1436 N TYR A 88 -6.769 1.478 5.924 1.00 0.00 N ATOM 1437 CA TYR A 88 -7.360 0.151 5.804 1.00 0.00 C ATOM 1438 C TYR A 88 -7.581 -0.218 4.340 1.00 0.00 C ATOM 1439 O TYR A 88 -8.076 0.589 3.554 1.00 0.00 O ATOM 1440 CB TYR A 88 -8.687 0.090 6.562 1.00 0.00 C ATOM 1441 CG TYR A 88 -9.687 1.136 6.120 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -9.446 2.488 6.331 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -10.870 0.770 5.491 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -10.357 3.446 5.929 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -11.786 1.723 5.085 1.00 0.00 C ATOM 1446 CZ TYR A 88 -11.525 3.058 5.307 1.00 0.00 C ATOM 1447 OH TYR A 88 -12.434 4.009 4.905 1.00 0.00 O ATOM 0 H TYR A 88 -6.990 2.110 5.154 1.00 0.00 H new ATOM 0 HA TYR A 88 -6.666 -0.568 6.240 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -9.126 -0.899 6.430 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -8.493 0.213 7.628 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -8.532 2.795 6.817 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -11.078 -0.275 5.316 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -10.155 4.493 6.101 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -12.701 1.423 4.596 1.00 0.00 H new ATOM 0 HH TYR A 88 -13.202 3.570 4.483 1.00 0.00 H new ATOM 1457 N GLY A 89 -7.210 -1.443 3.981 1.00 0.00 N ATOM 1458 CA GLY A 89 -7.375 -1.898 2.614 1.00 0.00 C ATOM 1459 C GLY A 89 -7.243 -3.402 2.483 1.00 0.00 C ATOM 1460 O GLY A 89 -7.142 -4.112 3.484 1.00 0.00 O ATOM 0 H GLY A 89 -6.798 -2.129 4.614 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -8.354 -1.589 2.247 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.631 -1.415 1.981 1.00 0.00 H new ATOM 1464 N TRP A 90 -7.245 -3.890 1.248 1.00 0.00 N ATOM 1465 CA TRP A 90 -7.124 -5.321 0.990 1.00 0.00 C ATOM 1466 C TRP A 90 -6.149 -5.589 -0.150 1.00 0.00 C ATOM 1467 O TRP A 90 -6.018 -4.783 -1.072 1.00 0.00 O ATOM 1468 CB TRP A 90 -8.493 -5.918 0.656 1.00 0.00 C ATOM 1469 CG TRP A 90 -9.456 -5.874 1.803 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -9.618 -6.821 2.773 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -10.392 -4.832 2.099 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -10.597 -6.431 3.655 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -11.087 -5.213 3.263 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -10.708 -3.612 1.494 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -12.079 -4.418 3.831 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -11.693 -2.824 2.061 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -12.368 -3.229 3.219 1.00 0.00 C ATOM 0 H TRP A 90 -7.329 -3.316 0.409 1.00 0.00 H new ATOM 0 HA TRP A 90 -6.738 -5.795 1.892 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -8.920 -5.378 -0.189 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -8.363 -6.953 0.340 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -9.058 -7.742 2.838 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -10.908 -6.962 4.469 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -10.193 -3.291 0.601 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -12.602 -4.729 4.723 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -11.946 -1.879 1.602 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -13.132 -2.590 3.637 1.00 0.00 H new ATOM 1488 N GLU A 91 -5.465 -6.726 -0.083 1.00 0.00 N ATOM 1489 CA GLU A 91 -4.500 -7.102 -1.110 1.00 0.00 C ATOM 1490 C GLU A 91 -4.545 -8.603 -1.375 1.00 0.00 C ATOM 1491 O GLU A 91 -4.905 -9.388 -0.498 1.00 0.00 O ATOM 1492 CB GLU A 91 -3.088 -6.688 -0.689 1.00 0.00 C ATOM 1493 CG GLU A 91 -2.976 -5.224 -0.294 1.00 0.00 C ATOM 1494 CD GLU A 91 -3.046 -4.292 -1.488 1.00 0.00 C ATOM 1495 OE1 GLU A 91 -2.289 -4.511 -2.457 1.00 0.00 O ATOM 1496 OE2 GLU A 91 -3.856 -3.343 -1.453 1.00 0.00 O ATOM 0 H GLU A 91 -5.561 -7.404 0.673 1.00 0.00 H new ATOM 0 HA GLU A 91 -4.764 -6.581 -2.030 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -2.772 -7.307 0.150 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.400 -6.888 -1.510 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.777 -4.977 0.403 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.035 -5.064 0.232 1.00 0.00 H new ATOM 1504 N SER A 92 -4.174 -8.995 -2.590 1.00 0.00 N ATOM 1505 CA SER A 92 -4.173 -10.404 -2.971 1.00 0.00 C ATOM 1506 C SER A 92 -2.797 -10.830 -3.473 1.00 0.00 C ATOM 1507 O SER A 92 -2.384 -10.459 -4.571 1.00 0.00 O ATOM 1508 CB SER A 92 -5.224 -10.662 -4.052 1.00 0.00 C ATOM 1509 OG SER A 92 -5.521 -12.043 -4.154 1.00 0.00 O ATOM 0 H SER A 92 -3.871 -8.358 -3.327 1.00 0.00 H new ATOM 0 HA SER A 92 -4.417 -10.994 -2.088 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.133 -10.107 -3.820 1.00 0.00 H new ATOM 0 HB3 SER A 92 -4.862 -10.293 -5.011 1.00 0.00 H new ATOM 0 HG SER A 92 -6.196 -12.182 -4.850 1.00 0.00 H new ATOM 1515 N THR A 93 -2.092 -11.611 -2.660 1.00 0.00 N ATOM 1516 CA THR A 93 -0.763 -12.088 -3.022 1.00 0.00 C ATOM 1517 C THR A 93 -0.849 -13.362 -3.856 1.00 0.00 C ATOM 1518 O THR A 93 -1.686 -14.228 -3.600 1.00 0.00 O ATOM 1519 CB THR A 93 0.069 -12.344 -1.764 1.00 0.00 C ATOM 1520 OG1 THR A 93 0.121 -11.184 -0.952 1.00 0.00 O ATOM 1521 CG2 THR A 93 1.493 -12.760 -2.062 1.00 0.00 C ATOM 0 H THR A 93 -2.419 -11.926 -1.747 1.00 0.00 H new ATOM 0 HA THR A 93 -0.278 -11.316 -3.620 1.00 0.00 H new ATOM 0 HB THR A 93 -0.432 -13.164 -1.249 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.656 -11.368 -0.152 1.00 0.00 H new ATOM 0 HG21 THR A 93 2.027 -12.925 -1.126 1.00 0.00 H new ATOM 0 HG22 THR A 93 1.489 -13.681 -2.645 1.00 0.00 H new ATOM 0 HG23 THR A 93 1.991 -11.974 -2.630 1.00 0.00 H new ATOM 1529 N TRP A 94 0.021 -13.469 -4.855 1.00 0.00 N ATOM 1530 CA TRP A 94 0.043 -14.636 -5.728 1.00 0.00 C ATOM 1531 C TRP A 94 1.375 -15.372 -5.617 1.00 0.00 C ATOM 1532 O TRP A 94 2.428 -14.752 -5.469 1.00 0.00 O ATOM 1533 CB TRP A 94 -0.202 -14.220 -7.180 1.00 0.00 C ATOM 1534 CG TRP A 94 -1.651 -14.014 -7.501 1.00 0.00 C ATOM 1535 CD1 TRP A 94 -2.268 -12.827 -7.776 1.00 0.00 C ATOM 1536 CD2 TRP A 94 -2.664 -15.023 -7.582 1.00 0.00 C ATOM 1537 NE1 TRP A 94 -3.604 -13.037 -8.022 1.00 0.00 N ATOM 1538 CE2 TRP A 94 -3.871 -14.377 -7.909 1.00 0.00 C ATOM 1539 CE3 TRP A 94 -2.668 -16.410 -7.409 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 -5.068 -15.070 -8.067 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 -3.857 -17.098 -7.566 1.00 0.00 C ATOM 1542 CH2 TRP A 94 -5.043 -16.428 -7.892 1.00 0.00 C ATOM 0 H TRP A 94 0.720 -12.761 -5.080 1.00 0.00 H new ATOM 0 HA TRP A 94 -0.753 -15.310 -5.412 1.00 0.00 H new ATOM 0 HB2 TRP A 94 0.343 -13.298 -7.383 1.00 0.00 H new ATOM 0 HB3 TRP A 94 0.205 -14.983 -7.843 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -1.778 -11.865 -7.797 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -4.286 -12.314 -8.251 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -1.758 -16.935 -7.157 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -5.983 -14.555 -8.319 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -3.871 -18.170 -7.435 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -5.956 -16.994 -8.008 1.00 0.00 H new ATOM 1553 N ARG A 95 1.320 -16.698 -5.691 1.00 0.00 N ATOM 1554 CA ARG A 95 2.521 -17.519 -5.600 1.00 0.00 C ATOM 1555 C ARG A 95 2.594 -18.508 -6.763 1.00 0.00 C ATOM 1556 O ARG A 95 1.917 -19.536 -6.754 1.00 0.00 O ATOM 1557 CB ARG A 95 2.543 -18.277 -4.271 1.00 0.00 C ATOM 1558 CG ARG A 95 1.317 -19.147 -4.046 1.00 0.00 C ATOM 1559 CD ARG A 95 1.653 -20.627 -4.145 1.00 0.00 C ATOM 1560 NE ARG A 95 0.473 -21.439 -4.434 1.00 0.00 N ATOM 1561 CZ ARG A 95 0.526 -22.694 -4.873 1.00 0.00 C ATOM 1562 NH1 ARG A 95 1.697 -23.286 -5.075 1.00 0.00 N ATOM 1563 NH2 ARG A 95 -0.596 -23.361 -5.110 1.00 0.00 N ATOM 0 H ARG A 95 0.456 -17.226 -5.814 1.00 0.00 H new ATOM 0 HA ARG A 95 3.388 -16.860 -5.651 1.00 0.00 H new ATOM 0 HB2 ARG A 95 3.434 -18.903 -4.234 1.00 0.00 H new ATOM 0 HB3 ARG A 95 2.624 -17.560 -3.454 1.00 0.00 H new ATOM 0 HG2 ARG A 95 0.895 -18.934 -3.064 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.553 -18.897 -4.782 1.00 0.00 H new ATOM 0 HD2 ARG A 95 2.397 -20.778 -4.927 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.102 -20.960 -3.209 1.00 0.00 H new ATOM 0 HE ARG A 95 -0.445 -21.019 -4.291 1.00 0.00 H new ATOM 0 HH11 ARG A 95 2.563 -22.779 -4.894 1.00 0.00 H new ATOM 0 HH12 ARG A 95 1.731 -24.248 -5.412 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -1.499 -22.912 -4.956 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -0.556 -24.323 -5.447 1.00 0.00 H new ATOM 1577 N PRO A 96 3.421 -18.215 -7.783 1.00 0.00 N ATOM 1578 CA PRO A 96 3.572 -19.091 -8.950 1.00 0.00 C ATOM 1579 C PRO A 96 4.258 -20.407 -8.599 1.00 0.00 C ATOM 1580 O PRO A 96 4.649 -20.628 -7.453 1.00 0.00 O ATOM 1581 CB PRO A 96 4.443 -18.271 -9.906 1.00 0.00 C ATOM 1582 CG PRO A 96 5.191 -17.330 -9.027 1.00 0.00 C ATOM 1583 CD PRO A 96 4.270 -17.012 -7.882 1.00 0.00 C ATOM 0 HA PRO A 96 2.608 -19.375 -9.372 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.122 -18.911 -10.469 1.00 0.00 H new ATOM 0 HB3 PRO A 96 3.834 -17.734 -10.633 1.00 0.00 H new ATOM 0 HG2 PRO A 96 6.116 -17.782 -8.670 1.00 0.00 H new ATOM 0 HG3 PRO A 96 5.467 -16.425 -9.569 1.00 0.00 H new ATOM 0 HD2 PRO A 96 4.822 -16.833 -6.960 1.00 0.00 H new ATOM 0 HD3 PRO A 96 3.679 -16.118 -8.078 1.00 0.00 H new ATOM 1591 N LEU A 97 4.402 -21.277 -9.594 1.00 0.00 N ATOM 1592 CA LEU A 97 5.040 -22.572 -9.389 1.00 0.00 C ATOM 1593 C LEU A 97 6.537 -22.492 -9.669 1.00 0.00 C ATOM 1594 O LEU A 97 6.981 -22.717 -10.795 1.00 0.00 O ATOM 1595 CB LEU A 97 4.398 -23.629 -10.289 1.00 0.00 C ATOM 1596 CG LEU A 97 2.884 -23.781 -10.132 1.00 0.00 C ATOM 1597 CD1 LEU A 97 2.154 -22.706 -10.922 1.00 0.00 C ATOM 1598 CD2 LEU A 97 2.440 -25.166 -10.577 1.00 0.00 C ATOM 0 H LEU A 97 4.086 -21.109 -10.549 1.00 0.00 H new ATOM 0 HA LEU A 97 4.898 -22.857 -8.347 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.617 -23.381 -11.328 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.867 -24.591 -10.085 1.00 0.00 H new ATOM 0 HG LEU A 97 2.633 -23.661 -9.078 1.00 0.00 H new ATOM 0 HD11 LEU A 97 1.078 -22.831 -10.798 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.450 -21.722 -10.557 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.410 -22.793 -11.978 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.360 -25.257 -10.459 1.00 0.00 H new ATOM 0 HD22 LEU A 97 2.704 -25.314 -11.624 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.937 -25.921 -9.967 1.00 0.00 H new ATOM 1610 N ALA A 98 7.311 -22.169 -8.637 1.00 0.00 N ATOM 1611 CA ALA A 98 8.758 -22.059 -8.772 1.00 0.00 C ATOM 1612 C ALA A 98 9.415 -21.772 -7.426 1.00 0.00 C ATOM 1613 O ALA A 98 10.199 -22.577 -6.922 1.00 0.00 O ATOM 1614 CB ALA A 98 9.114 -20.973 -9.777 1.00 0.00 C ATOM 0 H ALA A 98 6.959 -21.979 -7.699 1.00 0.00 H new ATOM 0 HA ALA A 98 9.137 -23.014 -9.136 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.198 -20.902 -9.867 1.00 0.00 H new ATOM 0 HB2 ALA A 98 8.684 -21.220 -10.748 1.00 0.00 H new ATOM 0 HB3 ALA A 98 8.715 -20.017 -9.437 1.00 0.00 H new ATOM 1620 N ASP A 99 9.090 -20.620 -6.849 1.00 0.00 N ATOM 1621 CA ASP A 99 9.649 -20.225 -5.560 1.00 0.00 C ATOM 1622 C ASP A 99 8.543 -19.854 -4.578 1.00 0.00 C ATOM 1623 O ASP A 99 7.392 -19.658 -4.968 1.00 0.00 O ATOM 1624 CB ASP A 99 10.607 -19.046 -5.738 1.00 0.00 C ATOM 1625 CG ASP A 99 11.804 -19.130 -4.810 1.00 0.00 C ATOM 1626 OD1 ASP A 99 11.669 -19.720 -3.718 1.00 0.00 O ATOM 1627 OD2 ASP A 99 12.876 -18.606 -5.178 1.00 0.00 O ATOM 0 H ASP A 99 8.443 -19.943 -7.253 1.00 0.00 H new ATOM 0 HA ASP A 99 10.199 -21.074 -5.154 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.953 -19.015 -6.771 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.072 -18.115 -5.553 1.00 0.00 H new ATOM 1633 N GLU A 100 8.901 -19.759 -3.301 1.00 0.00 N ATOM 1634 CA GLU A 100 7.940 -19.410 -2.261 1.00 0.00 C ATOM 1635 C GLU A 100 8.213 -18.012 -1.715 1.00 0.00 C ATOM 1636 O GLU A 100 7.290 -17.297 -1.322 1.00 0.00 O ATOM 1637 CB GLU A 100 7.993 -20.433 -1.125 1.00 0.00 C ATOM 1638 CG GLU A 100 7.949 -21.875 -1.601 1.00 0.00 C ATOM 1639 CD GLU A 100 6.532 -22.382 -1.792 1.00 0.00 C ATOM 1640 OE1 GLU A 100 5.819 -22.547 -0.781 1.00 0.00 O ATOM 1641 OE2 GLU A 100 6.136 -22.614 -2.954 1.00 0.00 O ATOM 0 H GLU A 100 9.850 -19.919 -2.962 1.00 0.00 H new ATOM 0 HA GLU A 100 6.944 -19.420 -2.703 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.905 -20.277 -0.549 1.00 0.00 H new ATOM 0 HB3 GLU A 100 7.156 -20.257 -0.449 1.00 0.00 H new ATOM 0 HG2 GLU A 100 8.492 -21.960 -2.543 1.00 0.00 H new ATOM 0 HG3 GLU A 100 8.464 -22.508 -0.878 1.00 0.00 H new ATOM 1649 N ASN A 101 9.485 -17.629 -1.694 1.00 0.00 N ATOM 1650 CA ASN A 101 9.879 -16.316 -1.195 1.00 0.00 C ATOM 1651 C ASN A 101 9.286 -15.206 -2.058 1.00 0.00 C ATOM 1652 O ASN A 101 8.597 -14.318 -1.557 1.00 0.00 O ATOM 1653 CB ASN A 101 11.405 -16.197 -1.163 1.00 0.00 C ATOM 1654 CG ASN A 101 11.917 -15.674 0.165 1.00 0.00 C ATOM 1655 OD1 ASN A 101 11.224 -14.684 0.718 1.00 0.00 O flip ATOM 1656 ND2 ASN A 101 12.923 -16.153 0.688 1.00 0.00 N flip ATOM 0 H ASN A 101 10.260 -18.208 -2.016 1.00 0.00 H new ATOM 0 HA ASN A 101 9.493 -16.208 -0.182 1.00 0.00 H new ATOM 0 HB2 ASN A 101 11.847 -17.174 -1.360 1.00 0.00 H new ATOM 0 HB3 ASN A 101 11.732 -15.532 -1.962 1.00 0.00 H new ATOM 0 HD21 ASN A 101 13.424 -16.913 0.228 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.255 -15.790 1.582 1.00 0.00 H new ATOM 1663 N PHE A 102 9.559 -15.264 -3.357 1.00 0.00 N ATOM 1664 CA PHE A 102 9.053 -14.264 -4.289 1.00 0.00 C ATOM 1665 C PHE A 102 7.529 -14.300 -4.350 1.00 0.00 C ATOM 1666 O PHE A 102 6.930 -15.360 -4.532 1.00 0.00 O ATOM 1667 CB PHE A 102 9.637 -14.494 -5.685 1.00 0.00 C ATOM 1668 CG PHE A 102 10.846 -13.651 -5.975 1.00 0.00 C ATOM 1669 CD1 PHE A 102 12.046 -13.890 -5.325 1.00 0.00 C ATOM 1670 CD2 PHE A 102 10.781 -12.620 -6.898 1.00 0.00 C ATOM 1671 CE1 PHE A 102 13.160 -13.115 -5.590 1.00 0.00 C ATOM 1672 CE2 PHE A 102 11.891 -11.841 -7.168 1.00 0.00 C ATOM 1673 CZ PHE A 102 13.082 -12.090 -6.513 1.00 0.00 C ATOM 0 H PHE A 102 10.128 -15.993 -3.788 1.00 0.00 H new ATOM 0 HA PHE A 102 9.362 -13.282 -3.932 1.00 0.00 H new ATOM 0 HB2 PHE A 102 9.904 -15.546 -5.790 1.00 0.00 H new ATOM 0 HB3 PHE A 102 8.870 -14.284 -6.430 1.00 0.00 H new ATOM 0 HD1 PHE A 102 12.112 -14.691 -4.603 1.00 0.00 H new ATOM 0 HD2 PHE A 102 9.852 -12.422 -7.413 1.00 0.00 H new ATOM 0 HE1 PHE A 102 14.090 -13.311 -5.076 1.00 0.00 H new ATOM 0 HE2 PHE A 102 11.827 -11.040 -7.889 1.00 0.00 H new ATOM 0 HZ PHE A 102 13.951 -11.484 -6.722 1.00 0.00 H new ATOM 1683 N HIS A 103 6.907 -13.136 -4.196 1.00 0.00 N ATOM 1684 CA HIS A 103 5.453 -13.035 -4.234 1.00 0.00 C ATOM 1685 C HIS A 103 5.014 -11.736 -4.902 1.00 0.00 C ATOM 1686 O HIS A 103 5.707 -10.722 -4.824 1.00 0.00 O ATOM 1687 CB HIS A 103 4.879 -13.114 -2.818 1.00 0.00 C ATOM 1688 CG HIS A 103 4.834 -14.505 -2.267 1.00 0.00 C ATOM 1689 ND1 HIS A 103 4.644 -15.621 -3.055 1.00 0.00 N ATOM 1690 CD2 HIS A 103 4.957 -14.960 -0.998 1.00 0.00 C ATOM 1691 CE1 HIS A 103 4.651 -16.701 -2.294 1.00 0.00 C ATOM 1692 NE2 HIS A 103 4.840 -16.327 -1.042 1.00 0.00 N ATOM 0 H HIS A 103 7.387 -12.249 -4.044 1.00 0.00 H new ATOM 0 HA HIS A 103 5.071 -13.870 -4.821 1.00 0.00 H new ATOM 0 HB2 HIS A 103 5.479 -12.489 -2.156 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.871 -12.700 -2.820 1.00 0.00 H new ATOM 0 HD2 HIS A 103 5.117 -14.359 -0.115 1.00 0.00 H new ATOM 0 HE1 HIS A 103 4.524 -17.717 -2.638 1.00 0.00 H new ATOM 0 HE2 HIS A 103 4.891 -16.952 -0.238 1.00 0.00 H new ATOM 1701 N LEU A 104 3.859 -11.775 -5.558 1.00 0.00 N ATOM 1702 CA LEU A 104 3.329 -10.599 -6.240 1.00 0.00 C ATOM 1703 C LEU A 104 1.817 -10.499 -6.056 1.00 0.00 C ATOM 1704 O LEU A 104 1.075 -11.408 -6.428 1.00 0.00 O ATOM 1705 CB LEU A 104 3.670 -10.651 -7.730 1.00 0.00 C ATOM 1706 CG LEU A 104 5.159 -10.525 -8.057 1.00 0.00 C ATOM 1707 CD1 LEU A 104 5.824 -11.892 -8.054 1.00 0.00 C ATOM 1708 CD2 LEU A 104 5.353 -9.839 -9.402 1.00 0.00 C ATOM 0 H LEU A 104 3.273 -12.606 -5.632 1.00 0.00 H new ATOM 0 HA LEU A 104 3.790 -9.715 -5.799 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.302 -11.592 -8.139 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.133 -9.851 -8.239 1.00 0.00 H new ATOM 0 HG LEU A 104 5.630 -9.913 -7.287 1.00 0.00 H new ATOM 0 HD11 LEU A 104 6.883 -11.782 -8.289 1.00 0.00 H new ATOM 0 HD12 LEU A 104 5.716 -12.347 -7.069 1.00 0.00 H new ATOM 0 HD13 LEU A 104 5.351 -12.528 -8.802 1.00 0.00 H new ATOM 0 HD21 LEU A 104 6.418 -9.758 -9.619 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.868 -10.425 -10.183 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.912 -8.843 -9.369 1.00 0.00 H new ATOM 1720 N GLY A 105 1.369 -9.388 -5.479 1.00 0.00 N ATOM 1721 CA GLY A 105 -0.051 -9.191 -5.257 1.00 0.00 C ATOM 1722 C GLY A 105 -0.493 -7.770 -5.544 1.00 0.00 C ATOM 1723 O GLY A 105 0.325 -6.850 -5.564 1.00 0.00 O ATOM 0 H GLY A 105 1.963 -8.622 -5.162 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -0.613 -9.877 -5.890 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -0.292 -9.441 -4.224 1.00 0.00 H new ATOM 1727 N LEU A 106 -1.790 -7.590 -5.767 1.00 0.00 N ATOM 1728 CA LEU A 106 -2.341 -6.271 -6.056 1.00 0.00 C ATOM 1729 C LEU A 106 -3.697 -6.090 -5.379 1.00 0.00 C ATOM 1730 O LEU A 106 -4.410 -7.060 -5.124 1.00 0.00 O ATOM 1731 CB LEU A 106 -2.478 -6.071 -7.567 1.00 0.00 C ATOM 1732 CG LEU A 106 -1.327 -5.311 -8.226 1.00 0.00 C ATOM 1733 CD1 LEU A 106 -0.230 -6.272 -8.660 1.00 0.00 C ATOM 1734 CD2 LEU A 106 -1.831 -4.505 -9.414 1.00 0.00 C ATOM 0 H LEU A 106 -2.480 -8.341 -5.753 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.655 -5.522 -5.661 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.566 -7.049 -8.041 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.407 -5.536 -7.765 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.908 -4.620 -7.494 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.580 -5.712 -9.127 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.152 -6.805 -7.789 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -0.635 -6.988 -9.375 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.998 -3.971 -9.871 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.276 -5.177 -10.147 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.580 -3.789 -9.076 1.00 0.00 H new ATOM 1746 N GLY A 107 -4.046 -4.840 -5.090 1.00 0.00 N ATOM 1747 CA GLY A 107 -5.314 -4.555 -4.446 1.00 0.00 C ATOM 1748 C GLY A 107 -5.566 -3.068 -4.293 1.00 0.00 C ATOM 1749 O GLY A 107 -4.960 -2.254 -4.990 1.00 0.00 O ATOM 0 H GLY A 107 -3.473 -4.020 -5.290 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.121 -4.999 -5.028 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.333 -5.026 -3.463 1.00 0.00 H new ATOM 1753 N PHE A 108 -6.462 -2.712 -3.379 1.00 0.00 N ATOM 1754 CA PHE A 108 -6.794 -1.312 -3.136 1.00 0.00 C ATOM 1755 C PHE A 108 -6.537 -0.938 -1.680 1.00 0.00 C ATOM 1756 O PHE A 108 -6.628 -1.780 -0.787 1.00 0.00 O ATOM 1757 CB PHE A 108 -8.256 -1.042 -3.495 1.00 0.00 C ATOM 1758 CG PHE A 108 -8.517 -1.023 -4.974 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -8.730 -2.203 -5.668 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -8.549 0.175 -5.670 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -8.971 -2.189 -7.029 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -8.789 0.195 -7.031 1.00 0.00 C ATOM 1763 CZ PHE A 108 -9.000 -0.989 -7.711 1.00 0.00 C ATOM 0 H PHE A 108 -6.972 -3.374 -2.794 1.00 0.00 H new ATOM 0 HA PHE A 108 -6.154 -0.697 -3.769 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -8.882 -1.806 -3.034 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -8.555 -0.084 -3.069 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -8.707 -3.145 -5.140 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.385 1.103 -5.143 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -9.136 -3.116 -7.558 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -8.812 1.135 -7.562 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.187 -0.976 -8.775 1.00 0.00 H new ATOM 1773 N THR A 109 -6.216 0.331 -1.448 1.00 0.00 N ATOM 1774 CA THR A 109 -5.946 0.817 -0.099 1.00 0.00 C ATOM 1775 C THR A 109 -6.710 2.108 0.177 1.00 0.00 C ATOM 1776 O THR A 109 -6.805 2.981 -0.686 1.00 0.00 O ATOM 1777 CB THR A 109 -4.447 1.047 0.091 1.00 0.00 C ATOM 1778 OG1 THR A 109 -3.847 1.478 -1.117 1.00 0.00 O ATOM 1779 CG2 THR A 109 -3.706 -0.189 0.556 1.00 0.00 C ATOM 0 H THR A 109 -6.137 1.041 -2.176 1.00 0.00 H new ATOM 0 HA THR A 109 -6.283 0.059 0.608 1.00 0.00 H new ATOM 0 HB THR A 109 -4.369 1.811 0.864 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.987 1.905 -0.921 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.647 0.043 0.671 1.00 0.00 H new ATOM 0 HG22 THR A 109 -4.111 -0.518 1.513 1.00 0.00 H new ATOM 0 HG23 THR A 109 -3.825 -0.983 -0.181 1.00 0.00 H new ATOM 1787 N ALA A 110 -7.251 2.223 1.385 1.00 0.00 N ATOM 1788 CA ALA A 110 -8.006 3.407 1.776 1.00 0.00 C ATOM 1789 C ALA A 110 -7.415 4.046 3.028 1.00 0.00 C ATOM 1790 O ALA A 110 -6.806 3.367 3.854 1.00 0.00 O ATOM 1791 CB ALA A 110 -9.467 3.050 2.002 1.00 0.00 C ATOM 0 H ALA A 110 -7.180 1.510 2.111 1.00 0.00 H new ATOM 0 HA ALA A 110 -7.942 4.133 0.965 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -10.019 3.944 2.293 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -9.890 2.647 1.082 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -9.541 2.304 2.793 1.00 0.00 H new ATOM 1797 N GLY A 111 -7.599 5.356 3.161 1.00 0.00 N ATOM 1798 CA GLY A 111 -7.077 6.064 4.315 1.00 0.00 C ATOM 1799 C GLY A 111 -8.001 7.171 4.782 1.00 0.00 C ATOM 1800 O GLY A 111 -8.854 7.638 4.027 1.00 0.00 O ATOM 0 H GLY A 111 -8.100 5.939 2.491 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.920 5.358 5.130 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.103 6.487 4.068 1.00 0.00 H new ATOM 1804 N VAL A 112 -7.832 7.594 6.031 1.00 0.00 N ATOM 1805 CA VAL A 112 -8.658 8.654 6.598 1.00 0.00 C ATOM 1806 C VAL A 112 -7.875 9.479 7.612 1.00 0.00 C ATOM 1807 O VAL A 112 -7.439 8.964 8.642 1.00 0.00 O ATOM 1808 CB VAL A 112 -9.916 8.083 7.278 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -10.911 7.592 6.238 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -9.542 6.965 8.240 1.00 0.00 C ATOM 0 H VAL A 112 -7.131 7.219 6.670 1.00 0.00 H new ATOM 0 HA VAL A 112 -8.961 9.295 5.770 1.00 0.00 H new ATOM 0 HB VAL A 112 -10.390 8.880 7.851 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -11.793 7.192 6.738 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -11.204 8.422 5.594 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -10.450 6.810 5.635 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -10.444 6.574 8.711 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -9.043 6.166 7.692 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.872 7.354 9.006 1.00 0.00 H new ATOM 1820 N THR A 113 -7.699 10.763 7.315 1.00 0.00 N ATOM 1821 CA THR A 113 -6.969 11.659 8.203 1.00 0.00 C ATOM 1822 C THR A 113 -7.915 12.343 9.185 1.00 0.00 C ATOM 1823 O THR A 113 -8.759 13.147 8.790 1.00 0.00 O ATOM 1824 CB THR A 113 -6.211 12.710 7.390 1.00 0.00 C ATOM 1825 OG1 THR A 113 -5.900 12.217 6.099 1.00 0.00 O ATOM 1826 CG2 THR A 113 -4.914 13.148 8.039 1.00 0.00 C ATOM 0 H THR A 113 -8.052 11.205 6.466 1.00 0.00 H new ATOM 0 HA THR A 113 -6.254 11.064 8.771 1.00 0.00 H new ATOM 0 HB THR A 113 -6.879 13.569 7.334 1.00 0.00 H new ATOM 0 HG1 THR A 113 -5.417 12.904 5.594 1.00 0.00 H new ATOM 0 HG21 THR A 113 -4.427 13.894 7.411 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.124 13.579 9.018 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.257 12.287 8.156 1.00 0.00 H new ATOM 1834 N ALA A 114 -7.768 12.018 10.465 1.00 0.00 N ATOM 1835 CA ALA A 114 -8.609 12.599 11.503 1.00 0.00 C ATOM 1836 C ALA A 114 -8.049 13.935 11.981 1.00 0.00 C ATOM 1837 O ALA A 114 -6.864 14.219 11.809 1.00 0.00 O ATOM 1838 CB ALA A 114 -8.750 11.635 12.671 1.00 0.00 C ATOM 0 H ALA A 114 -7.073 11.355 10.808 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.595 12.781 11.076 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -9.381 12.083 13.438 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.204 10.707 12.324 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -7.766 11.423 13.089 1.00 0.00 H new ATOM 1844 N ARG A 115 -8.909 14.750 12.583 1.00 0.00 N ATOM 1845 CA ARG A 115 -8.500 16.056 13.087 1.00 0.00 C ATOM 1846 C ARG A 115 -7.648 15.911 14.344 1.00 0.00 C ATOM 1847 O ARG A 115 -7.357 14.800 14.784 1.00 0.00 O ATOM 1848 CB ARG A 115 -9.729 16.918 13.385 1.00 0.00 C ATOM 1849 CG ARG A 115 -10.775 16.213 14.234 1.00 0.00 C ATOM 1850 CD ARG A 115 -12.107 16.108 13.507 1.00 0.00 C ATOM 1851 NE ARG A 115 -12.114 15.020 12.531 1.00 0.00 N ATOM 1852 CZ ARG A 115 -12.255 13.737 12.852 1.00 0.00 C ATOM 1853 NH1 ARG A 115 -12.399 13.374 14.121 1.00 0.00 N ATOM 1854 NH2 ARG A 115 -12.250 12.811 11.902 1.00 0.00 N ATOM 0 H ARG A 115 -9.893 14.529 12.734 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.901 16.544 12.318 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.410 17.826 13.896 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.184 17.225 12.443 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -10.422 15.215 14.494 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -10.912 16.756 15.169 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -12.905 15.949 14.233 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -12.319 17.050 13.001 1.00 0.00 H new ATOM 0 HE ARG A 115 -12.004 15.259 11.545 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -12.402 14.081 14.856 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -12.507 12.388 14.360 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -12.138 13.083 10.925 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -12.358 11.827 12.148 1.00 0.00 H new ATOM 1868 N ASP A 116 -7.251 17.043 14.918 1.00 0.00 N ATOM 1869 CA ASP A 116 -6.432 17.042 16.125 1.00 0.00 C ATOM 1870 C ASP A 116 -7.163 17.720 17.279 1.00 0.00 C ATOM 1871 O ASP A 116 -7.164 17.221 18.404 1.00 0.00 O ATOM 1872 CB ASP A 116 -5.101 17.750 15.863 1.00 0.00 C ATOM 1873 CG ASP A 116 -5.289 19.150 15.313 1.00 0.00 C ATOM 1874 OD1 ASP A 116 -5.701 19.277 14.142 1.00 0.00 O ATOM 1875 OD2 ASP A 116 -5.024 20.120 16.054 1.00 0.00 O ATOM 0 H ASP A 116 -7.483 17.972 14.567 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.237 16.006 16.401 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -4.531 17.801 16.791 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -4.512 17.162 15.159 1.00 0.00 H new ATOM 1881 N ASN A 117 -7.784 18.860 16.993 1.00 0.00 N ATOM 1882 CA ASN A 117 -8.518 19.605 18.008 1.00 0.00 C ATOM 1883 C ASN A 117 -9.919 19.960 17.518 1.00 0.00 C ATOM 1884 O ASN A 117 -10.482 20.985 17.905 1.00 0.00 O ATOM 1885 CB ASN A 117 -7.759 20.879 18.384 1.00 0.00 C ATOM 1886 CG ASN A 117 -7.493 21.769 17.185 1.00 0.00 C ATOM 1887 OD1 ASN A 117 -7.730 21.378 16.043 1.00 0.00 O ATOM 1888 ND2 ASN A 117 -6.997 22.973 17.442 1.00 0.00 N ATOM 0 H ASN A 117 -7.793 19.287 16.067 1.00 0.00 H new ATOM 0 HA ASN A 117 -8.611 18.972 18.890 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -8.333 21.435 19.125 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -6.811 20.610 18.851 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -6.797 23.616 16.676 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -6.816 23.255 18.405 1.00 0.00 H new ATOM 1895 N TRP A 118 -10.477 19.108 16.664 1.00 0.00 N ATOM 1896 CA TRP A 118 -11.812 19.332 16.122 1.00 0.00 C ATOM 1897 C TRP A 118 -11.876 20.654 15.364 1.00 0.00 C ATOM 1898 O TRP A 118 -12.266 21.681 15.920 1.00 0.00 O ATOM 1899 CB TRP A 118 -12.850 19.324 17.245 1.00 0.00 C ATOM 1900 CG TRP A 118 -13.094 17.961 17.817 1.00 0.00 C ATOM 1901 CD1 TRP A 118 -13.099 16.776 17.137 1.00 0.00 C ATOM 1902 CD2 TRP A 118 -13.372 17.641 19.185 1.00 0.00 C ATOM 1903 NE1 TRP A 118 -13.362 15.740 18.001 1.00 0.00 N ATOM 1904 CE2 TRP A 118 -13.533 16.245 19.262 1.00 0.00 C ATOM 1905 CE3 TRP A 118 -13.498 18.401 20.352 1.00 0.00 C ATOM 1906 CZ2 TRP A 118 -13.814 15.594 20.462 1.00 0.00 C ATOM 1907 CZ3 TRP A 118 -13.777 17.753 21.540 1.00 0.00 C ATOM 1908 CH2 TRP A 118 -13.932 16.362 21.587 1.00 0.00 C ATOM 0 H TRP A 118 -10.025 18.256 16.332 1.00 0.00 H new ATOM 0 HA TRP A 118 -12.035 18.523 15.426 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -12.519 19.991 18.041 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -13.790 19.724 16.865 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -12.922 16.669 16.077 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -13.420 14.755 17.744 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -13.379 19.474 20.325 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -13.934 14.521 20.502 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -13.877 18.329 22.448 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -14.149 15.886 22.532 1.00 0.00 H new ATOM 1919 N ASN A 119 -11.494 20.621 14.091 1.00 0.00 N ATOM 1920 CA ASN A 119 -11.510 21.818 13.258 1.00 0.00 C ATOM 1921 C ASN A 119 -11.887 21.476 11.820 1.00 0.00 C ATOM 1922 O ASN A 119 -12.722 22.146 11.211 1.00 0.00 O ATOM 1923 CB ASN A 119 -10.144 22.505 13.289 1.00 0.00 C ATOM 1924 CG ASN A 119 -10.220 23.960 12.871 1.00 0.00 C ATOM 1925 OD1 ASN A 119 -11.215 24.639 13.123 1.00 0.00 O ATOM 1926 ND2 ASN A 119 -9.165 24.447 12.228 1.00 0.00 N ATOM 0 H ASN A 119 -11.170 19.779 13.614 1.00 0.00 H new ATOM 0 HA ASN A 119 -12.261 22.499 13.659 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -9.730 22.440 14.295 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -9.459 21.975 12.628 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -9.159 25.420 11.922 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -8.361 23.848 12.040 1.00 0.00 H new ATOM 1933 N TYR A 120 -11.267 20.431 11.282 1.00 0.00 N ATOM 1934 CA TYR A 120 -11.538 20.001 9.915 1.00 0.00 C ATOM 1935 C TYR A 120 -12.092 18.581 9.888 1.00 0.00 C ATOM 1936 O TYR A 120 -11.733 17.747 10.719 1.00 0.00 O ATOM 1937 CB TYR A 120 -10.263 20.079 9.073 1.00 0.00 C ATOM 1938 CG TYR A 120 -10.507 19.914 7.589 1.00 0.00 C ATOM 1939 CD1 TYR A 120 -11.181 20.889 6.864 1.00 0.00 C ATOM 1940 CD2 TYR A 120 -10.063 18.785 6.914 1.00 0.00 C ATOM 1941 CE1 TYR A 120 -11.406 20.742 5.509 1.00 0.00 C ATOM 1942 CE2 TYR A 120 -10.284 18.631 5.559 1.00 0.00 C ATOM 1943 CZ TYR A 120 -10.956 19.612 4.861 1.00 0.00 C ATOM 1944 OH TYR A 120 -11.177 19.462 3.511 1.00 0.00 O ATOM 0 H TYR A 120 -10.573 19.866 11.772 1.00 0.00 H new ATOM 0 HA TYR A 120 -12.288 20.670 9.493 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -9.780 21.040 9.249 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -9.569 19.307 9.407 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -11.535 21.776 7.368 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -9.536 18.014 7.457 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -11.932 21.509 4.960 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -9.932 17.746 5.049 1.00 0.00 H new ATOM 0 HH TYR A 120 -10.795 18.611 3.210 1.00 0.00 H new ATOM 1954 N ILE A 121 -12.969 18.313 8.926 1.00 0.00 N ATOM 1955 CA ILE A 121 -13.574 16.993 8.788 1.00 0.00 C ATOM 1956 C ILE A 121 -12.561 15.976 8.268 1.00 0.00 C ATOM 1957 O ILE A 121 -11.575 16.343 7.628 1.00 0.00 O ATOM 1958 CB ILE A 121 -14.784 17.027 7.835 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -14.416 17.740 6.531 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -15.966 17.712 8.504 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -15.044 17.116 5.304 1.00 0.00 C ATOM 0 H ILE A 121 -13.277 18.993 8.230 1.00 0.00 H new ATOM 0 HA ILE A 121 -13.910 16.693 9.781 1.00 0.00 H new ATOM 0 HB ILE A 121 -15.069 16.002 7.598 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.725 18.783 6.597 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -13.332 17.735 6.417 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -16.813 17.728 7.818 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -16.240 17.166 9.406 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -15.693 18.734 8.767 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.740 17.672 4.417 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -14.715 16.081 5.214 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -16.130 17.145 5.396 1.00 0.00 H new ATOM 1973 N PRO A 122 -12.791 14.679 8.534 1.00 0.00 N ATOM 1974 CA PRO A 122 -11.893 13.608 8.087 1.00 0.00 C ATOM 1975 C PRO A 122 -11.663 13.643 6.579 1.00 0.00 C ATOM 1976 O PRO A 122 -12.586 13.896 5.806 1.00 0.00 O ATOM 1977 CB PRO A 122 -12.625 12.318 8.489 1.00 0.00 C ATOM 1978 CG PRO A 122 -14.025 12.733 8.797 1.00 0.00 C ATOM 1979 CD PRO A 122 -13.939 14.150 9.283 1.00 0.00 C ATOM 0 HA PRO A 122 -10.903 13.700 8.533 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -12.601 11.586 7.682 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.154 11.853 9.355 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -14.657 12.662 7.912 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -14.466 12.086 9.556 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -14.852 14.707 9.071 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -13.778 14.200 10.360 1.00 0.00 H new ATOM 1987 N LEU A 123 -10.424 13.389 6.170 1.00 0.00 N ATOM 1988 CA LEU A 123 -10.071 13.393 4.755 1.00 0.00 C ATOM 1989 C LEU A 123 -9.872 11.971 4.236 1.00 0.00 C ATOM 1990 O LEU A 123 -8.761 11.443 4.261 1.00 0.00 O ATOM 1991 CB LEU A 123 -8.799 14.211 4.529 1.00 0.00 C ATOM 1992 CG LEU A 123 -8.512 14.572 3.070 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -9.307 15.800 2.658 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -7.023 14.804 2.864 1.00 0.00 C ATOM 0 H LEU A 123 -9.648 13.178 6.798 1.00 0.00 H new ATOM 0 HA LEU A 123 -10.894 13.849 4.204 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.870 15.132 5.108 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.951 13.651 4.923 1.00 0.00 H new ATOM 0 HG LEU A 123 -8.821 13.738 2.440 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -9.090 16.042 1.618 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -10.372 15.598 2.769 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -9.030 16.642 3.292 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.835 15.060 1.821 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.690 15.621 3.504 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -6.475 13.897 3.119 1.00 0.00 H new ATOM 2006 N PRO A 124 -10.951 11.330 3.755 1.00 0.00 N ATOM 2007 CA PRO A 124 -10.886 9.964 3.227 1.00 0.00 C ATOM 2008 C PRO A 124 -10.163 9.897 1.887 1.00 0.00 C ATOM 2009 O PRO A 124 -10.091 10.887 1.159 1.00 0.00 O ATOM 2010 CB PRO A 124 -12.357 9.579 3.060 1.00 0.00 C ATOM 2011 CG PRO A 124 -13.066 10.873 2.865 1.00 0.00 C ATOM 2012 CD PRO A 124 -12.316 11.886 3.686 1.00 0.00 C ATOM 0 HA PRO A 124 -10.329 9.297 3.885 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.499 8.917 2.206 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -12.730 9.051 3.938 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.078 11.156 1.812 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -14.105 10.801 3.188 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -12.326 12.870 3.217 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -12.753 12.002 4.678 1.00 0.00 H new ATOM 2020 N VAL A 125 -9.625 8.725 1.567 1.00 0.00 N ATOM 2021 CA VAL A 125 -8.906 8.532 0.313 1.00 0.00 C ATOM 2022 C VAL A 125 -8.993 7.083 -0.154 1.00 0.00 C ATOM 2023 O VAL A 125 -8.997 6.158 0.658 1.00 0.00 O ATOM 2024 CB VAL A 125 -7.423 8.926 0.450 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -7.274 10.439 0.489 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -6.813 8.292 1.691 1.00 0.00 C ATOM 0 H VAL A 125 -9.673 7.895 2.158 1.00 0.00 H new ATOM 0 HA VAL A 125 -9.380 9.178 -0.426 1.00 0.00 H new ATOM 0 HB VAL A 125 -6.886 8.553 -0.422 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -6.220 10.698 0.586 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -7.670 10.867 -0.432 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -7.825 10.837 1.341 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -5.765 8.582 1.770 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -7.352 8.632 2.575 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.884 7.207 1.618 1.00 0.00 H new ATOM 2036 N LEU A 126 -9.063 6.895 -1.467 1.00 0.00 N ATOM 2037 CA LEU A 126 -9.151 5.558 -2.044 1.00 0.00 C ATOM 2038 C LEU A 126 -8.360 5.476 -3.346 1.00 0.00 C ATOM 2039 O LEU A 126 -8.696 6.134 -4.331 1.00 0.00 O ATOM 2040 CB LEU A 126 -10.612 5.183 -2.297 1.00 0.00 C ATOM 2041 CG LEU A 126 -11.475 5.058 -1.040 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -12.887 5.556 -1.308 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -11.500 3.616 -0.554 1.00 0.00 C ATOM 0 H LEU A 126 -9.061 7.651 -2.152 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.721 4.853 -1.332 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -11.056 5.934 -2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -10.640 4.235 -2.834 1.00 0.00 H new ATOM 0 HG LEU A 126 -11.036 5.678 -0.258 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -13.485 5.459 -0.402 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -12.852 6.603 -1.610 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -13.337 4.964 -2.105 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.118 3.544 0.341 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.914 2.976 -1.333 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -10.485 3.293 -0.321 1.00 0.00 H new ATOM 2055 N LEU A 127 -7.307 4.664 -3.344 1.00 0.00 N ATOM 2056 CA LEU A 127 -6.469 4.496 -4.524 1.00 0.00 C ATOM 2057 C LEU A 127 -5.903 3.080 -4.592 1.00 0.00 C ATOM 2058 O LEU A 127 -5.773 2.405 -3.572 1.00 0.00 O ATOM 2059 CB LEU A 127 -5.327 5.515 -4.516 1.00 0.00 C ATOM 2060 CG LEU A 127 -4.583 5.643 -3.184 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -3.433 4.650 -3.119 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -4.076 7.064 -2.993 1.00 0.00 C ATOM 0 H LEU A 127 -7.015 4.112 -2.537 1.00 0.00 H new ATOM 0 HA LEU A 127 -7.088 4.664 -5.405 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.610 5.241 -5.290 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -5.730 6.491 -4.785 1.00 0.00 H new ATOM 0 HG LEU A 127 -5.278 5.415 -2.376 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.915 4.755 -2.166 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.822 3.636 -3.211 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -2.736 4.846 -3.934 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -3.550 7.138 -2.041 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -3.395 7.320 -3.805 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -4.919 7.755 -2.996 1.00 0.00 H new ATOM 2074 N PRO A 128 -5.557 2.611 -5.804 1.00 0.00 N ATOM 2075 CA PRO A 128 -5.002 1.268 -6.002 1.00 0.00 C ATOM 2076 C PRO A 128 -3.581 1.142 -5.464 1.00 0.00 C ATOM 2077 O PRO A 128 -2.808 2.100 -5.494 1.00 0.00 O ATOM 2078 CB PRO A 128 -5.014 1.100 -7.522 1.00 0.00 C ATOM 2079 CG PRO A 128 -4.938 2.488 -8.057 1.00 0.00 C ATOM 2080 CD PRO A 128 -5.679 3.352 -7.074 1.00 0.00 C ATOM 0 HA PRO A 128 -5.575 0.508 -5.470 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -4.170 0.499 -7.860 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -5.920 0.595 -7.857 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -3.902 2.811 -8.157 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -5.388 2.550 -9.048 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -5.239 4.347 -7.002 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -6.722 3.485 -7.363 1.00 0.00 H new ATOM 2088 N LEU A 129 -3.244 -0.045 -4.971 1.00 0.00 N ATOM 2089 CA LEU A 129 -1.915 -0.297 -4.426 1.00 0.00 C ATOM 2090 C LEU A 129 -1.448 -1.710 -4.763 1.00 0.00 C ATOM 2091 O LEU A 129 -2.256 -2.634 -4.860 1.00 0.00 O ATOM 2092 CB LEU A 129 -1.917 -0.096 -2.909 1.00 0.00 C ATOM 2093 CG LEU A 129 -0.568 -0.325 -2.225 1.00 0.00 C ATOM 2094 CD1 LEU A 129 -0.422 0.589 -1.018 1.00 0.00 C ATOM 2095 CD2 LEU A 129 -0.420 -1.781 -1.814 1.00 0.00 C ATOM 0 H LEU A 129 -3.873 -0.848 -4.938 1.00 0.00 H new ATOM 0 HA LEU A 129 -1.223 0.413 -4.879 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.249 0.919 -2.693 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.650 -0.772 -2.469 1.00 0.00 H new ATOM 0 HG LEU A 129 0.224 -0.087 -2.935 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.543 0.413 -0.543 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.484 1.629 -1.339 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.220 0.381 -0.305 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.545 -1.926 -1.329 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.218 -2.046 -1.120 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.481 -2.416 -2.697 1.00 0.00 H new ATOM 2107 N ALA A 130 -0.141 -1.869 -4.942 1.00 0.00 N ATOM 2108 CA ALA A 130 0.433 -3.169 -5.269 1.00 0.00 C ATOM 2109 C ALA A 130 1.540 -3.542 -4.291 1.00 0.00 C ATOM 2110 O ALA A 130 2.304 -2.685 -3.846 1.00 0.00 O ATOM 2111 CB ALA A 130 0.964 -3.166 -6.695 1.00 0.00 C ATOM 0 H ALA A 130 0.541 -1.114 -4.866 1.00 0.00 H new ATOM 0 HA ALA A 130 -0.355 -3.918 -5.187 1.00 0.00 H new ATOM 0 HB1 ALA A 130 1.390 -4.142 -6.927 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.149 -2.952 -7.386 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.734 -2.401 -6.795 1.00 0.00 H new ATOM 2117 N SER A 131 1.621 -4.827 -3.958 1.00 0.00 N ATOM 2118 CA SER A 131 2.636 -5.314 -3.032 1.00 0.00 C ATOM 2119 C SER A 131 3.410 -6.480 -3.638 1.00 0.00 C ATOM 2120 O SER A 131 2.854 -7.553 -3.870 1.00 0.00 O ATOM 2121 CB SER A 131 1.989 -5.746 -1.715 1.00 0.00 C ATOM 2122 OG SER A 131 1.374 -7.017 -1.842 1.00 0.00 O ATOM 0 H SER A 131 0.996 -5.549 -4.316 1.00 0.00 H new ATOM 0 HA SER A 131 3.334 -4.500 -2.836 1.00 0.00 H new ATOM 0 HB2 SER A 131 2.744 -5.781 -0.929 1.00 0.00 H new ATOM 0 HB3 SER A 131 1.247 -5.008 -1.411 1.00 0.00 H new ATOM 0 HG SER A 131 1.461 -7.332 -2.766 1.00 0.00 H new ATOM 2128 N VAL A 132 4.696 -6.262 -3.890 1.00 0.00 N ATOM 2129 CA VAL A 132 5.547 -7.295 -4.470 1.00 0.00 C ATOM 2130 C VAL A 132 6.928 -7.295 -3.821 1.00 0.00 C ATOM 2131 O VAL A 132 7.561 -6.249 -3.686 1.00 0.00 O ATOM 2132 CB VAL A 132 5.710 -7.104 -5.990 1.00 0.00 C ATOM 2133 CG1 VAL A 132 4.388 -7.342 -6.703 1.00 0.00 C ATOM 2134 CG2 VAL A 132 6.251 -5.715 -6.298 1.00 0.00 C ATOM 0 H VAL A 132 5.172 -5.380 -3.702 1.00 0.00 H new ATOM 0 HA VAL A 132 5.056 -8.250 -4.282 1.00 0.00 H new ATOM 0 HB VAL A 132 6.429 -7.837 -6.356 1.00 0.00 H new ATOM 0 HG11 VAL A 132 4.523 -7.203 -7.776 1.00 0.00 H new ATOM 0 HG12 VAL A 132 4.048 -8.359 -6.509 1.00 0.00 H new ATOM 0 HG13 VAL A 132 3.644 -6.635 -6.336 1.00 0.00 H new ATOM 0 HG21 VAL A 132 6.360 -5.598 -7.376 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.559 -4.963 -5.919 1.00 0.00 H new ATOM 0 HG23 VAL A 132 7.222 -5.588 -5.819 1.00 0.00 H new ATOM 2144 N GLY A 133 7.388 -8.476 -3.420 1.00 0.00 N ATOM 2145 CA GLY A 133 8.690 -8.587 -2.791 1.00 0.00 C ATOM 2146 C GLY A 133 8.821 -9.836 -1.940 1.00 0.00 C ATOM 2147 O GLY A 133 8.138 -10.832 -2.177 1.00 0.00 O ATOM 0 H GLY A 133 6.883 -9.356 -3.519 1.00 0.00 H new ATOM 0 HA2 GLY A 133 9.462 -8.593 -3.560 1.00 0.00 H new ATOM 0 HA3 GLY A 133 8.866 -7.708 -2.170 1.00 0.00 H new ATOM 2151 N TYR A 134 9.704 -9.781 -0.948 1.00 0.00 N ATOM 2152 CA TYR A 134 9.926 -10.913 -0.057 1.00 0.00 C ATOM 2153 C TYR A 134 8.837 -10.991 1.008 1.00 0.00 C ATOM 2154 O TYR A 134 8.312 -9.970 1.450 1.00 0.00 O ATOM 2155 CB TYR A 134 11.300 -10.804 0.607 1.00 0.00 C ATOM 2156 CG TYR A 134 12.453 -10.977 -0.357 1.00 0.00 C ATOM 2157 CD1 TYR A 134 12.697 -12.202 -0.965 1.00 0.00 C ATOM 2158 CD2 TYR A 134 13.297 -9.916 -0.657 1.00 0.00 C ATOM 2159 CE1 TYR A 134 13.751 -12.364 -1.846 1.00 0.00 C ATOM 2160 CE2 TYR A 134 14.352 -10.069 -1.537 1.00 0.00 C ATOM 2161 CZ TYR A 134 14.574 -11.295 -2.128 1.00 0.00 C ATOM 2162 OH TYR A 134 15.624 -11.453 -3.004 1.00 0.00 O ATOM 0 H TYR A 134 10.278 -8.963 -0.741 1.00 0.00 H new ATOM 0 HA TYR A 134 9.890 -11.825 -0.653 1.00 0.00 H new ATOM 0 HB2 TYR A 134 11.384 -9.831 1.091 1.00 0.00 H new ATOM 0 HB3 TYR A 134 11.376 -11.557 1.391 1.00 0.00 H new ATOM 0 HD1 TYR A 134 12.053 -13.041 -0.746 1.00 0.00 H new ATOM 0 HD2 TYR A 134 13.126 -8.955 -0.195 1.00 0.00 H new ATOM 0 HE1 TYR A 134 13.928 -13.323 -2.310 1.00 0.00 H new ATOM 0 HE2 TYR A 134 14.999 -9.233 -1.760 1.00 0.00 H new ATOM 0 HH TYR A 134 16.105 -10.604 -3.094 1.00 0.00 H new ATOM 2172 N GLY A 135 8.503 -12.212 1.417 1.00 0.00 N ATOM 2173 CA GLY A 135 7.477 -12.408 2.427 1.00 0.00 C ATOM 2174 C GLY A 135 7.657 -11.507 3.638 1.00 0.00 C ATOM 2175 O GLY A 135 6.785 -10.691 3.938 1.00 0.00 O ATOM 0 H GLY A 135 8.926 -13.071 1.066 1.00 0.00 H new ATOM 0 HA2 GLY A 135 6.499 -12.221 1.984 1.00 0.00 H new ATOM 0 HA3 GLY A 135 7.487 -13.449 2.750 1.00 0.00 H new ATOM 2179 N PRO A 136 8.784 -11.631 4.359 1.00 0.00 N ATOM 2180 CA PRO A 136 9.056 -10.812 5.545 1.00 0.00 C ATOM 2181 C PRO A 136 9.147 -9.326 5.214 1.00 0.00 C ATOM 2182 O PRO A 136 8.823 -8.474 6.042 1.00 0.00 O ATOM 2183 CB PRO A 136 10.408 -11.333 6.048 1.00 0.00 C ATOM 2184 CG PRO A 136 11.022 -12.014 4.875 1.00 0.00 C ATOM 2185 CD PRO A 136 9.879 -12.576 4.080 1.00 0.00 C ATOM 0 HA PRO A 136 8.257 -10.893 6.282 1.00 0.00 H new ATOM 0 HB2 PRO A 136 11.037 -10.517 6.404 1.00 0.00 H new ATOM 0 HB3 PRO A 136 10.279 -12.023 6.882 1.00 0.00 H new ATOM 0 HG2 PRO A 136 11.606 -11.313 4.278 1.00 0.00 H new ATOM 0 HG3 PRO A 136 11.702 -12.804 5.194 1.00 0.00 H new ATOM 0 HD2 PRO A 136 10.111 -12.621 3.016 1.00 0.00 H new ATOM 0 HD3 PRO A 136 9.628 -13.589 4.395 1.00 0.00 H new ATOM 2193 N VAL A 137 9.587 -9.022 3.997 1.00 0.00 N ATOM 2194 CA VAL A 137 9.718 -7.638 3.556 1.00 0.00 C ATOM 2195 C VAL A 137 9.224 -7.473 2.122 1.00 0.00 C ATOM 2196 O VAL A 137 9.845 -7.968 1.181 1.00 0.00 O ATOM 2197 CB VAL A 137 11.178 -7.154 3.651 1.00 0.00 C ATOM 2198 CG1 VAL A 137 12.083 -7.998 2.767 1.00 0.00 C ATOM 2199 CG2 VAL A 137 11.281 -5.681 3.281 1.00 0.00 C ATOM 0 H VAL A 137 9.859 -9.715 3.299 1.00 0.00 H new ATOM 0 HA VAL A 137 9.103 -7.031 4.220 1.00 0.00 H new ATOM 0 HB VAL A 137 11.510 -7.269 4.683 1.00 0.00 H new ATOM 0 HG11 VAL A 137 13.109 -7.639 2.849 1.00 0.00 H new ATOM 0 HG12 VAL A 137 12.036 -9.039 3.087 1.00 0.00 H new ATOM 0 HG13 VAL A 137 11.754 -7.921 1.731 1.00 0.00 H new ATOM 0 HG21 VAL A 137 12.320 -5.359 3.355 1.00 0.00 H new ATOM 0 HG22 VAL A 137 10.928 -5.537 2.260 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.669 -5.091 3.963 1.00 0.00 H new ATOM 2209 N THR A 138 8.104 -6.776 1.963 1.00 0.00 N ATOM 2210 CA THR A 138 7.526 -6.549 0.643 1.00 0.00 C ATOM 2211 C THR A 138 7.514 -5.063 0.300 1.00 0.00 C ATOM 2212 O THR A 138 7.378 -4.213 1.181 1.00 0.00 O ATOM 2213 CB THR A 138 6.103 -7.107 0.582 1.00 0.00 C ATOM 2214 OG1 THR A 138 5.234 -6.354 1.409 1.00 0.00 O ATOM 2215 CG2 THR A 138 6.009 -8.554 1.014 1.00 0.00 C ATOM 0 H THR A 138 7.578 -6.359 2.731 1.00 0.00 H new ATOM 0 HA THR A 138 8.145 -7.068 -0.089 1.00 0.00 H new ATOM 0 HB THR A 138 5.810 -7.038 -0.466 1.00 0.00 H new ATOM 0 HG1 THR A 138 4.328 -6.725 1.355 1.00 0.00 H new ATOM 0 HG21 THR A 138 4.973 -8.887 0.947 1.00 0.00 H new ATOM 0 HG22 THR A 138 6.631 -9.169 0.363 1.00 0.00 H new ATOM 0 HG23 THR A 138 6.355 -8.650 2.043 1.00 0.00 H new ATOM 2223 N PHE A 139 7.657 -4.757 -0.986 1.00 0.00 N ATOM 2224 CA PHE A 139 7.662 -3.374 -1.447 1.00 0.00 C ATOM 2225 C PHE A 139 6.247 -2.912 -1.785 1.00 0.00 C ATOM 2226 O PHE A 139 5.498 -3.618 -2.460 1.00 0.00 O ATOM 2227 CB PHE A 139 8.569 -3.226 -2.671 1.00 0.00 C ATOM 2228 CG PHE A 139 9.896 -2.594 -2.360 1.00 0.00 C ATOM 2229 CD1 PHE A 139 10.979 -3.373 -1.985 1.00 0.00 C ATOM 2230 CD2 PHE A 139 10.060 -1.220 -2.443 1.00 0.00 C ATOM 2231 CE1 PHE A 139 12.201 -2.794 -1.699 1.00 0.00 C ATOM 2232 CE2 PHE A 139 11.280 -0.636 -2.158 1.00 0.00 C ATOM 2233 CZ PHE A 139 12.352 -1.424 -1.785 1.00 0.00 C ATOM 0 H PHE A 139 7.771 -5.449 -1.727 1.00 0.00 H new ATOM 0 HA PHE A 139 8.047 -2.747 -0.643 1.00 0.00 H new ATOM 0 HB2 PHE A 139 8.738 -4.210 -3.109 1.00 0.00 H new ATOM 0 HB3 PHE A 139 8.057 -2.626 -3.423 1.00 0.00 H new ATOM 0 HD1 PHE A 139 10.867 -4.445 -1.915 1.00 0.00 H new ATOM 0 HD2 PHE A 139 9.225 -0.599 -2.734 1.00 0.00 H new ATOM 0 HE1 PHE A 139 13.037 -3.413 -1.408 1.00 0.00 H new ATOM 0 HE2 PHE A 139 11.395 0.436 -2.227 1.00 0.00 H new ATOM 0 HZ PHE A 139 13.306 -0.970 -1.561 1.00 0.00 H new ATOM 2243 N GLN A 140 5.890 -1.723 -1.312 1.00 0.00 N ATOM 2244 CA GLN A 140 4.565 -1.168 -1.565 1.00 0.00 C ATOM 2245 C GLN A 140 4.630 -0.062 -2.614 1.00 0.00 C ATOM 2246 O GLN A 140 5.454 0.848 -2.521 1.00 0.00 O ATOM 2247 CB GLN A 140 3.960 -0.627 -0.267 1.00 0.00 C ATOM 2248 CG GLN A 140 2.569 -1.163 0.026 1.00 0.00 C ATOM 2249 CD GLN A 140 2.574 -2.250 1.084 1.00 0.00 C ATOM 2250 OE1 GLN A 140 3.549 -2.987 1.228 1.00 0.00 O ATOM 2251 NE2 GLN A 140 1.481 -2.354 1.831 1.00 0.00 N ATOM 0 H GLN A 140 6.498 -1.126 -0.752 1.00 0.00 H new ATOM 0 HA GLN A 140 3.929 -1.967 -1.947 1.00 0.00 H new ATOM 0 HB2 GLN A 140 4.619 -0.878 0.564 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.917 0.461 -0.322 1.00 0.00 H new ATOM 0 HG2 GLN A 140 1.930 -0.344 0.355 1.00 0.00 H new ATOM 0 HG3 GLN A 140 2.134 -1.557 -0.893 1.00 0.00 H new ATOM 0 HE21 GLN A 140 0.696 -1.721 1.677 1.00 0.00 H new ATOM 0 HE22 GLN A 140 1.427 -3.066 2.559 1.00 0.00 H new ATOM 2260 N MET A 141 3.755 -0.147 -3.611 1.00 0.00 N ATOM 2261 CA MET A 141 3.713 0.846 -4.679 1.00 0.00 C ATOM 2262 C MET A 141 2.311 1.427 -4.827 1.00 0.00 C ATOM 2263 O MET A 141 1.359 0.707 -5.129 1.00 0.00 O ATOM 2264 CB MET A 141 4.163 0.222 -6.001 1.00 0.00 C ATOM 2265 CG MET A 141 5.666 0.026 -6.103 1.00 0.00 C ATOM 2266 SD MET A 141 6.479 1.346 -7.023 1.00 0.00 S ATOM 2267 CE MET A 141 5.998 0.933 -8.699 1.00 0.00 C ATOM 0 H MET A 141 3.065 -0.893 -3.702 1.00 0.00 H new ATOM 0 HA MET A 141 4.395 1.655 -4.417 1.00 0.00 H new ATOM 0 HB2 MET A 141 3.671 -0.743 -6.124 1.00 0.00 H new ATOM 0 HB3 MET A 141 3.831 0.856 -6.823 1.00 0.00 H new ATOM 0 HG2 MET A 141 6.090 -0.027 -5.100 1.00 0.00 H new ATOM 0 HG3 MET A 141 5.872 -0.929 -6.587 1.00 0.00 H new ATOM 0 HE1 MET A 141 6.303 1.734 -9.373 1.00 0.00 H new ATOM 0 HE2 MET A 141 6.482 0.003 -8.998 1.00 0.00 H new ATOM 0 HE3 MET A 141 4.916 0.810 -8.747 1.00 0.00 H new ATOM 2277 N THR A 142 2.192 2.733 -4.613 1.00 0.00 N ATOM 2278 CA THR A 142 0.905 3.411 -4.723 1.00 0.00 C ATOM 2279 C THR A 142 0.777 4.116 -6.071 1.00 0.00 C ATOM 2280 O THR A 142 1.678 4.840 -6.493 1.00 0.00 O ATOM 2281 CB THR A 142 0.738 4.422 -3.588 1.00 0.00 C ATOM 2282 OG1 THR A 142 1.972 5.057 -3.296 1.00 0.00 O ATOM 2283 CG2 THR A 142 0.228 3.802 -2.306 1.00 0.00 C ATOM 0 H THR A 142 2.970 3.343 -4.363 1.00 0.00 H new ATOM 0 HA THR A 142 0.119 2.660 -4.648 1.00 0.00 H new ATOM 0 HB THR A 142 -0.001 5.139 -3.946 1.00 0.00 H new ATOM 0 HG1 THR A 142 2.238 4.847 -2.377 1.00 0.00 H new ATOM 0 HG21 THR A 142 0.132 4.573 -1.542 1.00 0.00 H new ATOM 0 HG22 THR A 142 -0.745 3.345 -2.485 1.00 0.00 H new ATOM 0 HG23 THR A 142 0.929 3.040 -1.966 1.00 0.00 H new ATOM 2291 N TYR A 143 -0.350 3.897 -6.741 1.00 0.00 N ATOM 2292 CA TYR A 143 -0.598 4.509 -8.041 1.00 0.00 C ATOM 2293 C TYR A 143 -1.994 5.121 -8.097 1.00 0.00 C ATOM 2294 O TYR A 143 -2.875 4.755 -7.320 1.00 0.00 O ATOM 2295 CB TYR A 143 -0.438 3.474 -9.155 1.00 0.00 C ATOM 2296 CG TYR A 143 -0.599 4.048 -10.545 1.00 0.00 C ATOM 2297 CD1 TYR A 143 -1.854 4.161 -11.129 1.00 0.00 C ATOM 2298 CD2 TYR A 143 0.504 4.478 -11.270 1.00 0.00 C ATOM 2299 CE1 TYR A 143 -2.005 4.686 -12.399 1.00 0.00 C ATOM 2300 CE2 TYR A 143 0.362 5.005 -12.541 1.00 0.00 C ATOM 2301 CZ TYR A 143 -0.895 5.106 -13.100 1.00 0.00 C ATOM 2302 OH TYR A 143 -1.040 5.629 -14.364 1.00 0.00 O ATOM 0 H TYR A 143 -1.106 3.300 -6.405 1.00 0.00 H new ATOM 0 HA TYR A 143 0.134 5.304 -8.185 1.00 0.00 H new ATOM 0 HB2 TYR A 143 0.547 3.014 -9.073 1.00 0.00 H new ATOM 0 HB3 TYR A 143 -1.173 2.682 -9.011 1.00 0.00 H new ATOM 0 HD1 TYR A 143 -2.726 3.834 -10.582 1.00 0.00 H new ATOM 0 HD2 TYR A 143 1.489 4.400 -10.834 1.00 0.00 H new ATOM 0 HE1 TYR A 143 -2.988 4.767 -12.840 1.00 0.00 H new ATOM 0 HE2 TYR A 143 1.230 5.335 -13.092 1.00 0.00 H new ATOM 0 HH TYR A 143 -1.576 6.448 -14.319 1.00 0.00 H new ATOM 2312 N ILE A 144 -2.188 6.056 -9.022 1.00 0.00 N ATOM 2313 CA ILE A 144 -3.475 6.720 -9.181 1.00 0.00 C ATOM 2314 C ILE A 144 -3.822 6.909 -10.656 1.00 0.00 C ATOM 2315 O ILE A 144 -2.937 7.107 -11.489 1.00 0.00 O ATOM 2316 CB ILE A 144 -3.492 8.093 -8.479 1.00 0.00 C ATOM 2317 CG1 ILE A 144 -2.437 9.023 -9.087 1.00 0.00 C ATOM 2318 CG2 ILE A 144 -3.265 7.927 -6.983 1.00 0.00 C ATOM 2319 CD1 ILE A 144 -1.012 8.612 -8.782 1.00 0.00 C ATOM 0 H ILE A 144 -1.469 6.371 -9.673 1.00 0.00 H new ATOM 0 HA ILE A 144 -4.221 6.075 -8.717 1.00 0.00 H new ATOM 0 HB ILE A 144 -4.472 8.546 -8.630 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -2.573 9.054 -10.168 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -2.601 10.035 -8.716 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -3.280 8.905 -6.502 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -4.054 7.304 -6.562 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -2.298 7.453 -6.812 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -0.323 9.318 -9.246 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -0.857 8.609 -7.703 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -0.829 7.613 -9.178 1.00 0.00 H new ATOM 2331 N PRO A 145 -5.121 6.851 -11.000 1.00 0.00 N ATOM 2332 CA PRO A 145 -5.580 7.016 -12.383 1.00 0.00 C ATOM 2333 C PRO A 145 -5.448 8.456 -12.868 1.00 0.00 C ATOM 2334 O PRO A 145 -5.173 9.364 -12.085 1.00 0.00 O ATOM 2335 CB PRO A 145 -7.052 6.606 -12.319 1.00 0.00 C ATOM 2336 CG PRO A 145 -7.460 6.879 -10.914 1.00 0.00 C ATOM 2337 CD PRO A 145 -6.243 6.619 -10.070 1.00 0.00 C ATOM 0 HA PRO A 145 -4.989 6.425 -13.083 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -7.654 7.179 -13.024 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -7.181 5.554 -12.571 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -7.801 7.908 -10.800 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -8.287 6.234 -10.616 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -6.199 7.290 -9.213 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -6.236 5.602 -9.679 1.00 0.00 H new ATOM 2345 N GLY A 146 -5.647 8.658 -14.167 1.00 0.00 N ATOM 2346 CA GLY A 146 -5.547 9.988 -14.736 1.00 0.00 C ATOM 2347 C GLY A 146 -6.473 10.186 -15.920 1.00 0.00 C ATOM 2348 O GLY A 146 -7.390 9.394 -16.137 1.00 0.00 O ATOM 0 H GLY A 146 -5.876 7.923 -14.836 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -5.781 10.726 -13.969 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -4.519 10.169 -15.049 1.00 0.00 H new ATOM 2352 N THR A 147 -6.232 11.244 -16.688 1.00 0.00 N ATOM 2353 CA THR A 147 -7.051 11.542 -17.856 1.00 0.00 C ATOM 2354 C THR A 147 -6.388 11.031 -19.131 1.00 0.00 C ATOM 2355 O THR A 147 -7.063 10.611 -20.069 1.00 0.00 O ATOM 2356 CB THR A 147 -7.296 13.048 -17.964 1.00 0.00 C ATOM 2357 OG1 THR A 147 -6.210 13.772 -17.413 1.00 0.00 O ATOM 2358 CG2 THR A 147 -8.556 13.501 -17.258 1.00 0.00 C ATOM 0 H THR A 147 -5.476 11.909 -16.522 1.00 0.00 H new ATOM 0 HA THR A 147 -8.007 11.033 -17.736 1.00 0.00 H new ATOM 0 HB THR A 147 -7.405 13.249 -19.030 1.00 0.00 H new ATOM 0 HG1 THR A 147 -6.384 14.733 -17.493 1.00 0.00 H new ATOM 0 HG21 THR A 147 -8.670 14.579 -17.373 1.00 0.00 H new ATOM 0 HG22 THR A 147 -9.418 12.996 -17.693 1.00 0.00 H new ATOM 0 HG23 THR A 147 -8.488 13.255 -16.198 1.00 0.00 H new ATOM 2366 N TYR A 148 -5.059 11.071 -19.157 1.00 0.00 N ATOM 2367 CA TYR A 148 -4.303 10.612 -20.316 1.00 0.00 C ATOM 2368 C TYR A 148 -2.808 10.593 -20.018 1.00 0.00 C ATOM 2369 O TYR A 148 -2.149 9.563 -20.160 1.00 0.00 O ATOM 2370 CB TYR A 148 -4.584 11.510 -21.522 1.00 0.00 C ATOM 2371 CG TYR A 148 -4.633 10.764 -22.836 1.00 0.00 C ATOM 2372 CD1 TYR A 148 -3.470 10.295 -23.435 1.00 0.00 C ATOM 2373 CD2 TYR A 148 -5.842 10.529 -23.478 1.00 0.00 C ATOM 2374 CE1 TYR A 148 -3.511 9.612 -24.636 1.00 0.00 C ATOM 2375 CE2 TYR A 148 -5.891 9.847 -24.679 1.00 0.00 C ATOM 2376 CZ TYR A 148 -4.723 9.391 -25.253 1.00 0.00 C ATOM 2377 OH TYR A 148 -4.769 8.712 -26.450 1.00 0.00 O ATOM 0 H TYR A 148 -4.484 11.417 -18.388 1.00 0.00 H new ATOM 0 HA TYR A 148 -4.621 9.595 -20.547 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -5.534 12.022 -21.369 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -3.813 12.279 -21.579 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -2.518 10.467 -22.954 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -6.759 10.885 -23.031 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -2.598 9.254 -25.088 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -6.839 9.672 -25.166 1.00 0.00 H new ATOM 0 HH TYR A 148 -5.699 8.640 -26.750 1.00 0.00 H new ATOM 2387 N ASN A 149 -2.277 11.740 -19.605 1.00 0.00 N ATOM 2388 CA ASN A 149 -0.859 11.855 -19.287 1.00 0.00 C ATOM 2389 C ASN A 149 -0.627 11.751 -17.783 1.00 0.00 C ATOM 2390 O ASN A 149 -1.062 12.611 -17.017 1.00 0.00 O ATOM 2391 CB ASN A 149 -0.305 13.182 -19.808 1.00 0.00 C ATOM 2392 CG ASN A 149 -1.103 14.375 -19.319 1.00 0.00 C ATOM 2393 OD1 ASN A 149 -2.325 14.414 -19.451 1.00 0.00 O ATOM 2394 ND2 ASN A 149 -0.411 15.356 -18.751 1.00 0.00 N ATOM 0 H ASN A 149 -2.808 12.602 -19.483 1.00 0.00 H new ATOM 0 HA ASN A 149 -0.336 11.033 -19.775 1.00 0.00 H new ATOM 0 HB2 ASN A 149 0.733 13.288 -19.492 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -0.306 13.170 -20.898 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -0.893 16.185 -18.403 1.00 0.00 H new ATOM 0 HD22 ASN A 149 0.602 15.281 -18.663 1.00 0.00 H new ATOM 2401 N ASN A 150 0.060 10.693 -17.366 1.00 0.00 N ATOM 2402 CA ASN A 150 0.350 10.477 -15.954 1.00 0.00 C ATOM 2403 C ASN A 150 1.781 10.889 -15.624 1.00 0.00 C ATOM 2404 O ASN A 150 2.056 11.399 -14.538 1.00 0.00 O ATOM 2405 CB ASN A 150 0.132 9.008 -15.586 1.00 0.00 C ATOM 2406 CG ASN A 150 -1.301 8.720 -15.180 1.00 0.00 C ATOM 2407 OD1 ASN A 150 -1.558 8.206 -14.092 1.00 0.00 O ATOM 2408 ND2 ASN A 150 -2.242 9.052 -16.056 1.00 0.00 N ATOM 0 H ASN A 150 0.427 9.971 -17.987 1.00 0.00 H new ATOM 0 HA ASN A 150 -0.331 11.096 -15.370 1.00 0.00 H new ATOM 0 HB2 ASN A 150 0.399 8.380 -16.436 1.00 0.00 H new ATOM 0 HB3 ASN A 150 0.800 8.738 -14.768 1.00 0.00 H new ATOM 0 HD21 ASN A 150 -3.224 8.883 -15.838 1.00 0.00 H new ATOM 0 HD22 ASN A 150 -1.983 9.476 -16.947 1.00 0.00 H new ATOM 2415 N GLY A 151 2.688 10.665 -16.569 1.00 0.00 N ATOM 2416 CA GLY A 151 4.079 11.019 -16.360 1.00 0.00 C ATOM 2417 C GLY A 151 4.838 9.964 -15.576 1.00 0.00 C ATOM 2418 O GLY A 151 5.844 10.264 -14.933 1.00 0.00 O ATOM 0 H GLY A 151 2.484 10.245 -17.476 1.00 0.00 H new ATOM 0 HA2 GLY A 151 4.562 11.166 -17.326 1.00 0.00 H new ATOM 0 HA3 GLY A 151 4.132 11.969 -15.829 1.00 0.00 H new ATOM 2422 N ASN A 152 4.355 8.726 -15.630 1.00 0.00 N ATOM 2423 CA ASN A 152 4.995 7.624 -14.919 1.00 0.00 C ATOM 2424 C ASN A 152 5.086 7.918 -13.425 1.00 0.00 C ATOM 2425 O ASN A 152 6.085 7.601 -12.779 1.00 0.00 O ATOM 2426 CB ASN A 152 6.392 7.368 -15.487 1.00 0.00 C ATOM 2427 CG ASN A 152 6.852 5.939 -15.270 1.00 0.00 C ATOM 2428 OD1 ASN A 152 6.274 5.000 -15.816 1.00 0.00 O ATOM 2429 ND2 ASN A 152 7.896 5.770 -14.466 1.00 0.00 N ATOM 0 H ASN A 152 3.524 8.461 -16.158 1.00 0.00 H new ATOM 0 HA ASN A 152 4.384 6.732 -15.057 1.00 0.00 H new ATOM 0 HB2 ASN A 152 6.393 7.589 -16.554 1.00 0.00 H new ATOM 0 HB3 ASN A 152 7.102 8.050 -15.019 1.00 0.00 H new ATOM 0 HD21 ASN A 152 8.250 4.832 -14.280 1.00 0.00 H new ATOM 0 HD22 ASN A 152 8.344 6.579 -14.035 1.00 0.00 H new ATOM 2436 N VAL A 153 4.036 8.526 -12.882 1.00 0.00 N ATOM 2437 CA VAL A 153 3.998 8.862 -11.464 1.00 0.00 C ATOM 2438 C VAL A 153 3.802 7.614 -10.608 1.00 0.00 C ATOM 2439 O VAL A 153 2.743 6.988 -10.638 1.00 0.00 O ATOM 2440 CB VAL A 153 2.873 9.871 -11.155 1.00 0.00 C ATOM 2441 CG1 VAL A 153 1.512 9.281 -11.493 1.00 0.00 C ATOM 2442 CG2 VAL A 153 2.928 10.305 -9.698 1.00 0.00 C ATOM 0 H VAL A 153 3.201 8.796 -13.402 1.00 0.00 H new ATOM 0 HA VAL A 153 4.958 9.317 -11.220 1.00 0.00 H new ATOM 0 HB VAL A 153 3.023 10.752 -11.778 1.00 0.00 H new ATOM 0 HG11 VAL A 153 0.733 10.010 -11.267 1.00 0.00 H new ATOM 0 HG12 VAL A 153 1.477 9.030 -12.553 1.00 0.00 H new ATOM 0 HG13 VAL A 153 1.349 8.380 -10.901 1.00 0.00 H new ATOM 0 HG21 VAL A 153 2.127 11.017 -9.500 1.00 0.00 H new ATOM 0 HG22 VAL A 153 2.807 9.434 -9.054 1.00 0.00 H new ATOM 0 HG23 VAL A 153 3.890 10.776 -9.495 1.00 0.00 H new ATOM 2452 N TYR A 154 4.832 7.257 -9.847 1.00 0.00 N ATOM 2453 CA TYR A 154 4.773 6.083 -8.983 1.00 0.00 C ATOM 2454 C TYR A 154 5.403 6.375 -7.626 1.00 0.00 C ATOM 2455 O TYR A 154 6.399 7.094 -7.533 1.00 0.00 O ATOM 2456 CB TYR A 154 5.485 4.902 -9.644 1.00 0.00 C ATOM 2457 CG TYR A 154 4.604 4.114 -10.589 1.00 0.00 C ATOM 2458 CD1 TYR A 154 4.512 4.459 -11.932 1.00 0.00 C ATOM 2459 CD2 TYR A 154 3.865 3.029 -10.138 1.00 0.00 C ATOM 2460 CE1 TYR A 154 3.709 3.741 -12.798 1.00 0.00 C ATOM 2461 CE2 TYR A 154 3.059 2.307 -10.998 1.00 0.00 C ATOM 2462 CZ TYR A 154 2.984 2.667 -12.327 1.00 0.00 C ATOM 2463 OH TYR A 154 2.183 1.952 -13.186 1.00 0.00 O ATOM 0 H TYR A 154 5.717 7.763 -9.811 1.00 0.00 H new ATOM 0 HA TYR A 154 3.724 5.827 -8.830 1.00 0.00 H new ATOM 0 HB2 TYR A 154 6.352 5.272 -10.192 1.00 0.00 H new ATOM 0 HB3 TYR A 154 5.860 4.234 -8.868 1.00 0.00 H new ATOM 0 HD1 TYR A 154 5.077 5.301 -12.305 1.00 0.00 H new ATOM 0 HD2 TYR A 154 3.921 2.744 -9.098 1.00 0.00 H new ATOM 0 HE1 TYR A 154 3.650 4.020 -13.840 1.00 0.00 H new ATOM 0 HE2 TYR A 154 2.491 1.465 -10.631 1.00 0.00 H new ATOM 0 HH TYR A 154 1.742 1.227 -12.695 1.00 0.00 H new ATOM 2473 N PHE A 155 4.816 5.813 -6.573 1.00 0.00 N ATOM 2474 CA PHE A 155 5.321 6.013 -5.219 1.00 0.00 C ATOM 2475 C PHE A 155 5.867 4.711 -4.644 1.00 0.00 C ATOM 2476 O PHE A 155 5.351 3.630 -4.931 1.00 0.00 O ATOM 2477 CB PHE A 155 4.213 6.561 -4.316 1.00 0.00 C ATOM 2478 CG PHE A 155 4.222 8.058 -4.195 1.00 0.00 C ATOM 2479 CD1 PHE A 155 3.972 8.857 -5.300 1.00 0.00 C ATOM 2480 CD2 PHE A 155 4.480 8.665 -2.977 1.00 0.00 C ATOM 2481 CE1 PHE A 155 3.981 10.234 -5.191 1.00 0.00 C ATOM 2482 CE2 PHE A 155 4.489 10.043 -2.863 1.00 0.00 C ATOM 2483 CZ PHE A 155 4.238 10.828 -3.972 1.00 0.00 C ATOM 0 H PHE A 155 3.991 5.216 -6.632 1.00 0.00 H new ATOM 0 HA PHE A 155 6.135 6.737 -5.264 1.00 0.00 H new ATOM 0 HB2 PHE A 155 3.247 6.242 -4.706 1.00 0.00 H new ATOM 0 HB3 PHE A 155 4.316 6.124 -3.323 1.00 0.00 H new ATOM 0 HD1 PHE A 155 3.768 8.398 -6.256 1.00 0.00 H new ATOM 0 HD2 PHE A 155 4.676 8.056 -2.107 1.00 0.00 H new ATOM 0 HE1 PHE A 155 3.787 10.846 -6.060 1.00 0.00 H new ATOM 0 HE2 PHE A 155 4.692 10.505 -1.908 1.00 0.00 H new ATOM 0 HZ PHE A 155 4.243 11.904 -3.885 1.00 0.00 H new ATOM 2493 N ALA A 156 6.911 4.820 -3.830 1.00 0.00 N ATOM 2494 CA ALA A 156 7.527 3.651 -3.215 1.00 0.00 C ATOM 2495 C ALA A 156 7.186 3.568 -1.730 1.00 0.00 C ATOM 2496 O ALA A 156 6.780 4.557 -1.120 1.00 0.00 O ATOM 2497 CB ALA A 156 9.036 3.686 -3.410 1.00 0.00 C ATOM 0 H ALA A 156 7.349 5.707 -3.581 1.00 0.00 H new ATOM 0 HA ALA A 156 7.128 2.762 -3.703 1.00 0.00 H new ATOM 0 HB1 ALA A 156 9.483 2.807 -2.946 1.00 0.00 H new ATOM 0 HB2 ALA A 156 9.265 3.690 -4.476 1.00 0.00 H new ATOM 0 HB3 ALA A 156 9.442 4.586 -2.948 1.00 0.00 H new ATOM 2503 N TRP A 157 7.354 2.381 -1.156 1.00 0.00 N ATOM 2504 CA TRP A 157 7.064 2.168 0.257 1.00 0.00 C ATOM 2505 C TRP A 157 7.696 0.870 0.751 1.00 0.00 C ATOM 2506 O TRP A 157 8.183 0.065 -0.041 1.00 0.00 O ATOM 2507 CB TRP A 157 5.551 2.138 0.489 1.00 0.00 C ATOM 2508 CG TRP A 157 5.050 3.299 1.293 1.00 0.00 C ATOM 2509 CD1 TRP A 157 5.217 3.500 2.634 1.00 0.00 C ATOM 2510 CD2 TRP A 157 4.300 4.418 0.809 1.00 0.00 C ATOM 2511 NE1 TRP A 157 4.616 4.676 3.012 1.00 0.00 N ATOM 2512 CE2 TRP A 157 4.047 5.259 1.909 1.00 0.00 C ATOM 2513 CE3 TRP A 157 3.819 4.793 -0.449 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 3.334 6.449 1.789 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 3.111 5.973 -0.567 1.00 0.00 C ATOM 2516 CH2 TRP A 157 2.874 6.790 0.545 1.00 0.00 C ATOM 0 H TRP A 157 7.689 1.552 -1.647 1.00 0.00 H new ATOM 0 HA TRP A 157 7.493 2.996 0.822 1.00 0.00 H new ATOM 0 HB2 TRP A 157 5.043 2.127 -0.475 1.00 0.00 H new ATOM 0 HB3 TRP A 157 5.287 1.211 0.999 1.00 0.00 H new ATOM 0 HD1 TRP A 157 5.744 2.832 3.299 1.00 0.00 H new ATOM 0 HE1 TRP A 157 4.596 5.054 3.959 1.00 0.00 H new ATOM 0 HE3 TRP A 157 3.998 4.171 -1.313 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 3.150 7.080 2.646 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 2.734 6.271 -1.534 1.00 0.00 H new ATOM 0 HH2 TRP A 157 2.318 7.707 0.419 1.00 0.00 H new ATOM 2527 N MET A 158 7.682 0.675 2.066 1.00 0.00 N ATOM 2528 CA MET A 158 8.254 -0.526 2.666 1.00 0.00 C ATOM 2529 C MET A 158 7.358 -1.056 3.780 1.00 0.00 C ATOM 2530 O MET A 158 6.819 -0.288 4.577 1.00 0.00 O ATOM 2531 CB MET A 158 9.651 -0.231 3.217 1.00 0.00 C ATOM 2532 CG MET A 158 10.719 -0.124 2.141 1.00 0.00 C ATOM 2533 SD MET A 158 12.390 -0.126 2.819 1.00 0.00 S ATOM 2534 CE MET A 158 13.261 -1.067 1.569 1.00 0.00 C ATOM 0 H MET A 158 7.282 1.332 2.736 1.00 0.00 H new ATOM 0 HA MET A 158 8.330 -1.288 1.891 1.00 0.00 H new ATOM 0 HB2 MET A 158 9.621 0.701 3.781 1.00 0.00 H new ATOM 0 HB3 MET A 158 9.930 -1.018 3.917 1.00 0.00 H new ATOM 0 HG2 MET A 158 10.613 -0.956 1.445 1.00 0.00 H new ATOM 0 HG3 MET A 158 10.564 0.791 1.570 1.00 0.00 H new ATOM 0 HE1 MET A 158 14.204 -1.429 1.978 1.00 0.00 H new ATOM 0 HE2 MET A 158 12.650 -1.915 1.261 1.00 0.00 H new ATOM 0 HE3 MET A 158 13.459 -0.430 0.707 1.00 0.00 H new ATOM 2544 N ARG A 159 7.202 -2.375 3.829 1.00 0.00 N ATOM 2545 CA ARG A 159 6.370 -3.009 4.846 1.00 0.00 C ATOM 2546 C ARG A 159 7.085 -4.206 5.464 1.00 0.00 C ATOM 2547 O ARG A 159 7.512 -5.120 4.758 1.00 0.00 O ATOM 2548 CB ARG A 159 5.037 -3.453 4.241 1.00 0.00 C ATOM 2549 CG ARG A 159 4.071 -4.034 5.260 1.00 0.00 C ATOM 2550 CD ARG A 159 2.647 -4.059 4.727 1.00 0.00 C ATOM 2551 NE ARG A 159 2.495 -4.999 3.618 1.00 0.00 N ATOM 2552 CZ ARG A 159 1.323 -5.474 3.204 1.00 0.00 C ATOM 2553 NH1 ARG A 159 0.199 -5.103 3.805 1.00 0.00 N ATOM 2554 NH2 ARG A 159 1.273 -6.325 2.188 1.00 0.00 N ATOM 0 H ARG A 159 7.640 -3.025 3.177 1.00 0.00 H new ATOM 0 HA ARG A 159 6.178 -2.277 5.631 1.00 0.00 H new ATOM 0 HB2 ARG A 159 4.567 -2.600 3.752 1.00 0.00 H new ATOM 0 HB3 ARG A 159 5.228 -4.197 3.468 1.00 0.00 H new ATOM 0 HG2 ARG A 159 4.381 -5.046 5.521 1.00 0.00 H new ATOM 0 HG3 ARG A 159 4.108 -3.444 6.175 1.00 0.00 H new ATOM 0 HD2 ARG A 159 1.964 -4.333 5.531 1.00 0.00 H new ATOM 0 HD3 ARG A 159 2.366 -3.059 4.396 1.00 0.00 H new ATOM 0 HE ARG A 159 3.337 -5.309 3.133 1.00 0.00 H new ATOM 0 HH11 ARG A 159 0.231 -4.451 4.588 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -0.697 -5.470 3.483 1.00 0.00 H new ATOM 0 HH21 ARG A 159 2.133 -6.616 1.723 1.00 0.00 H new ATOM 0 HH22 ARG A 159 0.374 -6.689 1.871 1.00 0.00 H new ATOM 2568 N PHE A 160 7.209 -4.194 6.788 1.00 0.00 N ATOM 2569 CA PHE A 160 7.872 -5.280 7.503 1.00 0.00 C ATOM 2570 C PHE A 160 6.850 -6.191 8.174 1.00 0.00 C ATOM 2571 O PHE A 160 5.791 -5.740 8.609 1.00 0.00 O ATOM 2572 CB PHE A 160 8.833 -4.715 8.550 1.00 0.00 C ATOM 2573 CG PHE A 160 10.113 -4.187 7.967 1.00 0.00 C ATOM 2574 CD1 PHE A 160 10.091 -3.226 6.968 1.00 0.00 C ATOM 2575 CD2 PHE A 160 11.339 -4.650 8.419 1.00 0.00 C ATOM 2576 CE1 PHE A 160 11.266 -2.739 6.430 1.00 0.00 C ATOM 2577 CE2 PHE A 160 12.518 -4.166 7.884 1.00 0.00 C ATOM 2578 CZ PHE A 160 12.482 -3.209 6.889 1.00 0.00 C ATOM 0 H PHE A 160 6.860 -3.446 7.387 1.00 0.00 H new ATOM 0 HA PHE A 160 8.437 -5.868 6.780 1.00 0.00 H new ATOM 0 HB2 PHE A 160 8.334 -3.914 9.095 1.00 0.00 H new ATOM 0 HB3 PHE A 160 9.068 -5.495 9.274 1.00 0.00 H new ATOM 0 HD1 PHE A 160 9.144 -2.854 6.606 1.00 0.00 H new ATOM 0 HD2 PHE A 160 11.373 -5.397 9.198 1.00 0.00 H new ATOM 0 HE1 PHE A 160 11.235 -1.991 5.651 1.00 0.00 H new ATOM 0 HE2 PHE A 160 13.467 -4.536 8.244 1.00 0.00 H new ATOM 0 HZ PHE A 160 13.402 -2.829 6.470 1.00 0.00 H new ATOM 2588 N GLN A 161 7.175 -7.478 8.255 1.00 0.00 N ATOM 2589 CA GLN A 161 6.286 -8.454 8.874 1.00 0.00 C ATOM 2590 C GLN A 161 6.989 -9.186 10.013 1.00 0.00 C ATOM 2591 O GLN A 161 8.133 -9.619 9.874 1.00 0.00 O ATOM 2592 CB GLN A 161 5.796 -9.461 7.832 1.00 0.00 C ATOM 2593 CG GLN A 161 4.684 -8.926 6.944 1.00 0.00 C ATOM 2594 CD GLN A 161 5.191 -8.456 5.594 1.00 0.00 C ATOM 2595 OE1 GLN A 161 6.384 -8.213 5.417 1.00 0.00 O ATOM 2596 NE2 GLN A 161 4.283 -8.324 4.635 1.00 0.00 N ATOM 0 H GLN A 161 8.048 -7.869 7.900 1.00 0.00 H new ATOM 0 HA GLN A 161 5.430 -7.919 9.284 1.00 0.00 H new ATOM 0 HB2 GLN A 161 6.636 -9.762 7.206 1.00 0.00 H new ATOM 0 HB3 GLN A 161 5.442 -10.357 8.343 1.00 0.00 H new ATOM 0 HG2 GLN A 161 3.936 -9.705 6.796 1.00 0.00 H new ATOM 0 HG3 GLN A 161 4.187 -8.098 7.450 1.00 0.00 H new ATOM 0 HE21 GLN A 161 3.304 -8.537 4.827 1.00 0.00 H new ATOM 0 HE22 GLN A 161 4.564 -8.010 3.706 1.00 0.00 H new ATOM 2605 N PHE A 162 6.297 -9.318 11.140 1.00 0.00 N ATOM 2606 CA PHE A 162 6.855 -9.998 12.304 1.00 0.00 C ATOM 2607 C PHE A 162 5.828 -10.934 12.931 1.00 0.00 C ATOM 2608 O PHE A 162 4.673 -10.560 13.131 1.00 0.00 O ATOM 2609 CB PHE A 162 7.330 -8.975 13.338 1.00 0.00 C ATOM 2610 CG PHE A 162 8.316 -7.981 12.791 1.00 0.00 C ATOM 2611 CD1 PHE A 162 9.648 -8.325 12.629 1.00 0.00 C ATOM 2612 CD2 PHE A 162 7.909 -6.704 12.440 1.00 0.00 C ATOM 2613 CE1 PHE A 162 10.557 -7.413 12.126 1.00 0.00 C ATOM 2614 CE2 PHE A 162 8.813 -5.788 11.937 1.00 0.00 C ATOM 2615 CZ PHE A 162 10.139 -6.143 11.780 1.00 0.00 C ATOM 0 H PHE A 162 5.350 -8.964 11.272 1.00 0.00 H new ATOM 0 HA PHE A 162 7.707 -10.593 11.974 1.00 0.00 H new ATOM 0 HB2 PHE A 162 6.466 -8.439 13.730 1.00 0.00 H new ATOM 0 HB3 PHE A 162 7.785 -9.502 14.176 1.00 0.00 H new ATOM 0 HD1 PHE A 162 9.980 -9.317 12.899 1.00 0.00 H new ATOM 0 HD2 PHE A 162 6.874 -6.421 12.561 1.00 0.00 H new ATOM 0 HE1 PHE A 162 11.593 -7.693 12.004 1.00 0.00 H new ATOM 0 HE2 PHE A 162 8.483 -4.796 11.667 1.00 0.00 H new ATOM 0 HZ PHE A 162 10.847 -5.429 11.387 1.00 0.00 H new ATOM 2625 N LEU A 163 6.258 -12.153 13.242 1.00 0.00 N ATOM 2626 CA LEU A 163 5.375 -13.144 13.848 1.00 0.00 C ATOM 2627 C LEU A 163 5.711 -13.342 15.322 1.00 0.00 C ATOM 2628 O LEU A 163 6.852 -13.147 15.741 1.00 0.00 O ATOM 2629 CB LEU A 163 5.483 -14.476 13.104 1.00 0.00 C ATOM 2630 CG LEU A 163 4.302 -15.427 13.304 1.00 0.00 C ATOM 2631 CD1 LEU A 163 3.219 -15.156 12.271 1.00 0.00 C ATOM 2632 CD2 LEU A 163 4.764 -16.875 13.227 1.00 0.00 C ATOM 0 H LEU A 163 7.212 -12.478 13.085 1.00 0.00 H new ATOM 0 HA LEU A 163 4.351 -12.777 13.774 1.00 0.00 H new ATOM 0 HB2 LEU A 163 5.589 -14.272 12.039 1.00 0.00 H new ATOM 0 HB3 LEU A 163 6.394 -14.981 13.424 1.00 0.00 H new ATOM 0 HG LEU A 163 3.883 -15.253 14.295 1.00 0.00 H new ATOM 0 HD11 LEU A 163 2.386 -15.842 12.428 1.00 0.00 H new ATOM 0 HD12 LEU A 163 2.868 -14.129 12.373 1.00 0.00 H new ATOM 0 HD13 LEU A 163 3.626 -15.303 11.270 1.00 0.00 H new ATOM 0 HD21 LEU A 163 3.911 -17.537 13.372 1.00 0.00 H new ATOM 0 HD22 LEU A 163 5.208 -17.064 12.250 1.00 0.00 H new ATOM 0 HD23 LEU A 163 5.505 -17.062 14.005 1.00 0.00 H new ATOM 2644 N GLU A 164 4.709 -13.731 16.105 1.00 0.00 N ATOM 2645 CA GLU A 164 4.898 -13.956 17.534 1.00 0.00 C ATOM 2646 C GLU A 164 4.402 -15.341 17.936 1.00 0.00 C ATOM 2647 O GLU A 164 3.205 -15.622 17.882 1.00 0.00 O ATOM 2648 CB GLU A 164 4.164 -12.885 18.342 1.00 0.00 C ATOM 2649 CG GLU A 164 4.630 -11.469 18.038 1.00 0.00 C ATOM 2650 CD GLU A 164 3.621 -10.685 17.223 1.00 0.00 C ATOM 2651 OE1 GLU A 164 2.758 -10.017 17.830 1.00 0.00 O ATOM 2652 OE2 GLU A 164 3.693 -10.739 15.977 1.00 0.00 O ATOM 0 H GLU A 164 3.759 -13.897 15.774 1.00 0.00 H new ATOM 0 HA GLU A 164 5.965 -13.895 17.748 1.00 0.00 H new ATOM 0 HB2 GLU A 164 3.095 -12.958 18.141 1.00 0.00 H new ATOM 0 HB3 GLU A 164 4.303 -13.084 19.405 1.00 0.00 H new ATOM 0 HG2 GLU A 164 4.821 -10.945 18.974 1.00 0.00 H new ATOM 0 HG3 GLU A 164 5.575 -11.510 17.497 1.00 0.00 H new ATOM 2660 N HIS A 165 5.330 -16.203 18.338 1.00 0.00 N ATOM 2661 CA HIS A 165 4.986 -17.559 18.749 1.00 0.00 C ATOM 2662 C HIS A 165 4.035 -17.541 19.942 1.00 0.00 C ATOM 2663 O HIS A 165 3.559 -16.483 20.353 1.00 0.00 O ATOM 2664 CB HIS A 165 6.253 -18.343 19.100 1.00 0.00 C ATOM 2665 CG HIS A 165 6.591 -19.407 18.102 1.00 0.00 C ATOM 2666 ND1 HIS A 165 7.886 -19.794 17.825 1.00 0.00 N ATOM 2667 CD2 HIS A 165 5.797 -20.168 17.313 1.00 0.00 C ATOM 2668 CE1 HIS A 165 7.872 -20.745 16.908 1.00 0.00 C ATOM 2669 NE2 HIS A 165 6.617 -20.991 16.581 1.00 0.00 N ATOM 0 H HIS A 165 6.326 -15.987 18.388 1.00 0.00 H new ATOM 0 HA HIS A 165 4.483 -18.050 17.916 1.00 0.00 H new ATOM 0 HB2 HIS A 165 7.090 -17.649 19.178 1.00 0.00 H new ATOM 0 HB3 HIS A 165 6.127 -18.802 20.081 1.00 0.00 H new ATOM 0 HD2 HIS A 165 4.718 -20.134 17.268 1.00 0.00 H new ATOM 0 HE1 HIS A 165 8.740 -21.238 16.496 1.00 0.00 H new ATOM 0 HE2 HIS A 165 6.307 -21.680 15.896 1.00 0.00 H new ATOM 2678 N HIS A 166 3.761 -18.720 20.492 1.00 0.00 N ATOM 2679 CA HIS A 166 2.866 -18.840 21.637 1.00 0.00 C ATOM 2680 C HIS A 166 3.197 -20.084 22.456 1.00 0.00 C ATOM 2681 O HIS A 166 4.222 -20.730 22.236 1.00 0.00 O ATOM 2682 CB HIS A 166 1.411 -18.890 21.168 1.00 0.00 C ATOM 2683 CG HIS A 166 0.634 -17.652 21.494 1.00 0.00 C ATOM 2684 ND1 HIS A 166 -0.119 -17.515 22.641 1.00 0.00 N ATOM 2685 CD2 HIS A 166 0.498 -16.487 20.816 1.00 0.00 C ATOM 2686 CE1 HIS A 166 -0.686 -16.321 22.654 1.00 0.00 C ATOM 2687 NE2 HIS A 166 -0.328 -15.679 21.558 1.00 0.00 N ATOM 0 H HIS A 166 4.146 -19.605 20.163 1.00 0.00 H new ATOM 0 HA HIS A 166 3.004 -17.965 22.272 1.00 0.00 H new ATOM 0 HB2 HIS A 166 1.391 -19.048 20.090 1.00 0.00 H new ATOM 0 HB3 HIS A 166 0.920 -19.749 21.626 1.00 0.00 H new ATOM 0 HD1 HIS A 166 -0.222 -18.225 23.366 1.00 0.00 H new ATOM 0 HD2 HIS A 166 0.954 -16.240 19.869 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -1.332 -15.936 23.429 1.00 0.00 H new ATOM 2696 N HIS A 167 2.323 -20.414 23.401 1.00 0.00 N ATOM 2697 CA HIS A 167 2.522 -21.581 24.254 1.00 0.00 C ATOM 2698 C HIS A 167 3.808 -21.448 25.063 1.00 0.00 C ATOM 2699 O HIS A 167 4.894 -21.770 24.580 1.00 0.00 O ATOM 2700 CB HIS A 167 2.568 -22.854 23.408 1.00 0.00 C ATOM 2701 CG HIS A 167 1.275 -23.162 22.718 1.00 0.00 C ATOM 2702 ND1 HIS A 167 1.205 -23.652 21.431 1.00 0.00 N ATOM 2703 CD2 HIS A 167 -0.006 -23.048 23.145 1.00 0.00 C ATOM 2704 CE1 HIS A 167 -0.061 -23.824 21.095 1.00 0.00 C ATOM 2705 NE2 HIS A 167 -0.816 -23.465 22.117 1.00 0.00 N ATOM 0 H HIS A 167 1.470 -19.890 23.596 1.00 0.00 H new ATOM 0 HA HIS A 167 1.682 -21.643 24.946 1.00 0.00 H new ATOM 0 HB2 HIS A 167 3.355 -22.755 22.660 1.00 0.00 H new ATOM 0 HB3 HIS A 167 2.839 -23.695 24.046 1.00 0.00 H new ATOM 0 HD2 HIS A 167 -0.330 -22.695 24.113 1.00 0.00 H new ATOM 0 HE1 HIS A 167 -0.418 -24.195 20.146 1.00 0.00 H new ATOM 0 HE2 HIS A 167 -1.835 -23.493 22.139 1.00 0.00 H new ATOM 2714 N HIS A 168 3.679 -20.971 26.298 1.00 0.00 N ATOM 2715 CA HIS A 168 4.829 -20.795 27.176 1.00 0.00 C ATOM 2716 C HIS A 168 5.792 -19.756 26.609 1.00 0.00 C ATOM 2717 O HIS A 168 6.140 -19.795 25.429 1.00 0.00 O ATOM 2718 CB HIS A 168 5.556 -22.128 27.376 1.00 0.00 C ATOM 2719 CG HIS A 168 5.974 -22.373 28.792 1.00 0.00 C ATOM 2720 ND1 HIS A 168 5.161 -22.989 29.721 1.00 0.00 N ATOM 2721 CD2 HIS A 168 7.129 -22.085 29.438 1.00 0.00 C ATOM 2722 CE1 HIS A 168 5.797 -23.067 30.876 1.00 0.00 C ATOM 2723 NE2 HIS A 168 6.993 -22.526 30.732 1.00 0.00 N ATOM 0 H HIS A 168 2.788 -20.699 26.713 1.00 0.00 H new ATOM 0 HA HIS A 168 4.467 -20.440 28.141 1.00 0.00 H new ATOM 0 HB2 HIS A 168 4.905 -22.940 27.052 1.00 0.00 H new ATOM 0 HB3 HIS A 168 6.438 -22.152 26.736 1.00 0.00 H new ATOM 0 HD2 HIS A 168 7.996 -21.599 29.015 1.00 0.00 H new ATOM 0 HE1 HIS A 168 5.405 -23.500 31.785 1.00 0.00 H new ATOM 0 HE2 HIS A 168 7.701 -22.448 31.463 1.00 0.00 H new ATOM 2732 N HIS A 169 6.220 -18.827 27.459 1.00 0.00 N ATOM 2733 CA HIS A 169 7.142 -17.777 27.042 1.00 0.00 C ATOM 2734 C HIS A 169 7.736 -17.063 28.252 1.00 0.00 C ATOM 2735 O HIS A 169 8.002 -15.861 28.207 1.00 0.00 O ATOM 2736 CB HIS A 169 6.427 -16.770 26.140 1.00 0.00 C ATOM 2737 CG HIS A 169 7.296 -16.216 25.054 1.00 0.00 C ATOM 2738 ND1 HIS A 169 7.814 -16.990 24.037 1.00 0.00 N ATOM 2739 CD2 HIS A 169 7.738 -14.956 24.827 1.00 0.00 C ATOM 2740 CE1 HIS A 169 8.538 -16.231 23.233 1.00 0.00 C ATOM 2741 NE2 HIS A 169 8.507 -14.992 23.690 1.00 0.00 N ATOM 0 H HIS A 169 5.943 -18.780 28.440 1.00 0.00 H new ATOM 0 HA HIS A 169 7.954 -18.242 26.483 1.00 0.00 H new ATOM 0 HB2 HIS A 169 5.559 -17.251 25.689 1.00 0.00 H new ATOM 0 HB3 HIS A 169 6.055 -15.948 26.751 1.00 0.00 H new ATOM 0 HD2 HIS A 169 7.525 -14.085 25.429 1.00 0.00 H new ATOM 0 HE1 HIS A 169 9.065 -16.567 22.352 1.00 0.00 H new ATOM 0 HE2 HIS A 169 8.978 -14.192 23.267 1.00 0.00 H new ATOM 2750 N HIS A 170 7.938 -17.809 29.333 1.00 0.00 N ATOM 2751 CA HIS A 170 8.500 -17.246 30.556 1.00 0.00 C ATOM 2752 C HIS A 170 8.713 -18.331 31.606 1.00 0.00 C ATOM 2753 O HIS A 170 9.835 -18.416 32.149 1.00 0.00 O ATOM 2754 CB HIS A 170 7.581 -16.157 31.110 1.00 0.00 C ATOM 2755 CG HIS A 170 8.317 -15.017 31.743 1.00 0.00 C ATOM 2756 ND1 HIS A 170 8.914 -14.011 31.014 1.00 0.00 N ATOM 2757 CD2 HIS A 170 8.550 -14.726 33.044 1.00 0.00 C ATOM 2758 CE1 HIS A 170 9.484 -13.150 31.839 1.00 0.00 C ATOM 2759 NE2 HIS A 170 9.276 -13.561 33.076 1.00 0.00 N ATOM 2760 OXT HIS A 170 7.757 -19.088 31.877 1.00 0.00 O ATOM 0 H HIS A 170 7.721 -18.804 29.387 1.00 0.00 H new ATOM 0 HA HIS A 170 9.467 -16.806 30.313 1.00 0.00 H new ATOM 0 HB2 HIS A 170 6.958 -15.773 30.302 1.00 0.00 H new ATOM 0 HB3 HIS A 170 6.910 -16.599 31.847 1.00 0.00 H new ATOM 0 HD2 HIS A 170 8.225 -15.302 33.898 1.00 0.00 H new ATOM 0 HE1 HIS A 170 10.027 -12.262 31.550 1.00 0.00 H new ATOM 0 HE2 HIS A 170 9.602 -13.089 33.920 1.00 0.00 H new TER 2769 HIS A 170