USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1051 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 120 CYS SG : rot -127:sc= -6.81! USER MOD Set 1.2: A 127 CYS SG : rot -51:sc= -4.94! USER MOD Set 2.1: A 83 THR OG1 : rot -107:sc= 1.08 USER MOD Set 2.2: A 85 THR OG1 : rot -116:sc= 1.2 USER MOD Set 2.3: A 96 GLN : amide:sc= 2.02 K(o=6.9,f=-3.3!) USER MOD Set 2.4: A 98 GLN : amide:sc= 2.59 K(o=6.9,f=-9.3!) USER MOD Set 3.1: A 72 LYS NZ :NH3+ 142:sc= 1.18 (180deg=-0.0708) USER MOD Set 3.2: A 84 GLN : amide:sc= 1 K(o=2.2,f=-6.8!) USER MOD Set 4.1: A 22 TYR OH : rot -25:sc= 1.18 USER MOD Set 4.2: A 105 SER OG : rot 65:sc= 0.973 USER MOD Single : A 3 THR OG1 : rot -23:sc= 0.129 USER MOD Single : A 5 GLN : amide:sc= 0.899 K(o=0.9,f=0) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0.27) USER MOD Single : A 16 SER OG : rot -2:sc= 0.585 USER MOD Single : A 17 LYS NZ :NH3+ -166:sc= 1.15 (180deg=1.08) USER MOD Single : A 23 MET CE :methyl -165:sc= 0 (180deg=-0.395) USER MOD Single : A 24 LYS NZ :NH3+ -172:sc= 1.07 (180deg=0.742) USER MOD Single : A 34 LYS NZ :NH3+ -170:sc= 0.11 (180deg=0.0921) USER MOD Single : A 35 MET CE :methyl 179:sc= 0 (180deg=-0.000388) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ -145:sc= 0.829 (180deg=0.261) USER MOD Single : A 43 CYS SG : rot 180:sc= -0.0495 USER MOD Single : A 46 THR OG1 : rot -4:sc= 0.486 USER MOD Single : A 47 CYS SG : rot 180:sc= -0.0685 USER MOD Single : A 50 LYS NZ :NH3+ -175:sc= 1.72 (180deg=1.59) USER MOD Single : A 51 ASN : amide:sc= 0.474 K(o=0.47,f=-0.52) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -155:sc= 1.13 (180deg=0.978) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -82:sc= 1.21 USER MOD Single : A 59 THR OG1 : rot -77:sc= 1.2 USER MOD Single : A 61 LYS NZ :NH3+ -156:sc= 1.33 (180deg=1.15) USER MOD Single : A 62 THR OG1 : rot 3:sc= 0.48 USER MOD Single : A 63 THR OG1 : rot -16:sc= 1.02 USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-2.1) USER MOD Single : A 66 SER OG : rot 29:sc= 0.964 USER MOD Single : A 67 CYS SG : rot -43:sc= -1.06! USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 170:sc= -0.0405 USER MOD Single : A 77 THR OG1 : rot -76:sc= 1.28 USER MOD Single : A 82 LYS NZ :NH3+ 168:sc= 0.868 (180deg=0.275) USER MOD Single : A 87 CYS SG : rot -140:sc= -3.35 USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 HIS : no HD1:sc= 0.665 K(o=0.67,f=-4.3!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot -62:sc= 1.18 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ -121:sc= 1.17 (180deg=0.00457) USER MOD Single : A 112 LYS NZ :NH3+ 162:sc= 1.33 (180deg=1.09) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 2.34 (180deg=2.34) USER MOD Single : A 122 MET CE :methyl -179:sc= 0 (180deg=-0.00276) USER MOD Single : A 123 ASN : amide:sc= 0.585 K(o=0.59,f=-3.4!) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= 0.76 USER MOD Single : A 133 LYS NZ :NH3+ -135:sc= 0.861 (180deg=-1.79!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 3 0.257 -1.591 0.630 1.00 0.00 N ATOM 2 CA THR A 3 -0.493 -1.110 -0.566 1.00 0.00 C ATOM 3 C THR A 3 0.075 -1.758 -1.866 1.00 0.00 C ATOM 4 O THR A 3 -0.205 -2.930 -2.135 1.00 0.00 O ATOM 5 CB THR A 3 -0.614 0.447 -0.578 1.00 0.00 C ATOM 6 OG1 THR A 3 0.642 1.071 -0.341 1.00 0.00 O ATOM 7 CG2 THR A 3 -1.624 1.020 0.426 1.00 0.00 C ATOM 0 HA THR A 3 -1.528 -1.449 -0.515 1.00 0.00 H new ATOM 0 HB THR A 3 -0.980 0.671 -1.580 1.00 0.00 H new ATOM 0 HG1 THR A 3 1.230 0.451 0.138 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.640 2.107 0.346 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.617 0.626 0.209 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.334 0.735 1.437 1.00 0.00 H new ATOM 14 N VAL A 4 0.878 -1.031 -2.672 1.00 0.00 N ATOM 15 CA VAL A 4 1.542 -1.596 -3.894 1.00 0.00 C ATOM 16 C VAL A 4 2.588 -2.743 -3.634 1.00 0.00 C ATOM 17 O VAL A 4 2.810 -3.576 -4.516 1.00 0.00 O ATOM 18 CB VAL A 4 2.056 -0.417 -4.795 1.00 0.00 C ATOM 19 CG1 VAL A 4 3.336 0.289 -4.287 1.00 0.00 C ATOM 20 CG2 VAL A 4 2.271 -0.840 -6.265 1.00 0.00 C ATOM 0 H VAL A 4 1.090 -0.047 -2.508 1.00 0.00 H new ATOM 0 HA VAL A 4 0.784 -2.145 -4.453 1.00 0.00 H new ATOM 0 HB VAL A 4 1.243 0.306 -4.732 1.00 0.00 H new ATOM 0 HG11 VAL A 4 3.610 1.087 -4.977 1.00 0.00 H new ATOM 0 HG12 VAL A 4 3.151 0.711 -3.299 1.00 0.00 H new ATOM 0 HG13 VAL A 4 4.150 -0.433 -4.226 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.626 0.014 -6.841 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.010 -1.640 -6.309 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.329 -1.193 -6.684 1.00 0.00 H new ATOM 30 N GLN A 5 3.164 -2.825 -2.419 1.00 0.00 N ATOM 31 CA GLN A 5 4.040 -3.962 -1.997 1.00 0.00 C ATOM 32 C GLN A 5 3.376 -5.375 -1.818 1.00 0.00 C ATOM 33 O GLN A 5 4.090 -6.380 -1.877 1.00 0.00 O ATOM 34 CB GLN A 5 4.910 -3.466 -0.811 1.00 0.00 C ATOM 35 CG GLN A 5 6.044 -4.432 -0.366 1.00 0.00 C ATOM 36 CD GLN A 5 7.288 -3.762 0.219 1.00 0.00 C ATOM 37 OE1 GLN A 5 7.612 -3.868 1.397 1.00 0.00 O ATOM 38 NE2 GLN A 5 8.022 -3.068 -0.614 1.00 0.00 N ATOM 0 H GLN A 5 3.043 -2.114 -1.697 1.00 0.00 H new ATOM 0 HA GLN A 5 4.676 -4.218 -2.844 1.00 0.00 H new ATOM 0 HB2 GLN A 5 5.357 -2.510 -1.085 1.00 0.00 H new ATOM 0 HB3 GLN A 5 4.258 -3.280 0.043 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.640 -5.120 0.376 1.00 0.00 H new ATOM 0 HG3 GLN A 5 6.345 -5.031 -1.225 1.00 0.00 H new ATOM 0 HE21 GLN A 5 7.744 -2.986 -1.592 1.00 0.00 H new ATOM 0 HE22 GLN A 5 8.872 -2.610 -0.285 1.00 0.00 H new ATOM 47 N GLN A 6 2.035 -5.497 -1.745 1.00 0.00 N ATOM 48 CA GLN A 6 1.324 -6.762 -2.115 1.00 0.00 C ATOM 49 C GLN A 6 1.561 -7.269 -3.587 1.00 0.00 C ATOM 50 O GLN A 6 1.632 -8.482 -3.804 1.00 0.00 O ATOM 51 CB GLN A 6 -0.196 -6.624 -1.817 1.00 0.00 C ATOM 52 CG GLN A 6 -0.604 -6.596 -0.319 1.00 0.00 C ATOM 53 CD GLN A 6 -0.665 -5.210 0.333 1.00 0.00 C ATOM 54 OE1 GLN A 6 0.317 -4.688 0.848 1.00 0.00 O ATOM 55 NE2 GLN A 6 -1.814 -4.576 0.352 1.00 0.00 N ATOM 0 H GLN A 6 1.416 -4.747 -1.437 1.00 0.00 H new ATOM 0 HA GLN A 6 1.769 -7.535 -1.488 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.555 -5.708 -2.286 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.715 -7.453 -2.298 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -1.583 -7.066 -0.220 1.00 0.00 H new ATOM 0 HG3 GLN A 6 0.102 -7.209 0.241 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -2.638 -5.001 -0.074 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -1.883 -3.658 0.792 1.00 0.00 H new ATOM 64 N LEU A 7 1.703 -6.364 -4.576 1.00 0.00 N ATOM 65 CA LEU A 7 2.094 -6.725 -5.969 1.00 0.00 C ATOM 66 C LEU A 7 3.635 -6.908 -6.252 1.00 0.00 C ATOM 67 O LEU A 7 3.983 -7.154 -7.407 1.00 0.00 O ATOM 68 CB LEU A 7 1.514 -5.661 -6.956 1.00 0.00 C ATOM 69 CG LEU A 7 0.014 -5.259 -6.904 1.00 0.00 C ATOM 70 CD1 LEU A 7 -0.319 -4.366 -8.108 1.00 0.00 C ATOM 71 CD2 LEU A 7 -0.965 -6.440 -6.885 1.00 0.00 C ATOM 0 H LEU A 7 1.552 -5.364 -4.441 1.00 0.00 H new ATOM 0 HA LEU A 7 1.671 -7.718 -6.121 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.095 -4.749 -6.820 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.714 -6.019 -7.966 1.00 0.00 H new ATOM 0 HG LEU A 7 -0.116 -4.734 -5.958 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.371 -4.084 -8.072 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.299 -3.468 -8.077 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -0.121 -4.911 -9.031 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.988 -6.064 -6.848 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.830 -7.039 -7.786 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.774 -7.057 -6.007 1.00 0.00 H new ATOM 83 N GLU A 8 4.560 -6.804 -5.276 1.00 0.00 N ATOM 84 CA GLU A 8 6.032 -6.860 -5.528 1.00 0.00 C ATOM 85 C GLU A 8 6.636 -8.303 -5.409 1.00 0.00 C ATOM 86 O GLU A 8 6.172 -9.147 -4.633 1.00 0.00 O ATOM 87 CB GLU A 8 6.739 -5.851 -4.581 1.00 0.00 C ATOM 88 CG GLU A 8 6.598 -4.360 -4.988 1.00 0.00 C ATOM 89 CD GLU A 8 7.387 -3.409 -4.104 1.00 0.00 C ATOM 90 OE1 GLU A 8 8.605 -3.265 -4.325 1.00 0.00 O ATOM 91 OE2 GLU A 8 6.803 -2.784 -3.199 1.00 0.00 O ATOM 0 H GLU A 8 4.319 -6.679 -4.293 1.00 0.00 H new ATOM 0 HA GLU A 8 6.208 -6.577 -6.566 1.00 0.00 H new ATOM 0 HB2 GLU A 8 6.338 -5.977 -3.575 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.799 -6.101 -4.535 1.00 0.00 H new ATOM 0 HG2 GLU A 8 6.928 -4.241 -6.020 1.00 0.00 H new ATOM 0 HG3 GLU A 8 5.545 -4.082 -4.957 1.00 0.00 H new ATOM 98 N GLY A 9 7.691 -8.571 -6.202 1.00 0.00 N ATOM 99 CA GLY A 9 8.321 -9.919 -6.307 1.00 0.00 C ATOM 100 C GLY A 9 8.550 -10.414 -7.758 1.00 0.00 C ATOM 101 O GLY A 9 8.180 -9.749 -8.729 1.00 0.00 O ATOM 0 H GLY A 9 8.136 -7.867 -6.790 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.280 -9.899 -5.789 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.692 -10.641 -5.786 1.00 0.00 H new ATOM 105 N ARG A 10 9.142 -11.616 -7.904 1.00 0.00 N ATOM 106 CA ARG A 10 9.168 -12.344 -9.211 1.00 0.00 C ATOM 107 C ARG A 10 7.865 -13.190 -9.387 1.00 0.00 C ATOM 108 O ARG A 10 7.545 -14.050 -8.560 1.00 0.00 O ATOM 109 CB ARG A 10 10.480 -13.175 -9.335 1.00 0.00 C ATOM 110 CG ARG A 10 10.602 -14.025 -10.634 1.00 0.00 C ATOM 111 CD ARG A 10 11.952 -14.733 -10.877 1.00 0.00 C ATOM 112 NE ARG A 10 12.959 -13.873 -11.573 1.00 0.00 N ATOM 113 CZ ARG A 10 14.012 -13.294 -11.005 1.00 0.00 C ATOM 114 NH1 ARG A 10 14.217 -13.271 -9.713 1.00 0.00 N ATOM 115 NH2 ARG A 10 14.880 -12.714 -11.781 1.00 0.00 N ATOM 0 H ARG A 10 9.609 -12.110 -7.144 1.00 0.00 H new ATOM 0 HA ARG A 10 9.178 -11.632 -10.036 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.330 -12.494 -9.284 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.553 -13.841 -8.475 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.819 -14.783 -10.619 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.401 -13.375 -11.486 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.361 -15.056 -9.920 1.00 0.00 H new ATOM 0 HD3 ARG A 10 11.781 -15.631 -11.470 1.00 0.00 H new ATOM 0 HE ARG A 10 12.826 -13.717 -12.572 1.00 0.00 H new ATOM 0 HH11 ARG A 10 13.549 -13.714 -9.083 1.00 0.00 H new ATOM 0 HH12 ARG A 10 15.045 -12.810 -9.336 1.00 0.00 H new ATOM 0 HH21 ARG A 10 14.741 -12.713 -12.791 1.00 0.00 H new ATOM 0 HH22 ARG A 10 15.700 -12.260 -11.379 1.00 0.00 H new ATOM 129 N TRP A 11 7.130 -12.937 -10.480 1.00 0.00 N ATOM 130 CA TRP A 11 5.791 -13.544 -10.715 1.00 0.00 C ATOM 131 C TRP A 11 5.832 -14.381 -12.027 1.00 0.00 C ATOM 132 O TRP A 11 6.004 -13.833 -13.115 1.00 0.00 O ATOM 133 CB TRP A 11 4.735 -12.408 -10.777 1.00 0.00 C ATOM 134 CG TRP A 11 4.567 -11.602 -9.487 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.049 -10.299 -9.259 1.00 0.00 C ATOM 136 CD2 TRP A 11 3.860 -11.944 -8.356 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.643 -9.813 -8.008 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.901 -10.842 -7.467 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.082 -13.088 -8.049 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.151 -10.867 -6.271 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.351 -13.087 -6.863 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.396 -12.005 -5.978 1.00 0.00 C ATOM 0 H TRP A 11 7.435 -12.312 -11.227 1.00 0.00 H new ATOM 0 HA TRP A 11 5.516 -14.218 -9.903 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.008 -11.724 -11.581 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.772 -12.844 -11.042 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.655 -9.744 -9.959 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.850 -8.905 -7.592 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.056 -13.937 -8.716 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 3.161 -10.024 -5.597 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.736 -13.941 -6.622 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.839 -12.050 -5.054 1.00 0.00 H new ATOM 153 N ARG A 12 5.674 -15.705 -11.929 1.00 0.00 N ATOM 154 CA ARG A 12 6.036 -16.664 -13.010 1.00 0.00 C ATOM 155 C ARG A 12 4.792 -17.224 -13.763 1.00 0.00 C ATOM 156 O ARG A 12 3.899 -17.808 -13.141 1.00 0.00 O ATOM 157 CB ARG A 12 6.870 -17.751 -12.284 1.00 0.00 C ATOM 158 CG ARG A 12 7.406 -18.913 -13.149 1.00 0.00 C ATOM 159 CD ARG A 12 6.658 -20.233 -12.910 1.00 0.00 C ATOM 160 NE ARG A 12 7.291 -21.292 -13.730 1.00 0.00 N ATOM 161 CZ ARG A 12 6.874 -22.555 -13.812 1.00 0.00 C ATOM 162 NH1 ARG A 12 5.898 -23.065 -13.098 1.00 0.00 N ATOM 163 NH2 ARG A 12 7.480 -23.337 -14.656 1.00 0.00 N ATOM 0 H ARG A 12 5.291 -16.157 -11.099 1.00 0.00 H new ATOM 0 HA ARG A 12 6.604 -16.194 -13.812 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.720 -17.264 -11.806 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.257 -18.175 -11.489 1.00 0.00 H new ATOM 0 HG2 ARG A 12 7.326 -18.642 -14.202 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.465 -19.058 -12.937 1.00 0.00 H new ATOM 0 HD2 ARG A 12 6.693 -20.501 -11.854 1.00 0.00 H new ATOM 0 HD3 ARG A 12 5.607 -20.126 -13.177 1.00 0.00 H new ATOM 0 HE ARG A 12 8.113 -21.033 -14.276 1.00 0.00 H new ATOM 0 HH11 ARG A 12 5.402 -22.483 -12.423 1.00 0.00 H new ATOM 0 HH12 ARG A 12 5.636 -24.043 -13.218 1.00 0.00 H new ATOM 0 HH21 ARG A 12 8.245 -22.977 -15.226 1.00 0.00 H new ATOM 0 HH22 ARG A 12 7.190 -24.311 -14.748 1.00 0.00 H new ATOM 177 N LEU A 13 4.736 -17.081 -15.104 1.00 0.00 N ATOM 178 CA LEU A 13 3.520 -17.430 -15.893 1.00 0.00 C ATOM 179 C LEU A 13 3.171 -18.955 -15.913 1.00 0.00 C ATOM 180 O LEU A 13 3.985 -19.805 -16.285 1.00 0.00 O ATOM 181 CB LEU A 13 3.649 -16.861 -17.339 1.00 0.00 C ATOM 182 CG LEU A 13 2.361 -16.929 -18.210 1.00 0.00 C ATOM 183 CD1 LEU A 13 1.277 -15.973 -17.697 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.652 -16.603 -19.682 1.00 0.00 C ATOM 0 H LEU A 13 5.510 -16.729 -15.667 1.00 0.00 H new ATOM 0 HA LEU A 13 2.679 -16.962 -15.381 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.966 -15.820 -17.273 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.442 -17.404 -17.853 1.00 0.00 H new ATOM 0 HG LEU A 13 1.999 -17.954 -18.135 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.394 -16.050 -18.331 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.013 -16.238 -16.673 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.653 -14.950 -17.721 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.728 -16.661 -20.257 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.064 -15.597 -19.757 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.371 -17.320 -20.078 1.00 0.00 H new ATOM 196 N VAL A 14 1.908 -19.260 -15.583 1.00 0.00 N ATOM 197 CA VAL A 14 1.329 -20.632 -15.666 1.00 0.00 C ATOM 198 C VAL A 14 0.181 -20.654 -16.735 1.00 0.00 C ATOM 199 O VAL A 14 0.373 -21.239 -17.807 1.00 0.00 O ATOM 200 CB VAL A 14 0.993 -21.224 -14.246 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.264 -21.654 -13.480 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.169 -20.332 -13.283 1.00 0.00 C ATOM 0 H VAL A 14 1.244 -18.563 -15.246 1.00 0.00 H new ATOM 0 HA VAL A 14 2.072 -21.339 -16.034 1.00 0.00 H new ATOM 0 HB VAL A 14 0.360 -22.069 -14.516 1.00 0.00 H new ATOM 0 HG11 VAL A 14 1.984 -22.056 -12.506 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.791 -22.419 -14.050 1.00 0.00 H new ATOM 0 HG13 VAL A 14 2.915 -20.791 -13.342 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.010 -20.861 -12.343 1.00 0.00 H new ATOM 0 HG22 VAL A 14 0.711 -19.406 -13.091 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.795 -20.100 -13.737 1.00 0.00 H new ATOM 212 N ASP A 15 -0.965 -19.993 -16.477 1.00 0.00 N ATOM 213 CA ASP A 15 -2.146 -19.959 -17.393 1.00 0.00 C ATOM 214 C ASP A 15 -2.122 -18.727 -18.369 1.00 0.00 C ATOM 215 O ASP A 15 -1.603 -17.653 -18.037 1.00 0.00 O ATOM 216 CB ASP A 15 -3.394 -19.930 -16.462 1.00 0.00 C ATOM 217 CG ASP A 15 -4.763 -20.275 -17.056 1.00 0.00 C ATOM 218 OD1 ASP A 15 -4.977 -20.131 -18.278 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.664 -20.650 -16.271 1.00 0.00 O ATOM 0 H ASP A 15 -1.108 -19.459 -15.620 1.00 0.00 H new ATOM 0 HA ASP A 15 -2.150 -20.828 -18.051 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -3.208 -20.619 -15.638 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.463 -18.931 -16.032 1.00 0.00 H new ATOM 224 N SER A 16 -2.699 -18.862 -19.581 1.00 0.00 N ATOM 225 CA SER A 16 -2.953 -17.706 -20.496 1.00 0.00 C ATOM 226 C SER A 16 -4.166 -17.896 -21.469 1.00 0.00 C ATOM 227 O SER A 16 -4.052 -17.771 -22.693 1.00 0.00 O ATOM 228 CB SER A 16 -1.637 -17.359 -21.229 1.00 0.00 C ATOM 229 OG SER A 16 -0.698 -16.810 -20.314 1.00 0.00 O ATOM 0 H SER A 16 -3.002 -19.760 -19.959 1.00 0.00 H new ATOM 0 HA SER A 16 -3.265 -16.859 -19.884 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.223 -18.254 -21.693 1.00 0.00 H new ATOM 0 HB3 SER A 16 -1.835 -16.647 -22.030 1.00 0.00 H new ATOM 0 HG SER A 16 -1.109 -16.738 -19.427 1.00 0.00 H new ATOM 235 N LYS A 17 -5.365 -18.106 -20.906 1.00 0.00 N ATOM 236 CA LYS A 17 -6.639 -18.190 -21.683 1.00 0.00 C ATOM 237 C LYS A 17 -7.143 -16.816 -22.248 1.00 0.00 C ATOM 238 O LYS A 17 -7.131 -15.793 -21.553 1.00 0.00 O ATOM 239 CB LYS A 17 -7.685 -18.942 -20.818 1.00 0.00 C ATOM 240 CG LYS A 17 -8.091 -18.280 -19.472 1.00 0.00 C ATOM 241 CD LYS A 17 -8.344 -19.321 -18.362 1.00 0.00 C ATOM 242 CE LYS A 17 -8.288 -18.718 -16.947 1.00 0.00 C ATOM 243 NZ LYS A 17 -8.118 -19.829 -15.976 1.00 0.00 N ATOM 0 H LYS A 17 -5.493 -18.224 -19.901 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.457 -18.759 -22.595 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.587 -19.076 -21.416 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.295 -19.937 -20.603 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -7.304 -17.596 -19.154 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.991 -17.683 -19.620 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.321 -19.779 -18.517 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.603 -20.116 -18.442 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.461 -18.013 -16.867 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -9.202 -18.163 -16.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.313 -19.483 -15.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -8.779 -20.597 -16.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.142 -20.186 -16.024 1.00 0.00 H new ATOM 257 N GLY A 18 -7.527 -16.797 -23.540 1.00 0.00 N ATOM 258 CA GLY A 18 -7.757 -15.525 -24.295 1.00 0.00 C ATOM 259 C GLY A 18 -6.538 -14.831 -24.971 1.00 0.00 C ATOM 260 O GLY A 18 -6.728 -13.937 -25.798 1.00 0.00 O ATOM 0 H GLY A 18 -7.687 -17.640 -24.091 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.495 -15.729 -25.071 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.207 -14.809 -23.608 1.00 0.00 H new ATOM 264 N PHE A 19 -5.295 -15.217 -24.632 1.00 0.00 N ATOM 265 CA PHE A 19 -4.058 -14.535 -25.106 1.00 0.00 C ATOM 266 C PHE A 19 -3.727 -14.639 -26.635 1.00 0.00 C ATOM 267 O PHE A 19 -3.251 -13.651 -27.201 1.00 0.00 O ATOM 268 CB PHE A 19 -2.911 -14.989 -24.159 1.00 0.00 C ATOM 269 CG PHE A 19 -1.599 -14.181 -24.202 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.602 -12.794 -24.011 1.00 0.00 C ATOM 271 CD2 PHE A 19 -0.379 -14.841 -24.386 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.411 -12.074 -24.048 1.00 0.00 C ATOM 273 CE2 PHE A 19 0.815 -14.122 -24.402 1.00 0.00 C ATOM 274 CZ PHE A 19 0.797 -12.739 -24.236 1.00 0.00 C ATOM 0 H PHE A 19 -5.110 -16.012 -24.020 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.214 -13.458 -25.042 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.288 -14.966 -23.137 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.675 -16.028 -24.388 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.535 -12.279 -23.834 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.362 -15.913 -24.516 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.425 -11.000 -23.931 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.754 -14.637 -24.543 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.722 -12.182 -24.253 1.00 0.00 H new ATOM 284 N ASP A 20 -4.021 -15.770 -27.309 1.00 0.00 N ATOM 285 CA ASP A 20 -4.018 -15.863 -28.803 1.00 0.00 C ATOM 286 C ASP A 20 -4.897 -14.783 -29.540 1.00 0.00 C ATOM 287 O ASP A 20 -4.391 -14.019 -30.372 1.00 0.00 O ATOM 288 CB ASP A 20 -4.409 -17.331 -29.160 1.00 0.00 C ATOM 289 CG ASP A 20 -4.045 -17.732 -30.585 1.00 0.00 C ATOM 290 OD1 ASP A 20 -2.916 -18.223 -30.788 1.00 0.00 O ATOM 291 OD2 ASP A 20 -4.781 -17.416 -31.543 1.00 0.00 O ATOM 0 H ASP A 20 -4.267 -16.645 -26.846 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.021 -15.625 -29.174 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.915 -18.009 -28.464 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.483 -17.456 -29.020 1.00 0.00 H new ATOM 296 N GLU A 21 -6.186 -14.695 -29.168 1.00 0.00 N ATOM 297 CA GLU A 21 -7.126 -13.634 -29.624 1.00 0.00 C ATOM 298 C GLU A 21 -6.708 -12.170 -29.238 1.00 0.00 C ATOM 299 O GLU A 21 -6.725 -11.287 -30.099 1.00 0.00 O ATOM 300 CB GLU A 21 -8.550 -13.976 -29.100 1.00 0.00 C ATOM 301 CG GLU A 21 -9.149 -15.350 -29.512 1.00 0.00 C ATOM 302 CD GLU A 21 -10.465 -15.671 -28.825 1.00 0.00 C ATOM 303 OE1 GLU A 21 -10.433 -16.221 -27.703 1.00 0.00 O ATOM 304 OE2 GLU A 21 -11.531 -15.388 -29.409 1.00 0.00 O ATOM 0 H GLU A 21 -6.619 -15.365 -28.533 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.104 -13.634 -30.714 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -8.529 -13.930 -28.011 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.231 -13.195 -29.439 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.300 -15.362 -30.591 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.428 -16.135 -29.282 1.00 0.00 H new ATOM 311 N TYR A 22 -6.305 -11.904 -27.977 1.00 0.00 N ATOM 312 CA TYR A 22 -5.725 -10.595 -27.559 1.00 0.00 C ATOM 313 C TYR A 22 -4.428 -10.140 -28.322 1.00 0.00 C ATOM 314 O TYR A 22 -4.381 -8.985 -28.754 1.00 0.00 O ATOM 315 CB TYR A 22 -5.605 -10.640 -26.008 1.00 0.00 C ATOM 316 CG TYR A 22 -4.910 -9.433 -25.356 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.552 -8.194 -25.254 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.566 -9.545 -24.984 1.00 0.00 C ATOM 319 CE1 TYR A 22 -4.845 -7.073 -24.815 1.00 0.00 C ATOM 320 CE2 TYR A 22 -2.870 -8.433 -24.526 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.503 -7.197 -24.460 1.00 0.00 C ATOM 322 OH TYR A 22 -2.762 -6.100 -24.121 1.00 0.00 O ATOM 0 H TYR A 22 -6.369 -12.582 -27.218 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.395 -9.790 -27.860 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.607 -10.730 -25.587 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -5.061 -11.543 -25.730 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.596 -8.105 -25.515 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -3.067 -10.500 -25.053 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.336 -6.113 -24.751 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.838 -8.529 -24.222 1.00 0.00 H new ATOM 0 HH TYR A 22 -3.149 -5.302 -24.539 1.00 0.00 H new ATOM 332 N MET A 23 -3.402 -10.997 -28.513 1.00 0.00 N ATOM 333 CA MET A 23 -2.241 -10.665 -29.400 1.00 0.00 C ATOM 334 C MET A 23 -2.605 -10.440 -30.911 1.00 0.00 C ATOM 335 O MET A 23 -2.114 -9.488 -31.521 1.00 0.00 O ATOM 336 CB MET A 23 -1.094 -11.694 -29.232 1.00 0.00 C ATOM 337 CG MET A 23 -0.409 -11.733 -27.850 1.00 0.00 C ATOM 338 SD MET A 23 1.047 -12.804 -27.882 1.00 0.00 S ATOM 339 CE MET A 23 0.289 -14.437 -27.990 1.00 0.00 C ATOM 0 H MET A 23 -3.344 -11.916 -28.075 1.00 0.00 H new ATOM 0 HA MET A 23 -1.891 -9.691 -29.057 1.00 0.00 H new ATOM 0 HB2 MET A 23 -1.491 -12.687 -29.446 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.334 -11.486 -29.985 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.117 -10.725 -27.556 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.114 -12.093 -27.100 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.031 -15.199 -27.752 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.538 -14.502 -27.282 1.00 0.00 H new ATOM 0 HE3 MET A 23 -0.085 -14.598 -29.001 1.00 0.00 H new ATOM 349 N LYS A 24 -3.507 -11.247 -31.504 1.00 0.00 N ATOM 350 CA LYS A 24 -4.214 -10.889 -32.772 1.00 0.00 C ATOM 351 C LYS A 24 -4.836 -9.447 -32.805 1.00 0.00 C ATOM 352 O LYS A 24 -4.533 -8.682 -33.724 1.00 0.00 O ATOM 353 CB LYS A 24 -5.203 -12.068 -33.035 1.00 0.00 C ATOM 354 CG LYS A 24 -6.181 -11.989 -34.238 1.00 0.00 C ATOM 355 CD LYS A 24 -7.483 -11.212 -33.920 1.00 0.00 C ATOM 356 CE LYS A 24 -8.573 -11.320 -35.000 1.00 0.00 C ATOM 357 NZ LYS A 24 -9.711 -10.451 -34.593 1.00 0.00 N ATOM 0 H LYS A 24 -3.771 -12.159 -31.130 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.513 -10.793 -33.601 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.608 -12.973 -33.156 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.803 -12.199 -32.134 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.676 -11.510 -35.077 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.438 -13.000 -34.555 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.888 -11.578 -32.976 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.237 -10.160 -33.775 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -8.182 -11.008 -35.968 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -8.902 -12.354 -35.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -10.515 -10.609 -35.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -9.994 -10.683 -33.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -9.421 -9.454 -34.641 1.00 0.00 H new ATOM 371 N GLU A 25 -5.661 -9.076 -31.810 1.00 0.00 N ATOM 372 CA GLU A 25 -6.354 -7.757 -31.774 1.00 0.00 C ATOM 373 C GLU A 25 -5.486 -6.500 -31.407 1.00 0.00 C ATOM 374 O GLU A 25 -5.703 -5.418 -31.959 1.00 0.00 O ATOM 375 CB GLU A 25 -7.609 -7.922 -30.870 1.00 0.00 C ATOM 376 CG GLU A 25 -8.882 -7.268 -31.453 1.00 0.00 C ATOM 377 CD GLU A 25 -9.523 -8.059 -32.593 1.00 0.00 C ATOM 378 OE1 GLU A 25 -9.020 -8.020 -33.737 1.00 0.00 O ATOM 379 OE2 GLU A 25 -10.507 -8.786 -32.358 1.00 0.00 O ATOM 0 H GLU A 25 -5.871 -9.671 -31.009 1.00 0.00 H new ATOM 0 HA GLU A 25 -6.627 -7.509 -32.800 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -7.796 -8.984 -30.713 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -7.402 -7.487 -29.892 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.613 -7.145 -30.654 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.633 -6.270 -31.813 1.00 0.00 H new ATOM 386 N LEU A 26 -4.475 -6.647 -30.531 1.00 0.00 N ATOM 387 CA LEU A 26 -3.310 -5.706 -30.435 1.00 0.00 C ATOM 388 C LEU A 26 -2.590 -5.269 -31.763 1.00 0.00 C ATOM 389 O LEU A 26 -2.128 -4.128 -31.856 1.00 0.00 O ATOM 390 CB LEU A 26 -2.226 -6.347 -29.505 1.00 0.00 C ATOM 391 CG LEU A 26 -2.368 -6.207 -27.972 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.247 -7.011 -27.286 1.00 0.00 C ATOM 393 CD2 LEU A 26 -2.272 -4.741 -27.521 1.00 0.00 C ATOM 0 H LEU A 26 -4.429 -7.417 -29.864 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.762 -4.790 -30.055 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -2.185 -7.412 -29.735 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.262 -5.923 -29.785 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.350 -6.587 -27.690 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.341 -6.917 -26.204 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.328 -8.061 -27.567 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.277 -6.625 -27.601 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.377 -4.686 -26.437 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.304 -4.333 -27.813 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.067 -4.163 -27.992 1.00 0.00 H new ATOM 405 N GLY A 27 -2.394 -6.196 -32.718 1.00 0.00 N ATOM 406 CA GLY A 27 -1.396 -6.032 -33.808 1.00 0.00 C ATOM 407 C GLY A 27 -0.038 -6.696 -33.501 1.00 0.00 C ATOM 408 O GLY A 27 0.972 -6.007 -33.327 1.00 0.00 O ATOM 0 H GLY A 27 -2.913 -7.073 -32.763 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -1.800 -6.456 -34.727 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.239 -4.969 -33.990 1.00 0.00 H new ATOM 412 N VAL A 28 -0.038 -8.034 -33.451 1.00 0.00 N ATOM 413 CA VAL A 28 1.182 -8.858 -33.209 1.00 0.00 C ATOM 414 C VAL A 28 1.305 -9.850 -34.416 1.00 0.00 C ATOM 415 O VAL A 28 0.395 -10.649 -34.673 1.00 0.00 O ATOM 416 CB VAL A 28 1.118 -9.631 -31.842 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.426 -10.392 -31.530 1.00 0.00 C ATOM 418 CG2 VAL A 28 0.821 -8.787 -30.586 1.00 0.00 C ATOM 0 H VAL A 28 -0.883 -8.591 -33.576 1.00 0.00 H new ATOM 0 HA VAL A 28 2.059 -8.214 -33.139 1.00 0.00 H new ATOM 0 HB VAL A 28 0.273 -10.296 -32.020 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.328 -10.908 -30.575 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.620 -11.120 -32.318 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.254 -9.685 -31.477 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.803 -9.434 -29.709 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.597 -8.031 -30.464 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.147 -8.299 -30.696 1.00 0.00 H new ATOM 428 N GLY A 29 2.452 -9.842 -35.122 1.00 0.00 N ATOM 429 CA GLY A 29 2.732 -10.840 -36.195 1.00 0.00 C ATOM 430 C GLY A 29 2.899 -12.305 -35.719 1.00 0.00 C ATOM 431 O GLY A 29 3.315 -12.558 -34.587 1.00 0.00 O ATOM 0 H GLY A 29 3.200 -9.164 -34.977 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.920 -10.803 -36.922 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.641 -10.540 -36.717 1.00 0.00 H new ATOM 435 N ILE A 30 2.583 -13.279 -36.585 1.00 0.00 N ATOM 436 CA ILE A 30 2.532 -14.737 -36.209 1.00 0.00 C ATOM 437 C ILE A 30 3.800 -15.365 -35.522 1.00 0.00 C ATOM 438 O ILE A 30 3.660 -16.061 -34.512 1.00 0.00 O ATOM 439 CB ILE A 30 2.005 -15.626 -37.389 1.00 0.00 C ATOM 440 CG1 ILE A 30 2.795 -15.497 -38.725 1.00 0.00 C ATOM 441 CG2 ILE A 30 0.483 -15.446 -37.629 1.00 0.00 C ATOM 442 CD1 ILE A 30 2.781 -16.762 -39.595 1.00 0.00 C ATOM 0 H ILE A 30 2.354 -13.101 -37.563 1.00 0.00 H new ATOM 0 HA ILE A 30 1.806 -14.740 -35.396 1.00 0.00 H new ATOM 0 HB ILE A 30 2.188 -16.643 -37.043 1.00 0.00 H new ATOM 0 HG12 ILE A 30 2.379 -14.670 -39.301 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.829 -15.238 -38.498 1.00 0.00 H new ATOM 0 HG21 ILE A 30 0.167 -16.082 -38.456 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -0.063 -15.725 -36.728 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.274 -14.404 -37.873 1.00 0.00 H new ATOM 0 HD11 ILE A 30 3.354 -16.584 -40.505 1.00 0.00 H new ATOM 0 HD12 ILE A 30 3.226 -17.589 -39.042 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.753 -17.012 -39.857 1.00 0.00 H new ATOM 454 N ALA A 31 5.019 -15.083 -36.017 1.00 0.00 N ATOM 455 CA ALA A 31 6.285 -15.375 -35.284 1.00 0.00 C ATOM 456 C ALA A 31 6.443 -14.715 -33.869 1.00 0.00 C ATOM 457 O ALA A 31 6.847 -15.396 -32.923 1.00 0.00 O ATOM 458 CB ALA A 31 7.444 -14.998 -36.225 1.00 0.00 C ATOM 0 H ALA A 31 5.164 -14.649 -36.929 1.00 0.00 H new ATOM 0 HA ALA A 31 6.279 -16.436 -35.036 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.394 -15.195 -35.729 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.380 -15.592 -37.137 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.379 -13.939 -36.476 1.00 0.00 H new ATOM 464 N LEU A 32 6.074 -13.427 -33.715 1.00 0.00 N ATOM 465 CA LEU A 32 5.937 -12.773 -32.374 1.00 0.00 C ATOM 466 C LEU A 32 4.806 -13.365 -31.458 1.00 0.00 C ATOM 467 O LEU A 32 5.040 -13.544 -30.259 1.00 0.00 O ATOM 468 CB LEU A 32 5.797 -11.229 -32.533 1.00 0.00 C ATOM 469 CG LEU A 32 6.996 -10.454 -33.148 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.593 -9.003 -33.461 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.227 -10.438 -32.223 1.00 0.00 C ATOM 0 H LEU A 32 5.863 -12.808 -34.498 1.00 0.00 H new ATOM 0 HA LEU A 32 6.860 -13.001 -31.842 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.920 -11.034 -33.150 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.595 -10.807 -31.548 1.00 0.00 H new ATOM 0 HG LEU A 32 7.266 -10.980 -34.064 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.443 -8.474 -33.891 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.767 -9.000 -34.172 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.283 -8.505 -32.542 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.035 -9.884 -32.702 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.967 -9.958 -31.280 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.552 -11.461 -32.032 1.00 0.00 H new ATOM 483 N ARG A 33 3.621 -13.725 -32.002 1.00 0.00 N ATOM 484 CA ARG A 33 2.585 -14.512 -31.265 1.00 0.00 C ATOM 485 C ARG A 33 3.064 -15.919 -30.762 1.00 0.00 C ATOM 486 O ARG A 33 2.866 -16.241 -29.588 1.00 0.00 O ATOM 487 CB ARG A 33 1.262 -14.664 -32.075 1.00 0.00 C ATOM 488 CG ARG A 33 0.551 -13.378 -32.564 1.00 0.00 C ATOM 489 CD ARG A 33 -0.992 -13.349 -32.672 1.00 0.00 C ATOM 490 NE ARG A 33 -1.694 -14.399 -33.474 1.00 0.00 N ATOM 491 CZ ARG A 33 -2.272 -15.475 -32.928 1.00 0.00 C ATOM 492 NH1 ARG A 33 -1.837 -16.012 -31.829 1.00 0.00 N ATOM 493 NH2 ARG A 33 -3.305 -16.028 -33.492 1.00 0.00 N ATOM 0 H ARG A 33 3.350 -13.484 -32.955 1.00 0.00 H new ATOM 0 HA ARG A 33 2.393 -13.911 -30.376 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.476 -15.279 -32.949 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.556 -15.221 -31.458 1.00 0.00 H new ATOM 0 HG2 ARG A 33 0.846 -12.569 -31.896 1.00 0.00 H new ATOM 0 HG3 ARG A 33 0.951 -13.139 -33.550 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.391 -13.391 -31.659 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.272 -12.380 -33.085 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.734 -14.289 -34.487 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.028 -15.613 -31.352 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -2.304 -16.832 -31.443 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.681 -15.642 -34.358 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -3.739 -16.848 -33.069 1.00 0.00 H new ATOM 507 N LYS A 34 3.718 -16.730 -31.623 1.00 0.00 N ATOM 508 CA LYS A 34 4.435 -17.964 -31.203 1.00 0.00 C ATOM 509 C LYS A 34 5.544 -17.741 -30.117 1.00 0.00 C ATOM 510 O LYS A 34 5.484 -18.399 -29.078 1.00 0.00 O ATOM 511 CB LYS A 34 4.930 -18.657 -32.497 1.00 0.00 C ATOM 512 CG LYS A 34 5.491 -20.081 -32.284 1.00 0.00 C ATOM 513 CD LYS A 34 5.871 -20.761 -33.618 1.00 0.00 C ATOM 514 CE LYS A 34 6.357 -22.220 -33.501 1.00 0.00 C ATOM 515 NZ LYS A 34 7.732 -22.302 -32.933 1.00 0.00 N ATOM 0 H LYS A 34 3.766 -16.552 -32.626 1.00 0.00 H new ATOM 0 HA LYS A 34 3.750 -18.623 -30.669 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.104 -18.707 -33.206 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.704 -18.039 -32.952 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.369 -20.032 -31.640 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.749 -20.689 -31.766 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.004 -20.736 -34.279 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.654 -20.172 -34.097 1.00 0.00 H new ATOM 0 HE2 LYS A 34 5.669 -22.783 -32.870 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.342 -22.688 -34.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.089 -23.274 -33.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.360 -21.652 -33.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.709 -22.037 -31.928 1.00 0.00 H new ATOM 529 N MET A 35 6.492 -16.799 -30.323 1.00 0.00 N ATOM 530 CA MET A 35 7.422 -16.302 -29.263 1.00 0.00 C ATOM 531 C MET A 35 6.742 -15.938 -27.893 1.00 0.00 C ATOM 532 O MET A 35 7.053 -16.583 -26.891 1.00 0.00 O ATOM 533 CB MET A 35 8.213 -15.121 -29.891 1.00 0.00 C ATOM 534 CG MET A 35 9.321 -14.497 -29.015 1.00 0.00 C ATOM 535 SD MET A 35 9.665 -12.818 -29.580 1.00 0.00 S ATOM 536 CE MET A 35 8.354 -11.904 -28.734 1.00 0.00 C ATOM 0 H MET A 35 6.641 -16.356 -31.229 1.00 0.00 H new ATOM 0 HA MET A 35 8.091 -17.110 -28.967 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.666 -15.468 -30.820 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.504 -14.337 -30.156 1.00 0.00 H new ATOM 0 HG2 MET A 35 9.009 -14.483 -27.971 1.00 0.00 H new ATOM 0 HG3 MET A 35 10.226 -15.102 -29.069 1.00 0.00 H new ATOM 0 HE1 MET A 35 8.441 -10.843 -28.968 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.383 -12.270 -29.066 1.00 0.00 H new ATOM 0 HE3 MET A 35 8.447 -12.047 -27.657 1.00 0.00 H new ATOM 546 N GLY A 36 5.806 -14.965 -27.851 1.00 0.00 N ATOM 547 CA GLY A 36 5.049 -14.614 -26.612 1.00 0.00 C ATOM 548 C GLY A 36 4.272 -15.729 -25.868 1.00 0.00 C ATOM 549 O GLY A 36 4.321 -15.785 -24.636 1.00 0.00 O ATOM 0 H GLY A 36 5.550 -14.401 -28.662 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.756 -14.178 -25.906 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.335 -13.832 -26.872 1.00 0.00 H new ATOM 553 N ALA A 37 3.579 -16.616 -26.601 1.00 0.00 N ATOM 554 CA ALA A 37 2.992 -17.854 -26.026 1.00 0.00 C ATOM 555 C ALA A 37 4.016 -18.928 -25.514 1.00 0.00 C ATOM 556 O ALA A 37 3.888 -19.367 -24.367 1.00 0.00 O ATOM 557 CB ALA A 37 2.017 -18.408 -27.084 1.00 0.00 C ATOM 0 H ALA A 37 3.407 -16.504 -27.600 1.00 0.00 H new ATOM 0 HA ALA A 37 2.478 -17.593 -25.101 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.556 -19.322 -26.710 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.243 -17.668 -27.288 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.562 -18.626 -28.003 1.00 0.00 H new ATOM 563 N MET A 38 5.014 -19.356 -26.321 1.00 0.00 N ATOM 564 CA MET A 38 6.006 -20.395 -25.899 1.00 0.00 C ATOM 565 C MET A 38 7.112 -19.967 -24.874 1.00 0.00 C ATOM 566 O MET A 38 7.536 -20.800 -24.068 1.00 0.00 O ATOM 567 CB MET A 38 6.563 -21.143 -27.146 1.00 0.00 C ATOM 568 CG MET A 38 7.740 -20.501 -27.913 1.00 0.00 C ATOM 569 SD MET A 38 8.118 -21.448 -29.401 1.00 0.00 S ATOM 570 CE MET A 38 9.259 -22.687 -28.755 1.00 0.00 C ATOM 0 H MET A 38 5.161 -19.004 -27.267 1.00 0.00 H new ATOM 0 HA MET A 38 5.433 -21.091 -25.286 1.00 0.00 H new ATOM 0 HB2 MET A 38 6.876 -22.137 -26.827 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.741 -21.278 -27.849 1.00 0.00 H new ATOM 0 HG2 MET A 38 7.490 -19.475 -28.182 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.619 -20.457 -27.270 1.00 0.00 H new ATOM 0 HE1 MET A 38 9.578 -23.345 -29.564 1.00 0.00 H new ATOM 0 HE2 MET A 38 10.130 -22.191 -28.326 1.00 0.00 H new ATOM 0 HE3 MET A 38 8.760 -23.275 -27.985 1.00 0.00 H new ATOM 580 N ALA A 39 7.570 -18.700 -24.882 1.00 0.00 N ATOM 581 CA ALA A 39 8.624 -18.195 -23.957 1.00 0.00 C ATOM 582 C ALA A 39 8.382 -18.261 -22.410 1.00 0.00 C ATOM 583 O ALA A 39 9.359 -18.300 -21.653 1.00 0.00 O ATOM 584 CB ALA A 39 8.908 -16.754 -24.413 1.00 0.00 C ATOM 0 H ALA A 39 7.224 -17.991 -25.528 1.00 0.00 H new ATOM 0 HA ALA A 39 9.464 -18.885 -24.044 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.677 -16.316 -23.776 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.254 -16.761 -25.447 1.00 0.00 H new ATOM 0 HB3 ALA A 39 7.995 -16.163 -24.340 1.00 0.00 H new ATOM 590 N LYS A 40 7.112 -18.273 -21.954 1.00 0.00 N ATOM 591 CA LYS A 40 6.722 -18.419 -20.518 1.00 0.00 C ATOM 592 C LYS A 40 7.267 -17.279 -19.567 1.00 0.00 C ATOM 593 O LYS A 40 8.111 -17.583 -18.719 1.00 0.00 O ATOM 594 CB LYS A 40 6.984 -19.891 -20.059 1.00 0.00 C ATOM 595 CG LYS A 40 6.205 -20.381 -18.808 1.00 0.00 C ATOM 596 CD LYS A 40 4.910 -21.192 -19.069 1.00 0.00 C ATOM 597 CE LYS A 40 3.745 -20.382 -19.668 1.00 0.00 C ATOM 598 NZ LYS A 40 2.494 -21.191 -19.724 1.00 0.00 N ATOM 0 H LYS A 40 6.309 -18.181 -22.576 1.00 0.00 H new ATOM 0 HA LYS A 40 5.649 -18.249 -20.427 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.745 -20.554 -20.890 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.050 -20.001 -19.860 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.876 -20.995 -18.208 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.946 -19.510 -18.206 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.145 -22.016 -19.743 1.00 0.00 H new ATOM 0 HD3 LYS A 40 4.580 -21.634 -18.129 1.00 0.00 H new ATOM 0 HE2 LYS A 40 3.575 -19.488 -19.069 1.00 0.00 H new ATOM 0 HE3 LYS A 40 4.010 -20.048 -20.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 1.953 -20.936 -20.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 2.736 -22.202 -19.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 1.919 -21.001 -18.878 1.00 0.00 H new ATOM 612 N PRO A 41 6.834 -15.980 -19.655 1.00 0.00 N ATOM 613 CA PRO A 41 7.483 -14.866 -18.905 1.00 0.00 C ATOM 614 C PRO A 41 7.390 -14.837 -17.346 1.00 0.00 C ATOM 615 O PRO A 41 6.341 -15.082 -16.741 1.00 0.00 O ATOM 616 CB PRO A 41 6.860 -13.600 -19.536 1.00 0.00 C ATOM 617 CG PRO A 41 5.626 -14.075 -20.300 1.00 0.00 C ATOM 618 CD PRO A 41 6.006 -15.476 -20.769 1.00 0.00 C ATOM 0 HA PRO A 41 8.562 -14.975 -19.010 1.00 0.00 H new ATOM 0 HB2 PRO A 41 6.589 -12.875 -18.769 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.567 -13.108 -20.204 1.00 0.00 H new ATOM 0 HG2 PRO A 41 4.743 -14.093 -19.662 1.00 0.00 H new ATOM 0 HG3 PRO A 41 5.399 -13.419 -21.141 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.127 -16.099 -20.934 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.561 -15.452 -21.707 1.00 0.00 H new ATOM 626 N ASP A 42 8.500 -14.405 -16.735 1.00 0.00 N ATOM 627 CA ASP A 42 8.563 -13.999 -15.309 1.00 0.00 C ATOM 628 C ASP A 42 8.501 -12.437 -15.217 1.00 0.00 C ATOM 629 O ASP A 42 9.404 -11.721 -15.662 1.00 0.00 O ATOM 630 CB ASP A 42 9.841 -14.603 -14.665 1.00 0.00 C ATOM 631 CG ASP A 42 9.674 -16.033 -14.144 1.00 0.00 C ATOM 632 OD1 ASP A 42 9.410 -16.960 -14.938 1.00 0.00 O ATOM 633 OD2 ASP A 42 9.785 -16.229 -12.915 1.00 0.00 O ATOM 0 H ASP A 42 9.396 -14.323 -17.216 1.00 0.00 H new ATOM 0 HA ASP A 42 7.711 -14.384 -14.748 1.00 0.00 H new ATOM 0 HB2 ASP A 42 10.645 -14.590 -15.401 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.154 -13.963 -13.840 1.00 0.00 H new ATOM 638 N CYS A 43 7.408 -11.911 -14.643 1.00 0.00 N ATOM 639 CA CYS A 43 7.205 -10.457 -14.425 1.00 0.00 C ATOM 640 C CYS A 43 7.717 -10.018 -13.013 1.00 0.00 C ATOM 641 O CYS A 43 7.136 -10.382 -11.986 1.00 0.00 O ATOM 642 CB CYS A 43 5.697 -10.203 -14.644 1.00 0.00 C ATOM 643 SG CYS A 43 5.304 -8.434 -14.456 1.00 0.00 S ATOM 0 H CYS A 43 6.630 -12.481 -14.312 1.00 0.00 H new ATOM 0 HA CYS A 43 7.786 -9.851 -15.121 1.00 0.00 H new ATOM 0 HB2 CYS A 43 5.408 -10.540 -15.639 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.118 -10.787 -13.929 1.00 0.00 H new ATOM 0 HG CYS A 43 4.031 -8.249 -14.647 1.00 0.00 H new ATOM 649 N ILE A 44 8.814 -9.243 -12.962 1.00 0.00 N ATOM 650 CA ILE A 44 9.475 -8.838 -11.682 1.00 0.00 C ATOM 651 C ILE A 44 9.060 -7.374 -11.345 1.00 0.00 C ATOM 652 O ILE A 44 9.498 -6.436 -12.017 1.00 0.00 O ATOM 653 CB ILE A 44 11.032 -9.050 -11.679 1.00 0.00 C ATOM 654 CG1 ILE A 44 11.468 -10.496 -12.061 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.663 -8.703 -10.304 1.00 0.00 C ATOM 656 CD1 ILE A 44 11.789 -10.680 -13.549 1.00 0.00 C ATOM 0 H ILE A 44 9.275 -8.875 -13.794 1.00 0.00 H new ATOM 0 HA ILE A 44 9.124 -9.501 -10.891 1.00 0.00 H new ATOM 0 HB ILE A 44 11.397 -8.366 -12.445 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.346 -10.766 -11.475 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.674 -11.189 -11.783 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.740 -8.864 -10.347 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.461 -7.659 -10.064 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.231 -9.342 -9.534 1.00 0.00 H new ATOM 0 HD11 ILE A 44 12.084 -11.713 -13.733 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.907 -10.444 -14.144 1.00 0.00 H new ATOM 0 HD13 ILE A 44 12.605 -10.014 -13.830 1.00 0.00 H new ATOM 668 N ILE A 45 8.245 -7.200 -10.292 1.00 0.00 N ATOM 669 CA ILE A 45 7.735 -5.864 -9.852 1.00 0.00 C ATOM 670 C ILE A 45 8.562 -5.405 -8.597 1.00 0.00 C ATOM 671 O ILE A 45 8.721 -6.157 -7.626 1.00 0.00 O ATOM 672 CB ILE A 45 6.178 -5.936 -9.619 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.374 -6.313 -10.904 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.596 -4.616 -9.046 1.00 0.00 C ATOM 675 CD1 ILE A 45 3.894 -6.688 -10.698 1.00 0.00 C ATOM 0 H ILE A 45 7.914 -7.972 -9.714 1.00 0.00 H new ATOM 0 HA ILE A 45 7.877 -5.103 -10.620 1.00 0.00 H new ATOM 0 HB ILE A 45 6.058 -6.734 -8.886 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.421 -5.472 -11.596 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.875 -7.152 -11.387 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.520 -4.723 -8.906 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.067 -4.397 -8.088 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.792 -3.800 -9.742 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.443 -6.930 -11.660 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.826 -7.553 -10.038 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.365 -5.847 -10.250 1.00 0.00 H new ATOM 687 N THR A 46 9.103 -4.170 -8.606 1.00 0.00 N ATOM 688 CA THR A 46 9.847 -3.594 -7.437 1.00 0.00 C ATOM 689 C THR A 46 9.708 -2.031 -7.420 1.00 0.00 C ATOM 690 O THR A 46 9.986 -1.357 -8.417 1.00 0.00 O ATOM 691 CB THR A 46 11.328 -4.092 -7.417 1.00 0.00 C ATOM 692 OG1 THR A 46 11.358 -5.518 -7.382 1.00 0.00 O ATOM 693 CG2 THR A 46 12.136 -3.634 -6.192 1.00 0.00 C ATOM 0 H THR A 46 9.045 -3.540 -9.406 1.00 0.00 H new ATOM 0 HA THR A 46 9.401 -3.954 -6.510 1.00 0.00 H new ATOM 0 HB THR A 46 11.774 -3.666 -8.316 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.443 -5.863 -7.317 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.152 -4.024 -6.259 1.00 0.00 H new ATOM 0 HG22 THR A 46 12.167 -2.545 -6.163 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.663 -4.008 -5.284 1.00 0.00 H new ATOM 701 N CYS A 47 9.273 -1.454 -6.285 1.00 0.00 N ATOM 702 CA CYS A 47 8.933 -0.011 -6.172 1.00 0.00 C ATOM 703 C CYS A 47 10.026 0.860 -5.475 1.00 0.00 C ATOM 704 O CYS A 47 10.435 0.578 -4.344 1.00 0.00 O ATOM 705 CB CYS A 47 7.608 0.051 -5.376 1.00 0.00 C ATOM 706 SG CYS A 47 6.941 1.750 -5.348 1.00 0.00 S ATOM 0 H CYS A 47 9.145 -1.970 -5.415 1.00 0.00 H new ATOM 0 HA CYS A 47 8.851 0.411 -7.174 1.00 0.00 H new ATOM 0 HB2 CYS A 47 6.878 -0.623 -5.825 1.00 0.00 H new ATOM 0 HB3 CYS A 47 7.776 -0.295 -4.356 1.00 0.00 H new ATOM 0 HG CYS A 47 5.829 1.769 -4.675 1.00 0.00 H new ATOM 712 N ASP A 48 10.410 1.986 -6.107 1.00 0.00 N ATOM 713 CA ASP A 48 11.088 3.115 -5.393 1.00 0.00 C ATOM 714 C ASP A 48 10.059 4.050 -4.659 1.00 0.00 C ATOM 715 O ASP A 48 10.154 4.256 -3.446 1.00 0.00 O ATOM 716 CB ASP A 48 11.973 3.915 -6.386 1.00 0.00 C ATOM 717 CG ASP A 48 13.237 3.230 -6.899 1.00 0.00 C ATOM 718 OD1 ASP A 48 14.070 2.793 -6.078 1.00 0.00 O ATOM 719 OD2 ASP A 48 13.417 3.167 -8.134 1.00 0.00 O ATOM 0 H ASP A 48 10.269 2.149 -7.104 1.00 0.00 H new ATOM 0 HA ASP A 48 11.728 2.690 -4.619 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.360 4.181 -7.247 1.00 0.00 H new ATOM 0 HB3 ASP A 48 12.266 4.847 -5.903 1.00 0.00 H new ATOM 724 N GLY A 49 9.075 4.606 -5.392 1.00 0.00 N ATOM 725 CA GLY A 49 7.952 5.373 -4.795 1.00 0.00 C ATOM 726 C GLY A 49 6.779 5.490 -5.783 1.00 0.00 C ATOM 727 O GLY A 49 5.874 4.653 -5.772 1.00 0.00 O ATOM 0 H GLY A 49 9.031 4.540 -6.409 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.616 4.881 -3.882 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.296 6.368 -4.513 1.00 0.00 H new ATOM 731 N LYS A 50 6.825 6.487 -6.682 1.00 0.00 N ATOM 732 CA LYS A 50 5.993 6.465 -7.924 1.00 0.00 C ATOM 733 C LYS A 50 6.608 5.640 -9.104 1.00 0.00 C ATOM 734 O LYS A 50 5.843 5.005 -9.830 1.00 0.00 O ATOM 735 CB LYS A 50 5.620 7.895 -8.396 1.00 0.00 C ATOM 736 CG LYS A 50 4.640 8.687 -7.495 1.00 0.00 C ATOM 737 CD LYS A 50 4.506 10.186 -7.865 1.00 0.00 C ATOM 738 CE LYS A 50 3.957 10.535 -9.268 1.00 0.00 C ATOM 739 NZ LYS A 50 2.503 10.239 -9.387 1.00 0.00 N ATOM 0 H LYS A 50 7.416 7.313 -6.586 1.00 0.00 H new ATOM 0 HA LYS A 50 5.084 5.940 -7.633 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.539 8.473 -8.491 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.184 7.822 -9.393 1.00 0.00 H new ATOM 0 HG2 LYS A 50 3.656 8.221 -7.551 1.00 0.00 H new ATOM 0 HG3 LYS A 50 4.972 8.608 -6.460 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.859 10.657 -7.125 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.490 10.645 -7.766 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.130 11.592 -9.472 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.505 9.971 -10.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.193 10.407 -10.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.329 9.245 -9.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 1.969 10.858 -8.744 1.00 0.00 H new ATOM 753 N ASN A 51 7.936 5.643 -9.338 1.00 0.00 N ATOM 754 CA ASN A 51 8.562 4.830 -10.421 1.00 0.00 C ATOM 755 C ASN A 51 8.616 3.308 -10.040 1.00 0.00 C ATOM 756 O ASN A 51 9.403 2.869 -9.194 1.00 0.00 O ATOM 757 CB ASN A 51 9.906 5.469 -10.876 1.00 0.00 C ATOM 758 CG ASN A 51 11.080 5.424 -9.891 1.00 0.00 C ATOM 759 OD1 ASN A 51 11.090 6.129 -8.887 1.00 0.00 O ATOM 760 ND2 ASN A 51 12.068 4.595 -10.143 1.00 0.00 N ATOM 0 H ASN A 51 8.601 6.195 -8.797 1.00 0.00 H new ATOM 0 HA ASN A 51 7.933 4.848 -11.311 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.219 4.975 -11.796 1.00 0.00 H new ATOM 0 HB3 ASN A 51 9.715 6.513 -11.124 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.857 4.531 -9.500 1.00 0.00 H new ATOM 0 HD22 ASN A 51 12.046 4.015 -10.982 1.00 0.00 H new ATOM 767 N LEU A 52 7.718 2.523 -10.648 1.00 0.00 N ATOM 768 CA LEU A 52 7.547 1.079 -10.349 1.00 0.00 C ATOM 769 C LEU A 52 8.282 0.242 -11.439 1.00 0.00 C ATOM 770 O LEU A 52 7.889 0.234 -12.611 1.00 0.00 O ATOM 771 CB LEU A 52 6.016 0.844 -10.264 1.00 0.00 C ATOM 772 CG LEU A 52 5.554 -0.586 -9.892 1.00 0.00 C ATOM 773 CD1 LEU A 52 5.834 -0.928 -8.421 1.00 0.00 C ATOM 774 CD2 LEU A 52 4.053 -0.740 -10.183 1.00 0.00 C ATOM 0 H LEU A 52 7.081 2.866 -11.367 1.00 0.00 H new ATOM 0 HA LEU A 52 7.993 0.762 -9.406 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.605 1.537 -9.529 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.577 1.104 -11.227 1.00 0.00 H new ATOM 0 HG LEU A 52 6.128 -1.282 -10.504 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.491 -1.941 -8.211 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.905 -0.860 -8.229 1.00 0.00 H new ATOM 0 HD13 LEU A 52 5.305 -0.226 -7.777 1.00 0.00 H new ATOM 0 HD21 LEU A 52 3.733 -1.748 -9.920 1.00 0.00 H new ATOM 0 HD22 LEU A 52 3.492 -0.015 -9.593 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.868 -0.566 -11.243 1.00 0.00 H new ATOM 786 N THR A 53 9.368 -0.445 -11.053 1.00 0.00 N ATOM 787 CA THR A 53 10.244 -1.180 -12.010 1.00 0.00 C ATOM 788 C THR A 53 9.631 -2.573 -12.348 1.00 0.00 C ATOM 789 O THR A 53 9.482 -3.429 -11.472 1.00 0.00 O ATOM 790 CB THR A 53 11.702 -1.257 -11.467 1.00 0.00 C ATOM 791 OG1 THR A 53 12.185 0.041 -11.124 1.00 0.00 O ATOM 792 CG2 THR A 53 12.708 -1.799 -12.495 1.00 0.00 C ATOM 0 H THR A 53 9.671 -0.514 -10.081 1.00 0.00 H new ATOM 0 HA THR A 53 10.298 -0.633 -12.951 1.00 0.00 H new ATOM 0 HB THR A 53 11.639 -1.927 -10.609 1.00 0.00 H new ATOM 0 HG1 THR A 53 13.101 -0.030 -10.784 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.703 -1.826 -12.051 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.416 -2.806 -12.793 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.719 -1.150 -13.371 1.00 0.00 H new ATOM 800 N ILE A 54 9.265 -2.764 -13.626 1.00 0.00 N ATOM 801 CA ILE A 54 8.602 -4.001 -14.125 1.00 0.00 C ATOM 802 C ILE A 54 9.559 -4.614 -15.205 1.00 0.00 C ATOM 803 O ILE A 54 9.666 -4.105 -16.328 1.00 0.00 O ATOM 804 CB ILE A 54 7.134 -3.731 -14.627 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.237 -3.039 -13.549 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.466 -5.042 -15.127 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.780 -2.728 -13.932 1.00 0.00 C ATOM 0 H ILE A 54 9.417 -2.066 -14.354 1.00 0.00 H new ATOM 0 HA ILE A 54 8.455 -4.727 -13.325 1.00 0.00 H new ATOM 0 HB ILE A 54 7.221 -3.035 -15.461 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.224 -3.675 -12.664 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.717 -2.103 -13.262 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.453 -4.827 -15.468 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.047 -5.455 -15.952 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.429 -5.765 -14.312 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.277 -2.250 -13.091 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.765 -2.059 -14.792 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.264 -3.655 -14.184 1.00 0.00 H new ATOM 819 N LYS A 55 10.245 -5.717 -14.856 1.00 0.00 N ATOM 820 CA LYS A 55 11.074 -6.498 -15.817 1.00 0.00 C ATOM 821 C LYS A 55 10.284 -7.739 -16.345 1.00 0.00 C ATOM 822 O LYS A 55 9.814 -8.557 -15.553 1.00 0.00 O ATOM 823 CB LYS A 55 12.392 -6.908 -15.103 1.00 0.00 C ATOM 824 CG LYS A 55 13.475 -7.485 -16.044 1.00 0.00 C ATOM 825 CD LYS A 55 14.710 -8.020 -15.295 1.00 0.00 C ATOM 826 CE LYS A 55 15.816 -8.448 -16.277 1.00 0.00 C ATOM 827 NZ LYS A 55 16.829 -9.267 -15.564 1.00 0.00 N ATOM 0 H LYS A 55 10.247 -6.097 -13.910 1.00 0.00 H new ATOM 0 HA LYS A 55 11.317 -5.891 -16.689 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.800 -6.037 -14.591 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.161 -7.649 -14.337 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.040 -8.290 -16.636 1.00 0.00 H new ATOM 0 HG3 LYS A 55 13.790 -6.710 -16.743 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.093 -7.251 -14.625 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.423 -8.869 -14.675 1.00 0.00 H new ATOM 0 HE2 LYS A 55 15.385 -9.020 -17.099 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.288 -7.568 -16.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.740 -9.202 -16.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.939 -8.914 -14.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 16.518 -10.259 -15.539 1.00 0.00 H new ATOM 841 N THR A 56 10.189 -7.917 -17.670 1.00 0.00 N ATOM 842 CA THR A 56 9.614 -9.148 -18.290 1.00 0.00 C ATOM 843 C THR A 56 10.791 -10.080 -18.726 1.00 0.00 C ATOM 844 O THR A 56 11.365 -9.897 -19.805 1.00 0.00 O ATOM 845 CB THR A 56 8.668 -8.733 -19.463 1.00 0.00 C ATOM 846 OG1 THR A 56 7.580 -7.958 -18.969 1.00 0.00 O ATOM 847 CG2 THR A 56 8.019 -9.904 -20.221 1.00 0.00 C ATOM 0 H THR A 56 10.503 -7.224 -18.350 1.00 0.00 H new ATOM 0 HA THR A 56 9.004 -9.714 -17.586 1.00 0.00 H new ATOM 0 HB THR A 56 9.322 -8.189 -20.144 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.996 -7.703 -19.713 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.382 -9.515 -21.015 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.797 -10.532 -20.655 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.418 -10.496 -19.531 1.00 0.00 H new ATOM 855 N GLU A 57 11.134 -11.084 -17.899 1.00 0.00 N ATOM 856 CA GLU A 57 12.127 -12.137 -18.259 1.00 0.00 C ATOM 857 C GLU A 57 11.404 -13.333 -18.961 1.00 0.00 C ATOM 858 O GLU A 57 10.850 -14.217 -18.301 1.00 0.00 O ATOM 859 CB GLU A 57 12.883 -12.609 -16.982 1.00 0.00 C ATOM 860 CG GLU A 57 13.915 -11.622 -16.384 1.00 0.00 C ATOM 861 CD GLU A 57 14.631 -12.050 -15.099 1.00 0.00 C ATOM 862 OE1 GLU A 57 14.128 -12.891 -14.320 1.00 0.00 O ATOM 863 OE2 GLU A 57 15.703 -11.473 -14.821 1.00 0.00 O ATOM 0 H GLU A 57 10.739 -11.197 -16.965 1.00 0.00 H new ATOM 0 HA GLU A 57 12.858 -11.726 -18.955 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.144 -12.837 -16.213 1.00 0.00 H new ATOM 0 HB3 GLU A 57 13.398 -13.541 -17.216 1.00 0.00 H new ATOM 0 HG2 GLU A 57 14.672 -11.424 -17.143 1.00 0.00 H new ATOM 0 HG3 GLU A 57 13.406 -10.678 -16.189 1.00 0.00 H new ATOM 870 N SER A 58 11.412 -13.366 -20.304 1.00 0.00 N ATOM 871 CA SER A 58 10.930 -14.543 -21.086 1.00 0.00 C ATOM 872 C SER A 58 12.114 -15.373 -21.674 1.00 0.00 C ATOM 873 O SER A 58 13.175 -14.831 -22.007 1.00 0.00 O ATOM 874 CB SER A 58 9.887 -14.071 -22.135 1.00 0.00 C ATOM 875 OG SER A 58 10.460 -13.746 -23.402 1.00 0.00 O ATOM 0 H SER A 58 11.746 -12.595 -20.882 1.00 0.00 H new ATOM 0 HA SER A 58 10.418 -15.243 -20.426 1.00 0.00 H new ATOM 0 HB2 SER A 58 9.142 -14.854 -22.272 1.00 0.00 H new ATOM 0 HB3 SER A 58 9.363 -13.197 -21.747 1.00 0.00 H new ATOM 0 HG SER A 58 10.823 -12.836 -23.373 1.00 0.00 H new ATOM 881 N THR A 59 11.918 -16.692 -21.856 1.00 0.00 N ATOM 882 CA THR A 59 12.991 -17.623 -22.358 1.00 0.00 C ATOM 883 C THR A 59 13.252 -17.570 -23.913 1.00 0.00 C ATOM 884 O THR A 59 13.308 -18.592 -24.602 1.00 0.00 O ATOM 885 CB THR A 59 12.713 -19.078 -21.846 1.00 0.00 C ATOM 886 OG1 THR A 59 11.486 -19.600 -22.354 1.00 0.00 O ATOM 887 CG2 THR A 59 12.698 -19.263 -20.319 1.00 0.00 C ATOM 0 H THR A 59 11.029 -17.155 -21.667 1.00 0.00 H new ATOM 0 HA THR A 59 13.930 -17.264 -21.936 1.00 0.00 H new ATOM 0 HB THR A 59 13.572 -19.627 -22.231 1.00 0.00 H new ATOM 0 HG1 THR A 59 10.735 -19.210 -21.859 1.00 0.00 H new ATOM 0 HG21 THR A 59 12.497 -20.307 -20.081 1.00 0.00 H new ATOM 0 HG22 THR A 59 13.666 -18.977 -19.908 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.920 -18.635 -19.884 1.00 0.00 H new ATOM 895 N LEU A 60 13.420 -16.353 -24.461 1.00 0.00 N ATOM 896 CA LEU A 60 13.348 -16.047 -25.920 1.00 0.00 C ATOM 897 C LEU A 60 13.592 -14.518 -26.143 1.00 0.00 C ATOM 898 O LEU A 60 14.554 -14.143 -26.819 1.00 0.00 O ATOM 899 CB LEU A 60 12.011 -16.542 -26.573 1.00 0.00 C ATOM 900 CG LEU A 60 12.157 -17.762 -27.511 1.00 0.00 C ATOM 901 CD1 LEU A 60 10.813 -18.481 -27.692 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.703 -17.327 -28.876 1.00 0.00 C ATOM 0 H LEU A 60 13.615 -15.527 -23.895 1.00 0.00 H new ATOM 0 HA LEU A 60 14.136 -16.602 -26.429 1.00 0.00 H new ATOM 0 HB2 LEU A 60 11.308 -16.794 -25.779 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.573 -15.719 -27.137 1.00 0.00 H new ATOM 0 HG LEU A 60 12.861 -18.455 -27.051 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.944 -19.335 -28.356 1.00 0.00 H new ATOM 0 HD12 LEU A 60 10.452 -18.827 -26.723 1.00 0.00 H new ATOM 0 HD13 LEU A 60 10.087 -17.792 -28.125 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.799 -18.198 -29.524 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.018 -16.611 -29.330 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.680 -16.862 -28.746 1.00 0.00 H new ATOM 914 N LYS A 61 12.727 -13.639 -25.588 1.00 0.00 N ATOM 915 CA LYS A 61 12.909 -12.159 -25.638 1.00 0.00 C ATOM 916 C LYS A 61 12.733 -11.507 -24.221 1.00 0.00 C ATOM 917 O LYS A 61 12.351 -12.153 -23.238 1.00 0.00 O ATOM 918 CB LYS A 61 11.965 -11.612 -26.751 1.00 0.00 C ATOM 919 CG LYS A 61 12.410 -10.262 -27.369 1.00 0.00 C ATOM 920 CD LYS A 61 11.635 -9.935 -28.661 1.00 0.00 C ATOM 921 CE LYS A 61 12.206 -8.784 -29.515 1.00 0.00 C ATOM 922 NZ LYS A 61 11.898 -7.467 -28.898 1.00 0.00 N ATOM 0 H LYS A 61 11.884 -13.928 -25.093 1.00 0.00 H new ATOM 0 HA LYS A 61 13.929 -11.885 -25.908 1.00 0.00 H new ATOM 0 HB2 LYS A 61 11.894 -12.354 -27.546 1.00 0.00 H new ATOM 0 HB3 LYS A 61 10.965 -11.494 -26.335 1.00 0.00 H new ATOM 0 HG2 LYS A 61 12.258 -9.463 -26.643 1.00 0.00 H new ATOM 0 HG3 LYS A 61 13.478 -10.297 -27.586 1.00 0.00 H new ATOM 0 HD2 LYS A 61 11.597 -10.834 -29.276 1.00 0.00 H new ATOM 0 HD3 LYS A 61 10.608 -9.688 -28.393 1.00 0.00 H new ATOM 0 HE2 LYS A 61 13.285 -8.900 -29.616 1.00 0.00 H new ATOM 0 HE3 LYS A 61 11.786 -8.827 -30.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.910 -6.729 -29.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 10.957 -7.502 -28.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.612 -7.247 -28.174 1.00 0.00 H new ATOM 936 N THR A 62 13.093 -10.224 -24.067 1.00 0.00 N ATOM 937 CA THR A 62 13.092 -9.529 -22.734 1.00 0.00 C ATOM 938 C THR A 62 12.795 -8.004 -22.905 1.00 0.00 C ATOM 939 O THR A 62 13.087 -7.384 -23.936 1.00 0.00 O ATOM 940 CB THR A 62 14.411 -9.871 -21.961 1.00 0.00 C ATOM 941 OG1 THR A 62 14.428 -11.266 -21.663 1.00 0.00 O ATOM 942 CG2 THR A 62 14.628 -9.188 -20.600 1.00 0.00 C ATOM 0 H THR A 62 13.392 -9.630 -24.840 1.00 0.00 H new ATOM 0 HA THR A 62 12.279 -9.897 -22.108 1.00 0.00 H new ATOM 0 HB THR A 62 15.188 -9.515 -22.638 1.00 0.00 H new ATOM 0 HG1 THR A 62 13.636 -11.693 -22.052 1.00 0.00 H new ATOM 0 HG21 THR A 62 15.578 -9.514 -20.177 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.643 -8.106 -20.734 1.00 0.00 H new ATOM 0 HG23 THR A 62 13.817 -9.459 -19.924 1.00 0.00 H new ATOM 950 N THR A 63 12.152 -7.389 -21.896 1.00 0.00 N ATOM 951 CA THR A 63 11.885 -5.915 -21.867 1.00 0.00 C ATOM 952 C THR A 63 11.779 -5.428 -20.385 1.00 0.00 C ATOM 953 O THR A 63 11.204 -6.101 -19.525 1.00 0.00 O ATOM 954 CB THR A 63 10.636 -5.555 -22.732 1.00 0.00 C ATOM 955 OG1 THR A 63 10.847 -5.993 -24.071 1.00 0.00 O ATOM 956 CG2 THR A 63 10.317 -4.056 -22.842 1.00 0.00 C ATOM 0 H THR A 63 11.800 -7.884 -21.077 1.00 0.00 H new ATOM 0 HA THR A 63 12.720 -5.380 -22.320 1.00 0.00 H new ATOM 0 HB THR A 63 9.808 -6.045 -22.220 1.00 0.00 H new ATOM 0 HG1 THR A 63 11.800 -6.174 -24.209 1.00 0.00 H new ATOM 0 HG21 THR A 63 9.433 -3.917 -23.464 1.00 0.00 H new ATOM 0 HG22 THR A 63 10.129 -3.650 -21.848 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.163 -3.536 -23.293 1.00 0.00 H new ATOM 964 N GLN A 64 12.352 -4.250 -20.086 1.00 0.00 N ATOM 965 CA GLN A 64 12.402 -3.685 -18.707 1.00 0.00 C ATOM 966 C GLN A 64 12.013 -2.176 -18.723 1.00 0.00 C ATOM 967 O GLN A 64 12.544 -1.396 -19.521 1.00 0.00 O ATOM 968 CB GLN A 64 13.832 -3.937 -18.155 1.00 0.00 C ATOM 969 CG GLN A 64 14.057 -3.576 -16.663 1.00 0.00 C ATOM 970 CD GLN A 64 15.478 -3.880 -16.175 1.00 0.00 C ATOM 971 OE1 GLN A 64 15.846 -5.020 -15.907 1.00 0.00 O ATOM 972 NE2 GLN A 64 16.326 -2.887 -16.047 1.00 0.00 N ATOM 0 H GLN A 64 12.796 -3.655 -20.786 1.00 0.00 H new ATOM 0 HA GLN A 64 11.680 -4.169 -18.050 1.00 0.00 H new ATOM 0 HB2 GLN A 64 14.073 -4.991 -18.294 1.00 0.00 H new ATOM 0 HB3 GLN A 64 14.539 -3.366 -18.757 1.00 0.00 H new ATOM 0 HG2 GLN A 64 13.849 -2.516 -16.517 1.00 0.00 H new ATOM 0 HG3 GLN A 64 13.344 -4.128 -16.051 1.00 0.00 H new ATOM 0 HE21 GLN A 64 16.033 -1.935 -16.266 1.00 0.00 H new ATOM 0 HE22 GLN A 64 17.278 -3.067 -15.728 1.00 0.00 H new ATOM 981 N PHE A 65 11.102 -1.762 -17.824 1.00 0.00 N ATOM 982 CA PHE A 65 10.601 -0.356 -17.771 1.00 0.00 C ATOM 983 C PHE A 65 10.245 0.095 -16.317 1.00 0.00 C ATOM 984 O PHE A 65 9.704 -0.677 -15.522 1.00 0.00 O ATOM 985 CB PHE A 65 9.416 -0.151 -18.767 1.00 0.00 C ATOM 986 CG PHE A 65 8.129 -0.964 -18.517 1.00 0.00 C ATOM 987 CD1 PHE A 65 7.129 -0.463 -17.677 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.974 -2.233 -19.086 1.00 0.00 C ATOM 989 CE1 PHE A 65 5.988 -1.217 -17.415 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.840 -2.992 -18.810 1.00 0.00 C ATOM 991 CZ PHE A 65 5.846 -2.482 -17.979 1.00 0.00 C ATOM 0 H PHE A 65 10.691 -2.374 -17.119 1.00 0.00 H new ATOM 0 HA PHE A 65 11.414 0.295 -18.092 1.00 0.00 H new ATOM 0 HB2 PHE A 65 9.152 0.907 -18.763 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.774 -0.387 -19.769 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.242 0.513 -17.229 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.737 -2.625 -19.742 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.214 -0.821 -16.775 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.731 -3.976 -19.241 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.963 -3.069 -17.772 1.00 0.00 H new ATOM 1001 N SER A 66 10.487 1.377 -15.993 1.00 0.00 N ATOM 1002 CA SER A 66 10.014 1.994 -14.724 1.00 0.00 C ATOM 1003 C SER A 66 8.725 2.834 -14.969 1.00 0.00 C ATOM 1004 O SER A 66 8.807 3.950 -15.498 1.00 0.00 O ATOM 1005 CB SER A 66 11.161 2.826 -14.110 1.00 0.00 C ATOM 1006 OG SER A 66 11.432 4.003 -14.875 1.00 0.00 O ATOM 0 H SER A 66 11.010 2.016 -16.591 1.00 0.00 H new ATOM 0 HA SER A 66 9.741 1.219 -14.008 1.00 0.00 H new ATOM 0 HB2 SER A 66 10.900 3.108 -13.090 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.062 2.215 -14.051 1.00 0.00 H new ATOM 0 HG SER A 66 10.614 4.294 -15.329 1.00 0.00 H new ATOM 1012 N CYS A 67 7.550 2.302 -14.595 1.00 0.00 N ATOM 1013 CA CYS A 67 6.254 2.984 -14.831 1.00 0.00 C ATOM 1014 C CYS A 67 5.876 3.997 -13.709 1.00 0.00 C ATOM 1015 O CYS A 67 5.807 3.650 -12.526 1.00 0.00 O ATOM 1016 CB CYS A 67 5.171 1.912 -15.058 1.00 0.00 C ATOM 1017 SG CYS A 67 4.932 0.802 -13.635 1.00 0.00 S ATOM 0 H CYS A 67 7.464 1.400 -14.127 1.00 0.00 H new ATOM 0 HA CYS A 67 6.342 3.601 -15.725 1.00 0.00 H new ATOM 0 HB2 CYS A 67 4.226 2.405 -15.286 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.439 1.317 -15.931 1.00 0.00 H new ATOM 0 HG CYS A 67 6.090 0.460 -13.152 1.00 0.00 H new ATOM 1023 N THR A 68 5.619 5.256 -14.097 1.00 0.00 N ATOM 1024 CA THR A 68 5.346 6.365 -13.137 1.00 0.00 C ATOM 1025 C THR A 68 3.867 6.299 -12.628 1.00 0.00 C ATOM 1026 O THR A 68 2.916 6.563 -13.368 1.00 0.00 O ATOM 1027 CB THR A 68 5.715 7.725 -13.808 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.021 7.683 -14.377 1.00 0.00 O ATOM 1029 CG2 THR A 68 5.754 8.907 -12.829 1.00 0.00 C ATOM 0 H THR A 68 5.592 5.544 -15.075 1.00 0.00 H new ATOM 0 HA THR A 68 5.970 6.263 -12.249 1.00 0.00 H new ATOM 0 HB THR A 68 4.931 7.871 -14.551 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.225 8.547 -14.792 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.017 9.817 -13.368 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.774 9.029 -12.367 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.498 8.715 -12.056 1.00 0.00 H new ATOM 1037 N LEU A 69 3.682 5.911 -11.357 1.00 0.00 N ATOM 1038 CA LEU A 69 2.357 5.536 -10.805 1.00 0.00 C ATOM 1039 C LEU A 69 1.505 6.780 -10.395 1.00 0.00 C ATOM 1040 O LEU A 69 1.925 7.598 -9.568 1.00 0.00 O ATOM 1041 CB LEU A 69 2.657 4.588 -9.613 1.00 0.00 C ATOM 1042 CG LEU A 69 1.452 3.790 -9.069 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.057 2.643 -10.015 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.799 3.236 -7.680 1.00 0.00 C ATOM 0 H LEU A 69 4.441 5.846 -10.678 1.00 0.00 H new ATOM 0 HA LEU A 69 1.741 5.038 -11.554 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.428 3.881 -9.920 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.074 5.180 -8.798 1.00 0.00 H new ATOM 0 HG LEU A 69 0.597 4.463 -8.998 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.206 2.105 -9.598 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.787 3.051 -10.989 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.898 1.959 -10.129 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.951 2.672 -7.291 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.667 2.581 -7.756 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.025 4.062 -7.005 1.00 0.00 H new ATOM 1056 N GLY A 70 0.327 6.948 -11.015 1.00 0.00 N ATOM 1057 CA GLY A 70 -0.370 8.263 -11.076 1.00 0.00 C ATOM 1058 C GLY A 70 0.283 9.314 -12.009 1.00 0.00 C ATOM 1059 O GLY A 70 0.555 10.435 -11.569 1.00 0.00 O ATOM 0 H GLY A 70 -0.172 6.193 -11.486 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.396 8.097 -11.404 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.420 8.676 -10.069 1.00 0.00 H new ATOM 1063 N GLU A 71 0.563 8.910 -13.259 1.00 0.00 N ATOM 1064 CA GLU A 71 1.222 9.733 -14.313 1.00 0.00 C ATOM 1065 C GLU A 71 1.371 8.872 -15.622 1.00 0.00 C ATOM 1066 O GLU A 71 1.308 7.630 -15.603 1.00 0.00 O ATOM 1067 CB GLU A 71 2.596 10.356 -13.877 1.00 0.00 C ATOM 1068 CG GLU A 71 2.673 11.901 -13.986 1.00 0.00 C ATOM 1069 CD GLU A 71 2.733 12.476 -15.397 1.00 0.00 C ATOM 1070 OE1 GLU A 71 1.795 12.246 -16.192 1.00 0.00 O ATOM 1071 OE2 GLU A 71 3.720 13.169 -15.711 1.00 0.00 O ATOM 0 H GLU A 71 0.333 7.971 -13.585 1.00 0.00 H new ATOM 0 HA GLU A 71 0.577 10.592 -14.500 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.799 10.068 -12.845 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.386 9.923 -14.490 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.804 12.323 -13.481 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.554 12.239 -13.441 1.00 0.00 H new ATOM 1078 N LYS A 72 1.569 9.548 -16.772 1.00 0.00 N ATOM 1079 CA LYS A 72 1.968 8.877 -18.041 1.00 0.00 C ATOM 1080 C LYS A 72 3.514 8.828 -18.289 1.00 0.00 C ATOM 1081 O LYS A 72 4.282 9.694 -17.863 1.00 0.00 O ATOM 1082 CB LYS A 72 1.155 9.403 -19.263 1.00 0.00 C ATOM 1083 CG LYS A 72 1.531 10.796 -19.833 1.00 0.00 C ATOM 1084 CD LYS A 72 1.386 10.934 -21.367 1.00 0.00 C ATOM 1085 CE LYS A 72 -0.054 10.919 -21.918 1.00 0.00 C ATOM 1086 NZ LYS A 72 0.010 11.264 -23.366 1.00 0.00 N ATOM 0 H LYS A 72 1.461 10.559 -16.855 1.00 0.00 H new ATOM 0 HA LYS A 72 1.694 7.829 -17.916 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.250 8.674 -20.068 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.103 9.429 -18.980 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.905 11.549 -19.355 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.562 11.018 -19.559 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.861 11.866 -21.674 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.942 10.123 -21.838 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.506 9.937 -21.779 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.676 11.636 -21.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.685 10.694 -23.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.205 12.274 -23.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.964 11.065 -23.728 1.00 0.00 H new ATOM 1100 N PHE A 73 3.945 7.816 -19.054 1.00 0.00 N ATOM 1101 CA PHE A 73 5.339 7.692 -19.573 1.00 0.00 C ATOM 1102 C PHE A 73 5.327 7.113 -21.034 1.00 0.00 C ATOM 1103 O PHE A 73 4.351 6.478 -21.451 1.00 0.00 O ATOM 1104 CB PHE A 73 6.207 6.885 -18.552 1.00 0.00 C ATOM 1105 CG PHE A 73 6.017 5.353 -18.507 1.00 0.00 C ATOM 1106 CD1 PHE A 73 4.850 4.794 -17.978 1.00 0.00 C ATOM 1107 CD2 PHE A 73 6.977 4.514 -19.086 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.622 3.425 -18.076 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.758 3.141 -19.156 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.575 2.600 -18.663 1.00 0.00 C ATOM 0 H PHE A 73 3.340 7.046 -19.340 1.00 0.00 H new ATOM 0 HA PHE A 73 5.811 8.671 -19.659 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.256 7.087 -18.769 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.006 7.278 -17.555 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.123 5.427 -17.491 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.891 4.934 -19.480 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.704 3.003 -17.696 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.506 2.496 -19.593 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.396 1.537 -18.736 1.00 0.00 H new ATOM 1120 N GLU A 74 6.419 7.266 -21.814 1.00 0.00 N ATOM 1121 CA GLU A 74 6.576 6.488 -23.081 1.00 0.00 C ATOM 1122 C GLU A 74 7.116 5.049 -22.778 1.00 0.00 C ATOM 1123 O GLU A 74 8.296 4.842 -22.474 1.00 0.00 O ATOM 1124 CB GLU A 74 7.434 7.242 -24.134 1.00 0.00 C ATOM 1125 CG GLU A 74 7.335 6.590 -25.544 1.00 0.00 C ATOM 1126 CD GLU A 74 8.301 7.080 -26.606 1.00 0.00 C ATOM 1127 OE1 GLU A 74 9.534 7.034 -26.396 1.00 0.00 O ATOM 1128 OE2 GLU A 74 7.852 7.374 -27.732 1.00 0.00 O ATOM 0 H GLU A 74 7.190 7.900 -21.605 1.00 0.00 H new ATOM 0 HA GLU A 74 5.590 6.380 -23.533 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.107 8.280 -24.191 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.475 7.253 -23.812 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.476 5.515 -25.429 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.321 6.740 -25.915 1.00 0.00 H new ATOM 1135 N GLU A 75 6.228 4.056 -22.906 1.00 0.00 N ATOM 1136 CA GLU A 75 6.589 2.625 -22.936 1.00 0.00 C ATOM 1137 C GLU A 75 7.027 2.185 -24.374 1.00 0.00 C ATOM 1138 O GLU A 75 6.516 2.650 -25.399 1.00 0.00 O ATOM 1139 CB GLU A 75 5.329 1.889 -22.399 1.00 0.00 C ATOM 1140 CG GLU A 75 5.408 0.340 -22.300 1.00 0.00 C ATOM 1141 CD GLU A 75 4.661 -0.464 -23.360 1.00 0.00 C ATOM 1142 OE1 GLU A 75 4.308 0.074 -24.438 1.00 0.00 O ATOM 1143 OE2 GLU A 75 4.370 -1.647 -23.088 1.00 0.00 O ATOM 0 H GLU A 75 5.225 4.221 -22.993 1.00 0.00 H new ATOM 0 HA GLU A 75 7.455 2.385 -22.319 1.00 0.00 H new ATOM 0 HB2 GLU A 75 5.104 2.281 -21.407 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.487 2.145 -23.042 1.00 0.00 H new ATOM 0 HG2 GLU A 75 6.459 0.052 -22.335 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.029 0.044 -21.322 1.00 0.00 H new ATOM 1150 N THR A 76 7.999 1.266 -24.436 1.00 0.00 N ATOM 1151 CA THR A 76 8.274 0.464 -25.664 1.00 0.00 C ATOM 1152 C THR A 76 7.920 -1.022 -25.359 1.00 0.00 C ATOM 1153 O THR A 76 8.501 -1.643 -24.463 1.00 0.00 O ATOM 1154 CB THR A 76 9.740 0.691 -26.135 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.928 2.074 -26.396 1.00 0.00 O ATOM 1156 CG2 THR A 76 10.154 -0.084 -27.400 1.00 0.00 C ATOM 0 H THR A 76 8.617 1.049 -23.654 1.00 0.00 H new ATOM 0 HA THR A 76 7.653 0.781 -26.502 1.00 0.00 H new ATOM 0 HB THR A 76 10.364 0.316 -25.324 1.00 0.00 H new ATOM 0 HG1 THR A 76 10.881 2.254 -26.536 1.00 0.00 H new ATOM 0 HG21 THR A 76 11.192 0.144 -27.643 1.00 0.00 H new ATOM 0 HG22 THR A 76 10.050 -1.154 -27.222 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.514 0.209 -28.232 1.00 0.00 H new ATOM 1164 N THR A 77 6.978 -1.589 -26.129 1.00 0.00 N ATOM 1165 CA THR A 77 6.531 -3.006 -25.971 1.00 0.00 C ATOM 1166 C THR A 77 7.636 -4.042 -26.366 1.00 0.00 C ATOM 1167 O THR A 77 8.478 -3.785 -27.236 1.00 0.00 O ATOM 1168 CB THR A 77 5.229 -3.276 -26.803 1.00 0.00 C ATOM 1169 OG1 THR A 77 5.453 -3.074 -28.193 1.00 0.00 O ATOM 1170 CG2 THR A 77 4.003 -2.433 -26.421 1.00 0.00 C ATOM 0 H THR A 77 6.499 -1.091 -26.879 1.00 0.00 H new ATOM 0 HA THR A 77 6.322 -3.143 -24.910 1.00 0.00 H new ATOM 0 HB THR A 77 5.001 -4.315 -26.564 1.00 0.00 H new ATOM 0 HG1 THR A 77 5.479 -2.113 -28.384 1.00 0.00 H new ATOM 0 HG21 THR A 77 3.162 -2.703 -27.060 1.00 0.00 H new ATOM 0 HG22 THR A 77 3.742 -2.621 -25.379 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.233 -1.376 -26.552 1.00 0.00 H new ATOM 1178 N ALA A 78 7.578 -5.261 -25.791 1.00 0.00 N ATOM 1179 CA ALA A 78 8.400 -6.411 -26.277 1.00 0.00 C ATOM 1180 C ALA A 78 8.262 -6.821 -27.788 1.00 0.00 C ATOM 1181 O ALA A 78 9.236 -7.295 -28.380 1.00 0.00 O ATOM 1182 CB ALA A 78 8.123 -7.599 -25.336 1.00 0.00 C ATOM 0 H ALA A 78 6.979 -5.483 -24.996 1.00 0.00 H new ATOM 0 HA ALA A 78 9.437 -6.078 -26.245 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.706 -8.462 -25.658 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.404 -7.330 -24.318 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.062 -7.847 -25.366 1.00 0.00 H new ATOM 1188 N ASP A 79 7.093 -6.593 -28.407 1.00 0.00 N ATOM 1189 CA ASP A 79 6.873 -6.745 -29.873 1.00 0.00 C ATOM 1190 C ASP A 79 7.603 -5.699 -30.787 1.00 0.00 C ATOM 1191 O ASP A 79 8.182 -6.077 -31.809 1.00 0.00 O ATOM 1192 CB ASP A 79 5.345 -6.672 -30.152 1.00 0.00 C ATOM 1193 CG ASP A 79 4.440 -7.674 -29.447 1.00 0.00 C ATOM 1194 OD1 ASP A 79 4.720 -8.888 -29.482 1.00 0.00 O ATOM 1195 OD2 ASP A 79 3.409 -7.236 -28.888 1.00 0.00 O ATOM 0 H ASP A 79 6.257 -6.294 -27.906 1.00 0.00 H new ATOM 0 HA ASP A 79 7.310 -7.709 -30.135 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.005 -5.671 -29.887 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.196 -6.786 -31.226 1.00 0.00 H new ATOM 1200 N GLY A 80 7.509 -4.396 -30.462 1.00 0.00 N ATOM 1201 CA GLY A 80 7.880 -3.292 -31.395 1.00 0.00 C ATOM 1202 C GLY A 80 7.052 -1.982 -31.314 1.00 0.00 C ATOM 1203 O GLY A 80 7.608 -0.910 -31.556 1.00 0.00 O ATOM 0 H GLY A 80 7.177 -4.070 -29.554 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.926 -3.041 -31.221 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.809 -3.673 -32.414 1.00 0.00 H new ATOM 1207 N ARG A 81 5.742 -2.043 -30.998 1.00 0.00 N ATOM 1208 CA ARG A 81 4.884 -0.835 -30.791 1.00 0.00 C ATOM 1209 C ARG A 81 5.343 0.039 -29.571 1.00 0.00 C ATOM 1210 O ARG A 81 5.718 -0.501 -28.523 1.00 0.00 O ATOM 1211 CB ARG A 81 3.409 -1.272 -30.539 1.00 0.00 C ATOM 1212 CG ARG A 81 2.683 -2.128 -31.615 1.00 0.00 C ATOM 1213 CD ARG A 81 1.271 -2.623 -31.193 1.00 0.00 C ATOM 1214 NE ARG A 81 1.242 -3.381 -29.907 1.00 0.00 N ATOM 1215 CZ ARG A 81 1.775 -4.588 -29.715 1.00 0.00 C ATOM 1216 NH1 ARG A 81 2.133 -5.395 -30.675 1.00 0.00 N ATOM 1217 NH2 ARG A 81 1.970 -5.008 -28.502 1.00 0.00 N ATOM 0 H ARG A 81 5.241 -2.923 -30.877 1.00 0.00 H new ATOM 0 HA ARG A 81 4.975 -0.235 -31.696 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.386 -1.831 -29.603 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.820 -0.368 -30.385 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.591 -1.541 -32.529 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.302 -2.993 -31.853 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.608 -1.762 -31.108 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.870 -3.257 -31.984 1.00 0.00 H new ATOM 0 HE ARG A 81 0.778 -2.941 -29.113 1.00 0.00 H new ATOM 0 HH11 ARG A 81 2.011 -5.115 -31.648 1.00 0.00 H new ATOM 0 HH12 ARG A 81 2.535 -6.306 -30.452 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.716 -4.417 -27.711 1.00 0.00 H new ATOM 0 HH22 ARG A 81 2.377 -5.929 -28.341 1.00 0.00 H new ATOM 1231 N LYS A 82 5.279 1.374 -29.702 1.00 0.00 N ATOM 1232 CA LYS A 82 5.590 2.320 -28.589 1.00 0.00 C ATOM 1233 C LYS A 82 4.283 3.031 -28.115 1.00 0.00 C ATOM 1234 O LYS A 82 3.495 3.516 -28.935 1.00 0.00 O ATOM 1235 CB LYS A 82 6.690 3.321 -29.038 1.00 0.00 C ATOM 1236 CG LYS A 82 8.074 2.675 -29.321 1.00 0.00 C ATOM 1237 CD LYS A 82 9.205 3.673 -29.645 1.00 0.00 C ATOM 1238 CE LYS A 82 9.771 4.394 -28.406 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.168 5.795 -28.689 1.00 0.00 N ATOM 0 H LYS A 82 5.013 1.837 -30.571 1.00 0.00 H new ATOM 0 HA LYS A 82 5.985 1.774 -27.733 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.351 3.833 -29.939 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.809 4.081 -28.265 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.368 2.086 -28.452 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.971 1.982 -30.156 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.014 3.141 -30.146 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.830 4.417 -30.348 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.023 4.386 -27.613 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.636 3.844 -28.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.348 6.293 -27.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 11.032 5.801 -29.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.403 6.275 -29.204 1.00 0.00 H new ATOM 1253 N THR A 83 4.034 3.054 -26.794 1.00 0.00 N ATOM 1254 CA THR A 83 2.700 3.413 -26.224 1.00 0.00 C ATOM 1255 C THR A 83 2.833 4.525 -25.128 1.00 0.00 C ATOM 1256 O THR A 83 3.718 4.482 -24.268 1.00 0.00 O ATOM 1257 CB THR A 83 1.916 2.152 -25.720 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.432 1.627 -24.499 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.782 0.976 -26.704 1.00 0.00 C ATOM 0 H THR A 83 4.735 2.829 -26.089 1.00 0.00 H new ATOM 0 HA THR A 83 2.099 3.835 -27.029 1.00 0.00 H new ATOM 0 HB THR A 83 0.920 2.574 -25.586 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.914 0.793 -24.679 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.220 0.170 -26.233 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.258 1.309 -27.600 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.774 0.615 -26.977 1.00 0.00 H new ATOM 1267 N GLN A 84 1.939 5.535 -25.143 1.00 0.00 N ATOM 1268 CA GLN A 84 1.860 6.566 -24.065 1.00 0.00 C ATOM 1269 C GLN A 84 1.001 6.025 -22.881 1.00 0.00 C ATOM 1270 O GLN A 84 -0.230 5.956 -22.951 1.00 0.00 O ATOM 1271 CB GLN A 84 1.272 7.888 -24.627 1.00 0.00 C ATOM 1272 CG GLN A 84 2.184 8.698 -25.584 1.00 0.00 C ATOM 1273 CD GLN A 84 3.081 9.712 -24.875 1.00 0.00 C ATOM 1274 OE1 GLN A 84 2.605 10.732 -24.381 1.00 0.00 O ATOM 1275 NE2 GLN A 84 4.367 9.479 -24.790 1.00 0.00 N ATOM 0 H GLN A 84 1.256 5.666 -25.889 1.00 0.00 H new ATOM 0 HA GLN A 84 2.863 6.778 -23.694 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.347 7.653 -25.154 1.00 0.00 H new ATOM 0 HB3 GLN A 84 1.006 8.528 -23.786 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.810 8.005 -26.147 1.00 0.00 H new ATOM 0 HG3 GLN A 84 1.560 9.223 -26.307 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.760 8.632 -25.201 1.00 0.00 H new ATOM 0 HE22 GLN A 84 4.975 10.144 -24.313 1.00 0.00 H new ATOM 1284 N THR A 85 1.667 5.601 -21.803 1.00 0.00 N ATOM 1285 CA THR A 85 1.071 4.655 -20.826 1.00 0.00 C ATOM 1286 C THR A 85 0.824 5.356 -19.461 1.00 0.00 C ATOM 1287 O THR A 85 1.778 5.620 -18.725 1.00 0.00 O ATOM 1288 CB THR A 85 1.988 3.401 -20.749 1.00 0.00 C ATOM 1289 OG1 THR A 85 1.959 2.717 -21.996 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.559 2.369 -19.709 1.00 0.00 C ATOM 0 H THR A 85 2.618 5.891 -21.576 1.00 0.00 H new ATOM 0 HA THR A 85 0.084 4.321 -21.146 1.00 0.00 H new ATOM 0 HB THR A 85 2.971 3.788 -20.479 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.573 1.825 -21.871 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.253 1.528 -19.723 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.563 2.826 -18.720 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.555 2.014 -19.941 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.451 5.595 -19.096 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.828 6.044 -17.717 1.00 0.00 C ATOM 1300 C VAL A 86 -1.036 4.819 -16.759 1.00 0.00 C ATOM 1301 O VAL A 86 -1.872 3.944 -17.022 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.980 7.108 -17.733 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -3.344 6.627 -18.264 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -2.208 7.768 -16.352 1.00 0.00 C ATOM 0 H VAL A 86 -1.245 5.488 -19.727 1.00 0.00 H new ATOM 0 HA VAL A 86 0.009 6.590 -17.282 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.597 7.833 -18.451 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.059 7.449 -18.227 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.234 6.288 -19.294 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.705 5.804 -17.647 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.017 8.495 -16.425 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.473 7.003 -15.622 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.295 8.272 -16.034 1.00 0.00 H new ATOM 1314 N CYS A 87 -0.258 4.757 -15.660 1.00 0.00 N ATOM 1315 CA CYS A 87 -0.301 3.613 -14.705 1.00 0.00 C ATOM 1316 C CYS A 87 -0.956 3.991 -13.346 1.00 0.00 C ATOM 1317 O CYS A 87 -0.479 4.901 -12.665 1.00 0.00 O ATOM 1318 CB CYS A 87 1.145 3.119 -14.520 1.00 0.00 C ATOM 1319 SG CYS A 87 1.739 2.435 -16.097 1.00 0.00 S ATOM 0 H CYS A 87 0.411 5.483 -15.405 1.00 0.00 H new ATOM 0 HA CYS A 87 -0.930 2.821 -15.111 1.00 0.00 H new ATOM 0 HB2 CYS A 87 1.786 3.940 -14.200 1.00 0.00 H new ATOM 0 HB3 CYS A 87 1.187 2.359 -13.740 1.00 0.00 H new ATOM 0 HG CYS A 87 2.441 1.365 -15.869 1.00 0.00 H new ATOM 1325 N ASN A 88 -2.027 3.287 -12.930 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.767 3.613 -11.672 1.00 0.00 C ATOM 1327 C ASN A 88 -3.034 2.337 -10.811 1.00 0.00 C ATOM 1328 O ASN A 88 -3.640 1.370 -11.281 1.00 0.00 O ATOM 1329 CB ASN A 88 -4.112 4.317 -12.014 1.00 0.00 C ATOM 1330 CG ASN A 88 -3.987 5.742 -12.568 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -3.439 6.639 -11.937 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -4.502 6.008 -13.743 1.00 0.00 N ATOM 0 H ASN A 88 -2.407 2.488 -13.438 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.143 4.285 -11.083 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.646 3.708 -12.743 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.725 4.348 -11.114 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.444 6.953 -14.123 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.961 5.270 -14.278 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.635 2.366 -9.526 1.00 0.00 N ATOM 1340 CA PHE A 89 -3.017 1.326 -8.530 1.00 0.00 C ATOM 1341 C PHE A 89 -4.323 1.742 -7.778 1.00 0.00 C ATOM 1342 O PHE A 89 -4.315 2.686 -6.982 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.798 1.097 -7.591 1.00 0.00 C ATOM 1344 CG PHE A 89 -1.996 0.058 -6.473 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -2.013 -1.311 -6.762 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -2.179 0.483 -5.153 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.196 -2.240 -5.741 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.373 -0.448 -4.136 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.366 -1.808 -4.429 1.00 0.00 C ATOM 0 H PHE A 89 -2.042 3.102 -9.142 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.254 0.378 -9.013 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.948 0.789 -8.200 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.533 2.050 -7.132 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.884 -1.648 -7.780 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.170 1.538 -4.922 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.206 -3.296 -5.967 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.529 -0.115 -3.121 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.493 -2.530 -3.636 1.00 0.00 H new ATOM 1359 N THR A 90 -5.425 1.007 -8.007 1.00 0.00 N ATOM 1360 CA THR A 90 -6.688 1.171 -7.227 1.00 0.00 C ATOM 1361 C THR A 90 -6.839 0.025 -6.176 1.00 0.00 C ATOM 1362 O THR A 90 -7.458 -1.005 -6.454 1.00 0.00 O ATOM 1363 CB THR A 90 -7.904 1.394 -8.183 1.00 0.00 C ATOM 1364 OG1 THR A 90 -9.081 1.584 -7.410 1.00 0.00 O ATOM 1365 CG2 THR A 90 -8.237 0.297 -9.211 1.00 0.00 C ATOM 0 H THR A 90 -5.477 0.287 -8.728 1.00 0.00 H new ATOM 0 HA THR A 90 -6.650 2.081 -6.628 1.00 0.00 H new ATOM 0 HB THR A 90 -7.585 2.257 -8.767 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.845 1.726 -8.007 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.104 0.600 -9.798 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.384 0.148 -9.874 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.458 -0.635 -8.690 1.00 0.00 H new ATOM 1373 N ASP A 91 -6.244 0.237 -4.980 1.00 0.00 N ATOM 1374 CA ASP A 91 -6.266 -0.686 -3.796 1.00 0.00 C ATOM 1375 C ASP A 91 -6.481 -2.225 -4.037 1.00 0.00 C ATOM 1376 O ASP A 91 -7.546 -2.795 -3.779 1.00 0.00 O ATOM 1377 CB ASP A 91 -7.172 -0.048 -2.707 1.00 0.00 C ATOM 1378 CG ASP A 91 -6.883 -0.532 -1.284 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -5.719 -0.423 -0.838 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -7.816 -1.008 -0.606 1.00 0.00 O ATOM 0 H ASP A 91 -5.711 1.087 -4.794 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.237 -0.754 -3.444 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -7.053 1.035 -2.741 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -8.214 -0.262 -2.946 1.00 0.00 H new ATOM 1385 N GLY A 92 -5.452 -2.865 -4.608 1.00 0.00 N ATOM 1386 CA GLY A 92 -5.557 -4.249 -5.147 1.00 0.00 C ATOM 1387 C GLY A 92 -5.194 -4.423 -6.639 1.00 0.00 C ATOM 1388 O GLY A 92 -4.525 -5.400 -6.980 1.00 0.00 O ATOM 0 H GLY A 92 -4.526 -2.452 -4.714 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.909 -4.898 -4.558 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.578 -4.599 -4.999 1.00 0.00 H new ATOM 1392 N ALA A 93 -5.671 -3.527 -7.524 1.00 0.00 N ATOM 1393 CA ALA A 93 -5.524 -3.673 -8.994 1.00 0.00 C ATOM 1394 C ALA A 93 -4.646 -2.557 -9.648 1.00 0.00 C ATOM 1395 O ALA A 93 -4.985 -1.370 -9.609 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.958 -3.682 -9.559 1.00 0.00 C ATOM 0 H ALA A 93 -6.169 -2.681 -7.246 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.990 -4.594 -9.228 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.921 -3.787 -10.643 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -7.512 -4.518 -9.132 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.456 -2.747 -9.302 1.00 0.00 H new ATOM 1402 N LEU A 94 -3.537 -2.953 -10.298 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.691 -2.039 -11.115 1.00 0.00 C ATOM 1404 C LEU A 94 -3.164 -2.013 -12.601 1.00 0.00 C ATOM 1405 O LEU A 94 -2.922 -2.957 -13.359 1.00 0.00 O ATOM 1406 CB LEU A 94 -1.218 -2.496 -10.927 1.00 0.00 C ATOM 1407 CG LEU A 94 -0.121 -1.852 -11.816 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.020 -0.341 -11.577 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.225 -2.543 -11.547 1.00 0.00 C ATOM 0 H LEU A 94 -3.195 -3.914 -10.277 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.780 -1.004 -10.786 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.947 -2.319 -9.886 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.183 -3.574 -11.087 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.421 -1.989 -12.855 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.801 0.058 -12.224 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.925 0.153 -11.802 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.285 -0.161 -10.535 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.997 -2.092 -12.171 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.492 -2.424 -10.497 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.143 -3.604 -11.782 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.799 -0.904 -13.013 1.00 0.00 N ATOM 1422 CA VAL A 95 -4.271 -0.692 -14.412 1.00 0.00 C ATOM 1423 C VAL A 95 -3.154 0.065 -15.211 1.00 0.00 C ATOM 1424 O VAL A 95 -2.917 1.259 -14.996 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.656 0.050 -14.425 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -6.194 0.295 -15.857 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.778 -0.696 -13.662 1.00 0.00 C ATOM 0 H VAL A 95 -4.005 -0.121 -12.392 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.444 -1.648 -14.906 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.431 0.992 -13.924 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.153 0.811 -15.802 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.484 0.907 -16.413 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.324 -0.660 -16.365 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.701 -0.119 -13.718 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.935 -1.676 -14.112 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.489 -0.818 -12.618 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.502 -0.632 -16.159 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.562 -0.006 -17.133 1.00 0.00 C ATOM 1439 C GLN A 96 -2.336 0.333 -18.453 1.00 0.00 C ATOM 1440 O GLN A 96 -2.705 -0.568 -19.215 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.367 -0.991 -17.297 1.00 0.00 C ATOM 1442 CG GLN A 96 0.792 -0.502 -18.197 1.00 0.00 C ATOM 1443 CD GLN A 96 2.016 -1.424 -18.320 1.00 0.00 C ATOM 1444 OE1 GLN A 96 2.433 -2.100 -17.383 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.666 -1.463 -19.459 1.00 0.00 N ATOM 0 H GLN A 96 -2.604 -1.640 -16.279 1.00 0.00 H new ATOM 0 HA GLN A 96 -1.155 0.948 -16.797 1.00 0.00 H new ATOM 0 HB2 GLN A 96 0.035 -1.212 -16.308 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -0.747 -1.928 -17.704 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.395 -0.331 -19.198 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.131 0.463 -17.819 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.339 -0.911 -20.252 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.498 -2.046 -19.552 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.620 1.629 -18.697 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.498 2.075 -19.818 1.00 0.00 C ATOM 1456 C HIS A 97 -2.658 2.581 -21.033 1.00 0.00 C ATOM 1457 O HIS A 97 -2.116 3.689 -21.005 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.427 3.170 -19.228 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.550 3.653 -20.147 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.438 4.666 -21.083 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.774 2.991 -20.303 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.619 4.500 -21.770 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.501 3.549 -21.338 1.00 0.00 N ATOM 0 H HIS A 97 -2.255 2.396 -18.133 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.093 1.252 -20.216 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.873 2.786 -18.311 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.815 4.028 -18.950 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.104 2.159 -19.698 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.844 5.109 -22.633 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -8.433 3.317 -21.682 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.581 1.767 -22.091 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.545 1.899 -23.157 1.00 0.00 C ATOM 1474 C GLN A 98 -2.111 2.632 -24.416 1.00 0.00 C ATOM 1475 O GLN A 98 -2.885 2.033 -25.168 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.089 0.459 -23.550 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.511 -0.476 -22.449 1.00 0.00 C ATOM 1478 CD GLN A 98 1.010 -0.605 -22.434 1.00 0.00 C ATOM 1479 OE1 GLN A 98 1.714 0.116 -21.735 1.00 0.00 O ATOM 1480 NE2 GLN A 98 1.555 -1.546 -23.166 1.00 0.00 N ATOM 0 H GLN A 98 -3.228 0.994 -22.245 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.710 2.491 -22.782 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -1.945 -0.047 -23.995 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.334 0.554 -24.330 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -0.837 -0.109 -21.476 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.942 -1.469 -22.576 1.00 0.00 H new ATOM 0 HE21 GLN A 98 0.968 -2.145 -23.747 1.00 0.00 H new ATOM 0 HE22 GLN A 98 2.566 -1.680 -23.155 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.717 3.893 -24.666 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.301 4.713 -25.772 1.00 0.00 C ATOM 1491 C GLU A 99 -1.352 4.779 -27.014 1.00 0.00 C ATOM 1492 O GLU A 99 -0.221 5.268 -26.917 1.00 0.00 O ATOM 1493 CB GLU A 99 -2.603 6.151 -25.254 1.00 0.00 C ATOM 1494 CG GLU A 99 -3.615 6.301 -24.088 1.00 0.00 C ATOM 1495 CD GLU A 99 -5.056 5.966 -24.410 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -5.353 4.778 -24.635 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -5.918 6.860 -24.309 1.00 0.00 O ATOM 0 H GLU A 99 -0.999 4.376 -24.126 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.226 4.233 -26.092 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -1.660 6.599 -24.939 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.970 6.740 -26.095 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -3.289 5.662 -23.267 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.574 7.329 -23.728 1.00 0.00 H new ATOM 1504 N TRP A 100 -1.815 4.332 -28.196 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.047 4.472 -29.474 1.00 0.00 C ATOM 1506 C TRP A 100 -2.016 4.626 -30.693 1.00 0.00 C ATOM 1507 O TRP A 100 -2.934 3.820 -30.844 1.00 0.00 O ATOM 1508 CB TRP A 100 0.001 3.323 -29.634 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.504 1.948 -30.114 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -0.451 1.488 -31.448 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.198 0.977 -29.414 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.105 0.248 -31.600 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -1.572 -0.040 -30.329 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -1.599 0.901 -28.056 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.361 -1.130 -29.895 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.373 -0.185 -27.651 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -2.755 -1.180 -28.556 1.00 0.00 C ATOM 0 H TRP A 100 -2.717 3.868 -28.306 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.465 5.393 -29.439 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.765 3.662 -30.334 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.492 3.182 -28.671 1.00 0.00 H new ATOM 0 HD1 TRP A 100 0.032 2.021 -32.254 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.210 -0.308 -32.449 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.311 1.667 -27.351 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -2.653 -1.908 -30.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -2.683 -0.259 -26.619 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.366 -2.002 -28.213 1.00 0.00 H new ATOM 1528 N ASP A 101 -1.832 5.632 -31.574 1.00 0.00 N ATOM 1529 CA ASP A 101 -2.616 5.765 -32.857 1.00 0.00 C ATOM 1530 C ASP A 101 -4.195 5.724 -32.756 1.00 0.00 C ATOM 1531 O ASP A 101 -4.878 5.080 -33.563 1.00 0.00 O ATOM 1532 CB ASP A 101 -2.061 4.777 -33.927 1.00 0.00 C ATOM 1533 CG ASP A 101 -0.604 4.959 -34.340 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -0.292 5.956 -35.023 1.00 0.00 O ATOM 1535 OD2 ASP A 101 0.230 4.100 -33.979 1.00 0.00 O ATOM 0 H ASP A 101 -1.148 6.376 -31.435 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.448 6.795 -33.170 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -2.183 3.762 -33.548 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -2.680 4.860 -34.820 1.00 0.00 H new ATOM 1540 N GLY A 102 -4.781 6.384 -31.737 1.00 0.00 N ATOM 1541 CA GLY A 102 -6.214 6.173 -31.357 1.00 0.00 C ATOM 1542 C GLY A 102 -6.666 4.767 -30.867 1.00 0.00 C ATOM 1543 O GLY A 102 -7.807 4.377 -31.121 1.00 0.00 O ATOM 0 H GLY A 102 -4.295 7.068 -31.157 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.455 6.888 -30.571 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.825 6.432 -32.222 1.00 0.00 H new ATOM 1547 N LYS A 103 -5.786 4.015 -30.188 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.026 2.593 -29.809 1.00 0.00 C ATOM 1549 C LYS A 103 -5.567 2.400 -28.333 1.00 0.00 C ATOM 1550 O LYS A 103 -4.401 2.657 -28.003 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.219 1.624 -30.727 1.00 0.00 C ATOM 1552 CG LYS A 103 -5.488 1.709 -32.251 1.00 0.00 C ATOM 1553 CD LYS A 103 -4.289 1.226 -33.098 1.00 0.00 C ATOM 1554 CE LYS A 103 -4.303 1.691 -34.566 1.00 0.00 C ATOM 1555 NZ LYS A 103 -5.405 1.046 -35.332 1.00 0.00 N ATOM 0 H LYS A 103 -4.880 4.368 -29.880 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.086 2.366 -29.923 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.157 1.805 -30.560 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.423 0.603 -30.404 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.365 1.109 -32.495 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.723 2.740 -32.517 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.368 1.575 -32.630 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.264 0.136 -33.077 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -4.417 2.774 -34.605 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -3.347 1.454 -35.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -5.386 1.381 -36.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -5.281 0.013 -35.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -6.318 1.292 -34.900 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.470 1.916 -27.465 1.00 0.00 N ATOM 1570 CA GLU A 104 -6.137 1.601 -26.051 1.00 0.00 C ATOM 1571 C GLU A 104 -5.928 0.069 -25.819 1.00 0.00 C ATOM 1572 O GLU A 104 -6.652 -0.777 -26.355 1.00 0.00 O ATOM 1573 CB GLU A 104 -7.171 2.249 -25.091 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.580 1.614 -24.962 1.00 0.00 C ATOM 1575 CD GLU A 104 -9.465 2.333 -23.957 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -9.237 2.184 -22.737 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -10.392 3.052 -24.377 1.00 0.00 O ATOM 0 H GLU A 104 -7.442 1.731 -27.711 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.171 2.049 -25.815 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.727 2.270 -24.096 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -7.305 3.285 -25.402 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -9.067 1.622 -25.937 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.476 0.570 -24.665 1.00 0.00 H new ATOM 1584 N SER A 105 -4.959 -0.283 -24.961 1.00 0.00 N ATOM 1585 CA SER A 105 -4.922 -1.615 -24.297 1.00 0.00 C ATOM 1586 C SER A 105 -4.847 -1.435 -22.753 1.00 0.00 C ATOM 1587 O SER A 105 -4.011 -0.698 -22.221 1.00 0.00 O ATOM 1588 CB SER A 105 -3.777 -2.493 -24.844 1.00 0.00 C ATOM 1589 OG SER A 105 -3.773 -3.765 -24.194 1.00 0.00 O ATOM 0 H SER A 105 -4.185 0.330 -24.704 1.00 0.00 H new ATOM 0 HA SER A 105 -5.845 -2.147 -24.528 1.00 0.00 H new ATOM 0 HB2 SER A 105 -3.894 -2.627 -25.919 1.00 0.00 H new ATOM 0 HB3 SER A 105 -2.821 -1.994 -24.687 1.00 0.00 H new ATOM 0 HG SER A 105 -4.594 -4.250 -24.419 1.00 0.00 H new ATOM 1595 N THR A 106 -5.722 -2.146 -22.034 1.00 0.00 N ATOM 1596 CA THR A 106 -5.943 -1.928 -20.576 1.00 0.00 C ATOM 1597 C THR A 106 -5.443 -3.185 -19.803 1.00 0.00 C ATOM 1598 O THR A 106 -6.059 -4.250 -19.902 1.00 0.00 O ATOM 1599 CB THR A 106 -7.443 -1.583 -20.291 1.00 0.00 C ATOM 1600 OG1 THR A 106 -8.290 -2.704 -20.495 1.00 0.00 O ATOM 1601 CG2 THR A 106 -8.058 -0.449 -21.132 1.00 0.00 C ATOM 0 H THR A 106 -6.300 -2.887 -22.431 1.00 0.00 H new ATOM 0 HA THR A 106 -5.370 -1.070 -20.225 1.00 0.00 H new ATOM 0 HB THR A 106 -7.398 -1.257 -19.252 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.246 -2.981 -21.434 1.00 0.00 H new ATOM 0 HG21 THR A 106 -9.099 -0.305 -20.842 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.503 0.473 -20.961 1.00 0.00 H new ATOM 0 HG23 THR A 106 -8.008 -0.712 -22.189 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.311 -3.103 -19.078 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.695 -4.303 -18.422 1.00 0.00 C ATOM 1611 C ILE A 107 -3.987 -4.240 -16.887 1.00 0.00 C ATOM 1612 O ILE A 107 -3.304 -3.496 -16.175 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.156 -4.457 -18.727 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -1.628 -4.064 -20.140 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.641 -5.864 -18.342 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -2.236 -4.813 -21.335 1.00 0.00 C ATOM 0 H ILE A 107 -3.799 -2.234 -18.925 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.152 -5.198 -18.845 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.735 -3.683 -18.085 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.800 -2.997 -20.283 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.549 -4.217 -20.155 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.577 -5.936 -18.566 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.800 -6.031 -17.277 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.183 -6.618 -18.912 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.787 -4.449 -22.259 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -2.041 -5.881 -21.232 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -3.312 -4.641 -21.363 1.00 0.00 H new ATOM 1628 N THR A 108 -4.964 -5.014 -16.370 1.00 0.00 N ATOM 1629 CA THR A 108 -5.348 -4.961 -14.924 1.00 0.00 C ATOM 1630 C THR A 108 -4.632 -6.110 -14.140 1.00 0.00 C ATOM 1631 O THR A 108 -5.103 -7.251 -14.095 1.00 0.00 O ATOM 1632 CB THR A 108 -6.902 -4.967 -14.779 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.482 -3.920 -15.554 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.409 -4.743 -13.347 1.00 0.00 C ATOM 0 H THR A 108 -5.504 -5.682 -16.919 1.00 0.00 H new ATOM 0 HA THR A 108 -5.008 -4.027 -14.475 1.00 0.00 H new ATOM 0 HB THR A 108 -7.193 -5.963 -15.113 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.457 -3.940 -15.453 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.499 -4.763 -13.340 1.00 0.00 H new ATOM 0 HG22 THR A 108 -7.028 -5.532 -12.698 1.00 0.00 H new ATOM 0 HG23 THR A 108 -7.061 -3.776 -12.985 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.489 -5.795 -13.506 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.720 -6.769 -12.681 1.00 0.00 C ATOM 1644 C ARG A 109 -3.249 -6.779 -11.212 1.00 0.00 C ATOM 1645 O ARG A 109 -3.052 -5.792 -10.494 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.204 -6.418 -12.695 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.473 -6.296 -14.054 1.00 0.00 C ATOM 1648 CD ARG A 109 1.058 -6.259 -13.865 1.00 0.00 C ATOM 1649 NE ARG A 109 1.799 -6.116 -15.150 1.00 0.00 N ATOM 1650 CZ ARG A 109 2.004 -4.964 -15.792 1.00 0.00 C ATOM 1651 NH1 ARG A 109 1.519 -3.815 -15.397 1.00 0.00 N ATOM 1652 NH2 ARG A 109 2.720 -4.967 -16.876 1.00 0.00 N ATOM 0 H ARG A 109 -3.067 -4.867 -13.544 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.856 -7.761 -13.111 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -1.081 -5.471 -12.169 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.685 -7.177 -12.110 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.743 -7.138 -14.691 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -0.801 -5.391 -14.566 1.00 0.00 H new ATOM 0 HD2 ARG A 109 1.318 -5.429 -13.208 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.379 -7.173 -13.366 1.00 0.00 H new ATOM 0 HE ARG A 109 2.179 -6.964 -15.571 1.00 0.00 H new ATOM 0 HH11 ARG A 109 0.948 -3.765 -14.553 1.00 0.00 H new ATOM 0 HH12 ARG A 109 1.712 -2.969 -15.933 1.00 0.00 H new ATOM 0 HH21 ARG A 109 3.115 -5.841 -17.224 1.00 0.00 H new ATOM 0 HH22 ARG A 109 2.887 -4.096 -17.379 1.00 0.00 H new ATOM 1666 N LYS A 110 -3.919 -7.857 -10.753 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.558 -7.872 -9.402 1.00 0.00 C ATOM 1668 C LYS A 110 -4.284 -9.180 -8.594 1.00 0.00 C ATOM 1669 O LYS A 110 -4.163 -10.279 -9.146 1.00 0.00 O ATOM 1670 CB LYS A 110 -6.051 -7.458 -9.538 1.00 0.00 C ATOM 1671 CG LYS A 110 -7.064 -8.516 -10.032 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.334 -7.867 -10.626 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.556 -8.800 -10.593 1.00 0.00 C ATOM 1674 NZ LYS A 110 -10.557 -8.392 -11.612 1.00 0.00 N ATOM 0 H LYS A 110 -4.036 -8.721 -11.282 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.082 -7.123 -8.769 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.388 -7.105 -8.563 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.099 -6.608 -10.219 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.592 -9.146 -10.786 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -7.343 -9.166 -9.203 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.563 -6.957 -10.072 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.137 -7.572 -11.657 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -9.241 -9.827 -10.777 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -10.009 -8.779 -9.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -11.460 -8.174 -11.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -10.216 -7.549 -12.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.697 -9.167 -12.291 1.00 0.00 H new ATOM 1688 N LEU A 111 -4.172 -9.046 -7.261 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.689 -10.141 -6.374 1.00 0.00 C ATOM 1690 C LEU A 111 -4.848 -11.083 -5.912 1.00 0.00 C ATOM 1691 O LEU A 111 -5.766 -10.660 -5.203 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.898 -9.499 -5.188 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.525 -10.118 -4.818 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.626 -11.529 -4.218 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.529 -10.113 -5.990 1.00 0.00 C ATOM 0 H LEU A 111 -4.409 -8.188 -6.763 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.015 -10.795 -6.927 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.739 -8.446 -5.422 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.532 -9.537 -4.302 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.138 -9.460 -4.040 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.627 -11.897 -3.984 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.223 -11.495 -3.307 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.100 -12.197 -4.937 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.413 -10.559 -5.669 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.940 -10.690 -6.819 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.353 -9.087 -6.314 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.807 -12.357 -6.337 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.878 -13.356 -6.055 1.00 0.00 C ATOM 1709 C LYS A 112 -5.220 -14.672 -5.527 1.00 0.00 C ATOM 1710 O LYS A 112 -4.488 -15.345 -6.259 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.729 -13.556 -7.350 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.829 -12.479 -7.560 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.393 -12.306 -8.991 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.073 -13.547 -9.601 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.833 -13.190 -10.837 1.00 0.00 N ATOM 0 H LYS A 112 -4.035 -12.734 -6.887 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.559 -13.012 -5.276 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.063 -13.553 -8.213 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.200 -14.538 -7.314 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.661 -12.714 -6.896 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.426 -11.519 -7.239 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.114 -11.489 -8.980 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.578 -12.003 -9.648 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -8.320 -14.299 -9.838 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.749 -13.991 -8.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.021 -14.051 -11.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -10.735 -12.744 -10.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.273 -12.526 -11.409 1.00 0.00 H new ATOM 1729 N ASP A 113 -5.465 -15.027 -4.243 1.00 0.00 N ATOM 1730 CA ASP A 113 -4.901 -16.256 -3.582 1.00 0.00 C ATOM 1731 C ASP A 113 -3.323 -16.352 -3.494 1.00 0.00 C ATOM 1732 O ASP A 113 -2.733 -17.431 -3.602 1.00 0.00 O ATOM 1733 CB ASP A 113 -5.654 -17.491 -4.174 1.00 0.00 C ATOM 1734 CG ASP A 113 -5.418 -18.828 -3.478 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -5.698 -18.937 -2.269 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -4.924 -19.769 -4.143 1.00 0.00 O ATOM 0 H ASP A 113 -6.060 -14.476 -3.624 1.00 0.00 H new ATOM 0 HA ASP A 113 -5.098 -16.208 -2.511 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.723 -17.280 -4.155 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.368 -17.596 -5.221 1.00 0.00 H new ATOM 1741 N GLY A 114 -2.602 -15.229 -3.318 1.00 0.00 N ATOM 1742 CA GLY A 114 -1.122 -15.200 -3.546 1.00 0.00 C ATOM 1743 C GLY A 114 -0.576 -15.332 -4.999 1.00 0.00 C ATOM 1744 O GLY A 114 0.634 -15.489 -5.162 1.00 0.00 O ATOM 0 H GLY A 114 -3.000 -14.337 -3.024 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -0.745 -14.262 -3.137 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.683 -16.004 -2.956 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.435 -15.277 -6.031 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.034 -15.220 -7.461 1.00 0.00 C ATOM 1750 C LYS A 115 -1.348 -13.793 -8.016 1.00 0.00 C ATOM 1751 O LYS A 115 -2.382 -13.181 -7.716 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.796 -16.310 -8.281 1.00 0.00 C ATOM 1753 CG LYS A 115 -1.193 -17.741 -8.323 1.00 0.00 C ATOM 1754 CD LYS A 115 -1.147 -18.543 -7.003 1.00 0.00 C ATOM 1755 CE LYS A 115 -2.535 -19.050 -6.580 1.00 0.00 C ATOM 1756 NZ LYS A 115 -2.543 -19.596 -5.200 1.00 0.00 N ATOM 0 H LYS A 115 -2.447 -15.270 -5.900 1.00 0.00 H new ATOM 0 HA LYS A 115 0.034 -15.417 -7.553 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.807 -16.385 -7.880 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.886 -15.955 -9.307 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -1.762 -18.323 -9.049 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -0.175 -17.664 -8.704 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.473 -19.391 -7.119 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.736 -17.915 -6.213 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -3.253 -18.233 -6.648 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -2.864 -19.823 -7.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -3.501 -19.925 -4.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -1.878 -20.393 -5.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.256 -18.853 -4.531 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.470 -13.295 -8.899 1.00 0.00 N ATOM 1771 CA LEU A 116 -0.737 -12.064 -9.689 1.00 0.00 C ATOM 1772 C LEU A 116 -1.570 -12.444 -10.949 1.00 0.00 C ATOM 1773 O LEU A 116 -1.056 -12.999 -11.927 1.00 0.00 O ATOM 1774 CB LEU A 116 0.631 -11.416 -10.014 1.00 0.00 C ATOM 1775 CG LEU A 116 0.599 -10.053 -10.751 1.00 0.00 C ATOM 1776 CD1 LEU A 116 0.315 -8.902 -9.769 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.936 -9.821 -11.472 1.00 0.00 C ATOM 0 H LEU A 116 0.437 -13.721 -9.091 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.330 -11.331 -9.142 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.176 -11.284 -9.079 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.204 -12.117 -10.621 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.206 -10.075 -11.485 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.298 -7.957 -10.312 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.651 -9.063 -9.289 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.096 -8.870 -9.010 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.909 -8.862 -11.989 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.747 -9.818 -10.743 1.00 0.00 H new ATOM 0 HD23 LEU A 116 2.102 -10.619 -12.196 1.00 0.00 H new ATOM 1789 N VAL A 117 -2.878 -12.169 -10.893 1.00 0.00 N ATOM 1790 CA VAL A 117 -3.827 -12.527 -11.981 1.00 0.00 C ATOM 1791 C VAL A 117 -3.998 -11.265 -12.880 1.00 0.00 C ATOM 1792 O VAL A 117 -4.529 -10.227 -12.466 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.148 -13.113 -11.386 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.218 -13.396 -12.463 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -4.913 -14.451 -10.638 1.00 0.00 C ATOM 0 H VAL A 117 -3.317 -11.696 -10.103 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.451 -13.329 -12.617 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.498 -12.341 -10.701 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.112 -13.801 -11.990 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.469 -12.469 -12.979 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.829 -14.117 -13.182 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.860 -14.818 -10.243 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.499 -15.186 -11.328 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.215 -14.291 -9.816 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.498 -11.377 -14.115 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.404 -10.243 -15.068 1.00 0.00 C ATOM 1807 C VAL A 118 -4.585 -10.378 -16.076 1.00 0.00 C ATOM 1808 O VAL A 118 -4.515 -11.107 -17.073 1.00 0.00 O ATOM 1809 CB VAL A 118 -1.967 -10.188 -15.689 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.814 -9.056 -16.726 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -0.843 -10.026 -14.632 1.00 0.00 C ATOM 0 H VAL A 118 -3.143 -12.256 -14.492 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.519 -9.270 -14.590 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.854 -11.156 -16.178 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.800 -9.063 -17.125 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.525 -9.208 -17.538 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -2.010 -8.096 -16.248 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.125 -9.995 -15.132 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.995 -9.099 -14.078 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -0.868 -10.869 -13.942 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.669 -9.653 -15.770 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.892 -9.586 -16.602 1.00 0.00 C ATOM 1823 C GLU A 119 -6.771 -8.354 -17.549 1.00 0.00 C ATOM 1824 O GLU A 119 -7.057 -7.210 -17.177 1.00 0.00 O ATOM 1825 CB GLU A 119 -8.101 -9.520 -15.624 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.393 -10.850 -14.873 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.281 -10.777 -13.638 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -10.267 -10.009 -13.619 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -8.992 -11.489 -12.649 1.00 0.00 O ATOM 0 H GLU A 119 -5.728 -9.085 -14.925 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.032 -10.455 -17.245 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.917 -8.735 -14.890 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.990 -9.230 -16.184 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.854 -11.541 -15.579 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.439 -11.286 -14.577 1.00 0.00 H new ATOM 1836 N CYS A 120 -6.289 -8.588 -18.778 1.00 0.00 N ATOM 1837 CA CYS A 120 -6.167 -7.520 -19.800 1.00 0.00 C ATOM 1838 C CYS A 120 -7.434 -7.429 -20.705 1.00 0.00 C ATOM 1839 O CYS A 120 -8.053 -8.453 -21.016 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.876 -7.753 -20.616 1.00 0.00 C ATOM 1841 SG CYS A 120 -5.177 -8.829 -22.022 1.00 0.00 S ATOM 0 H CYS A 120 -5.975 -9.505 -19.096 1.00 0.00 H new ATOM 0 HA CYS A 120 -6.097 -6.553 -19.301 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -4.486 -6.797 -20.964 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -4.113 -8.194 -19.975 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.337 -9.821 -21.997 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.775 -6.224 -21.190 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.777 -6.055 -22.285 1.00 0.00 C ATOM 1848 C VAL A 121 -8.314 -4.937 -23.276 1.00 0.00 C ATOM 1849 O VAL A 121 -7.999 -3.807 -22.877 1.00 0.00 O ATOM 1850 CB VAL A 121 -10.247 -5.933 -21.747 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -10.583 -4.670 -20.930 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -11.305 -6.079 -22.862 1.00 0.00 C ATOM 0 H VAL A 121 -7.379 -5.347 -20.850 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.818 -6.968 -22.879 1.00 0.00 H new ATOM 0 HB VAL A 121 -10.290 -6.773 -21.053 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -11.626 -4.706 -20.617 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.942 -4.625 -20.050 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -10.419 -3.785 -21.545 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.302 -5.986 -22.432 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -11.157 -5.298 -23.608 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.203 -7.056 -23.334 1.00 0.00 H new ATOM 1862 N MET A 122 -8.305 -5.266 -24.583 1.00 0.00 N ATOM 1863 CA MET A 122 -8.119 -4.271 -25.680 1.00 0.00 C ATOM 1864 C MET A 122 -9.347 -3.305 -25.822 1.00 0.00 C ATOM 1865 O MET A 122 -9.243 -2.108 -25.551 1.00 0.00 O ATOM 1866 CB MET A 122 -7.739 -5.096 -26.949 1.00 0.00 C ATOM 1867 CG MET A 122 -7.511 -4.295 -28.247 1.00 0.00 C ATOM 1868 SD MET A 122 -6.082 -3.207 -28.105 1.00 0.00 S ATOM 1869 CE MET A 122 -6.213 -2.356 -29.689 1.00 0.00 C ATOM 0 H MET A 122 -8.425 -6.222 -24.916 1.00 0.00 H new ATOM 0 HA MET A 122 -7.313 -3.567 -25.475 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.831 -5.658 -26.731 1.00 0.00 H new ATOM 0 HB3 MET A 122 -8.529 -5.824 -27.132 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.365 -4.983 -29.080 1.00 0.00 H new ATOM 0 HG3 MET A 122 -8.399 -3.704 -28.473 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.392 -1.646 -29.790 1.00 0.00 H new ATOM 0 HE2 MET A 122 -6.164 -3.084 -30.498 1.00 0.00 H new ATOM 0 HE3 MET A 122 -7.162 -1.822 -29.738 1.00 0.00 H new ATOM 1879 N ASN A 123 -10.507 -3.849 -26.212 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.809 -3.123 -26.221 1.00 0.00 C ATOM 1881 C ASN A 123 -12.934 -4.129 -25.815 1.00 0.00 C ATOM 1882 O ASN A 123 -13.391 -4.116 -24.670 1.00 0.00 O ATOM 1883 CB ASN A 123 -12.009 -2.285 -27.524 1.00 0.00 C ATOM 1884 CG ASN A 123 -11.851 -3.005 -28.876 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -12.642 -3.865 -29.248 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -10.823 -2.711 -29.634 1.00 0.00 N ATOM 0 H ASN A 123 -10.582 -4.814 -26.535 1.00 0.00 H new ATOM 0 HA ASN A 123 -11.843 -2.336 -25.468 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -13.008 -1.850 -27.492 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -11.300 -1.457 -27.501 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -10.689 -3.196 -30.521 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -10.157 -1.998 -29.336 1.00 0.00 H new ATOM 1893 N ASN A 124 -13.305 -5.056 -26.712 1.00 0.00 N ATOM 1894 CA ASN A 124 -14.016 -6.315 -26.350 1.00 0.00 C ATOM 1895 C ASN A 124 -13.075 -7.512 -25.948 1.00 0.00 C ATOM 1896 O ASN A 124 -13.438 -8.285 -25.058 1.00 0.00 O ATOM 1897 CB ASN A 124 -14.954 -6.641 -27.548 1.00 0.00 C ATOM 1898 CG ASN A 124 -15.942 -7.792 -27.328 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -15.717 -8.924 -27.738 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -17.060 -7.553 -26.687 1.00 0.00 N ATOM 0 H ASN A 124 -13.125 -4.964 -27.712 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.587 -6.164 -25.434 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -15.521 -5.743 -27.796 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -14.337 -6.878 -28.414 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -17.731 -8.306 -26.534 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -17.259 -6.614 -26.341 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.915 -7.709 -26.611 1.00 0.00 N ATOM 1908 CA VAL A 125 -11.149 -8.989 -26.558 1.00 0.00 C ATOM 1909 C VAL A 125 -10.186 -9.019 -25.320 1.00 0.00 C ATOM 1910 O VAL A 125 -9.391 -8.100 -25.084 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.436 -9.233 -27.932 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.598 -10.530 -27.968 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -11.413 -9.335 -29.130 1.00 0.00 C ATOM 0 H VAL A 125 -11.480 -6.996 -27.196 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.830 -9.826 -26.407 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.799 -8.354 -28.026 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -9.133 -10.636 -28.948 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.824 -10.484 -27.202 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.245 -11.387 -27.779 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.848 -9.504 -30.047 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -12.101 -10.165 -28.969 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.979 -8.407 -29.218 1.00 0.00 H new ATOM 1923 N THR A 126 -10.294 -10.110 -24.546 1.00 0.00 N ATOM 1924 CA THR A 126 -9.653 -10.256 -23.204 1.00 0.00 C ATOM 1925 C THR A 126 -8.476 -11.291 -23.183 1.00 0.00 C ATOM 1926 O THR A 126 -8.450 -12.243 -23.967 1.00 0.00 O ATOM 1927 CB THR A 126 -10.724 -10.657 -22.130 1.00 0.00 C ATOM 1928 OG1 THR A 126 -11.319 -11.916 -22.426 1.00 0.00 O ATOM 1929 CG2 THR A 126 -11.883 -9.673 -21.910 1.00 0.00 C ATOM 0 H THR A 126 -10.831 -10.931 -24.825 1.00 0.00 H new ATOM 0 HA THR A 126 -9.224 -9.283 -22.966 1.00 0.00 H new ATOM 0 HB THR A 126 -10.128 -10.671 -21.218 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.980 -12.136 -21.736 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.553 -10.065 -21.145 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.487 -8.710 -21.587 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.433 -9.545 -22.842 1.00 0.00 H new ATOM 1937 N CYS A 127 -7.543 -11.161 -22.215 1.00 0.00 N ATOM 1938 CA CYS A 127 -6.700 -12.306 -21.756 1.00 0.00 C ATOM 1939 C CYS A 127 -6.676 -12.399 -20.199 1.00 0.00 C ATOM 1940 O CYS A 127 -6.454 -11.394 -19.517 1.00 0.00 O ATOM 1941 CB CYS A 127 -5.271 -12.239 -22.342 1.00 0.00 C ATOM 1942 SG CYS A 127 -4.170 -11.175 -21.387 1.00 0.00 S ATOM 0 H CYS A 127 -7.349 -10.283 -21.734 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.157 -13.220 -22.136 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -4.852 -13.245 -22.381 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -5.321 -11.874 -23.368 1.00 0.00 H new ATOM 0 HG CYS A 127 -4.739 -10.022 -21.196 1.00 0.00 H new ATOM 1947 N THR A 128 -6.865 -13.605 -19.634 1.00 0.00 N ATOM 1948 CA THR A 128 -6.722 -13.844 -18.164 1.00 0.00 C ATOM 1949 C THR A 128 -5.436 -14.696 -17.910 1.00 0.00 C ATOM 1950 O THR A 128 -5.446 -15.925 -18.049 1.00 0.00 O ATOM 1951 CB THR A 128 -8.039 -14.475 -17.622 1.00 0.00 C ATOM 1952 OG1 THR A 128 -9.135 -13.600 -17.870 1.00 0.00 O ATOM 1953 CG2 THR A 128 -8.054 -14.740 -16.109 1.00 0.00 C ATOM 0 H THR A 128 -7.118 -14.439 -20.164 1.00 0.00 H new ATOM 0 HA THR A 128 -6.583 -12.916 -17.610 1.00 0.00 H new ATOM 0 HB THR A 128 -8.114 -15.429 -18.144 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.960 -14.004 -17.528 1.00 0.00 H new ATOM 0 HG21 THR A 128 -9.011 -15.179 -15.826 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.249 -15.428 -15.852 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.914 -13.801 -15.574 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.326 -14.025 -17.547 1.00 0.00 N ATOM 1962 CA ARG A 129 -3.003 -14.683 -17.346 1.00 0.00 C ATOM 1963 C ARG A 129 -2.679 -14.872 -15.829 1.00 0.00 C ATOM 1964 O ARG A 129 -2.593 -13.892 -15.085 1.00 0.00 O ATOM 1965 CB ARG A 129 -1.883 -13.850 -18.026 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.934 -13.686 -19.568 1.00 0.00 C ATOM 1967 CD ARG A 129 -0.570 -13.408 -20.247 1.00 0.00 C ATOM 1968 NE ARG A 129 0.169 -12.219 -19.725 1.00 0.00 N ATOM 1969 CZ ARG A 129 -0.046 -10.950 -20.060 1.00 0.00 C ATOM 1970 NH1 ARG A 129 -0.952 -10.569 -20.922 1.00 0.00 N ATOM 1971 NH2 ARG A 129 0.693 -10.043 -19.495 1.00 0.00 N ATOM 0 H ARG A 129 -4.311 -13.018 -17.384 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.051 -15.671 -17.805 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -1.892 -12.854 -17.583 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -0.926 -14.304 -17.770 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -2.359 -14.592 -20.000 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -2.615 -12.869 -19.808 1.00 0.00 H new ATOM 0 HD2 ARG A 129 0.062 -14.288 -20.131 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.735 -13.273 -21.316 1.00 0.00 H new ATOM 0 HE ARG A 129 0.909 -12.398 -19.047 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.543 -11.262 -21.380 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.068 -9.578 -21.136 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.408 -10.315 -18.820 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.558 -9.059 -19.726 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.468 -16.117 -15.363 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.173 -16.396 -13.917 1.00 0.00 C ATOM 1987 C ILE A 130 -0.615 -16.489 -13.761 1.00 0.00 C ATOM 1988 O ILE A 130 0.045 -17.297 -14.424 1.00 0.00 O ATOM 1989 CB ILE A 130 -2.951 -17.659 -13.375 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.510 -17.574 -13.249 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.484 -18.102 -11.961 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.326 -16.963 -14.393 1.00 0.00 C ATOM 0 H ILE A 130 -2.493 -16.951 -15.950 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.540 -15.584 -13.290 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.702 -18.359 -14.172 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.881 -18.586 -13.088 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.734 -17.005 -12.347 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.057 -18.974 -11.645 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.424 -18.355 -11.991 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -2.643 -17.288 -11.254 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.385 -16.985 -14.137 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.013 -15.931 -14.553 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.161 -17.537 -15.305 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.052 -15.681 -12.847 1.00 0.00 N ATOM 2005 CA TYR A 131 1.406 -15.683 -12.536 1.00 0.00 C ATOM 2006 C TYR A 131 1.646 -16.042 -11.024 1.00 0.00 C ATOM 2007 O TYR A 131 1.102 -15.387 -10.126 1.00 0.00 O ATOM 2008 CB TYR A 131 2.010 -14.289 -12.868 1.00 0.00 C ATOM 2009 CG TYR A 131 2.098 -13.796 -14.328 1.00 0.00 C ATOM 2010 CD1 TYR A 131 1.003 -13.159 -14.928 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.324 -13.802 -14.998 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.150 -12.520 -16.158 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.476 -13.151 -16.218 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.386 -12.500 -16.794 1.00 0.00 C ATOM 2015 OH TYR A 131 2.543 -11.863 -17.996 1.00 0.00 O ATOM 0 H TYR A 131 -0.585 -15.006 -12.299 1.00 0.00 H new ATOM 0 HA TYR A 131 1.900 -16.440 -13.146 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.433 -13.549 -12.314 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.022 -14.273 -12.462 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.042 -13.163 -14.435 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.166 -14.320 -14.562 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.300 -12.038 -16.619 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.434 -13.150 -16.717 1.00 0.00 H new ATOM 0 HH TYR A 131 3.473 -11.949 -18.293 1.00 0.00 H new ATOM 2025 N GLU A 132 2.474 -17.065 -10.734 1.00 0.00 N ATOM 2026 CA GLU A 132 2.739 -17.549 -9.341 1.00 0.00 C ATOM 2027 C GLU A 132 3.995 -16.897 -8.668 1.00 0.00 C ATOM 2028 O GLU A 132 5.005 -16.638 -9.329 1.00 0.00 O ATOM 2029 CB GLU A 132 2.785 -19.103 -9.377 1.00 0.00 C ATOM 2030 CG GLU A 132 4.007 -19.764 -10.076 1.00 0.00 C ATOM 2031 CD GLU A 132 3.935 -21.266 -10.306 1.00 0.00 C ATOM 2032 OE1 GLU A 132 3.250 -21.994 -9.559 1.00 0.00 O ATOM 2033 OE2 GLU A 132 4.598 -21.731 -11.256 1.00 0.00 O ATOM 0 H GLU A 132 2.983 -17.586 -11.448 1.00 0.00 H new ATOM 0 HA GLU A 132 1.926 -17.226 -8.691 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.747 -19.466 -8.350 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.881 -19.456 -9.873 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.150 -19.279 -11.042 1.00 0.00 H new ATOM 0 HG3 GLU A 132 4.895 -19.554 -9.479 1.00 0.00 H new ATOM 2040 N LYS A 133 3.953 -16.628 -7.346 1.00 0.00 N ATOM 2041 CA LYS A 133 5.062 -15.917 -6.642 1.00 0.00 C ATOM 2042 C LYS A 133 6.324 -16.810 -6.405 1.00 0.00 C ATOM 2043 O LYS A 133 6.255 -17.824 -5.704 1.00 0.00 O ATOM 2044 CB LYS A 133 4.546 -15.318 -5.300 1.00 0.00 C ATOM 2045 CG LYS A 133 5.326 -14.050 -4.875 1.00 0.00 C ATOM 2046 CD LYS A 133 4.812 -13.412 -3.571 1.00 0.00 C ATOM 2047 CE LYS A 133 5.414 -12.007 -3.330 1.00 0.00 C ATOM 2048 NZ LYS A 133 5.601 -11.765 -1.879 1.00 0.00 N ATOM 0 H LYS A 133 3.173 -16.887 -6.741 1.00 0.00 H new ATOM 0 HA LYS A 133 5.387 -15.112 -7.301 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.488 -15.073 -5.398 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.628 -16.070 -4.515 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.378 -14.306 -4.753 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.268 -13.313 -5.676 1.00 0.00 H new ATOM 0 HD2 LYS A 133 3.725 -13.338 -3.609 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.058 -14.060 -2.730 1.00 0.00 H new ATOM 0 HE2 LYS A 133 6.371 -11.921 -3.845 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.756 -11.246 -3.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 5.261 -10.812 -1.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 5.063 -12.471 -1.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.611 -11.843 -1.641 1.00 0.00 H new ATOM 2062 N VAL A 134 7.481 -16.401 -6.952 1.00 0.00 N ATOM 2063 CA VAL A 134 8.774 -17.121 -6.745 1.00 0.00 C ATOM 2064 C VAL A 134 9.518 -16.462 -5.533 1.00 0.00 C ATOM 2065 O VAL A 134 10.318 -15.532 -5.693 1.00 0.00 O ATOM 2066 CB VAL A 134 9.600 -17.160 -8.080 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.966 -17.874 -7.940 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.869 -17.848 -9.259 1.00 0.00 C ATOM 0 H VAL A 134 7.560 -15.574 -7.544 1.00 0.00 H new ATOM 0 HA VAL A 134 8.612 -18.168 -6.488 1.00 0.00 H new ATOM 0 HB VAL A 134 9.739 -16.101 -8.296 1.00 0.00 H new ATOM 0 HG11 VAL A 134 11.482 -17.864 -8.900 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.572 -17.357 -7.196 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.807 -18.905 -7.625 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.508 -17.832 -10.142 1.00 0.00 H new ATOM 0 HG22 VAL A 134 8.642 -18.881 -8.994 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.942 -17.316 -9.472 1.00 0.00 H new ATOM 2078 N GLU A 135 9.236 -16.969 -4.324 1.00 0.00 N ATOM 2079 CA GLU A 135 9.960 -16.616 -3.079 1.00 0.00 C ATOM 2080 C GLU A 135 10.057 -17.863 -2.160 1.00 0.00 C ATOM 2081 O GLU A 135 11.174 -18.144 -1.668 1.00 0.00 O ATOM 2082 CB GLU A 135 9.374 -15.362 -2.373 1.00 0.00 C ATOM 2083 CG GLU A 135 7.909 -15.415 -1.863 1.00 0.00 C ATOM 2084 CD GLU A 135 7.385 -14.154 -1.168 1.00 0.00 C ATOM 2085 OE1 GLU A 135 7.898 -13.036 -1.392 1.00 0.00 O ATOM 2086 OE2 GLU A 135 6.347 -14.243 -0.482 1.00 0.00 O ATOM 2087 OXT GLU A 135 9.043 -18.566 -1.926 1.00 0.00 O ATOM 0 H GLU A 135 8.488 -17.647 -4.174 1.00 0.00 H new ATOM 0 HA GLU A 135 10.976 -16.319 -3.341 1.00 0.00 H new ATOM 0 HB2 GLU A 135 10.013 -15.133 -1.521 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.454 -14.524 -3.066 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.260 -15.633 -2.711 1.00 0.00 H new ATOM 0 HG3 GLU A 135 7.819 -16.251 -1.169 1.00 0.00 H new TER 2094 GLU A 135