USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 975 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 118 GLN : amide:sc= -0.486 K(o=-0.49,f=0.8) USER MOD Set 1.2: A 120 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 64 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 77 LYS NZ :NH3+ -118:sc= 1.13 (180deg=-0.164) USER MOD Set 3.2: A 81 TYR OH : rot 180:sc= 1.02 USER MOD Set 4.1: A 75 ASN : amide:sc= 0.09 X(o=-0.86,f=-1.1) USER MOD Set 4.2: A 78 ASN : amide:sc= -0.948 X(o=-0.86,f=-1.1) USER MOD Set 5.1: A 4 GLN : amide:sc= 0 X(o=0.27,f=-0.22) USER MOD Set 5.2: A 26 SER OG : rot -51:sc= 0.273 USER MOD Set 6.1: A 23 CYS SG : rot 165:sc= -3.4! USER MOD Set 6.2: A 97 CYS SG : rot 177:sc= -2.07! USER MOD Set 7.1: A 14 GLN : amide:sc= -1.16 K(o=-1.2,f=-5.4!) USER MOD Set 7.2: A 126 HIS : no HE2:sc= -0.0833 K(o=-1.2,f=-4.9) USER MOD Set 8.1: A 8 SER OG : rot 180:sc= 0.383 USER MOD Set 8.2: A 22 SER OG : rot 64:sc= 0.415 USER MOD Single : A 1 MET CE :methyl -161:sc= -0.15 (180deg=-0.647) USER MOD Single : A 1 MET N :NH3+ -172:sc=-0.00215 (180deg=-0.0964) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -90:sc= -0.527 USER MOD Single : A 33 ASN : amide:sc= 0.509 K(o=0.51,f=-2.6!) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.558 X(o=-0.56,f=-0.39) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -82:sc= 0.261 USER MOD Single : A 59 THR OG1 : rot -72:sc= 0.209 USER MOD Single : A 60 TYR OH : rot 15:sc= 0.783 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc= 1.05 K(o=1,f=-4.1!) USER MOD Single : A 84 MET CE :methyl -172:sc= -0.088 (180deg=-0.166) USER MOD Single : A 85 ASN : amide:sc= -0.785 K(o=-0.79,f=-0.22) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 4:sc= 0.523 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= -1.22 K(o=-1.2,f=-0.46) USER MOD Single : A 117 THR OG1 : rot 170:sc= 0 USER MOD Single : A 122 SER OG : rot -121:sc= 0.521 USER MOD Single : A 123 SER OG : rot 49:sc= 0.0855 USER MOD Single : A 127 HIS : no HD1:sc= 0.132 K(o=0.13,f=-0.68) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 129 HIS : no HE2:sc= 0.237 K(o=0.24,f=-1) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=-0.0023) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.413 -0.387 -3.895 1.00 0.00 N ATOM 2 CA MET A 1 -0.882 0.154 -3.412 1.00 0.00 C ATOM 3 C MET A 1 -1.014 1.622 -3.844 1.00 0.00 C ATOM 4 O MET A 1 -1.647 1.927 -4.859 1.00 0.00 O ATOM 5 CB MET A 1 -1.005 0.013 -1.868 1.00 0.00 C ATOM 6 CG MET A 1 -0.892 -1.413 -1.332 1.00 0.00 C ATOM 7 SD MET A 1 -1.036 -1.493 0.474 1.00 0.00 S ATOM 8 CE MET A 1 0.298 -0.408 1.015 1.00 0.00 C ATOM 0 H1 MET A 1 0.447 -1.412 -3.724 1.00 0.00 H new ATOM 0 H2 MET A 1 0.508 -0.203 -4.914 1.00 0.00 H new ATOM 0 H3 MET A 1 1.194 0.075 -3.386 1.00 0.00 H new ATOM 0 HA MET A 1 -1.695 -0.421 -3.856 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.230 0.622 -1.401 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.965 0.425 -1.557 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.670 -2.029 -1.782 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.065 -1.836 -1.636 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.541 -0.621 2.056 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.178 -0.577 0.395 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.018 0.631 0.922 1.00 0.00 H new ATOM 20 N GLN A 2 -0.352 2.516 -3.088 1.00 0.00 N ATOM 21 CA GLN A 2 -0.374 3.964 -3.327 1.00 0.00 C ATOM 22 C GLN A 2 0.734 4.319 -4.324 1.00 0.00 C ATOM 23 O GLN A 2 1.777 4.870 -3.946 1.00 0.00 O ATOM 24 CB GLN A 2 -0.187 4.717 -1.979 1.00 0.00 C ATOM 25 CG GLN A 2 -1.269 4.409 -0.928 1.00 0.00 C ATOM 26 CD GLN A 2 -1.026 5.076 0.432 1.00 0.00 C ATOM 27 OE1 GLN A 2 0.117 5.282 0.841 1.00 0.00 O ATOM 28 NE2 GLN A 2 -2.099 5.416 1.137 1.00 0.00 N ATOM 0 H GLN A 2 0.218 2.247 -2.286 1.00 0.00 H new ATOM 0 HA GLN A 2 -1.332 4.266 -3.750 1.00 0.00 H new ATOM 0 HB2 GLN A 2 0.788 4.461 -1.565 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -0.180 5.790 -2.173 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -2.236 4.732 -1.312 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -1.327 3.330 -0.787 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -3.032 5.231 0.768 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -1.990 5.863 2.048 1.00 0.00 H new ATOM 37 N LEU A 3 0.514 3.932 -5.595 1.00 0.00 N ATOM 38 CA LEU A 3 1.483 4.161 -6.671 1.00 0.00 C ATOM 39 C LEU A 3 1.474 5.663 -6.998 1.00 0.00 C ATOM 40 O LEU A 3 0.480 6.192 -7.503 1.00 0.00 O ATOM 41 CB LEU A 3 1.134 3.283 -7.920 1.00 0.00 C ATOM 42 CG LEU A 3 2.228 3.105 -9.038 1.00 0.00 C ATOM 43 CD1 LEU A 3 2.448 4.373 -9.886 1.00 0.00 C ATOM 44 CD2 LEU A 3 3.548 2.599 -8.440 1.00 0.00 C ATOM 0 H LEU A 3 -0.336 3.456 -5.898 1.00 0.00 H new ATOM 0 HA LEU A 3 2.486 3.868 -6.360 1.00 0.00 H new ATOM 0 HB2 LEU A 3 0.860 2.290 -7.562 1.00 0.00 H new ATOM 0 HB3 LEU A 3 0.247 3.709 -8.388 1.00 0.00 H new ATOM 0 HG LEU A 3 1.844 2.349 -9.723 1.00 0.00 H new ATOM 0 HD11 LEU A 3 3.214 4.180 -10.637 1.00 0.00 H new ATOM 0 HD12 LEU A 3 1.516 4.646 -10.381 1.00 0.00 H new ATOM 0 HD13 LEU A 3 2.769 5.191 -9.241 1.00 0.00 H new ATOM 0 HD21 LEU A 3 4.287 2.485 -9.233 1.00 0.00 H new ATOM 0 HD22 LEU A 3 3.913 3.316 -7.705 1.00 0.00 H new ATOM 0 HD23 LEU A 3 3.383 1.636 -7.956 1.00 0.00 H new ATOM 56 N GLN A 4 2.590 6.322 -6.681 1.00 0.00 N ATOM 57 CA GLN A 4 2.781 7.766 -6.868 1.00 0.00 C ATOM 58 C GLN A 4 3.744 7.993 -8.033 1.00 0.00 C ATOM 59 O GLN A 4 4.657 7.193 -8.258 1.00 0.00 O ATOM 60 CB GLN A 4 3.348 8.382 -5.559 1.00 0.00 C ATOM 61 CG GLN A 4 2.429 8.181 -4.339 1.00 0.00 C ATOM 62 CD GLN A 4 3.049 8.611 -3.004 1.00 0.00 C ATOM 63 OE1 GLN A 4 4.256 8.494 -2.796 1.00 0.00 O ATOM 64 NE2 GLN A 4 2.228 9.129 -2.103 1.00 0.00 N ATOM 0 H GLN A 4 3.405 5.859 -6.278 1.00 0.00 H new ATOM 0 HA GLN A 4 1.830 8.248 -7.096 1.00 0.00 H new ATOM 0 HB2 GLN A 4 4.321 7.937 -5.349 1.00 0.00 H new ATOM 0 HB3 GLN A 4 3.511 9.449 -5.710 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.508 8.743 -4.496 1.00 0.00 H new ATOM 0 HG3 GLN A 4 2.154 7.128 -4.276 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.232 9.211 -2.308 1.00 0.00 H new ATOM 0 HE22 GLN A 4 2.592 9.445 -1.204 1.00 0.00 H new ATOM 73 N LEU A 5 3.518 9.079 -8.776 1.00 0.00 N ATOM 74 CA LEU A 5 4.363 9.482 -9.903 1.00 0.00 C ATOM 75 C LEU A 5 4.810 10.933 -9.663 1.00 0.00 C ATOM 76 O LEU A 5 4.010 11.867 -9.758 1.00 0.00 O ATOM 77 CB LEU A 5 3.575 9.324 -11.237 1.00 0.00 C ATOM 78 CG LEU A 5 3.219 7.854 -11.647 1.00 0.00 C ATOM 79 CD1 LEU A 5 2.260 7.808 -12.853 1.00 0.00 C ATOM 80 CD2 LEU A 5 4.497 7.023 -11.915 1.00 0.00 C ATOM 0 H LEU A 5 2.734 9.710 -8.610 1.00 0.00 H new ATOM 0 HA LEU A 5 5.247 8.849 -9.980 1.00 0.00 H new ATOM 0 HB2 LEU A 5 2.649 9.894 -11.160 1.00 0.00 H new ATOM 0 HB3 LEU A 5 4.161 9.773 -12.039 1.00 0.00 H new ATOM 0 HG LEU A 5 2.696 7.403 -10.804 1.00 0.00 H new ATOM 0 HD11 LEU A 5 2.040 6.770 -13.103 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.334 8.325 -12.601 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.727 8.296 -13.708 1.00 0.00 H new ATOM 0 HD21 LEU A 5 4.218 6.008 -12.197 1.00 0.00 H new ATOM 0 HD22 LEU A 5 5.066 7.481 -12.724 1.00 0.00 H new ATOM 0 HD23 LEU A 5 5.108 6.994 -11.013 1.00 0.00 H new ATOM 92 N VAL A 6 6.106 11.086 -9.335 1.00 0.00 N ATOM 93 CA VAL A 6 6.727 12.376 -8.983 1.00 0.00 C ATOM 94 C VAL A 6 7.418 12.918 -10.229 1.00 0.00 C ATOM 95 O VAL A 6 8.444 12.382 -10.648 1.00 0.00 O ATOM 96 CB VAL A 6 7.784 12.205 -7.821 1.00 0.00 C ATOM 97 CG1 VAL A 6 8.427 13.567 -7.432 1.00 0.00 C ATOM 98 CG2 VAL A 6 7.143 11.509 -6.595 1.00 0.00 C ATOM 0 H VAL A 6 6.761 10.305 -9.307 1.00 0.00 H new ATOM 0 HA VAL A 6 5.958 13.064 -8.631 1.00 0.00 H new ATOM 0 HB VAL A 6 8.586 11.565 -8.188 1.00 0.00 H new ATOM 0 HG11 VAL A 6 9.149 13.413 -6.630 1.00 0.00 H new ATOM 0 HG12 VAL A 6 8.933 13.991 -8.299 1.00 0.00 H new ATOM 0 HG13 VAL A 6 7.650 14.253 -7.094 1.00 0.00 H new ATOM 0 HG21 VAL A 6 7.888 11.401 -5.807 1.00 0.00 H new ATOM 0 HG22 VAL A 6 6.312 12.111 -6.228 1.00 0.00 H new ATOM 0 HG23 VAL A 6 6.777 10.524 -6.886 1.00 0.00 H new ATOM 108 N GLU A 7 6.831 13.963 -10.823 1.00 0.00 N ATOM 109 CA GLU A 7 7.252 14.485 -12.133 1.00 0.00 C ATOM 110 C GLU A 7 8.080 15.771 -11.993 1.00 0.00 C ATOM 111 O GLU A 7 7.947 16.516 -11.008 1.00 0.00 O ATOM 112 CB GLU A 7 6.003 14.740 -13.012 1.00 0.00 C ATOM 113 CG GLU A 7 5.079 13.523 -13.145 1.00 0.00 C ATOM 114 CD GLU A 7 3.929 13.748 -14.125 1.00 0.00 C ATOM 115 OE1 GLU A 7 4.130 13.532 -15.337 1.00 0.00 O ATOM 116 OE2 GLU A 7 2.830 14.140 -13.691 1.00 0.00 O ATOM 0 H GLU A 7 6.050 14.473 -10.411 1.00 0.00 H new ATOM 0 HA GLU A 7 7.889 13.740 -12.609 1.00 0.00 H new ATOM 0 HB2 GLU A 7 5.436 15.570 -12.589 1.00 0.00 H new ATOM 0 HB3 GLU A 7 6.327 15.049 -14.006 1.00 0.00 H new ATOM 0 HG2 GLU A 7 5.665 12.664 -13.472 1.00 0.00 H new ATOM 0 HG3 GLU A 7 4.670 13.276 -12.165 1.00 0.00 H new ATOM 123 N SER A 8 8.925 16.023 -13.009 1.00 0.00 N ATOM 124 CA SER A 8 9.797 17.202 -13.090 1.00 0.00 C ATOM 125 C SER A 8 10.175 17.450 -14.562 1.00 0.00 C ATOM 126 O SER A 8 10.107 16.534 -15.393 1.00 0.00 O ATOM 127 CB SER A 8 11.066 16.998 -12.231 1.00 0.00 C ATOM 128 OG SER A 8 11.823 15.885 -12.682 1.00 0.00 O ATOM 0 H SER A 8 9.020 15.399 -13.810 1.00 0.00 H new ATOM 0 HA SER A 8 9.266 18.071 -12.702 1.00 0.00 H new ATOM 0 HB2 SER A 8 11.681 17.897 -12.268 1.00 0.00 H new ATOM 0 HB3 SER A 8 10.782 16.849 -11.189 1.00 0.00 H new ATOM 0 HG SER A 8 12.620 15.782 -12.121 1.00 0.00 H new ATOM 134 N GLY A 9 10.580 18.689 -14.869 1.00 0.00 N ATOM 135 CA GLY A 9 10.985 19.078 -16.225 1.00 0.00 C ATOM 136 C GLY A 9 9.991 20.023 -16.891 1.00 0.00 C ATOM 137 O GLY A 9 10.237 20.474 -18.008 1.00 0.00 O ATOM 0 H GLY A 9 10.636 19.446 -14.188 1.00 0.00 H new ATOM 0 HA2 GLY A 9 11.963 19.557 -16.184 1.00 0.00 H new ATOM 0 HA3 GLY A 9 11.094 18.183 -16.837 1.00 0.00 H new ATOM 141 N GLY A 10 8.870 20.324 -16.202 1.00 0.00 N ATOM 142 CA GLY A 10 7.835 21.227 -16.724 1.00 0.00 C ATOM 143 C GLY A 10 8.275 22.687 -16.729 1.00 0.00 C ATOM 144 O GLY A 10 7.965 23.447 -15.805 1.00 0.00 O ATOM 0 H GLY A 10 8.662 19.949 -15.276 1.00 0.00 H new ATOM 0 HA2 GLY A 10 7.575 20.927 -17.739 1.00 0.00 H new ATOM 0 HA3 GLY A 10 6.933 21.126 -16.121 1.00 0.00 H new ATOM 148 N GLY A 11 9.006 23.070 -17.784 1.00 0.00 N ATOM 149 CA GLY A 11 9.536 24.429 -17.933 1.00 0.00 C ATOM 150 C GLY A 11 8.926 25.157 -19.117 1.00 0.00 C ATOM 151 O GLY A 11 8.115 24.584 -19.864 1.00 0.00 O ATOM 0 H GLY A 11 9.245 22.447 -18.556 1.00 0.00 H new ATOM 0 HA2 GLY A 11 9.342 24.995 -17.022 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.618 24.384 -18.055 1.00 0.00 H new ATOM 155 N LEU A 12 9.316 26.434 -19.284 1.00 0.00 N ATOM 156 CA LEU A 12 8.912 27.249 -20.424 1.00 0.00 C ATOM 157 C LEU A 12 9.974 27.118 -21.514 1.00 0.00 C ATOM 158 O LEU A 12 11.124 27.529 -21.327 1.00 0.00 O ATOM 159 CB LEU A 12 8.697 28.728 -20.001 1.00 0.00 C ATOM 160 CG LEU A 12 8.043 29.704 -21.051 1.00 0.00 C ATOM 161 CD1 LEU A 12 7.363 30.901 -20.350 1.00 0.00 C ATOM 162 CD2 LEU A 12 9.059 30.217 -22.104 1.00 0.00 C ATOM 0 H LEU A 12 9.922 26.923 -18.625 1.00 0.00 H new ATOM 0 HA LEU A 12 7.957 26.897 -20.814 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.075 28.733 -19.106 1.00 0.00 H new ATOM 0 HB3 LEU A 12 9.666 29.140 -19.719 1.00 0.00 H new ATOM 0 HG LEU A 12 7.288 29.122 -21.579 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.920 31.558 -21.099 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.584 30.536 -19.681 1.00 0.00 H new ATOM 0 HD13 LEU A 12 8.105 31.455 -19.775 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.554 30.885 -22.802 1.00 0.00 H new ATOM 0 HD22 LEU A 12 9.862 30.756 -21.602 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.476 29.371 -22.650 1.00 0.00 H new ATOM 174 N VAL A 13 9.583 26.518 -22.632 1.00 0.00 N ATOM 175 CA VAL A 13 10.380 26.493 -23.858 1.00 0.00 C ATOM 176 C VAL A 13 9.648 27.310 -24.929 1.00 0.00 C ATOM 177 O VAL A 13 8.516 27.743 -24.717 1.00 0.00 O ATOM 178 CB VAL A 13 10.641 25.019 -24.354 1.00 0.00 C ATOM 179 CG1 VAL A 13 11.458 24.213 -23.313 1.00 0.00 C ATOM 180 CG2 VAL A 13 9.317 24.302 -24.705 1.00 0.00 C ATOM 0 H VAL A 13 8.692 26.028 -22.716 1.00 0.00 H new ATOM 0 HA VAL A 13 11.358 26.932 -23.659 1.00 0.00 H new ATOM 0 HB VAL A 13 11.235 25.078 -25.266 1.00 0.00 H new ATOM 0 HG11 VAL A 13 11.622 23.201 -23.683 1.00 0.00 H new ATOM 0 HG12 VAL A 13 12.420 24.700 -23.149 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.908 24.171 -22.373 1.00 0.00 H new ATOM 0 HG21 VAL A 13 9.531 23.288 -25.044 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.679 24.263 -23.822 1.00 0.00 H new ATOM 0 HG23 VAL A 13 8.806 24.849 -25.497 1.00 0.00 H new ATOM 190 N GLN A 14 10.312 27.546 -26.055 1.00 0.00 N ATOM 191 CA GLN A 14 9.719 28.241 -27.208 1.00 0.00 C ATOM 192 C GLN A 14 9.153 27.214 -28.205 1.00 0.00 C ATOM 193 O GLN A 14 9.563 26.039 -28.202 1.00 0.00 O ATOM 194 CB GLN A 14 10.765 29.170 -27.903 1.00 0.00 C ATOM 195 CG GLN A 14 11.891 28.476 -28.714 1.00 0.00 C ATOM 196 CD GLN A 14 12.850 27.623 -27.881 1.00 0.00 C ATOM 197 OE1 GLN A 14 13.096 27.899 -26.711 1.00 0.00 O ATOM 198 NE2 GLN A 14 13.408 26.589 -28.479 1.00 0.00 N ATOM 0 H GLN A 14 11.281 27.262 -26.201 1.00 0.00 H new ATOM 0 HA GLN A 14 8.904 28.871 -26.851 1.00 0.00 H new ATOM 0 HB2 GLN A 14 10.229 29.842 -28.573 1.00 0.00 H new ATOM 0 HB3 GLN A 14 11.231 29.789 -27.136 1.00 0.00 H new ATOM 0 HG2 GLN A 14 11.434 27.845 -29.476 1.00 0.00 H new ATOM 0 HG3 GLN A 14 12.467 29.240 -29.236 1.00 0.00 H new ATOM 0 HE21 GLN A 14 13.186 26.382 -29.453 1.00 0.00 H new ATOM 0 HE22 GLN A 14 14.062 25.996 -27.968 1.00 0.00 H new ATOM 207 N ALA A 15 8.205 27.670 -29.047 1.00 0.00 N ATOM 208 CA ALA A 15 7.581 26.849 -30.099 1.00 0.00 C ATOM 209 C ALA A 15 8.632 26.400 -31.129 1.00 0.00 C ATOM 210 O ALA A 15 9.255 27.239 -31.788 1.00 0.00 O ATOM 211 CB ALA A 15 6.449 27.636 -30.779 1.00 0.00 C ATOM 0 H ALA A 15 7.849 28.625 -29.015 1.00 0.00 H new ATOM 0 HA ALA A 15 7.155 25.956 -29.642 1.00 0.00 H new ATOM 0 HB1 ALA A 15 5.994 27.021 -31.555 1.00 0.00 H new ATOM 0 HB2 ALA A 15 5.695 27.902 -30.038 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.855 28.543 -31.226 1.00 0.00 H new ATOM 217 N GLY A 16 8.840 25.076 -31.224 1.00 0.00 N ATOM 218 CA GLY A 16 9.840 24.476 -32.118 1.00 0.00 C ATOM 219 C GLY A 16 10.982 23.832 -31.345 1.00 0.00 C ATOM 220 O GLY A 16 11.709 22.977 -31.881 1.00 0.00 O ATOM 0 H GLY A 16 8.316 24.391 -30.680 1.00 0.00 H new ATOM 0 HA2 GLY A 16 9.360 23.727 -32.748 1.00 0.00 H new ATOM 0 HA3 GLY A 16 10.239 25.243 -32.782 1.00 0.00 H new ATOM 224 N GLY A 17 11.129 24.241 -30.075 1.00 0.00 N ATOM 225 CA GLY A 17 12.147 23.699 -29.187 1.00 0.00 C ATOM 226 C GLY A 17 11.789 22.339 -28.603 1.00 0.00 C ATOM 227 O GLY A 17 10.684 21.823 -28.808 1.00 0.00 O ATOM 0 H GLY A 17 10.543 24.956 -29.644 1.00 0.00 H new ATOM 0 HA2 GLY A 17 13.086 23.614 -29.734 1.00 0.00 H new ATOM 0 HA3 GLY A 17 12.316 24.402 -28.371 1.00 0.00 H new ATOM 231 N SER A 18 12.752 21.751 -27.891 1.00 0.00 N ATOM 232 CA SER A 18 12.614 20.437 -27.243 1.00 0.00 C ATOM 233 C SER A 18 12.547 20.590 -25.710 1.00 0.00 C ATOM 234 O SER A 18 12.881 21.654 -25.171 1.00 0.00 O ATOM 235 CB SER A 18 13.808 19.546 -27.655 1.00 0.00 C ATOM 236 OG SER A 18 15.051 20.196 -27.422 1.00 0.00 O ATOM 0 H SER A 18 13.666 22.178 -27.744 1.00 0.00 H new ATOM 0 HA SER A 18 11.685 19.968 -27.567 1.00 0.00 H new ATOM 0 HB2 SER A 18 13.775 18.611 -27.096 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.724 19.289 -28.711 1.00 0.00 H new ATOM 0 HG SER A 18 15.785 19.605 -27.692 1.00 0.00 H new ATOM 242 N LEU A 19 12.127 19.513 -25.028 1.00 0.00 N ATOM 243 CA LEU A 19 12.040 19.462 -23.556 1.00 0.00 C ATOM 244 C LEU A 19 12.061 17.992 -23.111 1.00 0.00 C ATOM 245 O LEU A 19 11.483 17.139 -23.780 1.00 0.00 O ATOM 246 CB LEU A 19 10.749 20.176 -23.058 1.00 0.00 C ATOM 247 CG LEU A 19 10.574 20.325 -21.513 1.00 0.00 C ATOM 248 CD1 LEU A 19 11.735 21.125 -20.883 1.00 0.00 C ATOM 249 CD2 LEU A 19 9.201 20.952 -21.170 1.00 0.00 C ATOM 0 H LEU A 19 11.836 18.647 -25.483 1.00 0.00 H new ATOM 0 HA LEU A 19 12.891 19.984 -23.119 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.720 21.172 -23.500 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.889 19.630 -23.446 1.00 0.00 H new ATOM 0 HG LEU A 19 10.602 19.326 -21.079 1.00 0.00 H new ATOM 0 HD11 LEU A 19 11.578 21.208 -19.808 1.00 0.00 H new ATOM 0 HD12 LEU A 19 12.677 20.611 -21.074 1.00 0.00 H new ATOM 0 HD13 LEU A 19 11.770 22.122 -21.322 1.00 0.00 H new ATOM 0 HD21 LEU A 19 9.104 21.045 -20.088 1.00 0.00 H new ATOM 0 HD22 LEU A 19 9.127 21.939 -21.627 1.00 0.00 H new ATOM 0 HD23 LEU A 19 8.404 20.314 -21.552 1.00 0.00 H new ATOM 261 N ARG A 20 12.755 17.695 -22.003 1.00 0.00 N ATOM 262 CA ARG A 20 12.830 16.330 -21.449 1.00 0.00 C ATOM 263 C ARG A 20 12.138 16.276 -20.083 1.00 0.00 C ATOM 264 O ARG A 20 12.581 16.904 -19.117 1.00 0.00 O ATOM 265 CB ARG A 20 14.302 15.844 -21.342 1.00 0.00 C ATOM 266 CG ARG A 20 14.453 14.384 -20.839 1.00 0.00 C ATOM 267 CD ARG A 20 15.919 13.913 -20.808 1.00 0.00 C ATOM 268 NE ARG A 20 16.526 13.920 -22.151 1.00 0.00 N ATOM 269 CZ ARG A 20 17.837 13.862 -22.417 1.00 0.00 C ATOM 270 NH1 ARG A 20 18.742 13.839 -21.440 1.00 0.00 N ATOM 271 NH2 ARG A 20 18.233 13.845 -23.680 1.00 0.00 N ATOM 0 H ARG A 20 13.278 18.387 -21.467 1.00 0.00 H new ATOM 0 HA ARG A 20 12.311 15.657 -22.131 1.00 0.00 H new ATOM 0 HB2 ARG A 20 14.774 15.930 -22.321 1.00 0.00 H new ATOM 0 HB3 ARG A 20 14.844 16.507 -20.668 1.00 0.00 H new ATOM 0 HG2 ARG A 20 14.029 14.304 -19.838 1.00 0.00 H new ATOM 0 HG3 ARG A 20 13.876 13.721 -21.484 1.00 0.00 H new ATOM 0 HD2 ARG A 20 16.494 14.560 -20.146 1.00 0.00 H new ATOM 0 HD3 ARG A 20 15.968 12.907 -20.392 1.00 0.00 H new ATOM 0 HE ARG A 20 15.892 13.974 -22.948 1.00 0.00 H new ATOM 0 HH11 ARG A 20 18.441 13.866 -20.466 1.00 0.00 H new ATOM 0 HH12 ARG A 20 19.736 13.795 -21.666 1.00 0.00 H new ATOM 0 HH21 ARG A 20 17.544 13.876 -24.431 1.00 0.00 H new ATOM 0 HH22 ARG A 20 19.228 13.801 -23.902 1.00 0.00 H new ATOM 285 N LEU A 21 11.026 15.542 -20.031 1.00 0.00 N ATOM 286 CA LEU A 21 10.285 15.268 -18.799 1.00 0.00 C ATOM 287 C LEU A 21 10.862 14.013 -18.127 1.00 0.00 C ATOM 288 O LEU A 21 11.374 13.107 -18.805 1.00 0.00 O ATOM 289 CB LEU A 21 8.761 15.090 -19.100 1.00 0.00 C ATOM 290 CG LEU A 21 7.958 16.380 -19.465 1.00 0.00 C ATOM 291 CD1 LEU A 21 8.000 17.394 -18.320 1.00 0.00 C ATOM 292 CD2 LEU A 21 8.437 17.004 -20.787 1.00 0.00 C ATOM 0 H LEU A 21 10.608 15.114 -20.857 1.00 0.00 H new ATOM 0 HA LEU A 21 10.391 16.114 -18.120 1.00 0.00 H new ATOM 0 HB2 LEU A 21 8.658 14.382 -19.922 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.293 14.635 -18.227 1.00 0.00 H new ATOM 0 HG LEU A 21 6.920 16.084 -19.614 1.00 0.00 H new ATOM 0 HD11 LEU A 21 7.434 18.282 -18.600 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.562 16.951 -17.426 1.00 0.00 H new ATOM 0 HD13 LEU A 21 9.034 17.672 -18.118 1.00 0.00 H new ATOM 0 HD21 LEU A 21 7.851 17.898 -21.001 1.00 0.00 H new ATOM 0 HD22 LEU A 21 9.490 17.272 -20.702 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.310 16.285 -21.596 1.00 0.00 H new ATOM 304 N SER A 22 10.786 13.981 -16.799 1.00 0.00 N ATOM 305 CA SER A 22 11.312 12.891 -15.981 1.00 0.00 C ATOM 306 C SER A 22 10.403 12.683 -14.769 1.00 0.00 C ATOM 307 O SER A 22 10.117 13.634 -14.032 1.00 0.00 O ATOM 308 CB SER A 22 12.762 13.217 -15.545 1.00 0.00 C ATOM 309 OG SER A 22 12.871 14.524 -14.987 1.00 0.00 O ATOM 0 H SER A 22 10.350 14.724 -16.252 1.00 0.00 H new ATOM 0 HA SER A 22 11.333 11.967 -16.560 1.00 0.00 H new ATOM 0 HB2 SER A 22 13.094 12.481 -14.813 1.00 0.00 H new ATOM 0 HB3 SER A 22 13.427 13.133 -16.405 1.00 0.00 H new ATOM 0 HG SER A 22 12.336 14.576 -14.168 1.00 0.00 H new ATOM 315 N CYS A 23 9.951 11.440 -14.575 1.00 0.00 N ATOM 316 CA CYS A 23 9.043 11.064 -13.491 1.00 0.00 C ATOM 317 C CYS A 23 9.523 9.774 -12.843 1.00 0.00 C ATOM 318 O CYS A 23 9.802 8.810 -13.542 1.00 0.00 O ATOM 319 CB CYS A 23 7.613 10.864 -14.022 1.00 0.00 C ATOM 320 SG CYS A 23 6.448 10.292 -12.767 1.00 0.00 S ATOM 0 H CYS A 23 10.210 10.657 -15.176 1.00 0.00 H new ATOM 0 HA CYS A 23 9.036 11.868 -12.755 1.00 0.00 H new ATOM 0 HB2 CYS A 23 7.254 11.806 -14.437 1.00 0.00 H new ATOM 0 HB3 CYS A 23 7.636 10.144 -14.840 1.00 0.00 H new ATOM 0 HG CYS A 23 5.232 10.455 -13.197 1.00 0.00 H new ATOM 326 N VAL A 24 9.623 9.755 -11.509 1.00 0.00 N ATOM 327 CA VAL A 24 10.015 8.548 -10.759 1.00 0.00 C ATOM 328 C VAL A 24 8.769 7.957 -10.073 1.00 0.00 C ATOM 329 O VAL A 24 7.893 8.706 -9.623 1.00 0.00 O ATOM 330 CB VAL A 24 11.122 8.848 -9.681 1.00 0.00 C ATOM 331 CG1 VAL A 24 11.751 7.533 -9.157 1.00 0.00 C ATOM 332 CG2 VAL A 24 12.216 9.795 -10.224 1.00 0.00 C ATOM 0 H VAL A 24 9.437 10.566 -10.920 1.00 0.00 H new ATOM 0 HA VAL A 24 10.438 7.835 -11.467 1.00 0.00 H new ATOM 0 HB VAL A 24 10.633 9.356 -8.850 1.00 0.00 H new ATOM 0 HG11 VAL A 24 12.513 7.765 -8.413 1.00 0.00 H new ATOM 0 HG12 VAL A 24 10.977 6.915 -8.702 1.00 0.00 H new ATOM 0 HG13 VAL A 24 12.206 6.992 -9.986 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.959 9.975 -9.447 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.697 9.337 -11.088 1.00 0.00 H new ATOM 0 HG23 VAL A 24 11.764 10.742 -10.520 1.00 0.00 H new ATOM 342 N ALA A 25 8.714 6.621 -9.959 1.00 0.00 N ATOM 343 CA ALA A 25 7.576 5.934 -9.346 1.00 0.00 C ATOM 344 C ALA A 25 7.794 5.847 -7.824 1.00 0.00 C ATOM 345 O ALA A 25 8.588 5.031 -7.349 1.00 0.00 O ATOM 346 CB ALA A 25 7.406 4.533 -9.972 1.00 0.00 C ATOM 0 H ALA A 25 9.450 5.996 -10.286 1.00 0.00 H new ATOM 0 HA ALA A 25 6.660 6.494 -9.532 1.00 0.00 H new ATOM 0 HB1 ALA A 25 6.557 4.029 -9.510 1.00 0.00 H new ATOM 0 HB2 ALA A 25 7.230 4.632 -11.043 1.00 0.00 H new ATOM 0 HB3 ALA A 25 8.310 3.948 -9.805 1.00 0.00 H new ATOM 352 N SER A 26 7.137 6.791 -7.104 1.00 0.00 N ATOM 353 CA SER A 26 7.033 6.822 -5.629 1.00 0.00 C ATOM 354 C SER A 26 8.418 6.746 -4.939 1.00 0.00 C ATOM 355 O SER A 26 8.598 6.055 -3.923 1.00 0.00 O ATOM 356 CB SER A 26 6.070 5.695 -5.168 1.00 0.00 C ATOM 357 OG SER A 26 5.771 5.771 -3.779 1.00 0.00 O ATOM 0 H SER A 26 6.653 7.571 -7.548 1.00 0.00 H new ATOM 0 HA SER A 26 6.618 7.782 -5.322 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.144 5.756 -5.740 1.00 0.00 H new ATOM 0 HB3 SER A 26 6.518 4.726 -5.388 1.00 0.00 H new ATOM 0 HG SER A 26 6.605 5.831 -3.268 1.00 0.00 H new ATOM 363 N GLY A 27 9.396 7.466 -5.516 1.00 0.00 N ATOM 364 CA GLY A 27 10.776 7.465 -5.022 1.00 0.00 C ATOM 365 C GLY A 27 11.597 6.330 -5.622 1.00 0.00 C ATOM 366 O GLY A 27 12.606 6.585 -6.282 1.00 0.00 O ATOM 0 H GLY A 27 9.249 8.060 -6.332 1.00 0.00 H new ATOM 0 HA2 GLY A 27 11.247 8.419 -5.261 1.00 0.00 H new ATOM 0 HA3 GLY A 27 10.772 7.375 -3.936 1.00 0.00 H new ATOM 370 N ARG A 28 11.160 5.080 -5.359 1.00 0.00 N ATOM 371 CA ARG A 28 11.703 3.837 -5.975 1.00 0.00 C ATOM 372 C ARG A 28 10.769 2.638 -5.652 1.00 0.00 C ATOM 373 O ARG A 28 11.228 1.499 -5.502 1.00 0.00 O ATOM 374 CB ARG A 28 13.181 3.548 -5.509 1.00 0.00 C ATOM 375 CG ARG A 28 14.279 3.960 -6.527 1.00 0.00 C ATOM 376 CD ARG A 28 15.703 3.753 -5.986 1.00 0.00 C ATOM 377 NE ARG A 28 15.947 4.559 -4.770 1.00 0.00 N ATOM 378 CZ ARG A 28 16.772 4.232 -3.762 1.00 0.00 C ATOM 379 NH1 ARG A 28 17.439 3.085 -3.763 1.00 0.00 N ATOM 380 NH2 ARG A 28 16.906 5.057 -2.735 1.00 0.00 N ATOM 0 H ARG A 28 10.404 4.896 -4.699 1.00 0.00 H new ATOM 0 HA ARG A 28 11.736 3.979 -7.055 1.00 0.00 H new ATOM 0 HB2 ARG A 28 13.360 4.073 -4.571 1.00 0.00 H new ATOM 0 HB3 ARG A 28 13.280 2.482 -5.302 1.00 0.00 H new ATOM 0 HG2 ARG A 28 14.155 3.380 -7.442 1.00 0.00 H new ATOM 0 HG3 ARG A 28 14.146 5.008 -6.793 1.00 0.00 H new ATOM 0 HD2 ARG A 28 15.857 2.698 -5.761 1.00 0.00 H new ATOM 0 HD3 ARG A 28 16.427 4.024 -6.754 1.00 0.00 H new ATOM 0 HE ARG A 28 15.443 5.442 -4.690 1.00 0.00 H new ATOM 0 HH11 ARG A 28 17.330 2.432 -4.539 1.00 0.00 H new ATOM 0 HH12 ARG A 28 18.061 2.856 -2.987 1.00 0.00 H new ATOM 0 HH21 ARG A 28 16.385 5.933 -2.713 1.00 0.00 H new ATOM 0 HH22 ARG A 28 17.531 4.816 -1.965 1.00 0.00 H new ATOM 394 N THR A 29 9.453 2.898 -5.571 1.00 0.00 N ATOM 395 CA THR A 29 8.436 1.860 -5.320 1.00 0.00 C ATOM 396 C THR A 29 7.442 1.804 -6.494 1.00 0.00 C ATOM 397 O THR A 29 6.778 2.798 -6.807 1.00 0.00 O ATOM 398 CB THR A 29 7.687 2.122 -3.977 1.00 0.00 C ATOM 399 OG1 THR A 29 8.631 2.088 -2.895 1.00 0.00 O ATOM 400 CG2 THR A 29 6.572 1.092 -3.708 1.00 0.00 C ATOM 0 H THR A 29 9.063 3.834 -5.678 1.00 0.00 H new ATOM 0 HA THR A 29 8.939 0.897 -5.237 1.00 0.00 H new ATOM 0 HB THR A 29 7.215 3.102 -4.053 1.00 0.00 H new ATOM 0 HG1 THR A 29 8.165 2.254 -2.049 1.00 0.00 H new ATOM 0 HG21 THR A 29 6.085 1.323 -2.761 1.00 0.00 H new ATOM 0 HG22 THR A 29 5.838 1.132 -4.513 1.00 0.00 H new ATOM 0 HG23 THR A 29 7.004 0.092 -3.660 1.00 0.00 H new ATOM 408 N PHE A 30 7.346 0.624 -7.126 1.00 0.00 N ATOM 409 CA PHE A 30 6.496 0.396 -8.307 1.00 0.00 C ATOM 410 C PHE A 30 5.686 -0.905 -8.142 1.00 0.00 C ATOM 411 O PHE A 30 6.127 -1.832 -7.453 1.00 0.00 O ATOM 412 CB PHE A 30 7.370 0.330 -9.596 1.00 0.00 C ATOM 413 CG PHE A 30 8.256 -0.914 -9.690 1.00 0.00 C ATOM 414 CD1 PHE A 30 9.403 -1.035 -8.916 1.00 0.00 C ATOM 415 CD2 PHE A 30 7.929 -1.970 -10.550 1.00 0.00 C ATOM 416 CE1 PHE A 30 10.191 -2.166 -8.982 1.00 0.00 C ATOM 417 CE2 PHE A 30 8.720 -3.100 -10.619 1.00 0.00 C ATOM 418 CZ PHE A 30 9.853 -3.196 -9.834 1.00 0.00 C ATOM 0 H PHE A 30 7.860 -0.206 -6.830 1.00 0.00 H new ATOM 0 HA PHE A 30 5.799 1.229 -8.400 1.00 0.00 H new ATOM 0 HB2 PHE A 30 6.716 0.363 -10.467 1.00 0.00 H new ATOM 0 HB3 PHE A 30 8.002 1.217 -9.639 1.00 0.00 H new ATOM 0 HD1 PHE A 30 9.683 -0.231 -8.252 1.00 0.00 H new ATOM 0 HD2 PHE A 30 7.046 -1.900 -11.168 1.00 0.00 H new ATOM 0 HE1 PHE A 30 11.074 -2.244 -8.365 1.00 0.00 H new ATOM 0 HE2 PHE A 30 8.453 -3.907 -11.285 1.00 0.00 H new ATOM 0 HZ PHE A 30 10.474 -4.078 -9.888 1.00 0.00 H new ATOM 428 N ARG A 31 4.498 -0.929 -8.770 1.00 0.00 N ATOM 429 CA ARG A 31 3.701 -2.147 -9.027 1.00 0.00 C ATOM 430 C ARG A 31 2.608 -1.786 -10.033 1.00 0.00 C ATOM 431 O ARG A 31 1.433 -1.625 -9.688 1.00 0.00 O ATOM 432 CB ARG A 31 3.130 -2.826 -7.724 1.00 0.00 C ATOM 433 CG ARG A 31 3.930 -4.070 -7.261 1.00 0.00 C ATOM 434 CD ARG A 31 3.420 -4.678 -5.946 1.00 0.00 C ATOM 435 NE ARG A 31 4.210 -5.865 -5.542 1.00 0.00 N ATOM 436 CZ ARG A 31 5.338 -5.838 -4.809 1.00 0.00 C ATOM 437 NH1 ARG A 31 5.863 -4.684 -4.390 1.00 0.00 N ATOM 438 NH2 ARG A 31 5.946 -6.974 -4.498 1.00 0.00 N ATOM 0 H ARG A 31 4.052 -0.082 -9.123 1.00 0.00 H new ATOM 0 HA ARG A 31 4.355 -2.913 -9.444 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.120 -2.092 -6.918 1.00 0.00 H new ATOM 0 HB3 ARG A 31 2.095 -3.118 -7.902 1.00 0.00 H new ATOM 0 HG2 ARG A 31 3.888 -4.829 -8.042 1.00 0.00 H new ATOM 0 HG3 ARG A 31 4.977 -3.793 -7.141 1.00 0.00 H new ATOM 0 HD2 ARG A 31 3.465 -3.927 -5.157 1.00 0.00 H new ATOM 0 HD3 ARG A 31 2.373 -4.960 -6.059 1.00 0.00 H new ATOM 0 HE ARG A 31 3.871 -6.778 -5.845 1.00 0.00 H new ATOM 0 HH11 ARG A 31 5.408 -3.802 -4.625 1.00 0.00 H new ATOM 0 HH12 ARG A 31 6.719 -4.685 -3.835 1.00 0.00 H new ATOM 0 HH21 ARG A 31 5.559 -7.863 -4.814 1.00 0.00 H new ATOM 0 HH22 ARG A 31 6.801 -6.959 -3.943 1.00 0.00 H new ATOM 452 N SER A 32 3.049 -1.587 -11.278 1.00 0.00 N ATOM 453 CA SER A 32 2.199 -1.255 -12.425 1.00 0.00 C ATOM 454 C SER A 32 2.834 -1.880 -13.675 1.00 0.00 C ATOM 455 O SER A 32 4.030 -1.699 -13.910 1.00 0.00 O ATOM 456 CB SER A 32 2.070 0.282 -12.580 1.00 0.00 C ATOM 457 OG SER A 32 1.514 0.875 -11.418 1.00 0.00 O ATOM 0 H SER A 32 4.037 -1.654 -11.523 1.00 0.00 H new ATOM 0 HA SER A 32 1.194 -1.650 -12.280 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.052 0.713 -12.776 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.444 0.511 -13.442 1.00 0.00 H new ATOM 0 HG SER A 32 0.538 0.902 -11.500 1.00 0.00 H new ATOM 463 N ASN A 33 2.038 -2.616 -14.464 1.00 0.00 N ATOM 464 CA ASN A 33 2.547 -3.420 -15.582 1.00 0.00 C ATOM 465 C ASN A 33 2.816 -2.566 -16.823 1.00 0.00 C ATOM 466 O ASN A 33 3.870 -2.719 -17.449 1.00 0.00 O ATOM 467 CB ASN A 33 1.586 -4.581 -15.888 1.00 0.00 C ATOM 468 CG ASN A 33 1.553 -5.605 -14.753 1.00 0.00 C ATOM 469 OD1 ASN A 33 0.754 -5.494 -13.822 1.00 0.00 O ATOM 470 ND2 ASN A 33 2.432 -6.595 -14.814 1.00 0.00 N ATOM 0 H ASN A 33 1.026 -2.670 -14.345 1.00 0.00 H new ATOM 0 HA ASN A 33 3.506 -3.843 -15.283 1.00 0.00 H new ATOM 0 HB2 ASN A 33 0.583 -4.188 -16.053 1.00 0.00 H new ATOM 0 HB3 ASN A 33 1.892 -5.072 -16.812 1.00 0.00 H new ATOM 0 HD21 ASN A 33 2.462 -7.297 -14.074 1.00 0.00 H new ATOM 0 HD22 ASN A 33 3.079 -6.655 -15.601 1.00 0.00 H new ATOM 477 N ALA A 34 1.897 -1.646 -17.164 1.00 0.00 N ATOM 478 CA ALA A 34 2.112 -0.672 -18.259 1.00 0.00 C ATOM 479 C ALA A 34 2.130 0.758 -17.704 1.00 0.00 C ATOM 480 O ALA A 34 1.820 0.982 -16.534 1.00 0.00 O ATOM 481 CB ALA A 34 1.054 -0.812 -19.364 1.00 0.00 C ATOM 0 H ALA A 34 0.994 -1.553 -16.698 1.00 0.00 H new ATOM 0 HA ALA A 34 3.081 -0.888 -18.709 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.248 -0.080 -20.148 1.00 0.00 H new ATOM 0 HB2 ALA A 34 1.099 -1.816 -19.786 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.063 -0.640 -18.943 1.00 0.00 H new ATOM 487 N MET A 35 2.534 1.711 -18.561 1.00 0.00 N ATOM 488 CA MET A 35 2.612 3.155 -18.236 1.00 0.00 C ATOM 489 C MET A 35 2.340 3.975 -19.518 1.00 0.00 C ATOM 490 O MET A 35 2.363 3.424 -20.626 1.00 0.00 O ATOM 491 CB MET A 35 4.003 3.528 -17.617 1.00 0.00 C ATOM 492 CG MET A 35 4.220 3.059 -16.165 1.00 0.00 C ATOM 493 SD MET A 35 5.873 3.418 -15.525 1.00 0.00 S ATOM 494 CE MET A 35 5.719 2.898 -13.812 1.00 0.00 C ATOM 0 H MET A 35 2.822 1.501 -19.517 1.00 0.00 H new ATOM 0 HA MET A 35 1.857 3.391 -17.487 1.00 0.00 H new ATOM 0 HB2 MET A 35 4.787 3.100 -18.241 1.00 0.00 H new ATOM 0 HB3 MET A 35 4.121 4.611 -17.654 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.480 3.537 -15.524 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.044 1.985 -16.109 1.00 0.00 H new ATOM 0 HE1 MET A 35 6.665 3.062 -13.296 1.00 0.00 H new ATOM 0 HE2 MET A 35 4.934 3.477 -13.325 1.00 0.00 H new ATOM 0 HE3 MET A 35 5.464 1.839 -13.775 1.00 0.00 H new ATOM 504 N GLY A 36 2.072 5.283 -19.360 1.00 0.00 N ATOM 505 CA GLY A 36 1.769 6.166 -20.499 1.00 0.00 C ATOM 506 C GLY A 36 2.076 7.625 -20.195 1.00 0.00 C ATOM 507 O GLY A 36 2.643 7.930 -19.141 1.00 0.00 O ATOM 0 H GLY A 36 2.059 5.752 -18.454 1.00 0.00 H new ATOM 0 HA2 GLY A 36 2.348 5.848 -21.366 1.00 0.00 H new ATOM 0 HA3 GLY A 36 0.716 6.066 -20.764 1.00 0.00 H new ATOM 511 N TRP A 37 1.730 8.519 -21.138 1.00 0.00 N ATOM 512 CA TRP A 37 1.860 9.985 -20.995 1.00 0.00 C ATOM 513 C TRP A 37 0.664 10.651 -21.698 1.00 0.00 C ATOM 514 O TRP A 37 0.454 10.469 -22.907 1.00 0.00 O ATOM 515 CB TRP A 37 3.197 10.534 -21.598 1.00 0.00 C ATOM 516 CG TRP A 37 4.449 10.168 -20.823 1.00 0.00 C ATOM 517 CD1 TRP A 37 5.177 9.024 -20.941 1.00 0.00 C ATOM 518 CD2 TRP A 37 5.106 10.954 -19.808 1.00 0.00 C ATOM 519 NE1 TRP A 37 6.250 9.051 -20.091 1.00 0.00 N ATOM 520 CE2 TRP A 37 6.229 10.220 -19.381 1.00 0.00 C ATOM 521 CE3 TRP A 37 4.862 12.210 -19.232 1.00 0.00 C ATOM 522 CZ2 TRP A 37 7.101 10.690 -18.396 1.00 0.00 C ATOM 523 CZ3 TRP A 37 5.727 12.675 -18.254 1.00 0.00 C ATOM 524 CH2 TRP A 37 6.839 11.917 -17.848 1.00 0.00 C ATOM 0 H TRP A 37 1.344 8.240 -22.040 1.00 0.00 H new ATOM 0 HA TRP A 37 1.873 10.221 -19.931 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.298 10.162 -22.618 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.131 11.620 -21.660 1.00 0.00 H new ATOM 0 HD1 TRP A 37 4.942 8.210 -21.611 1.00 0.00 H new ATOM 0 HE1 TRP A 37 6.953 8.317 -20.002 1.00 0.00 H new ATOM 0 HE3 TRP A 37 4.016 12.803 -19.545 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 7.952 10.106 -18.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 5.544 13.636 -17.796 1.00 0.00 H new ATOM 0 HH2 TRP A 37 7.499 12.310 -17.089 1.00 0.00 H new ATOM 535 N PHE A 38 -0.132 11.386 -20.919 1.00 0.00 N ATOM 536 CA PHE A 38 -1.250 12.203 -21.410 1.00 0.00 C ATOM 537 C PHE A 38 -0.900 13.690 -21.219 1.00 0.00 C ATOM 538 O PHE A 38 0.012 14.030 -20.458 1.00 0.00 O ATOM 539 CB PHE A 38 -2.558 11.880 -20.627 1.00 0.00 C ATOM 540 CG PHE A 38 -3.079 10.452 -20.776 1.00 0.00 C ATOM 541 CD1 PHE A 38 -2.468 9.389 -20.114 1.00 0.00 C ATOM 542 CD2 PHE A 38 -4.216 10.179 -21.543 1.00 0.00 C ATOM 543 CE1 PHE A 38 -2.951 8.100 -20.243 1.00 0.00 C ATOM 544 CE2 PHE A 38 -4.694 8.891 -21.670 1.00 0.00 C ATOM 545 CZ PHE A 38 -4.069 7.854 -21.006 1.00 0.00 C ATOM 0 H PHE A 38 -0.017 11.433 -19.907 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.413 11.981 -22.465 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.385 12.076 -19.569 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -3.337 12.568 -20.956 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -1.605 9.575 -19.492 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -4.727 10.988 -22.043 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -2.449 7.284 -19.744 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -5.557 8.694 -22.289 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.458 6.850 -21.086 1.00 0.00 H new ATOM 555 N ARG A 39 -1.628 14.566 -21.919 1.00 0.00 N ATOM 556 CA ARG A 39 -1.599 16.016 -21.668 1.00 0.00 C ATOM 557 C ARG A 39 -3.007 16.479 -21.337 1.00 0.00 C ATOM 558 O ARG A 39 -3.962 16.108 -22.019 1.00 0.00 O ATOM 559 CB ARG A 39 -1.035 16.814 -22.871 1.00 0.00 C ATOM 560 CG ARG A 39 -1.839 16.749 -24.190 1.00 0.00 C ATOM 561 CD ARG A 39 -1.177 17.577 -25.310 1.00 0.00 C ATOM 562 NE ARG A 39 -1.944 17.523 -26.564 1.00 0.00 N ATOM 563 CZ ARG A 39 -1.792 18.358 -27.603 1.00 0.00 C ATOM 564 NH1 ARG A 39 -0.815 19.272 -27.628 1.00 0.00 N ATOM 565 NH2 ARG A 39 -2.604 18.240 -28.640 1.00 0.00 N ATOM 0 H ARG A 39 -2.255 14.293 -22.676 1.00 0.00 H new ATOM 0 HA ARG A 39 -0.929 16.206 -20.830 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.951 17.860 -22.576 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -0.025 16.458 -23.071 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -1.927 15.711 -24.510 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -2.851 17.116 -24.017 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.083 18.614 -24.987 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -0.167 17.206 -25.487 1.00 0.00 H new ATOM 0 HE ARG A 39 -2.649 16.791 -26.651 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.165 19.345 -26.845 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -0.720 19.895 -28.430 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -3.330 17.524 -28.640 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -2.504 18.865 -29.440 1.00 0.00 H new ATOM 579 N GLN A 40 -3.138 17.284 -20.294 1.00 0.00 N ATOM 580 CA GLN A 40 -4.428 17.796 -19.846 1.00 0.00 C ATOM 581 C GLN A 40 -4.465 19.280 -20.214 1.00 0.00 C ATOM 582 O GLN A 40 -3.532 20.030 -19.902 1.00 0.00 O ATOM 583 CB GLN A 40 -4.589 17.542 -18.312 1.00 0.00 C ATOM 584 CG GLN A 40 -6.045 17.432 -17.803 1.00 0.00 C ATOM 585 CD GLN A 40 -6.853 18.727 -17.886 1.00 0.00 C ATOM 586 OE1 GLN A 40 -6.325 19.827 -17.706 1.00 0.00 O ATOM 587 NE2 GLN A 40 -8.136 18.605 -18.180 1.00 0.00 N ATOM 0 H GLN A 40 -2.350 17.603 -19.730 1.00 0.00 H new ATOM 0 HA GLN A 40 -5.266 17.291 -20.326 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -4.063 16.622 -18.057 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -4.095 18.351 -17.774 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -6.559 16.662 -18.379 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -6.028 17.097 -16.766 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -8.541 17.680 -18.323 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -8.721 19.436 -18.264 1.00 0.00 H new ATOM 596 N ALA A 41 -5.538 19.693 -20.884 1.00 0.00 N ATOM 597 CA ALA A 41 -5.731 21.077 -21.333 1.00 0.00 C ATOM 598 C ALA A 41 -6.890 21.707 -20.535 1.00 0.00 C ATOM 599 O ALA A 41 -7.872 21.012 -20.243 1.00 0.00 O ATOM 600 CB ALA A 41 -5.996 21.104 -22.851 1.00 0.00 C ATOM 0 H ALA A 41 -6.308 19.073 -21.135 1.00 0.00 H new ATOM 0 HA ALA A 41 -4.831 21.664 -21.150 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -6.138 22.134 -23.177 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.145 20.671 -23.377 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -6.893 20.526 -23.074 1.00 0.00 H new ATOM 606 N PRO A 42 -6.785 23.019 -20.141 1.00 0.00 N ATOM 607 CA PRO A 42 -7.835 23.701 -19.339 1.00 0.00 C ATOM 608 C PRO A 42 -9.206 23.747 -20.074 1.00 0.00 C ATOM 609 O PRO A 42 -9.347 24.385 -21.124 1.00 0.00 O ATOM 610 CB PRO A 42 -7.245 25.122 -19.089 1.00 0.00 C ATOM 611 CG PRO A 42 -6.227 25.306 -20.173 1.00 0.00 C ATOM 612 CD PRO A 42 -5.640 23.935 -20.423 1.00 0.00 C ATOM 0 HA PRO A 42 -8.057 23.175 -18.411 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -8.020 25.887 -19.139 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -6.789 25.194 -18.101 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -6.686 25.706 -21.077 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -5.455 26.013 -19.869 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -5.283 23.830 -21.448 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -4.792 23.734 -19.768 1.00 0.00 H new ATOM 620 N GLY A 43 -10.199 23.034 -19.504 1.00 0.00 N ATOM 621 CA GLY A 43 -11.559 22.963 -20.062 1.00 0.00 C ATOM 622 C GLY A 43 -11.748 21.825 -21.061 1.00 0.00 C ATOM 623 O GLY A 43 -12.839 21.653 -21.623 1.00 0.00 O ATOM 0 H GLY A 43 -10.078 22.494 -18.647 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -12.272 22.842 -19.246 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -11.792 23.908 -20.552 1.00 0.00 H new ATOM 627 N LYS A 44 -10.674 21.057 -21.279 1.00 0.00 N ATOM 628 CA LYS A 44 -10.652 19.883 -22.171 1.00 0.00 C ATOM 629 C LYS A 44 -10.299 18.638 -21.347 1.00 0.00 C ATOM 630 O LYS A 44 -10.008 18.743 -20.151 1.00 0.00 O ATOM 631 CB LYS A 44 -9.616 20.097 -23.319 1.00 0.00 C ATOM 632 CG LYS A 44 -9.891 21.285 -24.292 1.00 0.00 C ATOM 633 CD LYS A 44 -10.960 20.990 -25.394 1.00 0.00 C ATOM 634 CE LYS A 44 -12.410 20.907 -24.876 1.00 0.00 C ATOM 635 NZ LYS A 44 -13.388 20.624 -25.956 1.00 0.00 N ATOM 0 H LYS A 44 -9.775 21.235 -20.832 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.634 19.747 -22.625 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -8.634 20.245 -22.869 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -9.563 19.180 -23.906 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -10.217 22.147 -23.709 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.956 21.564 -24.777 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -10.904 21.769 -26.154 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.708 20.049 -25.883 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -12.477 20.127 -24.117 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -12.673 21.847 -24.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.346 20.579 -25.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -13.347 21.381 -26.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -13.157 19.714 -26.404 1.00 0.00 H new ATOM 649 N GLU A 45 -10.367 17.460 -21.984 1.00 0.00 N ATOM 650 CA GLU A 45 -9.965 16.190 -21.346 1.00 0.00 C ATOM 651 C GLU A 45 -8.452 15.950 -21.520 1.00 0.00 C ATOM 652 O GLU A 45 -7.782 16.645 -22.305 1.00 0.00 O ATOM 653 CB GLU A 45 -10.771 14.993 -21.926 1.00 0.00 C ATOM 654 CG GLU A 45 -10.505 14.682 -23.407 1.00 0.00 C ATOM 655 CD GLU A 45 -11.194 13.391 -23.873 1.00 0.00 C ATOM 656 OE1 GLU A 45 -12.387 13.435 -24.247 1.00 0.00 O ATOM 657 OE2 GLU A 45 -10.552 12.317 -23.855 1.00 0.00 O ATOM 0 H GLU A 45 -10.697 17.356 -22.944 1.00 0.00 H new ATOM 0 HA GLU A 45 -10.186 16.266 -20.281 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -10.544 14.104 -21.338 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -11.834 15.196 -21.799 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -10.853 15.515 -24.017 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -9.431 14.595 -23.569 1.00 0.00 H new ATOM 664 N ARG A 46 -7.916 14.984 -20.751 1.00 0.00 N ATOM 665 CA ARG A 46 -6.541 14.501 -20.940 1.00 0.00 C ATOM 666 C ARG A 46 -6.456 13.659 -22.236 1.00 0.00 C ATOM 667 O ARG A 46 -7.114 12.621 -22.373 1.00 0.00 O ATOM 668 CB ARG A 46 -5.980 13.741 -19.682 1.00 0.00 C ATOM 669 CG ARG A 46 -6.546 12.332 -19.333 1.00 0.00 C ATOM 670 CD ARG A 46 -8.044 12.292 -18.919 1.00 0.00 C ATOM 671 NE ARG A 46 -8.951 12.093 -20.072 1.00 0.00 N ATOM 672 CZ ARG A 46 -10.275 11.860 -19.990 1.00 0.00 C ATOM 673 NH1 ARG A 46 -10.917 11.946 -18.830 1.00 0.00 N ATOM 674 NH2 ARG A 46 -10.956 11.567 -21.090 1.00 0.00 N ATOM 0 H ARG A 46 -8.418 14.523 -19.992 1.00 0.00 H new ATOM 0 HA ARG A 46 -5.890 15.368 -21.053 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -4.903 13.639 -19.813 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -6.136 14.382 -18.814 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -6.409 11.681 -20.197 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -5.952 11.913 -18.521 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.196 11.488 -18.199 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -8.302 13.224 -18.415 1.00 0.00 H new ATOM 0 HE ARG A 46 -8.540 12.136 -21.004 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -10.407 12.192 -17.982 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -11.920 11.766 -18.788 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -10.477 11.520 -21.989 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -11.959 11.389 -21.037 1.00 0.00 H new ATOM 688 N GLU A 47 -5.679 14.165 -23.201 1.00 0.00 N ATOM 689 CA GLU A 47 -5.498 13.547 -24.520 1.00 0.00 C ATOM 690 C GLU A 47 -4.273 12.623 -24.500 1.00 0.00 C ATOM 691 O GLU A 47 -3.254 12.959 -23.888 1.00 0.00 O ATOM 692 CB GLU A 47 -5.307 14.653 -25.594 1.00 0.00 C ATOM 693 CG GLU A 47 -5.135 14.128 -27.036 1.00 0.00 C ATOM 694 CD GLU A 47 -4.763 15.226 -28.049 1.00 0.00 C ATOM 695 OE1 GLU A 47 -5.663 15.781 -28.711 1.00 0.00 O ATOM 696 OE2 GLU A 47 -3.562 15.533 -28.186 1.00 0.00 O ATOM 0 H GLU A 47 -5.150 15.029 -23.085 1.00 0.00 H new ATOM 0 HA GLU A 47 -6.382 12.959 -24.764 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -6.168 15.321 -25.565 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -4.432 15.248 -25.332 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.362 13.360 -27.045 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -6.062 13.651 -27.353 1.00 0.00 H new ATOM 703 N PHE A 48 -4.382 11.477 -25.189 1.00 0.00 N ATOM 704 CA PHE A 48 -3.315 10.465 -25.236 1.00 0.00 C ATOM 705 C PHE A 48 -2.209 10.925 -26.213 1.00 0.00 C ATOM 706 O PHE A 48 -2.458 11.084 -27.412 1.00 0.00 O ATOM 707 CB PHE A 48 -3.899 9.070 -25.650 1.00 0.00 C ATOM 708 CG PHE A 48 -3.305 7.862 -24.915 1.00 0.00 C ATOM 709 CD1 PHE A 48 -4.069 6.708 -24.699 1.00 0.00 C ATOM 710 CD2 PHE A 48 -2.000 7.881 -24.420 1.00 0.00 C ATOM 711 CE1 PHE A 48 -3.548 5.624 -24.016 1.00 0.00 C ATOM 712 CE2 PHE A 48 -1.485 6.799 -23.741 1.00 0.00 C ATOM 713 CZ PHE A 48 -2.255 5.670 -23.538 1.00 0.00 C ATOM 0 H PHE A 48 -5.210 11.226 -25.728 1.00 0.00 H new ATOM 0 HA PHE A 48 -2.876 10.355 -24.244 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -4.976 9.082 -25.482 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.745 8.934 -26.720 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -5.082 6.664 -25.072 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.386 8.756 -24.572 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -4.152 4.743 -23.857 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.473 6.833 -23.365 1.00 0.00 H new ATOM 0 HZ PHE A 48 -1.845 4.824 -23.006 1.00 0.00 H new ATOM 723 N VAL A 49 -1.001 11.150 -25.671 1.00 0.00 N ATOM 724 CA VAL A 49 0.159 11.658 -26.438 1.00 0.00 C ATOM 725 C VAL A 49 1.057 10.494 -26.865 1.00 0.00 C ATOM 726 O VAL A 49 1.272 10.253 -28.063 1.00 0.00 O ATOM 727 CB VAL A 49 1.000 12.687 -25.583 1.00 0.00 C ATOM 728 CG1 VAL A 49 2.181 13.297 -26.394 1.00 0.00 C ATOM 729 CG2 VAL A 49 0.077 13.785 -25.018 1.00 0.00 C ATOM 0 H VAL A 49 -0.796 10.986 -24.685 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.221 12.170 -27.322 1.00 0.00 H new ATOM 0 HB VAL A 49 1.446 12.144 -24.750 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.730 13.998 -25.766 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.850 12.500 -26.718 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.791 13.821 -27.267 1.00 0.00 H new ATOM 0 HG21 VAL A 49 0.666 14.489 -24.430 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.405 14.313 -25.840 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.683 13.330 -24.383 1.00 0.00 H new ATOM 739 N ALA A 50 1.551 9.767 -25.854 1.00 0.00 N ATOM 740 CA ALA A 50 2.521 8.680 -26.018 1.00 0.00 C ATOM 741 C ALA A 50 2.292 7.621 -24.928 1.00 0.00 C ATOM 742 O ALA A 50 1.619 7.901 -23.934 1.00 0.00 O ATOM 743 CB ALA A 50 3.952 9.251 -25.966 1.00 0.00 C ATOM 0 H ALA A 50 1.282 9.922 -24.882 1.00 0.00 H new ATOM 0 HA ALA A 50 2.388 8.200 -26.988 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.671 8.441 -26.088 1.00 0.00 H new ATOM 0 HB2 ALA A 50 4.083 9.977 -26.768 1.00 0.00 H new ATOM 0 HB3 ALA A 50 4.114 9.739 -25.005 1.00 0.00 H new ATOM 749 N ALA A 51 2.845 6.407 -25.113 1.00 0.00 N ATOM 750 CA ALA A 51 2.642 5.299 -24.160 1.00 0.00 C ATOM 751 C ALA A 51 3.752 4.249 -24.248 1.00 0.00 C ATOM 752 O ALA A 51 4.508 4.164 -25.225 1.00 0.00 O ATOM 753 CB ALA A 51 1.263 4.637 -24.361 1.00 0.00 C ATOM 0 H ALA A 51 3.434 6.169 -25.911 1.00 0.00 H new ATOM 0 HA ALA A 51 2.679 5.735 -23.162 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.142 3.824 -23.645 1.00 0.00 H new ATOM 0 HB2 ALA A 51 0.478 5.377 -24.206 1.00 0.00 H new ATOM 0 HB3 ALA A 51 1.194 4.241 -25.374 1.00 0.00 H new ATOM 759 N ILE A 52 3.789 3.418 -23.214 1.00 0.00 N ATOM 760 CA ILE A 52 4.788 2.381 -23.030 1.00 0.00 C ATOM 761 C ILE A 52 4.119 1.029 -23.242 1.00 0.00 C ATOM 762 O ILE A 52 3.174 0.683 -22.520 1.00 0.00 O ATOM 763 CB ILE A 52 5.414 2.502 -21.586 1.00 0.00 C ATOM 764 CG1 ILE A 52 6.178 3.864 -21.465 1.00 0.00 C ATOM 765 CG2 ILE A 52 6.325 1.299 -21.229 1.00 0.00 C ATOM 766 CD1 ILE A 52 6.614 4.242 -20.063 1.00 0.00 C ATOM 0 H ILE A 52 3.103 3.451 -22.460 1.00 0.00 H new ATOM 0 HA ILE A 52 5.599 2.488 -23.750 1.00 0.00 H new ATOM 0 HB ILE A 52 4.602 2.482 -20.859 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.061 3.824 -22.103 1.00 0.00 H new ATOM 0 HG13 ILE A 52 5.538 4.656 -21.854 1.00 0.00 H new ATOM 0 HG21 ILE A 52 6.729 1.434 -20.226 1.00 0.00 H new ATOM 0 HG22 ILE A 52 5.743 0.378 -21.265 1.00 0.00 H new ATOM 0 HG23 ILE A 52 7.145 1.238 -21.945 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.133 5.200 -20.089 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.738 4.321 -19.419 1.00 0.00 H new ATOM 0 HD13 ILE A 52 7.284 3.477 -19.672 1.00 0.00 H new ATOM 778 N ARG A 53 4.583 0.305 -24.284 1.00 0.00 N ATOM 779 CA ARG A 53 4.111 -1.050 -24.591 1.00 0.00 C ATOM 780 C ARG A 53 4.476 -1.985 -23.422 1.00 0.00 C ATOM 781 O ARG A 53 5.618 -2.450 -23.325 1.00 0.00 O ATOM 782 CB ARG A 53 4.711 -1.563 -25.935 1.00 0.00 C ATOM 783 CG ARG A 53 4.239 -2.984 -26.351 1.00 0.00 C ATOM 784 CD ARG A 53 2.724 -3.055 -26.629 1.00 0.00 C ATOM 785 NE ARG A 53 2.261 -4.443 -26.818 1.00 0.00 N ATOM 786 CZ ARG A 53 1.141 -4.814 -27.460 1.00 0.00 C ATOM 787 NH1 ARG A 53 0.403 -3.934 -28.125 1.00 0.00 N ATOM 788 NH2 ARG A 53 0.783 -6.091 -27.463 1.00 0.00 N ATOM 0 H ARG A 53 5.293 0.648 -24.930 1.00 0.00 H new ATOM 0 HA ARG A 53 3.028 -1.036 -24.712 1.00 0.00 H new ATOM 0 HB2 ARG A 53 4.449 -0.861 -26.727 1.00 0.00 H new ATOM 0 HB3 ARG A 53 5.798 -1.564 -25.856 1.00 0.00 H new ATOM 0 HG2 ARG A 53 4.782 -3.295 -27.243 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.492 -3.691 -25.561 1.00 0.00 H new ATOM 0 HD2 ARG A 53 2.182 -2.602 -25.799 1.00 0.00 H new ATOM 0 HD3 ARG A 53 2.491 -2.471 -27.519 1.00 0.00 H new ATOM 0 HE ARG A 53 2.842 -5.185 -26.427 1.00 0.00 H new ATOM 0 HH11 ARG A 53 0.683 -2.954 -28.156 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -0.444 -4.238 -28.605 1.00 0.00 H new ATOM 0 HH21 ARG A 53 1.357 -6.783 -26.980 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -0.066 -6.382 -27.948 1.00 0.00 H new ATOM 802 N TRP A 54 3.494 -2.154 -22.516 1.00 0.00 N ATOM 803 CA TRP A 54 3.606 -2.929 -21.272 1.00 0.00 C ATOM 804 C TRP A 54 4.832 -2.452 -20.441 1.00 0.00 C ATOM 805 O TRP A 54 4.783 -1.371 -19.841 1.00 0.00 O ATOM 806 CB TRP A 54 3.592 -4.461 -21.565 1.00 0.00 C ATOM 807 CG TRP A 54 3.319 -5.331 -20.353 1.00 0.00 C ATOM 808 CD1 TRP A 54 2.116 -5.497 -19.712 1.00 0.00 C ATOM 809 CD2 TRP A 54 4.260 -6.155 -19.652 1.00 0.00 C ATOM 810 NE1 TRP A 54 2.260 -6.370 -18.665 1.00 0.00 N ATOM 811 CE2 TRP A 54 3.566 -6.785 -18.605 1.00 0.00 C ATOM 812 CE3 TRP A 54 5.619 -6.425 -19.818 1.00 0.00 C ATOM 813 CZ2 TRP A 54 4.194 -7.656 -17.719 1.00 0.00 C ATOM 814 CZ3 TRP A 54 6.241 -7.288 -18.937 1.00 0.00 C ATOM 815 CH2 TRP A 54 5.527 -7.899 -17.903 1.00 0.00 C ATOM 0 H TRP A 54 2.570 -1.739 -22.637 1.00 0.00 H new ATOM 0 HA TRP A 54 2.731 -2.744 -20.649 1.00 0.00 H new ATOM 0 HB2 TRP A 54 2.835 -4.666 -22.322 1.00 0.00 H new ATOM 0 HB3 TRP A 54 4.554 -4.745 -21.991 1.00 0.00 H new ATOM 0 HD1 TRP A 54 1.193 -5.011 -19.991 1.00 0.00 H new ATOM 0 HE1 TRP A 54 1.516 -6.664 -18.032 1.00 0.00 H new ATOM 0 HE3 TRP A 54 6.175 -5.967 -20.622 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 3.647 -8.124 -16.914 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 7.295 -7.494 -19.049 1.00 0.00 H new ATOM 0 HH2 TRP A 54 6.038 -8.577 -17.236 1.00 0.00 H new ATOM 826 N SER A 55 5.958 -3.183 -20.493 1.00 0.00 N ATOM 827 CA SER A 55 7.157 -2.849 -19.704 1.00 0.00 C ATOM 828 C SER A 55 8.399 -3.363 -20.456 1.00 0.00 C ATOM 829 O SER A 55 8.631 -4.576 -20.531 1.00 0.00 O ATOM 830 CB SER A 55 7.064 -3.459 -18.273 1.00 0.00 C ATOM 831 OG SER A 55 8.114 -3.003 -17.439 1.00 0.00 O ATOM 0 H SER A 55 6.063 -4.013 -21.076 1.00 0.00 H new ATOM 0 HA SER A 55 7.233 -1.768 -19.584 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.105 -3.196 -17.827 1.00 0.00 H new ATOM 0 HB3 SER A 55 7.097 -4.547 -18.338 1.00 0.00 H new ATOM 0 HG SER A 55 8.023 -3.404 -16.550 1.00 0.00 H new ATOM 837 N GLY A 56 9.164 -2.426 -21.045 1.00 0.00 N ATOM 838 CA GLY A 56 10.345 -2.748 -21.860 1.00 0.00 C ATOM 839 C GLY A 56 10.112 -2.490 -23.350 1.00 0.00 C ATOM 840 O GLY A 56 11.075 -2.334 -24.108 1.00 0.00 O ATOM 0 H GLY A 56 8.979 -1.426 -20.968 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.192 -2.153 -21.519 1.00 0.00 H new ATOM 0 HA3 GLY A 56 10.611 -3.795 -21.712 1.00 0.00 H new ATOM 844 N GLY A 57 8.829 -2.436 -23.767 1.00 0.00 N ATOM 845 CA GLY A 57 8.461 -2.049 -25.140 1.00 0.00 C ATOM 846 C GLY A 57 8.660 -0.553 -25.364 1.00 0.00 C ATOM 847 O GLY A 57 9.467 -0.144 -26.210 1.00 0.00 O ATOM 0 H GLY A 57 8.032 -2.656 -23.170 1.00 0.00 H new ATOM 0 HA2 GLY A 57 9.065 -2.610 -25.853 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.420 -2.312 -25.328 1.00 0.00 H new ATOM 851 N SER A 58 7.901 0.239 -24.584 1.00 0.00 N ATOM 852 CA SER A 58 8.100 1.693 -24.416 1.00 0.00 C ATOM 853 C SER A 58 8.094 2.476 -25.753 1.00 0.00 C ATOM 854 O SER A 58 9.060 3.171 -26.079 1.00 0.00 O ATOM 855 CB SER A 58 9.379 1.956 -23.568 1.00 0.00 C ATOM 856 OG SER A 58 9.441 3.301 -23.148 1.00 0.00 O ATOM 0 H SER A 58 7.116 -0.120 -24.041 1.00 0.00 H new ATOM 0 HA SER A 58 7.240 2.083 -23.872 1.00 0.00 H new ATOM 0 HB2 SER A 58 9.384 1.299 -22.698 1.00 0.00 H new ATOM 0 HB3 SER A 58 10.265 1.714 -24.155 1.00 0.00 H new ATOM 0 HG SER A 58 9.806 3.853 -23.871 1.00 0.00 H new ATOM 862 N THR A 59 6.963 2.396 -26.488 1.00 0.00 N ATOM 863 CA THR A 59 6.803 3.021 -27.820 1.00 0.00 C ATOM 864 C THR A 59 5.307 3.049 -28.202 1.00 0.00 C ATOM 865 O THR A 59 4.679 1.997 -28.341 1.00 0.00 O ATOM 866 CB THR A 59 7.635 2.271 -28.945 1.00 0.00 C ATOM 867 OG1 THR A 59 7.831 0.894 -28.580 1.00 0.00 O ATOM 868 CG2 THR A 59 9.003 2.933 -29.237 1.00 0.00 C ATOM 0 H THR A 59 6.132 1.894 -26.173 1.00 0.00 H new ATOM 0 HA THR A 59 7.193 4.037 -27.755 1.00 0.00 H new ATOM 0 HB THR A 59 7.048 2.339 -29.861 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.473 0.839 -27.842 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.520 2.371 -30.015 1.00 0.00 H new ATOM 0 HG22 THR A 59 8.847 3.958 -29.573 1.00 0.00 H new ATOM 0 HG23 THR A 59 9.607 2.936 -28.329 1.00 0.00 H new ATOM 876 N TYR A 60 4.790 4.278 -28.366 1.00 0.00 N ATOM 877 CA TYR A 60 3.429 4.622 -28.846 1.00 0.00 C ATOM 878 C TYR A 60 3.431 6.138 -29.064 1.00 0.00 C ATOM 879 O TYR A 60 3.854 6.873 -28.171 1.00 0.00 O ATOM 880 CB TYR A 60 2.280 4.245 -27.853 1.00 0.00 C ATOM 881 CG TYR A 60 1.779 2.792 -27.923 1.00 0.00 C ATOM 882 CD1 TYR A 60 1.186 2.297 -29.087 1.00 0.00 C ATOM 883 CD2 TYR A 60 1.864 1.929 -26.819 1.00 0.00 C ATOM 884 CE1 TYR A 60 0.711 1.004 -29.154 1.00 0.00 C ATOM 885 CE2 TYR A 60 1.388 0.632 -26.891 1.00 0.00 C ATOM 886 CZ TYR A 60 0.812 0.179 -28.056 1.00 0.00 C ATOM 887 OH TYR A 60 0.329 -1.107 -28.121 1.00 0.00 O ATOM 0 H TYR A 60 5.339 5.112 -28.156 1.00 0.00 H new ATOM 0 HA TYR A 60 3.225 4.049 -29.750 1.00 0.00 H new ATOM 0 HB2 TYR A 60 2.625 4.441 -26.838 1.00 0.00 H new ATOM 0 HB3 TYR A 60 1.435 4.909 -28.037 1.00 0.00 H new ATOM 0 HD1 TYR A 60 1.098 2.939 -29.951 1.00 0.00 H new ATOM 0 HD2 TYR A 60 2.307 2.283 -25.900 1.00 0.00 H new ATOM 0 HE1 TYR A 60 0.261 0.639 -30.065 1.00 0.00 H new ATOM 0 HE2 TYR A 60 1.468 -0.023 -26.036 1.00 0.00 H new ATOM 0 HH TYR A 60 0.172 -1.350 -29.057 1.00 0.00 H new ATOM 897 N TYR A 61 3.008 6.587 -30.254 1.00 0.00 N ATOM 898 CA TYR A 61 2.941 8.018 -30.623 1.00 0.00 C ATOM 899 C TYR A 61 2.081 8.188 -31.885 1.00 0.00 C ATOM 900 O TYR A 61 2.061 7.305 -32.754 1.00 0.00 O ATOM 901 CB TYR A 61 4.377 8.649 -30.818 1.00 0.00 C ATOM 902 CG TYR A 61 5.471 7.650 -31.239 1.00 0.00 C ATOM 903 CD1 TYR A 61 5.457 7.042 -32.496 1.00 0.00 C ATOM 904 CD2 TYR A 61 6.512 7.298 -30.366 1.00 0.00 C ATOM 905 CE1 TYR A 61 6.419 6.112 -32.858 1.00 0.00 C ATOM 906 CE2 TYR A 61 7.480 6.377 -30.727 1.00 0.00 C ATOM 907 CZ TYR A 61 7.431 5.789 -31.974 1.00 0.00 C ATOM 908 OH TYR A 61 8.381 4.851 -32.326 1.00 0.00 O ATOM 0 H TYR A 61 2.698 5.964 -31.000 1.00 0.00 H new ATOM 0 HA TYR A 61 2.474 8.560 -29.800 1.00 0.00 H new ATOM 0 HB2 TYR A 61 4.314 9.435 -31.571 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.679 9.125 -29.885 1.00 0.00 H new ATOM 0 HD1 TYR A 61 4.681 7.302 -33.201 1.00 0.00 H new ATOM 0 HD2 TYR A 61 6.559 7.757 -29.389 1.00 0.00 H new ATOM 0 HE1 TYR A 61 6.378 5.641 -33.829 1.00 0.00 H new ATOM 0 HE2 TYR A 61 8.269 6.120 -30.036 1.00 0.00 H new ATOM 0 HH TYR A 61 9.021 4.742 -31.592 1.00 0.00 H new ATOM 918 N ALA A 62 1.358 9.321 -31.952 1.00 0.00 N ATOM 919 CA ALA A 62 0.561 9.716 -33.132 1.00 0.00 C ATOM 920 C ALA A 62 1.497 10.173 -34.272 1.00 0.00 C ATOM 921 O ALA A 62 2.615 10.609 -34.003 1.00 0.00 O ATOM 922 CB ALA A 62 -0.426 10.838 -32.750 1.00 0.00 C ATOM 0 H ALA A 62 1.309 9.993 -31.186 1.00 0.00 H new ATOM 0 HA ALA A 62 -0.013 8.858 -33.482 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -1.009 11.123 -33.626 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.096 10.482 -31.968 1.00 0.00 H new ATOM 0 HB3 ALA A 62 0.129 11.703 -32.387 1.00 0.00 H new ATOM 928 N ASP A 63 1.023 10.102 -35.532 1.00 0.00 N ATOM 929 CA ASP A 63 1.828 10.447 -36.730 1.00 0.00 C ATOM 930 C ASP A 63 2.309 11.914 -36.705 1.00 0.00 C ATOM 931 O ASP A 63 3.334 12.246 -37.309 1.00 0.00 O ATOM 932 CB ASP A 63 1.001 10.193 -38.006 1.00 0.00 C ATOM 933 CG ASP A 63 0.505 8.743 -38.110 1.00 0.00 C ATOM 934 OD1 ASP A 63 1.213 7.891 -38.699 1.00 0.00 O ATOM 935 OD2 ASP A 63 -0.581 8.434 -37.569 1.00 0.00 O ATOM 0 H ASP A 63 0.072 9.805 -35.752 1.00 0.00 H new ATOM 0 HA ASP A 63 2.712 9.810 -36.725 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.145 10.868 -38.020 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.607 10.429 -38.880 1.00 0.00 H new ATOM 940 N SER A 64 1.546 12.779 -36.007 1.00 0.00 N ATOM 941 CA SER A 64 1.885 14.205 -35.817 1.00 0.00 C ATOM 942 C SER A 64 3.165 14.363 -34.974 1.00 0.00 C ATOM 943 O SER A 64 4.012 15.211 -35.260 1.00 0.00 O ATOM 944 CB SER A 64 0.705 14.926 -35.124 1.00 0.00 C ATOM 945 OG SER A 64 0.954 16.316 -34.936 1.00 0.00 O ATOM 0 H SER A 64 0.672 12.507 -35.556 1.00 0.00 H new ATOM 0 HA SER A 64 2.067 14.652 -36.794 1.00 0.00 H new ATOM 0 HB2 SER A 64 -0.197 14.799 -35.722 1.00 0.00 H new ATOM 0 HB3 SER A 64 0.515 14.460 -34.157 1.00 0.00 H new ATOM 0 HG SER A 64 0.182 16.730 -34.497 1.00 0.00 H new ATOM 951 N VAL A 65 3.299 13.502 -33.950 1.00 0.00 N ATOM 952 CA VAL A 65 4.395 13.565 -32.957 1.00 0.00 C ATOM 953 C VAL A 65 5.338 12.339 -33.081 1.00 0.00 C ATOM 954 O VAL A 65 6.194 12.117 -32.212 1.00 0.00 O ATOM 955 CB VAL A 65 3.799 13.666 -31.495 1.00 0.00 C ATOM 956 CG1 VAL A 65 2.964 14.963 -31.320 1.00 0.00 C ATOM 957 CG2 VAL A 65 2.968 12.409 -31.127 1.00 0.00 C ATOM 0 H VAL A 65 2.647 12.736 -33.784 1.00 0.00 H new ATOM 0 HA VAL A 65 4.987 14.458 -33.158 1.00 0.00 H new ATOM 0 HB VAL A 65 4.639 13.713 -30.803 1.00 0.00 H new ATOM 0 HG11 VAL A 65 2.567 15.006 -30.306 1.00 0.00 H new ATOM 0 HG12 VAL A 65 3.599 15.831 -31.498 1.00 0.00 H new ATOM 0 HG13 VAL A 65 2.140 14.964 -32.033 1.00 0.00 H new ATOM 0 HG21 VAL A 65 2.575 12.516 -30.116 1.00 0.00 H new ATOM 0 HG22 VAL A 65 2.140 12.302 -31.828 1.00 0.00 H new ATOM 0 HG23 VAL A 65 3.604 11.525 -31.178 1.00 0.00 H new ATOM 967 N LYS A 66 5.185 11.580 -34.188 1.00 0.00 N ATOM 968 CA LYS A 66 5.889 10.301 -34.421 1.00 0.00 C ATOM 969 C LYS A 66 7.392 10.531 -34.589 1.00 0.00 C ATOM 970 O LYS A 66 7.816 11.276 -35.479 1.00 0.00 O ATOM 971 CB LYS A 66 5.274 9.581 -35.664 1.00 0.00 C ATOM 972 CG LYS A 66 5.829 8.156 -35.990 1.00 0.00 C ATOM 973 CD LYS A 66 7.043 8.142 -36.950 1.00 0.00 C ATOM 974 CE LYS A 66 6.697 8.662 -38.354 1.00 0.00 C ATOM 975 NZ LYS A 66 7.881 8.689 -39.241 1.00 0.00 N ATOM 0 H LYS A 66 4.563 11.841 -34.953 1.00 0.00 H new ATOM 0 HA LYS A 66 5.758 9.656 -33.552 1.00 0.00 H new ATOM 0 HB2 LYS A 66 4.197 9.502 -35.514 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.429 10.215 -36.537 1.00 0.00 H new ATOM 0 HG2 LYS A 66 6.114 7.669 -35.057 1.00 0.00 H new ATOM 0 HG3 LYS A 66 5.029 7.560 -36.429 1.00 0.00 H new ATOM 0 HD2 LYS A 66 7.841 8.752 -36.528 1.00 0.00 H new ATOM 0 HD3 LYS A 66 7.427 7.125 -37.028 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.927 8.029 -38.796 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.279 9.666 -38.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 7.605 9.046 -40.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 8.606 9.313 -38.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 8.265 7.727 -39.336 1.00 0.00 H new ATOM 989 N GLY A 67 8.184 9.899 -33.709 1.00 0.00 N ATOM 990 CA GLY A 67 9.645 9.970 -33.758 1.00 0.00 C ATOM 991 C GLY A 67 10.218 11.169 -33.002 1.00 0.00 C ATOM 992 O GLY A 67 11.345 11.103 -32.500 1.00 0.00 O ATOM 0 H GLY A 67 7.826 9.326 -32.945 1.00 0.00 H new ATOM 0 HA2 GLY A 67 10.061 9.053 -33.340 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.965 10.019 -34.799 1.00 0.00 H new ATOM 996 N ARG A 68 9.438 12.268 -32.916 1.00 0.00 N ATOM 997 CA ARG A 68 9.848 13.489 -32.200 1.00 0.00 C ATOM 998 C ARG A 68 9.680 13.260 -30.693 1.00 0.00 C ATOM 999 O ARG A 68 10.618 13.419 -29.906 1.00 0.00 O ATOM 1000 CB ARG A 68 9.001 14.719 -32.633 1.00 0.00 C ATOM 1001 CG ARG A 68 8.751 14.877 -34.146 1.00 0.00 C ATOM 1002 CD ARG A 68 8.186 16.275 -34.516 1.00 0.00 C ATOM 1003 NE ARG A 68 7.245 16.818 -33.498 1.00 0.00 N ATOM 1004 CZ ARG A 68 6.050 17.375 -33.751 1.00 0.00 C ATOM 1005 NH1 ARG A 68 5.568 17.433 -34.981 1.00 0.00 N ATOM 1006 NH2 ARG A 68 5.337 17.880 -32.756 1.00 0.00 N ATOM 0 H ARG A 68 8.512 12.331 -33.339 1.00 0.00 H new ATOM 0 HA ARG A 68 10.890 13.698 -32.444 1.00 0.00 H new ATOM 0 HB2 ARG A 68 8.035 14.664 -32.131 1.00 0.00 H new ATOM 0 HB3 ARG A 68 9.497 15.620 -32.272 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.685 14.713 -34.684 1.00 0.00 H new ATOM 0 HG3 ARG A 68 8.053 14.108 -34.477 1.00 0.00 H new ATOM 0 HD2 ARG A 68 9.014 16.972 -34.643 1.00 0.00 H new ATOM 0 HD3 ARG A 68 7.674 16.210 -35.476 1.00 0.00 H new ATOM 0 HE ARG A 68 7.534 16.762 -32.521 1.00 0.00 H new ATOM 0 HH11 ARG A 68 6.106 17.050 -35.758 1.00 0.00 H new ATOM 0 HH12 ARG A 68 4.658 17.860 -35.152 1.00 0.00 H new ATOM 0 HH21 ARG A 68 5.696 17.845 -31.802 1.00 0.00 H new ATOM 0 HH22 ARG A 68 4.429 18.304 -32.944 1.00 0.00 H new ATOM 1020 N PHE A 69 8.451 12.881 -30.318 1.00 0.00 N ATOM 1021 CA PHE A 69 8.110 12.521 -28.945 1.00 0.00 C ATOM 1022 C PHE A 69 8.460 11.044 -28.751 1.00 0.00 C ATOM 1023 O PHE A 69 7.951 10.173 -29.461 1.00 0.00 O ATOM 1024 CB PHE A 69 6.603 12.779 -28.662 1.00 0.00 C ATOM 1025 CG PHE A 69 6.184 14.258 -28.623 1.00 0.00 C ATOM 1026 CD1 PHE A 69 6.519 15.136 -29.659 1.00 0.00 C ATOM 1027 CD2 PHE A 69 5.424 14.764 -27.563 1.00 0.00 C ATOM 1028 CE1 PHE A 69 6.117 16.456 -29.636 1.00 0.00 C ATOM 1029 CE2 PHE A 69 5.026 16.088 -27.541 1.00 0.00 C ATOM 1030 CZ PHE A 69 5.370 16.932 -28.578 1.00 0.00 C ATOM 0 H PHE A 69 7.665 12.817 -30.965 1.00 0.00 H new ATOM 0 HA PHE A 69 8.673 13.135 -28.243 1.00 0.00 H new ATOM 0 HB2 PHE A 69 6.015 12.272 -29.427 1.00 0.00 H new ATOM 0 HB3 PHE A 69 6.346 12.321 -27.707 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.103 14.774 -30.492 1.00 0.00 H new ATOM 0 HD2 PHE A 69 5.144 14.111 -26.750 1.00 0.00 H new ATOM 0 HE1 PHE A 69 6.387 17.117 -30.446 1.00 0.00 H new ATOM 0 HE2 PHE A 69 4.445 16.463 -26.711 1.00 0.00 H new ATOM 0 HZ PHE A 69 5.054 17.965 -28.561 1.00 0.00 H new ATOM 1040 N THR A 70 9.352 10.789 -27.798 1.00 0.00 N ATOM 1041 CA THR A 70 9.885 9.465 -27.504 1.00 0.00 C ATOM 1042 C THR A 70 9.745 9.221 -26.001 1.00 0.00 C ATOM 1043 O THR A 70 9.983 10.126 -25.197 1.00 0.00 O ATOM 1044 CB THR A 70 11.391 9.361 -27.929 1.00 0.00 C ATOM 1045 OG1 THR A 70 11.533 9.773 -29.302 1.00 0.00 O ATOM 1046 CG2 THR A 70 11.950 7.933 -27.754 1.00 0.00 C ATOM 0 H THR A 70 9.733 11.517 -27.194 1.00 0.00 H new ATOM 0 HA THR A 70 9.331 8.713 -28.066 1.00 0.00 H new ATOM 0 HB THR A 70 11.965 10.019 -27.276 1.00 0.00 H new ATOM 0 HG1 THR A 70 12.474 9.710 -29.567 1.00 0.00 H new ATOM 0 HG21 THR A 70 12.996 7.911 -28.061 1.00 0.00 H new ATOM 0 HG22 THR A 70 11.873 7.638 -26.708 1.00 0.00 H new ATOM 0 HG23 THR A 70 11.377 7.240 -28.370 1.00 0.00 H new ATOM 1054 N ILE A 71 9.338 8.007 -25.632 1.00 0.00 N ATOM 1055 CA ILE A 71 9.180 7.596 -24.235 1.00 0.00 C ATOM 1056 C ILE A 71 10.168 6.472 -23.935 1.00 0.00 C ATOM 1057 O ILE A 71 10.447 5.631 -24.796 1.00 0.00 O ATOM 1058 CB ILE A 71 7.706 7.148 -23.880 1.00 0.00 C ATOM 1059 CG1 ILE A 71 7.166 6.003 -24.805 1.00 0.00 C ATOM 1060 CG2 ILE A 71 6.756 8.358 -23.900 1.00 0.00 C ATOM 1061 CD1 ILE A 71 6.725 6.414 -26.209 1.00 0.00 C ATOM 0 H ILE A 71 9.106 7.273 -26.301 1.00 0.00 H new ATOM 0 HA ILE A 71 9.388 8.464 -23.610 1.00 0.00 H new ATOM 0 HB ILE A 71 7.742 6.734 -22.872 1.00 0.00 H new ATOM 0 HG12 ILE A 71 7.944 5.245 -24.899 1.00 0.00 H new ATOM 0 HG13 ILE A 71 6.320 5.531 -24.306 1.00 0.00 H new ATOM 0 HG21 ILE A 71 5.746 8.031 -23.653 1.00 0.00 H new ATOM 0 HG22 ILE A 71 7.088 9.094 -23.168 1.00 0.00 H new ATOM 0 HG23 ILE A 71 6.760 8.807 -24.893 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.372 5.537 -26.751 1.00 0.00 H new ATOM 0 HD12 ILE A 71 5.919 7.145 -26.138 1.00 0.00 H new ATOM 0 HD13 ILE A 71 7.568 6.854 -26.741 1.00 0.00 H new ATOM 1073 N SER A 72 10.726 6.491 -22.727 1.00 0.00 N ATOM 1074 CA SER A 72 11.664 5.478 -22.252 1.00 0.00 C ATOM 1075 C SER A 72 11.302 5.125 -20.811 1.00 0.00 C ATOM 1076 O SER A 72 11.070 6.014 -19.997 1.00 0.00 O ATOM 1077 CB SER A 72 13.108 6.017 -22.339 1.00 0.00 C ATOM 1078 OG SER A 72 13.444 6.380 -23.675 1.00 0.00 O ATOM 0 H SER A 72 10.536 7.221 -22.041 1.00 0.00 H new ATOM 0 HA SER A 72 11.602 4.583 -22.871 1.00 0.00 H new ATOM 0 HB2 SER A 72 13.215 6.883 -21.686 1.00 0.00 H new ATOM 0 HB3 SER A 72 13.804 5.259 -21.980 1.00 0.00 H new ATOM 0 HG SER A 72 14.363 6.719 -23.700 1.00 0.00 H new ATOM 1084 N ARG A 73 11.243 3.828 -20.507 1.00 0.00 N ATOM 1085 CA ARG A 73 10.965 3.339 -19.152 1.00 0.00 C ATOM 1086 C ARG A 73 12.201 2.600 -18.647 1.00 0.00 C ATOM 1087 O ARG A 73 12.652 1.638 -19.276 1.00 0.00 O ATOM 1088 CB ARG A 73 9.732 2.400 -19.159 1.00 0.00 C ATOM 1089 CG ARG A 73 9.317 1.853 -17.773 1.00 0.00 C ATOM 1090 CD ARG A 73 8.046 0.991 -17.835 1.00 0.00 C ATOM 1091 NE ARG A 73 7.690 0.441 -16.517 1.00 0.00 N ATOM 1092 CZ ARG A 73 6.565 -0.242 -16.235 1.00 0.00 C ATOM 1093 NH1 ARG A 73 5.623 -0.434 -17.157 1.00 0.00 N ATOM 1094 NH2 ARG A 73 6.393 -0.731 -15.018 1.00 0.00 N ATOM 0 H ARG A 73 11.386 3.085 -21.191 1.00 0.00 H new ATOM 0 HA ARG A 73 10.739 4.176 -18.491 1.00 0.00 H new ATOM 0 HB2 ARG A 73 8.887 2.938 -19.588 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.940 1.557 -19.818 1.00 0.00 H new ATOM 0 HG2 ARG A 73 10.134 1.261 -17.361 1.00 0.00 H new ATOM 0 HG3 ARG A 73 9.153 2.688 -17.091 1.00 0.00 H new ATOM 0 HD2 ARG A 73 7.219 1.591 -18.213 1.00 0.00 H new ATOM 0 HD3 ARG A 73 8.196 0.174 -18.541 1.00 0.00 H new ATOM 0 HE ARG A 73 8.351 0.590 -15.754 1.00 0.00 H new ATOM 0 HH11 ARG A 73 5.747 -0.060 -18.098 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.778 -0.955 -16.922 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.109 -0.589 -14.305 1.00 0.00 H new ATOM 0 HH22 ARG A 73 5.545 -1.250 -14.792 1.00 0.00 H new ATOM 1108 N ASP A 74 12.737 3.057 -17.511 1.00 0.00 N ATOM 1109 CA ASP A 74 13.931 2.474 -16.892 1.00 0.00 C ATOM 1110 C ASP A 74 13.585 2.034 -15.468 1.00 0.00 C ATOM 1111 O ASP A 74 13.684 2.816 -14.509 1.00 0.00 O ATOM 1112 CB ASP A 74 15.097 3.494 -16.902 1.00 0.00 C ATOM 1113 CG ASP A 74 15.500 3.937 -18.322 1.00 0.00 C ATOM 1114 OD1 ASP A 74 16.324 3.250 -18.963 1.00 0.00 O ATOM 1115 OD2 ASP A 74 14.997 4.976 -18.806 1.00 0.00 O ATOM 0 H ASP A 74 12.352 3.846 -16.992 1.00 0.00 H new ATOM 0 HA ASP A 74 14.257 1.603 -17.461 1.00 0.00 H new ATOM 0 HB2 ASP A 74 14.810 4.371 -16.322 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.962 3.053 -16.406 1.00 0.00 H new ATOM 1120 N ASN A 75 13.151 0.771 -15.358 1.00 0.00 N ATOM 1121 CA ASN A 75 12.720 0.153 -14.094 1.00 0.00 C ATOM 1122 C ASN A 75 13.933 -0.075 -13.141 1.00 0.00 C ATOM 1123 O ASN A 75 13.756 -0.342 -11.952 1.00 0.00 O ATOM 1124 CB ASN A 75 12.000 -1.194 -14.403 1.00 0.00 C ATOM 1125 CG ASN A 75 11.263 -1.790 -13.202 1.00 0.00 C ATOM 1126 OD1 ASN A 75 10.667 -1.060 -12.406 1.00 0.00 O ATOM 1127 ND2 ASN A 75 11.313 -3.108 -13.053 1.00 0.00 N ATOM 0 H ASN A 75 13.088 0.139 -16.156 1.00 0.00 H new ATOM 0 HA ASN A 75 12.028 0.825 -13.587 1.00 0.00 H new ATOM 0 HB2 ASN A 75 11.288 -1.037 -15.213 1.00 0.00 H new ATOM 0 HB3 ASN A 75 12.735 -1.915 -14.760 1.00 0.00 H new ATOM 0 HD21 ASN A 75 10.849 -3.550 -12.259 1.00 0.00 H new ATOM 0 HD22 ASN A 75 11.816 -3.679 -13.732 1.00 0.00 H new ATOM 1134 N ALA A 76 15.163 0.050 -13.695 1.00 0.00 N ATOM 1135 CA ALA A 76 16.434 -0.061 -12.942 1.00 0.00 C ATOM 1136 C ALA A 76 16.494 0.933 -11.756 1.00 0.00 C ATOM 1137 O ALA A 76 16.920 0.573 -10.653 1.00 0.00 O ATOM 1138 CB ALA A 76 17.619 0.146 -13.900 1.00 0.00 C ATOM 0 H ALA A 76 15.301 0.233 -14.689 1.00 0.00 H new ATOM 0 HA ALA A 76 16.491 -1.061 -12.513 1.00 0.00 H new ATOM 0 HB1 ALA A 76 18.554 0.064 -13.345 1.00 0.00 H new ATOM 0 HB2 ALA A 76 17.593 -0.614 -14.681 1.00 0.00 H new ATOM 0 HB3 ALA A 76 17.552 1.135 -14.354 1.00 0.00 H new ATOM 1144 N LYS A 77 16.067 2.188 -12.001 1.00 0.00 N ATOM 1145 CA LYS A 77 15.927 3.214 -10.937 1.00 0.00 C ATOM 1146 C LYS A 77 14.464 3.692 -10.826 1.00 0.00 C ATOM 1147 O LYS A 77 14.178 4.694 -10.153 1.00 0.00 O ATOM 1148 CB LYS A 77 16.896 4.414 -11.158 1.00 0.00 C ATOM 1149 CG LYS A 77 16.704 5.229 -12.462 1.00 0.00 C ATOM 1150 CD LYS A 77 17.328 4.566 -13.711 1.00 0.00 C ATOM 1151 CE LYS A 77 17.216 5.455 -14.961 1.00 0.00 C ATOM 1152 NZ LYS A 77 17.933 6.753 -14.816 1.00 0.00 N ATOM 0 H LYS A 77 15.811 2.521 -12.930 1.00 0.00 H new ATOM 0 HA LYS A 77 16.206 2.747 -9.992 1.00 0.00 H new ATOM 0 HB2 LYS A 77 16.794 5.095 -10.313 1.00 0.00 H new ATOM 0 HB3 LYS A 77 17.918 4.035 -11.140 1.00 0.00 H new ATOM 0 HG2 LYS A 77 15.638 5.375 -12.634 1.00 0.00 H new ATOM 0 HG3 LYS A 77 17.144 6.218 -12.329 1.00 0.00 H new ATOM 0 HD2 LYS A 77 18.378 4.347 -13.517 1.00 0.00 H new ATOM 0 HD3 LYS A 77 16.833 3.613 -13.900 1.00 0.00 H new ATOM 0 HE2 LYS A 77 17.618 4.918 -15.820 1.00 0.00 H new ATOM 0 HE3 LYS A 77 16.164 5.648 -15.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 17.252 7.536 -14.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 18.405 6.787 -13.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 18.643 6.844 -15.570 1.00 0.00 H new ATOM 1166 N ASN A 78 13.554 2.950 -11.499 1.00 0.00 N ATOM 1167 CA ASN A 78 12.085 3.157 -11.446 1.00 0.00 C ATOM 1168 C ASN A 78 11.672 4.533 -12.010 1.00 0.00 C ATOM 1169 O ASN A 78 10.623 5.077 -11.647 1.00 0.00 O ATOM 1170 CB ASN A 78 11.560 2.944 -9.993 1.00 0.00 C ATOM 1171 CG ASN A 78 11.888 1.557 -9.425 1.00 0.00 C ATOM 1172 OD1 ASN A 78 12.210 1.412 -8.250 1.00 0.00 O ATOM 1173 ND2 ASN A 78 11.769 0.517 -10.232 1.00 0.00 N ATOM 0 H ASN A 78 13.824 2.176 -12.106 1.00 0.00 H new ATOM 0 HA ASN A 78 11.618 2.411 -12.089 1.00 0.00 H new ATOM 0 HB2 ASN A 78 11.991 3.706 -9.343 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.480 3.088 -9.980 1.00 0.00 H new ATOM 0 HD21 ASN A 78 11.946 -0.424 -9.881 1.00 0.00 H new ATOM 0 HD22 ASN A 78 11.500 0.656 -11.206 1.00 0.00 H new ATOM 1180 N THR A 79 12.477 5.057 -12.953 1.00 0.00 N ATOM 1181 CA THR A 79 12.274 6.388 -13.537 1.00 0.00 C ATOM 1182 C THR A 79 11.923 6.267 -15.038 1.00 0.00 C ATOM 1183 O THR A 79 12.585 5.545 -15.792 1.00 0.00 O ATOM 1184 CB THR A 79 13.547 7.283 -13.350 1.00 0.00 C ATOM 1185 OG1 THR A 79 13.981 7.238 -11.975 1.00 0.00 O ATOM 1186 CG2 THR A 79 13.279 8.748 -13.742 1.00 0.00 C ATOM 0 H THR A 79 13.287 4.565 -13.330 1.00 0.00 H new ATOM 0 HA THR A 79 11.443 6.864 -13.016 1.00 0.00 H new ATOM 0 HB THR A 79 14.323 6.888 -14.006 1.00 0.00 H new ATOM 0 HG1 THR A 79 14.778 7.798 -11.865 1.00 0.00 H new ATOM 0 HG21 THR A 79 14.186 9.335 -13.598 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.979 8.795 -14.789 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.482 9.152 -13.117 1.00 0.00 H new ATOM 1194 N VAL A 80 10.867 6.982 -15.432 1.00 0.00 N ATOM 1195 CA VAL A 80 10.362 7.064 -16.804 1.00 0.00 C ATOM 1196 C VAL A 80 10.676 8.466 -17.371 1.00 0.00 C ATOM 1197 O VAL A 80 10.764 9.440 -16.616 1.00 0.00 O ATOM 1198 CB VAL A 80 8.810 6.795 -16.824 1.00 0.00 C ATOM 1199 CG1 VAL A 80 8.218 6.890 -18.250 1.00 0.00 C ATOM 1200 CG2 VAL A 80 8.488 5.423 -16.177 1.00 0.00 C ATOM 0 H VAL A 80 10.319 7.541 -14.778 1.00 0.00 H new ATOM 0 HA VAL A 80 10.847 6.309 -17.422 1.00 0.00 H new ATOM 0 HB VAL A 80 8.336 7.579 -16.233 1.00 0.00 H new ATOM 0 HG11 VAL A 80 7.146 6.697 -18.212 1.00 0.00 H new ATOM 0 HG12 VAL A 80 8.393 7.888 -18.651 1.00 0.00 H new ATOM 0 HG13 VAL A 80 8.697 6.152 -18.893 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.411 5.254 -16.199 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.991 4.632 -16.732 1.00 0.00 H new ATOM 0 HG23 VAL A 80 8.835 5.418 -15.144 1.00 0.00 H new ATOM 1210 N TYR A 81 10.873 8.553 -18.697 1.00 0.00 N ATOM 1211 CA TYR A 81 11.254 9.801 -19.387 1.00 0.00 C ATOM 1212 C TYR A 81 10.349 10.047 -20.609 1.00 0.00 C ATOM 1213 O TYR A 81 9.831 9.100 -21.210 1.00 0.00 O ATOM 1214 CB TYR A 81 12.745 9.736 -19.829 1.00 0.00 C ATOM 1215 CG TYR A 81 13.730 9.531 -18.669 1.00 0.00 C ATOM 1216 CD1 TYR A 81 14.098 8.247 -18.249 1.00 0.00 C ATOM 1217 CD2 TYR A 81 14.265 10.617 -17.972 1.00 0.00 C ATOM 1218 CE1 TYR A 81 14.961 8.057 -17.189 1.00 0.00 C ATOM 1219 CE2 TYR A 81 15.136 10.430 -16.915 1.00 0.00 C ATOM 1220 CZ TYR A 81 15.475 9.151 -16.523 1.00 0.00 C ATOM 1221 OH TYR A 81 16.331 8.964 -15.453 1.00 0.00 O ATOM 0 H TYR A 81 10.772 7.756 -19.326 1.00 0.00 H new ATOM 0 HA TYR A 81 11.126 10.631 -18.692 1.00 0.00 H new ATOM 0 HB2 TYR A 81 12.867 8.922 -20.544 1.00 0.00 H new ATOM 0 HB3 TYR A 81 13.000 10.659 -20.350 1.00 0.00 H new ATOM 0 HD1 TYR A 81 13.698 7.387 -18.766 1.00 0.00 H new ATOM 0 HD2 TYR A 81 13.993 11.621 -18.264 1.00 0.00 H new ATOM 0 HE1 TYR A 81 15.233 7.058 -16.882 1.00 0.00 H new ATOM 0 HE2 TYR A 81 15.550 11.283 -16.397 1.00 0.00 H new ATOM 0 HH TYR A 81 16.603 9.835 -15.096 1.00 0.00 H new ATOM 1231 N LEU A 82 10.169 11.334 -20.955 1.00 0.00 N ATOM 1232 CA LEU A 82 9.470 11.776 -22.173 1.00 0.00 C ATOM 1233 C LEU A 82 10.329 12.840 -22.869 1.00 0.00 C ATOM 1234 O LEU A 82 10.382 13.994 -22.433 1.00 0.00 O ATOM 1235 CB LEU A 82 8.059 12.339 -21.837 1.00 0.00 C ATOM 1236 CG LEU A 82 7.262 12.999 -23.014 1.00 0.00 C ATOM 1237 CD1 LEU A 82 6.977 12.004 -24.157 1.00 0.00 C ATOM 1238 CD2 LEU A 82 5.964 13.661 -22.500 1.00 0.00 C ATOM 0 H LEU A 82 10.511 12.108 -20.386 1.00 0.00 H new ATOM 0 HA LEU A 82 9.326 10.924 -22.838 1.00 0.00 H new ATOM 0 HB2 LEU A 82 7.456 11.526 -21.433 1.00 0.00 H new ATOM 0 HB3 LEU A 82 8.169 13.079 -21.044 1.00 0.00 H new ATOM 0 HG LEU A 82 7.895 13.781 -23.434 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.423 12.508 -24.949 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.919 11.629 -24.556 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.387 11.171 -23.775 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.430 14.112 -23.336 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.333 12.907 -22.030 1.00 0.00 H new ATOM 0 HD23 LEU A 82 6.213 14.432 -21.771 1.00 0.00 H new ATOM 1250 N GLN A 83 11.038 12.425 -23.923 1.00 0.00 N ATOM 1251 CA GLN A 83 11.840 13.323 -24.755 1.00 0.00 C ATOM 1252 C GLN A 83 10.945 13.937 -25.841 1.00 0.00 C ATOM 1253 O GLN A 83 10.611 13.288 -26.834 1.00 0.00 O ATOM 1254 CB GLN A 83 13.043 12.566 -25.388 1.00 0.00 C ATOM 1255 CG GLN A 83 13.970 13.432 -26.277 1.00 0.00 C ATOM 1256 CD GLN A 83 14.597 14.628 -25.543 1.00 0.00 C ATOM 1257 OE1 GLN A 83 15.670 14.516 -24.954 1.00 0.00 O ATOM 1258 NE2 GLN A 83 13.933 15.780 -25.582 1.00 0.00 N ATOM 0 H GLN A 83 11.071 11.451 -24.224 1.00 0.00 H new ATOM 0 HA GLN A 83 12.247 14.120 -24.134 1.00 0.00 H new ATOM 0 HB2 GLN A 83 13.639 12.128 -24.587 1.00 0.00 H new ATOM 0 HB3 GLN A 83 12.658 11.741 -25.987 1.00 0.00 H new ATOM 0 HG2 GLN A 83 14.767 12.804 -26.674 1.00 0.00 H new ATOM 0 HG3 GLN A 83 13.399 13.800 -27.130 1.00 0.00 H new ATOM 0 HE21 GLN A 83 13.045 15.840 -26.080 1.00 0.00 H new ATOM 0 HE22 GLN A 83 14.312 16.603 -25.114 1.00 0.00 H new ATOM 1267 N MET A 84 10.535 15.183 -25.608 1.00 0.00 N ATOM 1268 CA MET A 84 9.772 15.989 -26.564 1.00 0.00 C ATOM 1269 C MET A 84 10.738 16.645 -27.553 1.00 0.00 C ATOM 1270 O MET A 84 11.812 17.100 -27.155 1.00 0.00 O ATOM 1271 CB MET A 84 9.001 17.108 -25.824 1.00 0.00 C ATOM 1272 CG MET A 84 7.996 16.657 -24.766 1.00 0.00 C ATOM 1273 SD MET A 84 7.294 18.097 -23.929 1.00 0.00 S ATOM 1274 CE MET A 84 5.842 17.419 -23.158 1.00 0.00 C ATOM 0 H MET A 84 10.727 15.671 -24.733 1.00 0.00 H new ATOM 0 HA MET A 84 9.068 15.341 -27.086 1.00 0.00 H new ATOM 0 HB2 MET A 84 9.728 17.765 -25.346 1.00 0.00 H new ATOM 0 HB3 MET A 84 8.471 17.705 -26.566 1.00 0.00 H new ATOM 0 HG2 MET A 84 7.202 16.074 -25.232 1.00 0.00 H new ATOM 0 HG3 MET A 84 8.486 16.007 -24.041 1.00 0.00 H new ATOM 0 HE1 MET A 84 5.246 18.226 -22.732 1.00 0.00 H new ATOM 0 HE2 MET A 84 5.251 16.885 -23.902 1.00 0.00 H new ATOM 0 HE3 MET A 84 6.138 16.730 -22.367 1.00 0.00 H new ATOM 1284 N ASN A 85 10.356 16.683 -28.828 1.00 0.00 N ATOM 1285 CA ASN A 85 11.081 17.433 -29.871 1.00 0.00 C ATOM 1286 C ASN A 85 10.058 18.136 -30.769 1.00 0.00 C ATOM 1287 O ASN A 85 9.021 17.543 -31.101 1.00 0.00 O ATOM 1288 CB ASN A 85 12.013 16.509 -30.707 1.00 0.00 C ATOM 1289 CG ASN A 85 13.248 16.026 -29.943 1.00 0.00 C ATOM 1290 OD1 ASN A 85 14.301 16.664 -29.970 1.00 0.00 O ATOM 1291 ND2 ASN A 85 13.128 14.906 -29.252 1.00 0.00 N ATOM 0 H ASN A 85 9.531 16.194 -29.176 1.00 0.00 H new ATOM 0 HA ASN A 85 11.724 18.172 -29.393 1.00 0.00 H new ATOM 0 HB2 ASN A 85 11.444 15.643 -31.044 1.00 0.00 H new ATOM 0 HB3 ASN A 85 12.336 17.045 -31.599 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.921 14.547 -28.721 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.242 14.401 -29.250 1.00 0.00 H new ATOM 1298 N SER A 86 10.356 19.400 -31.128 1.00 0.00 N ATOM 1299 CA SER A 86 9.491 20.263 -31.959 1.00 0.00 C ATOM 1300 C SER A 86 8.111 20.439 -31.297 1.00 0.00 C ATOM 1301 O SER A 86 7.109 19.836 -31.708 1.00 0.00 O ATOM 1302 CB SER A 86 9.398 19.735 -33.419 1.00 0.00 C ATOM 1303 OG SER A 86 8.762 20.661 -34.286 1.00 0.00 O ATOM 0 H SER A 86 11.221 19.859 -30.843 1.00 0.00 H new ATOM 0 HA SER A 86 9.944 21.252 -32.024 1.00 0.00 H new ATOM 0 HB2 SER A 86 10.400 19.522 -33.791 1.00 0.00 H new ATOM 0 HB3 SER A 86 8.848 18.794 -33.429 1.00 0.00 H new ATOM 0 HG SER A 86 8.727 20.290 -35.192 1.00 0.00 H new ATOM 1309 N LEU A 87 8.104 21.222 -30.212 1.00 0.00 N ATOM 1310 CA LEU A 87 6.905 21.476 -29.401 1.00 0.00 C ATOM 1311 C LEU A 87 6.035 22.586 -30.011 1.00 0.00 C ATOM 1312 O LEU A 87 6.545 23.550 -30.583 1.00 0.00 O ATOM 1313 CB LEU A 87 7.323 21.822 -27.948 1.00 0.00 C ATOM 1314 CG LEU A 87 7.738 20.596 -27.082 1.00 0.00 C ATOM 1315 CD1 LEU A 87 8.364 21.021 -25.744 1.00 0.00 C ATOM 1316 CD2 LEU A 87 6.524 19.676 -26.856 1.00 0.00 C ATOM 0 H LEU A 87 8.936 21.701 -29.868 1.00 0.00 H new ATOM 0 HA LEU A 87 6.297 20.571 -29.387 1.00 0.00 H new ATOM 0 HB2 LEU A 87 8.155 22.525 -27.981 1.00 0.00 H new ATOM 0 HB3 LEU A 87 6.494 22.333 -27.458 1.00 0.00 H new ATOM 0 HG LEU A 87 8.504 20.045 -27.627 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.638 20.134 -25.173 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.254 21.621 -25.933 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.644 21.610 -25.176 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.823 18.821 -26.249 1.00 0.00 H new ATOM 0 HD22 LEU A 87 5.739 20.229 -26.341 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.149 19.325 -27.818 1.00 0.00 H new ATOM 1328 N LYS A 88 4.714 22.427 -29.867 1.00 0.00 N ATOM 1329 CA LYS A 88 3.713 23.338 -30.446 1.00 0.00 C ATOM 1330 C LYS A 88 3.453 24.497 -29.470 1.00 0.00 C ATOM 1331 O LYS A 88 3.534 24.286 -28.268 1.00 0.00 O ATOM 1332 CB LYS A 88 2.378 22.560 -30.699 1.00 0.00 C ATOM 1333 CG LYS A 88 2.548 21.118 -31.230 1.00 0.00 C ATOM 1334 CD LYS A 88 1.185 20.418 -31.435 1.00 0.00 C ATOM 1335 CE LYS A 88 1.293 18.913 -31.734 1.00 0.00 C ATOM 1336 NZ LYS A 88 -0.038 18.323 -32.040 1.00 0.00 N ATOM 0 H LYS A 88 4.304 21.656 -29.341 1.00 0.00 H new ATOM 0 HA LYS A 88 4.086 23.733 -31.391 1.00 0.00 H new ATOM 0 HB2 LYS A 88 1.815 22.523 -29.766 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.777 23.124 -31.412 1.00 0.00 H new ATOM 0 HG2 LYS A 88 3.091 21.140 -32.175 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.151 20.541 -30.529 1.00 0.00 H new ATOM 0 HD2 LYS A 88 0.578 20.558 -30.540 1.00 0.00 H new ATOM 0 HD3 LYS A 88 0.658 20.904 -32.256 1.00 0.00 H new ATOM 0 HE2 LYS A 88 1.965 18.756 -32.578 1.00 0.00 H new ATOM 0 HE3 LYS A 88 1.731 18.401 -30.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 0.069 17.307 -32.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -0.671 18.453 -31.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -0.444 18.796 -32.872 1.00 0.00 H new ATOM 1350 N PRO A 89 3.086 25.725 -29.948 1.00 0.00 N ATOM 1351 CA PRO A 89 2.602 26.803 -29.045 1.00 0.00 C ATOM 1352 C PRO A 89 1.282 26.381 -28.334 1.00 0.00 C ATOM 1353 O PRO A 89 0.948 26.884 -27.252 1.00 0.00 O ATOM 1354 CB PRO A 89 2.397 28.014 -29.990 1.00 0.00 C ATOM 1355 CG PRO A 89 2.266 27.415 -31.360 1.00 0.00 C ATOM 1356 CD PRO A 89 3.139 26.178 -31.358 1.00 0.00 C ATOM 0 HA PRO A 89 3.297 27.031 -28.237 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.506 28.580 -29.719 1.00 0.00 H new ATOM 0 HB3 PRO A 89 3.240 28.703 -29.939 1.00 0.00 H new ATOM 0 HG2 PRO A 89 1.229 27.160 -31.577 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.589 28.119 -32.127 1.00 0.00 H new ATOM 0 HD2 PRO A 89 2.759 25.417 -32.040 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.159 26.405 -31.670 1.00 0.00 H new ATOM 1364 N GLU A 90 0.565 25.431 -28.977 1.00 0.00 N ATOM 1365 CA GLU A 90 -0.597 24.725 -28.435 1.00 0.00 C ATOM 1366 C GLU A 90 -0.250 23.962 -27.137 1.00 0.00 C ATOM 1367 O GLU A 90 -1.083 23.852 -26.223 1.00 0.00 O ATOM 1368 CB GLU A 90 -1.083 23.735 -29.527 1.00 0.00 C ATOM 1369 CG GLU A 90 -2.059 22.657 -29.054 1.00 0.00 C ATOM 1370 CD GLU A 90 -2.440 21.656 -30.154 1.00 0.00 C ATOM 1371 OE1 GLU A 90 -1.839 20.558 -30.216 1.00 0.00 O ATOM 1372 OE2 GLU A 90 -3.328 21.961 -30.977 1.00 0.00 O ATOM 0 H GLU A 90 0.797 25.131 -29.924 1.00 0.00 H new ATOM 0 HA GLU A 90 -1.376 25.442 -28.177 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -1.559 24.306 -30.324 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -0.212 23.245 -29.962 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -1.615 22.116 -28.219 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -2.964 23.135 -28.679 1.00 0.00 H new ATOM 1379 N ASP A 91 1.003 23.489 -27.048 1.00 0.00 N ATOM 1380 CA ASP A 91 1.436 22.535 -26.013 1.00 0.00 C ATOM 1381 C ASP A 91 1.778 23.254 -24.678 1.00 0.00 C ATOM 1382 O ASP A 91 2.526 22.742 -23.841 1.00 0.00 O ATOM 1383 CB ASP A 91 2.623 21.694 -26.567 1.00 0.00 C ATOM 1384 CG ASP A 91 2.733 20.302 -25.921 1.00 0.00 C ATOM 1385 OD1 ASP A 91 1.881 19.435 -26.247 1.00 0.00 O ATOM 1386 OD2 ASP A 91 3.651 20.066 -25.109 1.00 0.00 O ATOM 0 H ASP A 91 1.746 23.757 -27.693 1.00 0.00 H new ATOM 0 HA ASP A 91 0.617 21.857 -25.775 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.507 21.579 -27.645 1.00 0.00 H new ATOM 0 HB3 ASP A 91 3.553 22.238 -26.403 1.00 0.00 H new ATOM 1391 N THR A 92 1.218 24.463 -24.490 1.00 0.00 N ATOM 1392 CA THR A 92 1.111 25.084 -23.171 1.00 0.00 C ATOM 1393 C THR A 92 -0.069 24.412 -22.431 1.00 0.00 C ATOM 1394 O THR A 92 -1.235 24.803 -22.597 1.00 0.00 O ATOM 1395 CB THR A 92 0.903 26.633 -23.286 1.00 0.00 C ATOM 1396 OG1 THR A 92 2.016 27.214 -23.982 1.00 0.00 O ATOM 1397 CG2 THR A 92 0.757 27.320 -21.914 1.00 0.00 C ATOM 0 H THR A 92 0.832 25.028 -25.246 1.00 0.00 H new ATOM 0 HA THR A 92 2.036 24.939 -22.612 1.00 0.00 H new ATOM 0 HB THR A 92 -0.026 26.791 -23.833 1.00 0.00 H new ATOM 0 HG1 THR A 92 1.886 28.183 -24.056 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.616 28.391 -22.057 1.00 0.00 H new ATOM 0 HG22 THR A 92 -0.105 26.907 -21.390 1.00 0.00 H new ATOM 0 HG23 THR A 92 1.657 27.148 -21.324 1.00 0.00 H new ATOM 1405 N ALA A 93 0.255 23.360 -21.665 1.00 0.00 N ATOM 1406 CA ALA A 93 -0.730 22.511 -20.970 1.00 0.00 C ATOM 1407 C ALA A 93 -0.040 21.741 -19.835 1.00 0.00 C ATOM 1408 O ALA A 93 1.191 21.742 -19.731 1.00 0.00 O ATOM 1409 CB ALA A 93 -1.405 21.544 -21.968 1.00 0.00 C ATOM 0 H ALA A 93 1.220 23.069 -21.507 1.00 0.00 H new ATOM 0 HA ALA A 93 -1.507 23.141 -20.538 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.130 20.924 -21.440 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -1.914 22.118 -22.743 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -0.648 20.907 -22.426 1.00 0.00 H new ATOM 1415 N VAL A 94 -0.821 21.081 -18.972 1.00 0.00 N ATOM 1416 CA VAL A 94 -0.271 20.338 -17.837 1.00 0.00 C ATOM 1417 C VAL A 94 -0.168 18.847 -18.213 1.00 0.00 C ATOM 1418 O VAL A 94 -1.174 18.151 -18.349 1.00 0.00 O ATOM 1419 CB VAL A 94 -1.097 20.595 -16.510 1.00 0.00 C ATOM 1420 CG1 VAL A 94 -2.615 20.354 -16.686 1.00 0.00 C ATOM 1421 CG2 VAL A 94 -0.522 19.772 -15.335 1.00 0.00 C ATOM 0 H VAL A 94 -1.838 21.048 -19.040 1.00 0.00 H new ATOM 0 HA VAL A 94 0.734 20.698 -17.617 1.00 0.00 H new ATOM 0 HB VAL A 94 -0.988 21.653 -16.272 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.126 20.546 -15.742 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -3.003 21.025 -17.452 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -2.787 19.321 -16.987 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -1.106 19.965 -14.435 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.569 18.710 -15.577 1.00 0.00 H new ATOM 0 HG23 VAL A 94 0.515 20.059 -15.163 1.00 0.00 H new ATOM 1431 N TYR A 95 1.073 18.382 -18.422 1.00 0.00 N ATOM 1432 CA TYR A 95 1.365 16.985 -18.778 1.00 0.00 C ATOM 1433 C TYR A 95 1.381 16.133 -17.516 1.00 0.00 C ATOM 1434 O TYR A 95 1.663 16.625 -16.428 1.00 0.00 O ATOM 1435 CB TYR A 95 2.736 16.867 -19.528 1.00 0.00 C ATOM 1436 CG TYR A 95 2.615 16.821 -21.054 1.00 0.00 C ATOM 1437 CD1 TYR A 95 2.327 17.966 -21.791 1.00 0.00 C ATOM 1438 CD2 TYR A 95 2.789 15.620 -21.754 1.00 0.00 C ATOM 1439 CE1 TYR A 95 2.222 17.921 -23.169 1.00 0.00 C ATOM 1440 CE2 TYR A 95 2.685 15.571 -23.130 1.00 0.00 C ATOM 1441 CZ TYR A 95 2.399 16.721 -23.835 1.00 0.00 C ATOM 1442 OH TYR A 95 2.292 16.673 -25.209 1.00 0.00 O ATOM 0 H TYR A 95 1.906 18.967 -18.349 1.00 0.00 H new ATOM 0 HA TYR A 95 0.585 16.627 -19.450 1.00 0.00 H new ATOM 0 HB2 TYR A 95 3.364 17.714 -19.250 1.00 0.00 H new ATOM 0 HB3 TYR A 95 3.247 15.966 -19.188 1.00 0.00 H new ATOM 0 HD1 TYR A 95 2.183 18.905 -21.278 1.00 0.00 H new ATOM 0 HD2 TYR A 95 3.009 14.715 -21.207 1.00 0.00 H new ATOM 0 HE1 TYR A 95 2.002 18.821 -23.724 1.00 0.00 H new ATOM 0 HE2 TYR A 95 2.827 14.636 -23.652 1.00 0.00 H new ATOM 0 HH TYR A 95 2.155 17.578 -25.558 1.00 0.00 H new ATOM 1452 N LEU A 96 1.030 14.862 -17.687 1.00 0.00 N ATOM 1453 CA LEU A 96 1.014 13.882 -16.606 1.00 0.00 C ATOM 1454 C LEU A 96 1.289 12.493 -17.178 1.00 0.00 C ATOM 1455 O LEU A 96 0.820 12.156 -18.272 1.00 0.00 O ATOM 1456 CB LEU A 96 -0.334 13.975 -15.820 1.00 0.00 C ATOM 1457 CG LEU A 96 -1.669 13.894 -16.666 1.00 0.00 C ATOM 1458 CD1 LEU A 96 -2.158 12.442 -16.877 1.00 0.00 C ATOM 1459 CD2 LEU A 96 -2.788 14.777 -16.058 1.00 0.00 C ATOM 0 H LEU A 96 0.746 14.480 -18.589 1.00 0.00 H new ATOM 0 HA LEU A 96 1.804 14.092 -15.885 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.352 13.172 -15.083 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.340 14.915 -15.268 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.426 14.290 -17.652 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -3.077 12.449 -17.464 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.393 11.874 -17.407 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.349 11.978 -15.909 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -3.688 14.694 -16.667 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -3.005 14.443 -15.043 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.460 15.816 -16.035 1.00 0.00 H new ATOM 1471 N CYS A 97 2.075 11.699 -16.453 1.00 0.00 N ATOM 1472 CA CYS A 97 2.329 10.304 -16.810 1.00 0.00 C ATOM 1473 C CYS A 97 1.272 9.424 -16.150 1.00 0.00 C ATOM 1474 O CYS A 97 0.739 9.768 -15.099 1.00 0.00 O ATOM 1475 CB CYS A 97 3.743 9.888 -16.366 1.00 0.00 C ATOM 1476 SG CYS A 97 4.084 10.205 -14.630 1.00 0.00 S ATOM 0 H CYS A 97 2.552 12.003 -15.604 1.00 0.00 H new ATOM 0 HA CYS A 97 2.271 10.184 -17.892 1.00 0.00 H new ATOM 0 HB2 CYS A 97 3.877 8.825 -16.564 1.00 0.00 H new ATOM 0 HB3 CYS A 97 4.475 10.420 -16.973 1.00 0.00 H new ATOM 0 HG CYS A 97 5.272 9.767 -14.334 1.00 0.00 H new ATOM 1482 N ALA A 98 0.949 8.313 -16.790 1.00 0.00 N ATOM 1483 CA ALA A 98 -0.018 7.340 -16.283 1.00 0.00 C ATOM 1484 C ALA A 98 0.699 6.046 -15.916 1.00 0.00 C ATOM 1485 O ALA A 98 1.809 5.779 -16.391 1.00 0.00 O ATOM 1486 CB ALA A 98 -1.104 7.080 -17.334 1.00 0.00 C ATOM 0 H ALA A 98 1.354 8.053 -17.689 1.00 0.00 H new ATOM 0 HA ALA A 98 -0.497 7.739 -15.389 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.819 6.354 -16.947 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -1.621 8.012 -17.562 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -0.645 6.688 -18.242 1.00 0.00 H new ATOM 1492 N ALA A 99 0.059 5.263 -15.055 1.00 0.00 N ATOM 1493 CA ALA A 99 0.502 3.922 -14.684 1.00 0.00 C ATOM 1494 C ALA A 99 -0.727 3.020 -14.600 1.00 0.00 C ATOM 1495 O ALA A 99 -1.774 3.428 -14.081 1.00 0.00 O ATOM 1496 CB ALA A 99 1.273 3.949 -13.357 1.00 0.00 C ATOM 0 H ALA A 99 -0.800 5.548 -14.585 1.00 0.00 H new ATOM 0 HA ALA A 99 1.187 3.532 -15.436 1.00 0.00 H new ATOM 0 HB1 ALA A 99 1.593 2.939 -13.101 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.147 4.592 -13.457 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.627 4.335 -12.569 1.00 0.00 H new ATOM 1502 N GLY A 100 -0.596 1.810 -15.123 1.00 0.00 N ATOM 1503 CA GLY A 100 -1.685 0.852 -15.187 1.00 0.00 C ATOM 1504 C GLY A 100 -1.216 -0.546 -14.863 1.00 0.00 C ATOM 1505 O GLY A 100 -0.028 -0.852 -14.998 1.00 0.00 O ATOM 0 H GLY A 100 0.278 1.464 -15.518 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -2.469 1.144 -14.488 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -2.125 0.867 -16.184 1.00 0.00 H new ATOM 1509 N VAL A 101 -2.151 -1.402 -14.446 1.00 0.00 N ATOM 1510 CA VAL A 101 -1.862 -2.790 -14.050 1.00 0.00 C ATOM 1511 C VAL A 101 -2.527 -3.767 -15.035 1.00 0.00 C ATOM 1512 O VAL A 101 -3.577 -3.453 -15.619 1.00 0.00 O ATOM 1513 CB VAL A 101 -2.352 -3.078 -12.579 1.00 0.00 C ATOM 1514 CG1 VAL A 101 -1.525 -2.264 -11.547 1.00 0.00 C ATOM 1515 CG2 VAL A 101 -3.874 -2.808 -12.428 1.00 0.00 C ATOM 0 H VAL A 101 -3.138 -1.154 -14.372 1.00 0.00 H new ATOM 0 HA VAL A 101 -0.782 -2.934 -14.077 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.188 -4.136 -12.374 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -1.884 -2.481 -10.541 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.473 -2.540 -11.625 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -1.637 -1.199 -11.750 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -4.180 -3.016 -11.403 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.084 -1.765 -12.665 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -4.427 -3.453 -13.110 1.00 0.00 H new ATOM 1525 N TRP A 102 -1.893 -4.942 -15.218 1.00 0.00 N ATOM 1526 CA TRP A 102 -2.397 -6.017 -16.090 1.00 0.00 C ATOM 1527 C TRP A 102 -3.649 -6.625 -15.446 1.00 0.00 C ATOM 1528 O TRP A 102 -3.582 -7.599 -14.686 1.00 0.00 O ATOM 1529 CB TRP A 102 -1.287 -7.072 -16.329 1.00 0.00 C ATOM 1530 CG TRP A 102 -1.614 -8.108 -17.384 1.00 0.00 C ATOM 1531 CD1 TRP A 102 -1.871 -9.445 -17.194 1.00 0.00 C ATOM 1532 CD2 TRP A 102 -1.711 -7.884 -18.802 1.00 0.00 C ATOM 1533 NE1 TRP A 102 -2.121 -10.049 -18.402 1.00 0.00 N ATOM 1534 CE2 TRP A 102 -2.029 -9.114 -19.401 1.00 0.00 C ATOM 1535 CE3 TRP A 102 -1.554 -6.758 -19.618 1.00 0.00 C ATOM 1536 CZ2 TRP A 102 -2.207 -9.248 -20.779 1.00 0.00 C ATOM 1537 CZ3 TRP A 102 -1.728 -6.890 -20.983 1.00 0.00 C ATOM 1538 CH2 TRP A 102 -2.048 -8.129 -21.553 1.00 0.00 C ATOM 0 H TRP A 102 -1.011 -5.172 -14.761 1.00 0.00 H new ATOM 0 HA TRP A 102 -2.673 -5.621 -17.067 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -0.371 -6.556 -16.617 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -1.082 -7.583 -15.388 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -1.876 -9.946 -16.237 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -2.340 -11.036 -18.535 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -1.301 -5.800 -19.188 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -2.461 -10.201 -21.220 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -1.616 -6.025 -21.620 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -2.172 -8.203 -22.623 1.00 0.00 H new ATOM 1549 N ARG A 103 -4.779 -5.969 -15.725 1.00 0.00 N ATOM 1550 CA ARG A 103 -6.054 -6.183 -15.025 1.00 0.00 C ATOM 1551 C ARG A 103 -6.668 -7.552 -15.393 1.00 0.00 C ATOM 1552 O ARG A 103 -6.425 -8.064 -16.492 1.00 0.00 O ATOM 1553 CB ARG A 103 -7.014 -5.009 -15.381 1.00 0.00 C ATOM 1554 CG ARG A 103 -8.233 -4.837 -14.452 1.00 0.00 C ATOM 1555 CD ARG A 103 -9.082 -3.607 -14.811 1.00 0.00 C ATOM 1556 NE ARG A 103 -10.072 -3.284 -13.762 1.00 0.00 N ATOM 1557 CZ ARG A 103 -10.146 -2.114 -13.103 1.00 0.00 C ATOM 1558 NH1 ARG A 103 -9.228 -1.173 -13.277 1.00 0.00 N ATOM 1559 NH2 ARG A 103 -11.124 -1.907 -12.241 1.00 0.00 N ATOM 0 H ARG A 103 -4.837 -5.261 -16.457 1.00 0.00 H new ATOM 0 HA ARG A 103 -5.887 -6.198 -13.948 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -6.442 -4.081 -15.375 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -7.374 -5.154 -16.399 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -8.855 -5.731 -14.505 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -7.890 -4.748 -13.421 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -8.428 -2.749 -14.967 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -9.600 -3.788 -15.753 1.00 0.00 H new ATOM 0 HE ARG A 103 -10.752 -4.004 -13.519 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -8.451 -1.331 -13.919 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -9.299 -0.291 -12.769 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -11.821 -2.633 -12.076 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -11.183 -1.021 -11.740 1.00 0.00 H new ATOM 1573 N SER A 104 -7.469 -8.126 -14.469 1.00 0.00 N ATOM 1574 CA SER A 104 -8.135 -9.436 -14.671 1.00 0.00 C ATOM 1575 C SER A 104 -9.205 -9.372 -15.792 1.00 0.00 C ATOM 1576 O SER A 104 -9.629 -10.408 -16.315 1.00 0.00 O ATOM 1577 CB SER A 104 -8.769 -9.909 -13.338 1.00 0.00 C ATOM 1578 OG SER A 104 -7.799 -9.980 -12.307 1.00 0.00 O ATOM 0 H SER A 104 -7.673 -7.699 -13.566 1.00 0.00 H new ATOM 0 HA SER A 104 -7.380 -10.155 -14.989 1.00 0.00 H new ATOM 0 HB2 SER A 104 -9.564 -9.223 -13.047 1.00 0.00 H new ATOM 0 HB3 SER A 104 -9.228 -10.888 -13.477 1.00 0.00 H new ATOM 0 HG SER A 104 -8.225 -10.279 -11.477 1.00 0.00 H new ATOM 1584 N SER A 105 -9.629 -8.144 -16.139 1.00 0.00 N ATOM 1585 CA SER A 105 -10.513 -7.870 -17.292 1.00 0.00 C ATOM 1586 C SER A 105 -9.801 -8.167 -18.633 1.00 0.00 C ATOM 1587 O SER A 105 -10.456 -8.405 -19.656 1.00 0.00 O ATOM 1588 CB SER A 105 -10.963 -6.388 -17.238 1.00 0.00 C ATOM 1589 OG SER A 105 -11.760 -6.006 -18.355 1.00 0.00 O ATOM 0 H SER A 105 -9.367 -7.304 -15.624 1.00 0.00 H new ATOM 0 HA SER A 105 -11.382 -8.525 -17.233 1.00 0.00 H new ATOM 0 HB2 SER A 105 -11.528 -6.219 -16.321 1.00 0.00 H new ATOM 0 HB3 SER A 105 -10.082 -5.748 -17.192 1.00 0.00 H new ATOM 0 HG SER A 105 -12.016 -5.064 -18.267 1.00 0.00 H new ATOM 1595 N GLY A 106 -8.455 -8.145 -18.613 1.00 0.00 N ATOM 1596 CA GLY A 106 -7.634 -8.382 -19.810 1.00 0.00 C ATOM 1597 C GLY A 106 -7.018 -7.097 -20.345 1.00 0.00 C ATOM 1598 O GLY A 106 -5.938 -7.113 -20.946 1.00 0.00 O ATOM 0 H GLY A 106 -7.911 -7.963 -17.770 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -6.842 -9.091 -19.571 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -8.248 -8.840 -20.586 1.00 0.00 H new ATOM 1602 N TRP A 107 -7.721 -5.978 -20.117 1.00 0.00 N ATOM 1603 CA TRP A 107 -7.287 -4.644 -20.551 1.00 0.00 C ATOM 1604 C TRP A 107 -6.397 -4.006 -19.477 1.00 0.00 C ATOM 1605 O TRP A 107 -6.845 -3.796 -18.346 1.00 0.00 O ATOM 1606 CB TRP A 107 -8.521 -3.744 -20.826 1.00 0.00 C ATOM 1607 CG TRP A 107 -9.397 -4.233 -21.959 1.00 0.00 C ATOM 1608 CD1 TRP A 107 -10.483 -5.068 -21.873 1.00 0.00 C ATOM 1609 CD2 TRP A 107 -9.248 -3.915 -23.351 1.00 0.00 C ATOM 1610 NE1 TRP A 107 -11.007 -5.283 -23.123 1.00 0.00 N ATOM 1611 CE2 TRP A 107 -10.269 -4.585 -24.043 1.00 0.00 C ATOM 1612 CE3 TRP A 107 -8.349 -3.120 -24.077 1.00 0.00 C ATOM 1613 CZ2 TRP A 107 -10.415 -4.494 -25.424 1.00 0.00 C ATOM 1614 CZ3 TRP A 107 -8.496 -3.031 -25.448 1.00 0.00 C ATOM 1615 CH2 TRP A 107 -9.524 -3.714 -26.108 1.00 0.00 C ATOM 0 H TRP A 107 -8.613 -5.974 -19.623 1.00 0.00 H new ATOM 0 HA TRP A 107 -6.713 -4.742 -21.472 1.00 0.00 H new ATOM 0 HB2 TRP A 107 -9.121 -3.679 -19.918 1.00 0.00 H new ATOM 0 HB3 TRP A 107 -8.179 -2.735 -21.054 1.00 0.00 H new ATOM 0 HD1 TRP A 107 -10.868 -5.493 -20.958 1.00 0.00 H new ATOM 0 HE1 TRP A 107 -11.816 -5.868 -23.333 1.00 0.00 H new ATOM 0 HE3 TRP A 107 -7.556 -2.587 -23.573 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 -11.205 -5.021 -25.938 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 -7.808 -2.425 -26.019 1.00 0.00 H new ATOM 0 HH2 TRP A 107 -9.616 -3.623 -27.180 1.00 0.00 H new ATOM 1626 N ASP A 108 -5.130 -3.729 -19.832 1.00 0.00 N ATOM 1627 CA ASP A 108 -4.208 -2.978 -18.964 1.00 0.00 C ATOM 1628 C ASP A 108 -4.595 -1.485 -19.038 1.00 0.00 C ATOM 1629 O ASP A 108 -4.293 -0.803 -20.025 1.00 0.00 O ATOM 1630 CB ASP A 108 -2.731 -3.211 -19.406 1.00 0.00 C ATOM 1631 CG ASP A 108 -1.677 -2.817 -18.346 1.00 0.00 C ATOM 1632 OD1 ASP A 108 -1.731 -1.684 -17.822 1.00 0.00 O ATOM 1633 OD2 ASP A 108 -0.775 -3.640 -18.047 1.00 0.00 O ATOM 0 H ASP A 108 -4.720 -4.017 -20.720 1.00 0.00 H new ATOM 0 HA ASP A 108 -4.287 -3.322 -17.933 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -2.601 -4.264 -19.656 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -2.543 -2.642 -20.316 1.00 0.00 H new ATOM 1638 N THR A 109 -5.304 -1.004 -18.008 1.00 0.00 N ATOM 1639 CA THR A 109 -5.911 0.343 -17.999 1.00 0.00 C ATOM 1640 C THR A 109 -5.186 1.260 -16.983 1.00 0.00 C ATOM 1641 O THR A 109 -4.784 0.780 -15.911 1.00 0.00 O ATOM 1642 CB THR A 109 -7.443 0.250 -17.665 1.00 0.00 C ATOM 1643 OG1 THR A 109 -8.036 1.560 -17.658 1.00 0.00 O ATOM 1644 CG2 THR A 109 -7.718 -0.445 -16.315 1.00 0.00 C ATOM 0 H THR A 109 -5.476 -1.535 -17.154 1.00 0.00 H new ATOM 0 HA THR A 109 -5.800 0.779 -18.992 1.00 0.00 H new ATOM 0 HB THR A 109 -7.894 -0.360 -18.448 1.00 0.00 H new ATOM 0 HG1 THR A 109 -8.991 1.486 -17.450 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.793 -0.481 -16.136 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.320 -1.460 -16.340 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.236 0.114 -15.513 1.00 0.00 H new ATOM 1652 N PRO A 110 -4.997 2.595 -17.298 1.00 0.00 N ATOM 1653 CA PRO A 110 -4.367 3.557 -16.362 1.00 0.00 C ATOM 1654 C PRO A 110 -5.230 3.755 -15.094 1.00 0.00 C ATOM 1655 O PRO A 110 -6.246 4.455 -15.132 1.00 0.00 O ATOM 1656 CB PRO A 110 -4.244 4.878 -17.186 1.00 0.00 C ATOM 1657 CG PRO A 110 -4.472 4.477 -18.613 1.00 0.00 C ATOM 1658 CD PRO A 110 -5.372 3.260 -18.573 1.00 0.00 C ATOM 0 HA PRO A 110 -3.400 3.209 -15.999 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -4.980 5.614 -16.862 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -3.261 5.332 -17.057 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -4.938 5.287 -19.175 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -3.528 4.247 -19.108 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -6.426 3.539 -18.586 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -5.204 2.608 -19.430 1.00 0.00 H new ATOM 1666 N ASP A 111 -4.853 3.074 -14.001 1.00 0.00 N ATOM 1667 CA ASP A 111 -5.526 3.207 -12.686 1.00 0.00 C ATOM 1668 C ASP A 111 -4.844 4.271 -11.817 1.00 0.00 C ATOM 1669 O ASP A 111 -5.382 4.679 -10.780 1.00 0.00 O ATOM 1670 CB ASP A 111 -5.554 1.834 -11.960 1.00 0.00 C ATOM 1671 CG ASP A 111 -6.540 0.849 -12.609 1.00 0.00 C ATOM 1672 OD1 ASP A 111 -6.111 -0.170 -13.188 1.00 0.00 O ATOM 1673 OD2 ASP A 111 -7.766 1.107 -12.535 1.00 0.00 O ATOM 0 H ASP A 111 -4.075 2.415 -13.997 1.00 0.00 H new ATOM 0 HA ASP A 111 -6.552 3.533 -12.858 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -4.554 1.401 -11.968 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -5.828 1.984 -10.916 1.00 0.00 H new ATOM 1678 N TYR A 112 -3.653 4.707 -12.250 1.00 0.00 N ATOM 1679 CA TYR A 112 -2.845 5.721 -11.551 1.00 0.00 C ATOM 1680 C TYR A 112 -2.460 6.812 -12.561 1.00 0.00 C ATOM 1681 O TYR A 112 -2.314 6.528 -13.759 1.00 0.00 O ATOM 1682 CB TYR A 112 -1.562 5.081 -10.933 1.00 0.00 C ATOM 1683 CG TYR A 112 -1.796 3.708 -10.278 1.00 0.00 C ATOM 1684 CD1 TYR A 112 -1.434 2.532 -10.937 1.00 0.00 C ATOM 1685 CD2 TYR A 112 -2.392 3.588 -9.016 1.00 0.00 C ATOM 1686 CE1 TYR A 112 -1.664 1.294 -10.379 1.00 0.00 C ATOM 1687 CE2 TYR A 112 -2.618 2.343 -8.451 1.00 0.00 C ATOM 1688 CZ TYR A 112 -2.250 1.202 -9.137 1.00 0.00 C ATOM 1689 OH TYR A 112 -2.474 -0.039 -8.583 1.00 0.00 O ATOM 0 H TYR A 112 -3.217 4.363 -13.105 1.00 0.00 H new ATOM 0 HA TYR A 112 -3.426 6.151 -10.735 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -0.810 4.975 -11.715 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -1.153 5.762 -10.187 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -0.963 2.594 -11.907 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -2.679 4.478 -8.476 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -1.385 0.398 -10.914 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -3.080 2.265 -7.478 1.00 0.00 H new ATOM 0 HH TYR A 112 -2.893 0.066 -7.703 1.00 0.00 H new ATOM 1699 N TRP A 113 -2.309 8.052 -12.081 1.00 0.00 N ATOM 1700 CA TRP A 113 -1.866 9.197 -12.900 1.00 0.00 C ATOM 1701 C TRP A 113 -0.877 10.058 -12.105 1.00 0.00 C ATOM 1702 O TRP A 113 -0.768 9.931 -10.873 1.00 0.00 O ATOM 1703 CB TRP A 113 -3.066 10.052 -13.402 1.00 0.00 C ATOM 1704 CG TRP A 113 -3.890 9.380 -14.487 1.00 0.00 C ATOM 1705 CD1 TRP A 113 -3.569 9.284 -15.814 1.00 0.00 C ATOM 1706 CD2 TRP A 113 -5.157 8.715 -14.338 1.00 0.00 C ATOM 1707 NE1 TRP A 113 -4.546 8.604 -16.493 1.00 0.00 N ATOM 1708 CE2 TRP A 113 -5.532 8.247 -15.612 1.00 0.00 C ATOM 1709 CE3 TRP A 113 -6.007 8.468 -13.254 1.00 0.00 C ATOM 1710 CZ2 TRP A 113 -6.713 7.550 -15.833 1.00 0.00 C ATOM 1711 CZ3 TRP A 113 -7.185 7.778 -13.473 1.00 0.00 C ATOM 1712 CH2 TRP A 113 -7.529 7.324 -14.754 1.00 0.00 C ATOM 0 H TRP A 113 -2.491 8.295 -11.107 1.00 0.00 H new ATOM 0 HA TRP A 113 -1.364 8.803 -13.784 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -3.715 10.281 -12.557 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -2.689 11.002 -13.782 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -2.673 9.687 -16.262 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -4.540 8.397 -17.492 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -5.747 8.811 -12.263 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -6.979 7.199 -16.819 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -7.850 7.586 -12.644 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -8.455 6.786 -14.894 1.00 0.00 H new ATOM 1723 N GLY A 114 -0.156 10.919 -12.831 1.00 0.00 N ATOM 1724 CA GLY A 114 0.887 11.757 -12.257 1.00 0.00 C ATOM 1725 C GLY A 114 0.352 12.944 -11.472 1.00 0.00 C ATOM 1726 O GLY A 114 -0.859 13.190 -11.438 1.00 0.00 O ATOM 0 H GLY A 114 -0.284 11.050 -13.834 1.00 0.00 H new ATOM 0 HA2 GLY A 114 1.510 11.149 -11.601 1.00 0.00 H new ATOM 0 HA3 GLY A 114 1.530 12.122 -13.058 1.00 0.00 H new ATOM 1730 N GLN A 115 1.266 13.680 -10.831 1.00 0.00 N ATOM 1731 CA GLN A 115 0.923 14.873 -10.040 1.00 0.00 C ATOM 1732 C GLN A 115 0.561 16.060 -10.950 1.00 0.00 C ATOM 1733 O GLN A 115 -0.221 16.941 -10.568 1.00 0.00 O ATOM 1734 CB GLN A 115 2.104 15.236 -9.121 1.00 0.00 C ATOM 1735 CG GLN A 115 2.433 14.157 -8.067 1.00 0.00 C ATOM 1736 CD GLN A 115 3.638 14.504 -7.189 1.00 0.00 C ATOM 1737 OE1 GLN A 115 3.921 15.675 -6.930 1.00 0.00 O ATOM 1738 NE2 GLN A 115 4.351 13.490 -6.721 1.00 0.00 N ATOM 0 H GLN A 115 2.264 13.468 -10.844 1.00 0.00 H new ATOM 0 HA GLN A 115 0.047 14.648 -9.431 1.00 0.00 H new ATOM 0 HB2 GLN A 115 2.988 15.412 -9.734 1.00 0.00 H new ATOM 0 HB3 GLN A 115 1.879 16.172 -8.610 1.00 0.00 H new ATOM 0 HG2 GLN A 115 1.562 14.006 -7.430 1.00 0.00 H new ATOM 0 HG3 GLN A 115 2.624 13.212 -8.575 1.00 0.00 H new ATOM 0 HE21 GLN A 115 4.090 12.532 -6.954 1.00 0.00 H new ATOM 0 HE22 GLN A 115 5.161 13.667 -6.127 1.00 0.00 H new ATOM 1747 N GLY A 116 1.140 16.057 -12.154 1.00 0.00 N ATOM 1748 CA GLY A 116 0.918 17.097 -13.143 1.00 0.00 C ATOM 1749 C GLY A 116 2.115 18.027 -13.247 1.00 0.00 C ATOM 1750 O GLY A 116 2.290 18.922 -12.407 1.00 0.00 O ATOM 0 H GLY A 116 1.779 15.325 -12.465 1.00 0.00 H new ATOM 0 HA2 GLY A 116 0.723 16.642 -14.114 1.00 0.00 H new ATOM 0 HA3 GLY A 116 0.031 17.672 -12.876 1.00 0.00 H new ATOM 1754 N THR A 117 2.936 17.811 -14.280 1.00 0.00 N ATOM 1755 CA THR A 117 4.067 18.683 -14.608 1.00 0.00 C ATOM 1756 C THR A 117 3.616 19.687 -15.700 1.00 0.00 C ATOM 1757 O THR A 117 3.399 19.335 -16.869 1.00 0.00 O ATOM 1758 CB THR A 117 5.323 17.836 -15.047 1.00 0.00 C ATOM 1759 OG1 THR A 117 6.407 18.692 -15.441 1.00 0.00 O ATOM 1760 CG2 THR A 117 5.011 16.838 -16.179 1.00 0.00 C ATOM 0 H THR A 117 2.833 17.020 -14.916 1.00 0.00 H new ATOM 0 HA THR A 117 4.376 19.246 -13.727 1.00 0.00 H new ATOM 0 HB THR A 117 5.615 17.255 -14.172 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.221 18.158 -15.554 1.00 0.00 H new ATOM 0 HG21 THR A 117 5.915 16.286 -16.436 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.242 16.141 -15.848 1.00 0.00 H new ATOM 0 HG23 THR A 117 4.656 17.381 -17.055 1.00 0.00 H new ATOM 1768 N GLN A 118 3.435 20.947 -15.272 1.00 0.00 N ATOM 1769 CA GLN A 118 2.863 22.019 -16.098 1.00 0.00 C ATOM 1770 C GLN A 118 3.944 22.551 -17.060 1.00 0.00 C ATOM 1771 O GLN A 118 4.830 23.314 -16.649 1.00 0.00 O ATOM 1772 CB GLN A 118 2.296 23.148 -15.163 1.00 0.00 C ATOM 1773 CG GLN A 118 1.140 24.017 -15.731 1.00 0.00 C ATOM 1774 CD GLN A 118 1.499 24.850 -16.968 1.00 0.00 C ATOM 1775 OE1 GLN A 118 1.975 25.977 -16.852 1.00 0.00 O ATOM 1776 NE2 GLN A 118 1.271 24.302 -18.150 1.00 0.00 N ATOM 0 H GLN A 118 3.685 21.252 -14.331 1.00 0.00 H new ATOM 0 HA GLN A 118 2.037 21.641 -16.701 1.00 0.00 H new ATOM 0 HB2 GLN A 118 1.948 22.682 -14.241 1.00 0.00 H new ATOM 0 HB3 GLN A 118 3.118 23.811 -14.895 1.00 0.00 H new ATOM 0 HG2 GLN A 118 0.305 23.363 -15.982 1.00 0.00 H new ATOM 0 HG3 GLN A 118 0.793 24.690 -14.947 1.00 0.00 H new ATOM 0 HE21 GLN A 118 0.875 23.364 -18.209 1.00 0.00 H new ATOM 0 HE22 GLN A 118 1.491 24.817 -19.002 1.00 0.00 H new ATOM 1785 N VAL A 119 3.880 22.115 -18.332 1.00 0.00 N ATOM 1786 CA VAL A 119 4.788 22.591 -19.392 1.00 0.00 C ATOM 1787 C VAL A 119 4.151 23.807 -20.090 1.00 0.00 C ATOM 1788 O VAL A 119 2.939 23.834 -20.341 1.00 0.00 O ATOM 1789 CB VAL A 119 5.142 21.462 -20.451 1.00 0.00 C ATOM 1790 CG1 VAL A 119 5.752 20.218 -19.757 1.00 0.00 C ATOM 1791 CG2 VAL A 119 3.928 21.067 -21.328 1.00 0.00 C ATOM 0 H VAL A 119 3.200 21.426 -18.653 1.00 0.00 H new ATOM 0 HA VAL A 119 5.730 22.876 -18.923 1.00 0.00 H new ATOM 0 HB VAL A 119 5.891 21.885 -21.121 1.00 0.00 H new ATOM 0 HG11 VAL A 119 5.985 19.461 -20.506 1.00 0.00 H new ATOM 0 HG12 VAL A 119 6.665 20.504 -19.234 1.00 0.00 H new ATOM 0 HG13 VAL A 119 5.036 19.813 -19.042 1.00 0.00 H new ATOM 0 HG21 VAL A 119 4.226 20.292 -22.034 1.00 0.00 H new ATOM 0 HG22 VAL A 119 3.127 20.690 -20.692 1.00 0.00 H new ATOM 0 HG23 VAL A 119 3.575 21.941 -21.876 1.00 0.00 H new ATOM 1801 N THR A 120 4.952 24.832 -20.368 1.00 0.00 N ATOM 1802 CA THR A 120 4.486 26.035 -21.060 1.00 0.00 C ATOM 1803 C THR A 120 5.358 26.251 -22.291 1.00 0.00 C ATOM 1804 O THR A 120 6.503 26.686 -22.177 1.00 0.00 O ATOM 1805 CB THR A 120 4.547 27.278 -20.107 1.00 0.00 C ATOM 1806 OG1 THR A 120 3.712 27.049 -18.960 1.00 0.00 O ATOM 1807 CG2 THR A 120 4.119 28.588 -20.797 1.00 0.00 C ATOM 0 H THR A 120 5.941 24.854 -20.121 1.00 0.00 H new ATOM 0 HA THR A 120 3.447 25.909 -21.365 1.00 0.00 H new ATOM 0 HB THR A 120 5.588 27.397 -19.808 1.00 0.00 H new ATOM 0 HG1 THR A 120 3.753 27.827 -18.365 1.00 0.00 H new ATOM 0 HG21 THR A 120 4.183 29.411 -20.086 1.00 0.00 H new ATOM 0 HG22 THR A 120 4.778 28.787 -21.642 1.00 0.00 H new ATOM 0 HG23 THR A 120 3.093 28.494 -21.152 1.00 0.00 H new ATOM 1815 N VAL A 121 4.841 25.913 -23.475 1.00 0.00 N ATOM 1816 CA VAL A 121 5.568 26.183 -24.709 1.00 0.00 C ATOM 1817 C VAL A 121 5.116 27.551 -25.229 1.00 0.00 C ATOM 1818 O VAL A 121 4.073 27.667 -25.896 1.00 0.00 O ATOM 1819 CB VAL A 121 5.354 25.057 -25.770 1.00 0.00 C ATOM 1820 CG1 VAL A 121 6.265 25.275 -27.002 1.00 0.00 C ATOM 1821 CG2 VAL A 121 5.571 23.656 -25.140 1.00 0.00 C ATOM 0 H VAL A 121 3.936 25.459 -23.601 1.00 0.00 H new ATOM 0 HA VAL A 121 6.640 26.198 -24.511 1.00 0.00 H new ATOM 0 HB VAL A 121 4.321 25.106 -26.115 1.00 0.00 H new ATOM 0 HG11 VAL A 121 6.096 24.477 -27.725 1.00 0.00 H new ATOM 0 HG12 VAL A 121 6.033 26.236 -27.461 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.309 25.266 -26.689 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.416 22.888 -25.898 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.588 23.585 -24.753 1.00 0.00 H new ATOM 0 HG23 VAL A 121 4.862 23.510 -24.325 1.00 0.00 H new ATOM 1831 N SER A 122 5.894 28.591 -24.864 1.00 0.00 N ATOM 1832 CA SER A 122 5.640 29.968 -25.295 1.00 0.00 C ATOM 1833 C SER A 122 5.794 30.098 -26.827 1.00 0.00 C ATOM 1834 O SER A 122 6.669 29.465 -27.425 1.00 0.00 O ATOM 1835 CB SER A 122 6.589 30.932 -24.563 1.00 0.00 C ATOM 1836 OG SER A 122 6.233 32.288 -24.779 1.00 0.00 O ATOM 0 H SER A 122 6.713 28.493 -24.263 1.00 0.00 H new ATOM 0 HA SER A 122 4.614 30.232 -25.040 1.00 0.00 H new ATOM 0 HB2 SER A 122 6.572 30.718 -23.494 1.00 0.00 H new ATOM 0 HB3 SER A 122 7.611 30.766 -24.905 1.00 0.00 H new ATOM 0 HG SER A 122 6.982 32.760 -25.199 1.00 0.00 H new ATOM 1842 N SER A 123 4.929 30.917 -27.437 1.00 0.00 N ATOM 1843 CA SER A 123 4.845 31.073 -28.894 1.00 0.00 C ATOM 1844 C SER A 123 6.079 31.818 -29.464 1.00 0.00 C ATOM 1845 O SER A 123 6.076 33.051 -29.564 1.00 0.00 O ATOM 1846 CB SER A 123 3.520 31.790 -29.245 1.00 0.00 C ATOM 1847 OG SER A 123 3.333 32.947 -28.443 1.00 0.00 O ATOM 0 H SER A 123 4.261 31.496 -26.928 1.00 0.00 H new ATOM 0 HA SER A 123 4.849 30.088 -29.362 1.00 0.00 H new ATOM 0 HB2 SER A 123 3.524 32.071 -30.298 1.00 0.00 H new ATOM 0 HB3 SER A 123 2.684 31.106 -29.101 1.00 0.00 H new ATOM 0 HG SER A 123 4.149 33.489 -28.456 1.00 0.00 H new ATOM 1853 N LEU A 124 7.133 31.025 -29.798 1.00 0.00 N ATOM 1854 CA LEU A 124 8.394 31.458 -30.468 1.00 0.00 C ATOM 1855 C LEU A 124 9.348 32.245 -29.533 1.00 0.00 C ATOM 1856 O LEU A 124 10.562 31.986 -29.510 1.00 0.00 O ATOM 1857 CB LEU A 124 8.141 32.237 -31.798 1.00 0.00 C ATOM 1858 CG LEU A 124 7.618 31.413 -33.023 1.00 0.00 C ATOM 1859 CD1 LEU A 124 8.516 30.195 -33.317 1.00 0.00 C ATOM 1860 CD2 LEU A 124 6.144 31.007 -32.856 1.00 0.00 C ATOM 0 H LEU A 124 7.129 30.024 -29.600 1.00 0.00 H new ATOM 0 HA LEU A 124 8.902 30.529 -30.728 1.00 0.00 H new ATOM 0 HB2 LEU A 124 7.422 33.030 -31.593 1.00 0.00 H new ATOM 0 HB3 LEU A 124 9.074 32.720 -32.089 1.00 0.00 H new ATOM 0 HG LEU A 124 7.670 32.069 -33.892 1.00 0.00 H new ATOM 0 HD11 LEU A 124 8.120 29.649 -34.173 1.00 0.00 H new ATOM 0 HD12 LEU A 124 9.528 30.534 -33.539 1.00 0.00 H new ATOM 0 HD13 LEU A 124 8.536 29.539 -32.447 1.00 0.00 H new ATOM 0 HD21 LEU A 124 5.822 30.437 -33.728 1.00 0.00 H new ATOM 0 HD22 LEU A 124 6.035 30.394 -31.962 1.00 0.00 H new ATOM 0 HD23 LEU A 124 5.529 31.902 -32.760 1.00 0.00 H new ATOM 1872 N GLU A 125 8.796 33.217 -28.796 1.00 0.00 N ATOM 1873 CA GLU A 125 9.518 33.984 -27.766 1.00 0.00 C ATOM 1874 C GLU A 125 9.810 33.098 -26.548 1.00 0.00 C ATOM 1875 O GLU A 125 8.886 32.713 -25.831 1.00 0.00 O ATOM 1876 CB GLU A 125 8.668 35.212 -27.326 1.00 0.00 C ATOM 1877 CG GLU A 125 8.316 36.192 -28.459 1.00 0.00 C ATOM 1878 CD GLU A 125 7.407 37.346 -28.005 1.00 0.00 C ATOM 1879 OE1 GLU A 125 7.903 38.285 -27.342 1.00 0.00 O ATOM 1880 OE2 GLU A 125 6.197 37.329 -28.314 1.00 0.00 O ATOM 0 H GLU A 125 7.821 33.499 -28.898 1.00 0.00 H new ATOM 0 HA GLU A 125 10.462 34.329 -28.187 1.00 0.00 H new ATOM 0 HB2 GLU A 125 7.743 34.853 -26.875 1.00 0.00 H new ATOM 0 HB3 GLU A 125 9.211 35.754 -26.552 1.00 0.00 H new ATOM 0 HG2 GLU A 125 9.236 36.605 -28.872 1.00 0.00 H new ATOM 0 HG3 GLU A 125 7.823 35.645 -29.263 1.00 0.00 H new ATOM 1887 N HIS A 126 11.086 32.760 -26.323 1.00 0.00 N ATOM 1888 CA HIS A 126 11.500 32.058 -25.101 1.00 0.00 C ATOM 1889 C HIS A 126 11.558 33.093 -23.963 1.00 0.00 C ATOM 1890 O HIS A 126 12.621 33.650 -23.656 1.00 0.00 O ATOM 1891 CB HIS A 126 12.856 31.321 -25.294 1.00 0.00 C ATOM 1892 CG HIS A 126 13.196 30.316 -24.203 1.00 0.00 C ATOM 1893 ND1 HIS A 126 13.932 29.179 -24.447 1.00 0.00 N ATOM 1894 CD2 HIS A 126 12.892 30.268 -22.871 1.00 0.00 C ATOM 1895 CE1 HIS A 126 14.068 28.487 -23.335 1.00 0.00 C ATOM 1896 NE2 HIS A 126 13.449 29.121 -22.363 1.00 0.00 N ATOM 0 H HIS A 126 11.849 32.961 -26.970 1.00 0.00 H new ATOM 0 HA HIS A 126 10.778 31.280 -24.852 1.00 0.00 H new ATOM 0 HB2 HIS A 126 12.839 30.803 -26.253 1.00 0.00 H new ATOM 0 HB3 HIS A 126 13.653 32.063 -25.346 1.00 0.00 H new ATOM 0 HD1 HIS A 126 14.315 28.912 -25.354 1.00 0.00 H new ATOM 0 HD2 HIS A 126 12.319 30.999 -22.320 1.00 0.00 H new ATOM 0 HE1 HIS A 126 14.600 27.552 -23.237 1.00 0.00 H new ATOM 1905 N HIS A 127 10.377 33.379 -23.389 1.00 0.00 N ATOM 1906 CA HIS A 127 10.219 34.345 -22.287 1.00 0.00 C ATOM 1907 C HIS A 127 10.797 33.792 -20.977 1.00 0.00 C ATOM 1908 O HIS A 127 10.878 32.577 -20.779 1.00 0.00 O ATOM 1909 CB HIS A 127 8.728 34.734 -22.095 1.00 0.00 C ATOM 1910 CG HIS A 127 8.176 35.657 -23.147 1.00 0.00 C ATOM 1911 ND1 HIS A 127 6.884 35.576 -23.621 1.00 0.00 N ATOM 1912 CD2 HIS A 127 8.727 36.731 -23.761 1.00 0.00 C ATOM 1913 CE1 HIS A 127 6.665 36.553 -24.474 1.00 0.00 C ATOM 1914 NE2 HIS A 127 7.766 37.267 -24.575 1.00 0.00 N ATOM 0 H HIS A 127 9.500 32.945 -23.678 1.00 0.00 H new ATOM 0 HA HIS A 127 10.777 35.242 -22.556 1.00 0.00 H new ATOM 0 HB2 HIS A 127 8.129 33.824 -22.080 1.00 0.00 H new ATOM 0 HB3 HIS A 127 8.613 35.207 -21.120 1.00 0.00 H new ATOM 0 HD2 HIS A 127 9.735 37.096 -23.632 1.00 0.00 H new ATOM 0 HE1 HIS A 127 5.741 36.738 -25.001 1.00 0.00 H new ATOM 0 HE2 HIS A 127 7.884 38.090 -25.166 1.00 0.00 H new ATOM 1923 N HIS A 128 11.223 34.707 -20.106 1.00 0.00 N ATOM 1924 CA HIS A 128 11.727 34.398 -18.762 1.00 0.00 C ATOM 1925 C HIS A 128 10.732 34.927 -17.718 1.00 0.00 C ATOM 1926 O HIS A 128 9.588 35.280 -18.048 1.00 0.00 O ATOM 1927 CB HIS A 128 13.141 35.030 -18.572 1.00 0.00 C ATOM 1928 CG HIS A 128 14.256 34.368 -19.341 1.00 0.00 C ATOM 1929 ND1 HIS A 128 15.562 34.801 -19.273 1.00 0.00 N ATOM 1930 CD2 HIS A 128 14.266 33.297 -20.176 1.00 0.00 C ATOM 1931 CE1 HIS A 128 16.320 34.035 -20.028 1.00 0.00 C ATOM 1932 NE2 HIS A 128 15.565 33.114 -20.588 1.00 0.00 N ATOM 0 H HIS A 128 11.229 35.705 -20.317 1.00 0.00 H new ATOM 0 HA HIS A 128 11.822 33.320 -18.634 1.00 0.00 H new ATOM 0 HB2 HIS A 128 13.094 36.079 -18.865 1.00 0.00 H new ATOM 0 HB3 HIS A 128 13.391 35.007 -17.511 1.00 0.00 H new ATOM 0 HD2 HIS A 128 13.413 32.700 -20.463 1.00 0.00 H new ATOM 0 HE1 HIS A 128 17.386 34.144 -20.165 1.00 0.00 H new ATOM 0 HE2 HIS A 128 15.890 32.385 -21.223 1.00 0.00 H new ATOM 1941 N HIS A 129 11.177 34.961 -16.461 1.00 0.00 N ATOM 1942 CA HIS A 129 10.405 35.495 -15.328 1.00 0.00 C ATOM 1943 C HIS A 129 11.377 36.049 -14.268 1.00 0.00 C ATOM 1944 O HIS A 129 12.605 35.933 -14.418 1.00 0.00 O ATOM 1945 CB HIS A 129 9.494 34.388 -14.731 1.00 0.00 C ATOM 1946 CG HIS A 129 10.239 33.232 -14.108 1.00 0.00 C ATOM 1947 ND1 HIS A 129 10.639 33.225 -12.790 1.00 0.00 N ATOM 1948 CD2 HIS A 129 10.671 32.058 -14.629 1.00 0.00 C ATOM 1949 CE1 HIS A 129 11.278 32.108 -12.528 1.00 0.00 C ATOM 1950 NE2 HIS A 129 11.311 31.378 -13.623 1.00 0.00 N ATOM 0 H HIS A 129 12.098 34.614 -16.193 1.00 0.00 H new ATOM 0 HA HIS A 129 9.761 36.306 -15.670 1.00 0.00 H new ATOM 0 HB2 HIS A 129 8.847 34.835 -13.977 1.00 0.00 H new ATOM 0 HB3 HIS A 129 8.846 34.004 -15.519 1.00 0.00 H new ATOM 0 HD1 HIS A 129 10.465 33.974 -12.119 1.00 0.00 H new ATOM 0 HD2 HIS A 129 10.537 31.720 -15.646 1.00 0.00 H new ATOM 0 HE1 HIS A 129 11.705 31.834 -11.574 1.00 0.00 H new ATOM 1959 N HIS A 130 10.819 36.646 -13.202 1.00 0.00 N ATOM 1960 CA HIS A 130 11.605 37.155 -12.067 1.00 0.00 C ATOM 1961 C HIS A 130 12.195 35.979 -11.270 1.00 0.00 C ATOM 1962 O HIS A 130 11.452 35.187 -10.681 1.00 0.00 O ATOM 1963 CB HIS A 130 10.741 38.053 -11.149 1.00 0.00 C ATOM 1964 CG HIS A 130 11.485 38.563 -9.940 1.00 0.00 C ATOM 1965 ND1 HIS A 130 11.394 37.972 -8.693 1.00 0.00 N ATOM 1966 CD2 HIS A 130 12.350 39.596 -9.796 1.00 0.00 C ATOM 1967 CE1 HIS A 130 12.168 38.617 -7.845 1.00 0.00 C ATOM 1968 NE2 HIS A 130 12.753 39.607 -8.486 1.00 0.00 N ATOM 0 H HIS A 130 9.814 36.789 -13.103 1.00 0.00 H new ATOM 0 HA HIS A 130 12.420 37.765 -12.458 1.00 0.00 H new ATOM 0 HB2 HIS A 130 10.373 38.902 -11.725 1.00 0.00 H new ATOM 0 HB3 HIS A 130 9.868 37.490 -10.819 1.00 0.00 H new ATOM 0 HD2 HIS A 130 12.663 40.282 -10.569 1.00 0.00 H new ATOM 0 HE1 HIS A 130 12.300 38.375 -6.801 1.00 0.00 H new ATOM 0 HE2 HIS A 130 13.403 40.276 -8.073 1.00 0.00 H new ATOM 1977 N HIS A 131 13.526 35.862 -11.308 1.00 0.00 N ATOM 1978 CA HIS A 131 14.291 34.881 -10.527 1.00 0.00 C ATOM 1979 C HIS A 131 15.519 35.607 -9.929 1.00 0.00 C ATOM 1980 O HIS A 131 15.446 36.065 -8.771 1.00 0.00 O ATOM 1981 CB HIS A 131 14.693 33.664 -11.416 1.00 0.00 C ATOM 1982 CG HIS A 131 15.521 32.621 -10.701 1.00 0.00 C ATOM 1983 ND1 HIS A 131 16.818 32.321 -11.057 1.00 0.00 N ATOM 1984 CD2 HIS A 131 15.223 31.798 -9.666 1.00 0.00 C ATOM 1985 CE1 HIS A 131 17.284 31.375 -10.268 1.00 0.00 C ATOM 1986 NE2 HIS A 131 16.336 31.033 -9.422 1.00 0.00 N ATOM 1987 OXT HIS A 131 16.527 35.783 -10.644 1.00 0.00 O ATOM 0 H HIS A 131 14.114 36.456 -11.892 1.00 0.00 H new ATOM 0 HA HIS A 131 13.688 34.475 -9.715 1.00 0.00 H new ATOM 0 HB2 HIS A 131 13.788 33.193 -11.799 1.00 0.00 H new ATOM 0 HB3 HIS A 131 15.252 34.027 -12.278 1.00 0.00 H new ATOM 0 HD2 HIS A 131 14.285 31.753 -9.133 1.00 0.00 H new ATOM 0 HE1 HIS A 131 18.277 30.951 -10.309 1.00 0.00 H new ATOM 0 HE2 HIS A 131 16.415 30.315 -8.701 1.00 0.00 H new TER 1996 HIS A 131