USER MOD reduce.3.24.130724 H: found=0, std=0, add=1206, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1204 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 47 ASN : amide:sc= -1.97! C(o=-1.6!,f=-6.9!) USER MOD Set 1.2: A 143 SER OG : rot 88:sc= 0.384 USER MOD Set 2.1: A 44 SER OG : rot 166:sc= -3.37! USER MOD Set 2.2: A 54 SER OG : rot 13:sc= 0.923 USER MOD Set 3.1: A 42 TYR OH : rot 76:sc= 0.859 USER MOD Set 3.2: A 166 HIS :FLIP no HD1:sc= 0.666 F(o=-0.24,f=1.5) USER MOD Set 4.1: A 11 SER OG : rot 126:sc= -0.645 USER MOD Set 4.2: A 25 CYS SG : rot -140:sc= -4.14! USER MOD Set 5.1: A 10 SER OG : rot -160:sc= 0.994 USER MOD Set 5.2: A 159 ASN : amide:sc= -1.93! C(o=-0.94!,f=-8.2!) USER MOD Set 6.1: A 2 ASN : amide:sc= -1.8! C(o=-2.6!,f=-4!) USER MOD Set 6.2: A 6 ASN : amide:sc= -0.74 K(o=-2.6,f=-5.8!) USER MOD Set 6.3: A 8 SER OG : rot 51:sc= -0.0485 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 CYS SG : rot -10:sc= -0.0831 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -59:sc= 1.26 USER MOD Single : A 35 SER OG : rot 80:sc= -1.68! USER MOD Single : A 40 ASN : amide:sc= 0.475 K(o=0.47,f=-1.2) USER MOD Single : A 45 ASN : amide:sc= -1.01 K(o=-1,f=-6!) USER MOD Single : A 49 HIS : no HD1:sc= -0.114 X(o=-0.11,f=-0.089) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 40:sc= 0.005 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.446 X(o=-0.45,f=-0.91) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 72 THR OG1 : rot -76:sc= 1.33 USER MOD Single : A 82 CYS SG : rot -170:sc= -5.8! USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 91 ASN : amide:sc= -0.104 K(o=-0.1,f=-2.8!) USER MOD Single : A 92 ASN : amide:sc= -0.0172 K(o=-0.017,f=-0.96) USER MOD Single : A 94 GLN : amide:sc= -0.453 X(o=-0.45,f=-0.11) USER MOD Single : A 95 ASN : amide:sc= -1.15 X(o=-1.1,f=-1.2) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 GLN :FLIP amide:sc= -1.19 F(o=-2.4!,f=-1.2) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 179:sc= 0.681 (180deg=0.68) USER MOD Single : A 113 SER OG : rot 180:sc= 0.197 USER MOD Single : A 119 ASN : amide:sc= 1.06 K(o=1.1,f=-1.3) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -0.471 K(o=-0.47,f=-5!) USER MOD Single : A 149 SER OG : rot 117:sc= 1.2 USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 HIS : no HE2:sc= -0.583! C(o=-0.58!,f=-6.4!) USER MOD Single : A 161 ASN : amide:sc= 0.886 K(o=0.89,f=-5.6!) USER MOD Single : A 167 CYS SG : rot 35:sc= -0.096 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.175 10.901 13.895 1.00 0.00 N ATOM 2 CA GLY A 1 -14.753 10.802 12.480 1.00 0.00 C ATOM 3 C GLY A 1 -14.154 9.450 12.168 1.00 0.00 C ATOM 4 O GLY A 1 -14.681 8.415 12.586 1.00 0.00 O ATOM 0 H1 GLY A 1 -15.581 11.842 14.071 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.890 10.173 14.096 1.00 0.00 H new ATOM 0 H3 GLY A 1 -14.351 10.758 14.514 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.611 10.978 11.831 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.023 11.582 12.262 1.00 0.00 H new ATOM 8 N ASN A 2 -13.046 9.457 11.444 1.00 0.00 N ATOM 9 CA ASN A 2 -12.362 8.228 11.075 1.00 0.00 C ATOM 10 C ASN A 2 -10.903 8.296 11.518 1.00 0.00 C ATOM 11 O ASN A 2 -10.581 9.011 12.466 1.00 0.00 O ATOM 12 CB ASN A 2 -12.469 7.997 9.566 1.00 0.00 C ATOM 13 CG ASN A 2 -13.913 7.932 9.094 1.00 0.00 C ATOM 14 OD1 ASN A 2 -14.487 8.931 8.660 1.00 0.00 O ATOM 15 ND2 ASN A 2 -14.513 6.761 9.192 1.00 0.00 N ATOM 0 H ASN A 2 -12.599 10.306 11.098 1.00 0.00 H new ATOM 0 HA ASN A 2 -12.836 7.386 11.579 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -11.953 8.800 9.040 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -11.962 7.068 9.306 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -15.486 6.661 8.903 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -14.004 5.956 9.557 1.00 0.00 H new ATOM 22 N TYR A 3 -10.013 7.577 10.841 1.00 0.00 N ATOM 23 CA TYR A 3 -8.608 7.583 11.222 1.00 0.00 C ATOM 24 C TYR A 3 -7.869 8.667 10.456 1.00 0.00 C ATOM 25 O TYR A 3 -7.776 9.806 10.913 1.00 0.00 O ATOM 26 CB TYR A 3 -7.975 6.213 10.988 1.00 0.00 C ATOM 27 CG TYR A 3 -8.594 5.104 11.815 1.00 0.00 C ATOM 28 CD1 TYR A 3 -9.847 4.589 11.502 1.00 0.00 C ATOM 29 CD2 TYR A 3 -7.918 4.565 12.901 1.00 0.00 C ATOM 30 CE1 TYR A 3 -10.410 3.575 12.250 1.00 0.00 C ATOM 31 CE2 TYR A 3 -8.472 3.546 13.652 1.00 0.00 C ATOM 32 CZ TYR A 3 -9.717 3.054 13.323 1.00 0.00 C ATOM 33 OH TYR A 3 -10.270 2.034 14.066 1.00 0.00 O ATOM 0 H TYR A 3 -10.237 6.991 10.037 1.00 0.00 H new ATOM 0 HA TYR A 3 -8.534 7.801 12.287 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -8.063 5.958 9.932 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -6.910 6.272 11.214 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -10.389 4.990 10.658 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -6.943 4.948 13.163 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -11.387 3.192 11.997 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -7.932 3.137 14.493 1.00 0.00 H new ATOM 0 HH TYR A 3 -9.653 1.781 14.784 1.00 0.00 H new ATOM 43 N ALA A 4 -7.357 8.320 9.292 1.00 0.00 N ATOM 44 CA ALA A 4 -6.663 9.276 8.458 1.00 0.00 C ATOM 45 C ALA A 4 -7.408 9.462 7.152 1.00 0.00 C ATOM 46 O ALA A 4 -7.445 10.565 6.610 1.00 0.00 O ATOM 47 CB ALA A 4 -5.228 8.840 8.188 1.00 0.00 C ATOM 0 H ALA A 4 -7.410 7.379 8.903 1.00 0.00 H new ATOM 0 HA ALA A 4 -6.628 10.226 8.991 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -4.735 9.581 7.558 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -4.691 8.751 9.132 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -5.230 7.876 7.680 1.00 0.00 H new ATOM 53 N GLY A 5 -8.040 8.390 6.662 1.00 0.00 N ATOM 54 CA GLY A 5 -8.751 8.488 5.414 1.00 0.00 C ATOM 55 C GLY A 5 -10.008 9.319 5.523 1.00 0.00 C ATOM 56 O GLY A 5 -10.130 10.359 4.876 1.00 0.00 O ATOM 0 H GLY A 5 -8.066 7.473 7.108 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -8.096 8.925 4.661 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -9.011 7.487 5.069 1.00 0.00 H new ATOM 60 N ASN A 6 -10.941 8.856 6.347 1.00 0.00 N ATOM 61 CA ASN A 6 -12.220 9.541 6.554 1.00 0.00 C ATOM 62 C ASN A 6 -13.055 9.538 5.279 1.00 0.00 C ATOM 63 O ASN A 6 -14.007 10.309 5.157 1.00 0.00 O ATOM 64 CB ASN A 6 -12.025 11.000 7.017 1.00 0.00 C ATOM 65 CG ASN A 6 -11.297 11.135 8.343 1.00 0.00 C ATOM 66 OD1 ASN A 6 -11.915 11.148 9.406 1.00 0.00 O ATOM 67 ND2 ASN A 6 -9.980 11.262 8.292 1.00 0.00 N ATOM 0 H ASN A 6 -10.837 7.999 6.890 1.00 0.00 H new ATOM 0 HA ASN A 6 -12.741 8.991 7.337 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -11.469 11.542 6.252 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -13.001 11.478 7.100 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -9.445 11.375 9.153 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -9.501 11.247 7.392 1.00 0.00 H new ATOM 74 N PHE A 7 -12.707 8.675 4.324 1.00 0.00 N ATOM 75 CA PHE A 7 -13.444 8.620 3.069 1.00 0.00 C ATOM 76 C PHE A 7 -14.888 8.190 3.282 1.00 0.00 C ATOM 77 O PHE A 7 -15.771 8.693 2.614 1.00 0.00 O ATOM 78 CB PHE A 7 -12.749 7.713 2.043 1.00 0.00 C ATOM 79 CG PHE A 7 -13.011 6.238 2.182 1.00 0.00 C ATOM 80 CD1 PHE A 7 -12.833 5.583 3.387 1.00 0.00 C ATOM 81 CD2 PHE A 7 -13.409 5.506 1.080 1.00 0.00 C ATOM 82 CE1 PHE A 7 -13.055 4.227 3.489 1.00 0.00 C ATOM 83 CE2 PHE A 7 -13.632 4.152 1.177 1.00 0.00 C ATOM 84 CZ PHE A 7 -13.455 3.512 2.383 1.00 0.00 C ATOM 0 H PHE A 7 -11.932 8.016 4.396 1.00 0.00 H new ATOM 0 HA PHE A 7 -13.456 9.632 2.665 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -13.057 8.024 1.045 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -11.674 7.879 2.111 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -12.517 6.140 4.257 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -13.547 6.003 0.131 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -12.915 3.726 4.435 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -13.945 3.592 0.308 1.00 0.00 H new ATOM 0 HZ PHE A 7 -13.630 2.449 2.461 1.00 0.00 H new ATOM 94 N SER A 8 -15.135 7.302 4.238 1.00 0.00 N ATOM 95 CA SER A 8 -16.490 6.826 4.503 1.00 0.00 C ATOM 96 C SER A 8 -17.385 7.964 4.979 1.00 0.00 C ATOM 97 O SER A 8 -18.612 7.871 4.933 1.00 0.00 O ATOM 98 CB SER A 8 -16.456 5.699 5.533 1.00 0.00 C ATOM 99 OG SER A 8 -15.677 6.069 6.659 1.00 0.00 O ATOM 0 H SER A 8 -14.419 6.898 4.841 1.00 0.00 H new ATOM 0 HA SER A 8 -16.909 6.440 3.574 1.00 0.00 H new ATOM 0 HB2 SER A 8 -17.471 5.459 5.850 1.00 0.00 H new ATOM 0 HB3 SER A 8 -16.043 4.798 5.079 1.00 0.00 H new ATOM 0 HG SER A 8 -15.974 6.943 6.989 1.00 0.00 H new ATOM 105 N GLY A 9 -16.756 9.035 5.439 1.00 0.00 N ATOM 106 CA GLY A 9 -17.492 10.194 5.907 1.00 0.00 C ATOM 107 C GLY A 9 -18.107 11.016 4.778 1.00 0.00 C ATOM 108 O GLY A 9 -19.111 11.702 4.986 1.00 0.00 O ATOM 0 H GLY A 9 -15.742 9.123 5.497 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -18.284 9.865 6.580 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -16.824 10.830 6.487 1.00 0.00 H new ATOM 112 N SER A 10 -17.519 10.961 3.584 1.00 0.00 N ATOM 113 CA SER A 10 -18.032 11.729 2.454 1.00 0.00 C ATOM 114 C SER A 10 -18.274 10.846 1.230 1.00 0.00 C ATOM 115 O SER A 10 -19.028 11.206 0.338 1.00 0.00 O ATOM 116 CB SER A 10 -17.053 12.855 2.108 1.00 0.00 C ATOM 117 OG SER A 10 -15.739 12.350 1.922 1.00 0.00 O ATOM 0 H SER A 10 -16.694 10.398 3.376 1.00 0.00 H new ATOM 0 HA SER A 10 -18.992 12.154 2.745 1.00 0.00 H new ATOM 0 HB2 SER A 10 -17.383 13.362 1.201 1.00 0.00 H new ATOM 0 HB3 SER A 10 -17.051 13.598 2.906 1.00 0.00 H new ATOM 0 HG SER A 10 -15.092 13.079 2.018 1.00 0.00 H new ATOM 123 N SER A 11 -17.638 9.695 1.197 1.00 0.00 N ATOM 124 CA SER A 11 -17.777 8.773 0.096 1.00 0.00 C ATOM 125 C SER A 11 -18.818 7.727 0.456 1.00 0.00 C ATOM 126 O SER A 11 -18.791 7.163 1.551 1.00 0.00 O ATOM 127 CB SER A 11 -16.426 8.119 -0.201 1.00 0.00 C ATOM 128 OG SER A 11 -16.410 7.529 -1.480 1.00 0.00 O ATOM 0 H SER A 11 -17.010 9.374 1.934 1.00 0.00 H new ATOM 0 HA SER A 11 -18.103 9.303 -0.799 1.00 0.00 H new ATOM 0 HB2 SER A 11 -15.636 8.867 -0.134 1.00 0.00 H new ATOM 0 HB3 SER A 11 -16.213 7.362 0.553 1.00 0.00 H new ATOM 0 HG SER A 11 -15.647 7.874 -1.990 1.00 0.00 H new ATOM 134 N ARG A 12 -19.753 7.490 -0.444 1.00 0.00 N ATOM 135 CA ARG A 12 -20.796 6.515 -0.195 1.00 0.00 C ATOM 136 C ARG A 12 -20.629 5.334 -1.132 1.00 0.00 C ATOM 137 O ARG A 12 -19.683 5.283 -1.903 1.00 0.00 O ATOM 138 CB ARG A 12 -22.184 7.140 -0.372 1.00 0.00 C ATOM 139 CG ARG A 12 -22.522 7.482 -1.815 1.00 0.00 C ATOM 140 CD ARG A 12 -23.975 7.909 -1.968 1.00 0.00 C ATOM 141 NE ARG A 12 -24.883 6.765 -1.916 1.00 0.00 N ATOM 142 CZ ARG A 12 -26.068 6.763 -1.305 1.00 0.00 C ATOM 143 NH1 ARG A 12 -26.521 7.861 -0.715 1.00 0.00 N ATOM 144 NH2 ARG A 12 -26.813 5.666 -1.309 1.00 0.00 N ATOM 0 H ARG A 12 -19.812 7.957 -1.349 1.00 0.00 H new ATOM 0 HA ARG A 12 -20.709 6.171 0.836 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -22.935 6.451 0.014 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -22.244 8.046 0.230 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -21.869 8.283 -2.161 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -22.329 6.617 -2.449 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -24.232 8.614 -1.177 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -24.103 8.432 -2.916 1.00 0.00 H new ATOM 0 HE ARG A 12 -24.589 5.906 -2.381 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -25.962 8.714 -0.727 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -27.428 7.852 -0.249 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -26.479 4.825 -1.779 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -27.720 5.664 -0.842 1.00 0.00 H new ATOM 158 N ASP A 13 -21.559 4.403 -1.044 1.00 0.00 N ATOM 159 CA ASP A 13 -21.566 3.189 -1.862 1.00 0.00 C ATOM 160 C ASP A 13 -20.185 2.564 -1.959 1.00 0.00 C ATOM 161 O ASP A 13 -19.743 2.179 -3.044 1.00 0.00 O ATOM 162 CB ASP A 13 -22.104 3.479 -3.263 1.00 0.00 C ATOM 163 CG ASP A 13 -23.607 3.654 -3.279 1.00 0.00 C ATOM 164 OD1 ASP A 13 -24.330 2.650 -3.115 1.00 0.00 O ATOM 165 OD2 ASP A 13 -24.076 4.795 -3.457 1.00 0.00 O ATOM 0 H ASP A 13 -22.345 4.462 -0.396 1.00 0.00 H new ATOM 0 HA ASP A 13 -22.225 2.476 -1.367 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -21.632 4.382 -3.651 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -21.829 2.663 -3.931 1.00 0.00 H new ATOM 170 N ILE A 14 -19.503 2.463 -0.826 1.00 0.00 N ATOM 171 CA ILE A 14 -18.175 1.913 -0.792 1.00 0.00 C ATOM 172 C ILE A 14 -18.237 0.392 -0.858 1.00 0.00 C ATOM 173 O ILE A 14 -18.568 -0.271 0.126 1.00 0.00 O ATOM 174 CB ILE A 14 -17.460 2.360 0.499 1.00 0.00 C ATOM 175 CG1 ILE A 14 -17.703 3.860 0.720 1.00 0.00 C ATOM 176 CG2 ILE A 14 -15.979 2.059 0.419 1.00 0.00 C ATOM 177 CD1 ILE A 14 -16.903 4.466 1.851 1.00 0.00 C ATOM 0 H ILE A 14 -19.860 2.760 0.082 1.00 0.00 H new ATOM 0 HA ILE A 14 -17.615 2.277 -1.653 1.00 0.00 H new ATOM 0 HB ILE A 14 -17.865 1.806 1.346 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -17.467 4.393 -0.201 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -18.763 4.018 0.917 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -15.492 2.382 1.339 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -15.832 0.987 0.287 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -15.545 2.591 -0.427 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -17.137 5.527 1.935 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -17.155 3.964 2.785 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -15.839 4.344 1.650 1.00 0.00 H new ATOM 189 N CYS A 15 -17.950 -0.145 -2.033 1.00 0.00 N ATOM 190 CA CYS A 15 -17.944 -1.578 -2.267 1.00 0.00 C ATOM 191 C CYS A 15 -16.838 -1.911 -3.257 1.00 0.00 C ATOM 192 O CYS A 15 -16.742 -1.293 -4.313 1.00 0.00 O ATOM 193 CB CYS A 15 -19.292 -2.045 -2.815 1.00 0.00 C ATOM 194 SG CYS A 15 -20.713 -1.570 -1.803 1.00 0.00 S ATOM 0 H CYS A 15 -17.713 0.407 -2.857 1.00 0.00 H new ATOM 0 HA CYS A 15 -17.767 -2.093 -1.323 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -19.423 -1.639 -3.818 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -19.276 -3.131 -2.910 1.00 0.00 H new ATOM 0 HG CYS A 15 -20.297 -1.098 -0.666 1.00 0.00 H new ATOM 200 N LEU A 16 -15.986 -2.863 -2.914 1.00 0.00 N ATOM 201 CA LEU A 16 -14.890 -3.231 -3.796 1.00 0.00 C ATOM 202 C LEU A 16 -15.197 -4.444 -4.643 1.00 0.00 C ATOM 203 O LEU A 16 -16.054 -5.268 -4.316 1.00 0.00 O ATOM 204 CB LEU A 16 -13.593 -3.507 -3.032 1.00 0.00 C ATOM 205 CG LEU A 16 -13.705 -3.666 -1.527 1.00 0.00 C ATOM 206 CD1 LEU A 16 -14.314 -5.015 -1.181 1.00 0.00 C ATOM 207 CD2 LEU A 16 -12.332 -3.496 -0.893 1.00 0.00 C ATOM 0 H LEU A 16 -16.030 -3.390 -2.042 1.00 0.00 H new ATOM 0 HA LEU A 16 -14.760 -2.364 -4.444 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -13.147 -4.415 -3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -12.898 -2.692 -3.237 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.365 -2.896 -1.128 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -14.388 -5.114 -0.098 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -15.309 -5.089 -1.621 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -13.683 -5.811 -1.576 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -12.414 -3.610 0.188 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.653 -4.252 -1.288 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.945 -2.504 -1.125 1.00 0.00 H new ATOM 219 N ASP A 17 -14.468 -4.532 -5.737 1.00 0.00 N ATOM 220 CA ASP A 17 -14.571 -5.644 -6.651 1.00 0.00 C ATOM 221 C ASP A 17 -13.426 -6.597 -6.353 1.00 0.00 C ATOM 222 O ASP A 17 -12.394 -6.588 -7.032 1.00 0.00 O ATOM 223 CB ASP A 17 -14.512 -5.160 -8.103 1.00 0.00 C ATOM 224 CG ASP A 17 -14.836 -6.260 -9.092 1.00 0.00 C ATOM 225 OD1 ASP A 17 -16.033 -6.518 -9.322 1.00 0.00 O ATOM 226 OD2 ASP A 17 -13.897 -6.866 -9.650 1.00 0.00 O ATOM 0 H ASP A 17 -13.784 -3.828 -6.016 1.00 0.00 H new ATOM 0 HA ASP A 17 -15.526 -6.152 -6.520 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -15.213 -4.336 -8.237 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.517 -4.769 -8.312 1.00 0.00 H new ATOM 231 N GLY A 18 -13.567 -7.324 -5.255 1.00 0.00 N ATOM 232 CA GLY A 18 -12.560 -8.285 -4.853 1.00 0.00 C ATOM 233 C GLY A 18 -11.404 -7.630 -4.126 1.00 0.00 C ATOM 234 O GLY A 18 -11.047 -8.023 -3.021 1.00 0.00 O ATOM 0 H GLY A 18 -14.370 -7.264 -4.629 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -13.014 -9.037 -4.207 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -12.185 -8.806 -5.734 1.00 0.00 H new ATOM 238 N ALA A 19 -10.828 -6.620 -4.756 1.00 0.00 N ATOM 239 CA ALA A 19 -9.712 -5.894 -4.190 1.00 0.00 C ATOM 240 C ALA A 19 -9.739 -4.446 -4.655 1.00 0.00 C ATOM 241 O ALA A 19 -9.038 -3.597 -4.115 1.00 0.00 O ATOM 242 CB ALA A 19 -8.409 -6.561 -4.591 1.00 0.00 C ATOM 0 H ALA A 19 -11.123 -6.283 -5.673 1.00 0.00 H new ATOM 0 HA ALA A 19 -9.790 -5.906 -3.103 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -7.572 -6.011 -4.162 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -8.396 -7.586 -4.222 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.322 -6.566 -5.678 1.00 0.00 H new ATOM 248 N ARG A 20 -10.550 -4.167 -5.667 1.00 0.00 N ATOM 249 CA ARG A 20 -10.673 -2.807 -6.184 1.00 0.00 C ATOM 250 C ARG A 20 -11.711 -2.019 -5.384 1.00 0.00 C ATOM 251 O ARG A 20 -12.904 -2.072 -5.679 1.00 0.00 O ATOM 252 CB ARG A 20 -11.047 -2.818 -7.670 1.00 0.00 C ATOM 253 CG ARG A 20 -9.962 -3.386 -8.569 1.00 0.00 C ATOM 254 CD ARG A 20 -10.276 -3.151 -10.039 1.00 0.00 C ATOM 255 NE ARG A 20 -9.220 -3.656 -10.915 1.00 0.00 N ATOM 256 CZ ARG A 20 -8.562 -2.908 -11.806 1.00 0.00 C ATOM 257 NH1 ARG A 20 -8.837 -1.615 -11.934 1.00 0.00 N ATOM 258 NH2 ARG A 20 -7.625 -3.459 -12.566 1.00 0.00 N ATOM 0 H ARG A 20 -11.129 -4.857 -6.144 1.00 0.00 H new ATOM 0 HA ARG A 20 -9.705 -2.318 -6.077 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -11.958 -3.402 -7.802 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -11.272 -1.800 -7.986 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -9.005 -2.925 -8.322 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -9.858 -4.455 -8.385 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -11.218 -3.638 -10.290 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -10.412 -2.084 -10.214 1.00 0.00 H new ATOM 0 HE ARG A 20 -8.969 -4.642 -10.841 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -9.555 -1.186 -11.350 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -8.330 -1.051 -12.616 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -7.408 -4.451 -12.470 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.121 -2.891 -13.247 1.00 0.00 H new ATOM 272 N LEU A 21 -11.236 -1.308 -4.363 1.00 0.00 N ATOM 273 CA LEU A 21 -12.082 -0.497 -3.485 1.00 0.00 C ATOM 274 C LEU A 21 -12.766 0.622 -4.243 1.00 0.00 C ATOM 275 O LEU A 21 -12.120 1.540 -4.725 1.00 0.00 O ATOM 276 CB LEU A 21 -11.248 0.057 -2.333 1.00 0.00 C ATOM 277 CG LEU A 21 -11.979 0.982 -1.368 1.00 0.00 C ATOM 278 CD1 LEU A 21 -12.689 0.167 -0.314 1.00 0.00 C ATOM 279 CD2 LEU A 21 -11.012 1.950 -0.713 1.00 0.00 C ATOM 0 H LEU A 21 -10.246 -1.277 -4.119 1.00 0.00 H new ATOM 0 HA LEU A 21 -12.867 -1.137 -3.082 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.844 -0.782 -1.766 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -10.399 0.598 -2.752 1.00 0.00 H new ATOM 0 HG LEU A 21 -12.713 1.559 -1.931 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -13.210 0.835 0.373 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -13.410 -0.497 -0.792 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -11.961 -0.426 0.239 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -11.556 2.600 -0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -10.257 1.392 -0.160 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -10.527 2.555 -1.480 1.00 0.00 H new ATOM 291 N ARG A 22 -14.083 0.551 -4.317 1.00 0.00 N ATOM 292 CA ARG A 22 -14.845 1.541 -5.046 1.00 0.00 C ATOM 293 C ARG A 22 -15.817 2.256 -4.121 1.00 0.00 C ATOM 294 O ARG A 22 -16.501 1.628 -3.327 1.00 0.00 O ATOM 295 CB ARG A 22 -15.598 0.868 -6.191 1.00 0.00 C ATOM 296 CG ARG A 22 -16.220 1.833 -7.181 1.00 0.00 C ATOM 297 CD ARG A 22 -17.043 1.087 -8.210 1.00 0.00 C ATOM 298 NE ARG A 22 -18.224 0.469 -7.607 1.00 0.00 N ATOM 299 CZ ARG A 22 -18.597 -0.792 -7.808 1.00 0.00 C ATOM 300 NH1 ARG A 22 -17.880 -1.583 -8.595 1.00 0.00 N ATOM 301 NH2 ARG A 22 -19.690 -1.254 -7.211 1.00 0.00 N ATOM 0 H ARG A 22 -14.643 -0.181 -3.881 1.00 0.00 H new ATOM 0 HA ARG A 22 -14.159 2.282 -5.456 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -14.912 0.210 -6.725 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -16.383 0.238 -5.773 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -16.851 2.548 -6.652 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -15.438 2.405 -7.679 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -17.353 1.774 -8.997 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -16.429 0.319 -8.681 1.00 0.00 H new ATOM 0 HE ARG A 22 -18.800 1.043 -6.991 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -17.039 -1.225 -9.048 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -18.169 -2.549 -8.747 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -20.236 -0.643 -6.604 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -19.983 -2.220 -7.360 1.00 0.00 H new ATOM 315 N ALA A 23 -15.854 3.568 -4.229 1.00 0.00 N ATOM 316 CA ALA A 23 -16.727 4.393 -3.425 1.00 0.00 C ATOM 317 C ALA A 23 -17.064 5.682 -4.160 1.00 0.00 C ATOM 318 O ALA A 23 -16.268 6.199 -4.945 1.00 0.00 O ATOM 319 CB ALA A 23 -16.088 4.711 -2.085 1.00 0.00 C ATOM 0 H ALA A 23 -15.274 4.094 -4.883 1.00 0.00 H new ATOM 0 HA ALA A 23 -17.647 3.837 -3.246 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -16.764 5.333 -1.498 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -15.889 3.784 -1.548 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -15.152 5.245 -2.246 1.00 0.00 H new ATOM 325 N GLU A 24 -18.254 6.170 -3.905 1.00 0.00 N ATOM 326 CA GLU A 24 -18.762 7.397 -4.487 1.00 0.00 C ATOM 327 C GLU A 24 -18.272 8.595 -3.678 1.00 0.00 C ATOM 328 O GLU A 24 -18.992 9.121 -2.830 1.00 0.00 O ATOM 329 CB GLU A 24 -20.293 7.359 -4.487 1.00 0.00 C ATOM 330 CG GLU A 24 -20.888 6.336 -5.436 1.00 0.00 C ATOM 331 CD GLU A 24 -21.525 6.974 -6.649 1.00 0.00 C ATOM 332 OE1 GLU A 24 -22.722 7.322 -6.578 1.00 0.00 O ATOM 333 OE2 GLU A 24 -20.840 7.131 -7.678 1.00 0.00 O ATOM 0 H GLU A 24 -18.914 5.717 -3.273 1.00 0.00 H new ATOM 0 HA GLU A 24 -18.401 7.492 -5.511 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -20.640 7.146 -3.476 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -20.670 8.347 -4.752 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -20.107 5.648 -5.759 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -21.635 5.745 -4.906 1.00 0.00 H new ATOM 340 N CYS A 25 -17.032 8.989 -3.921 1.00 0.00 N ATOM 341 CA CYS A 25 -16.416 10.111 -3.241 1.00 0.00 C ATOM 342 C CYS A 25 -17.156 11.414 -3.505 1.00 0.00 C ATOM 343 O CYS A 25 -17.326 11.828 -4.655 1.00 0.00 O ATOM 344 CB CYS A 25 -14.973 10.237 -3.707 1.00 0.00 C ATOM 345 SG CYS A 25 -13.978 8.760 -3.426 1.00 0.00 S ATOM 0 H CYS A 25 -16.423 8.534 -4.601 1.00 0.00 H new ATOM 0 HA CYS A 25 -16.458 9.924 -2.168 1.00 0.00 H new ATOM 0 HB2 CYS A 25 -14.965 10.470 -4.772 1.00 0.00 H new ATOM 0 HB3 CYS A 25 -14.508 11.078 -3.193 1.00 0.00 H new ATOM 0 HG CYS A 25 -12.789 9.106 -3.031 1.00 0.00 H new ATOM 351 N ARG A 26 -17.613 12.045 -2.436 1.00 0.00 N ATOM 352 CA ARG A 26 -18.309 13.313 -2.540 1.00 0.00 C ATOM 353 C ARG A 26 -17.336 14.419 -2.933 1.00 0.00 C ATOM 354 O ARG A 26 -16.344 14.657 -2.245 1.00 0.00 O ATOM 355 CB ARG A 26 -18.959 13.666 -1.204 1.00 0.00 C ATOM 356 CG ARG A 26 -19.956 14.808 -1.291 1.00 0.00 C ATOM 357 CD ARG A 26 -20.536 15.141 0.073 1.00 0.00 C ATOM 358 NE ARG A 26 -21.503 16.228 0.000 1.00 0.00 N ATOM 359 CZ ARG A 26 -21.367 17.390 0.633 1.00 0.00 C ATOM 360 NH1 ARG A 26 -20.318 17.607 1.418 1.00 0.00 N ATOM 361 NH2 ARG A 26 -22.285 18.330 0.482 1.00 0.00 N ATOM 0 H ARG A 26 -17.513 11.696 -1.483 1.00 0.00 H new ATOM 0 HA ARG A 26 -19.079 13.222 -3.306 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -19.465 12.784 -0.812 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -18.179 13.930 -0.490 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -19.467 15.690 -1.705 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -20.761 14.539 -1.975 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -21.016 14.255 0.490 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -19.730 15.417 0.753 1.00 0.00 H new ATOM 0 HE ARG A 26 -22.336 16.090 -0.572 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -19.612 16.881 1.538 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -20.219 18.500 1.901 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -23.093 18.162 -0.118 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -22.185 19.223 0.965 1.00 0.00 H new ATOM 375 N ARG A 27 -17.618 15.082 -4.039 1.00 0.00 N ATOM 376 CA ARG A 27 -16.781 16.166 -4.512 1.00 0.00 C ATOM 377 C ARG A 27 -17.333 17.477 -3.982 1.00 0.00 C ATOM 378 O ARG A 27 -18.538 17.590 -3.714 1.00 0.00 O ATOM 379 CB ARG A 27 -16.748 16.190 -6.041 1.00 0.00 C ATOM 380 CG ARG A 27 -15.596 16.999 -6.610 1.00 0.00 C ATOM 381 CD ARG A 27 -15.589 16.987 -8.130 1.00 0.00 C ATOM 382 NE ARG A 27 -14.247 17.222 -8.666 1.00 0.00 N ATOM 383 CZ ARG A 27 -13.783 18.411 -9.052 1.00 0.00 C ATOM 384 NH1 ARG A 27 -14.539 19.495 -8.942 1.00 0.00 N ATOM 385 NH2 ARG A 27 -12.558 18.512 -9.543 1.00 0.00 N ATOM 0 H ARG A 27 -18.426 14.886 -4.629 1.00 0.00 H new ATOM 0 HA ARG A 27 -15.762 16.021 -4.153 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -16.681 15.167 -6.411 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -17.687 16.601 -6.410 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -15.665 18.027 -6.256 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -14.653 16.597 -6.240 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -15.961 16.027 -8.488 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -16.269 17.752 -8.503 1.00 0.00 H new ATOM 0 HE ARG A 27 -13.623 16.420 -8.750 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -15.482 19.422 -8.560 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -14.177 20.401 -9.239 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -11.971 17.682 -9.625 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -12.201 19.420 -9.839 1.00 0.00 H new ATOM 399 N GLY A 28 -16.440 18.463 -3.868 1.00 0.00 N ATOM 400 CA GLY A 28 -16.774 19.782 -3.343 1.00 0.00 C ATOM 401 C GLY A 28 -17.923 20.464 -4.062 1.00 0.00 C ATOM 402 O GLY A 28 -18.482 21.443 -3.563 1.00 0.00 O ATOM 0 H GLY A 28 -15.462 18.365 -4.139 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -17.026 19.687 -2.287 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -15.892 20.419 -3.404 1.00 0.00 H new ATOM 406 N ASP A 29 -18.275 19.956 -5.232 1.00 0.00 N ATOM 407 CA ASP A 29 -19.377 20.507 -6.004 1.00 0.00 C ATOM 408 C ASP A 29 -20.698 20.011 -5.441 1.00 0.00 C ATOM 409 O ASP A 29 -21.772 20.397 -5.901 1.00 0.00 O ATOM 410 CB ASP A 29 -19.262 20.114 -7.476 1.00 0.00 C ATOM 411 CG ASP A 29 -17.996 20.631 -8.121 1.00 0.00 C ATOM 412 OD1 ASP A 29 -17.916 21.842 -8.415 1.00 0.00 O ATOM 413 OD2 ASP A 29 -17.070 19.825 -8.338 1.00 0.00 O ATOM 0 H ASP A 29 -17.811 19.160 -5.669 1.00 0.00 H new ATOM 0 HA ASP A 29 -19.336 21.594 -5.934 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -19.291 19.028 -7.561 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -20.125 20.499 -8.019 1.00 0.00 H new ATOM 418 N GLY A 30 -20.602 19.148 -4.443 1.00 0.00 N ATOM 419 CA GLY A 30 -21.775 18.592 -3.814 1.00 0.00 C ATOM 420 C GLY A 30 -22.242 17.353 -4.536 1.00 0.00 C ATOM 421 O GLY A 30 -23.320 16.826 -4.258 1.00 0.00 O ATOM 0 H GLY A 30 -19.718 18.820 -4.054 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -21.554 18.349 -2.775 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -22.573 19.334 -3.805 1.00 0.00 H new ATOM 425 N GLY A 31 -21.420 16.883 -5.463 1.00 0.00 N ATOM 426 CA GLY A 31 -21.777 15.705 -6.236 1.00 0.00 C ATOM 427 C GLY A 31 -20.921 14.502 -5.909 1.00 0.00 C ATOM 428 O GLY A 31 -19.732 14.639 -5.641 1.00 0.00 O ATOM 0 H GLY A 31 -20.515 17.292 -5.695 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -22.823 15.460 -6.053 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -21.684 15.932 -7.298 1.00 0.00 H new ATOM 432 N TYR A 32 -21.520 13.320 -5.933 1.00 0.00 N ATOM 433 CA TYR A 32 -20.802 12.090 -5.641 1.00 0.00 C ATOM 434 C TYR A 32 -20.225 11.501 -6.918 1.00 0.00 C ATOM 435 O TYR A 32 -20.944 11.285 -7.893 1.00 0.00 O ATOM 436 CB TYR A 32 -21.730 11.074 -4.970 1.00 0.00 C ATOM 437 CG TYR A 32 -22.061 11.412 -3.537 1.00 0.00 C ATOM 438 CD1 TYR A 32 -21.226 11.007 -2.511 1.00 0.00 C ATOM 439 CD2 TYR A 32 -23.203 12.131 -3.206 1.00 0.00 C ATOM 440 CE1 TYR A 32 -21.512 11.299 -1.197 1.00 0.00 C ATOM 441 CE2 TYR A 32 -23.498 12.430 -1.889 1.00 0.00 C ATOM 442 CZ TYR A 32 -22.646 12.013 -0.890 1.00 0.00 C ATOM 443 OH TYR A 32 -22.934 12.301 0.425 1.00 0.00 O ATOM 0 H TYR A 32 -22.507 13.188 -6.153 1.00 0.00 H new ATOM 0 HA TYR A 32 -19.985 12.323 -4.958 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -22.656 11.007 -5.542 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -21.263 10.090 -5.004 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -20.331 10.450 -2.746 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -23.870 12.461 -3.989 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -20.849 10.969 -0.411 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -24.391 12.987 -1.645 1.00 0.00 H new ATOM 0 HH TYR A 32 -23.769 12.812 0.473 1.00 0.00 H new ATOM 453 N SER A 33 -18.927 11.254 -6.913 1.00 0.00 N ATOM 454 CA SER A 33 -18.257 10.689 -8.073 1.00 0.00 C ATOM 455 C SER A 33 -17.698 9.310 -7.751 1.00 0.00 C ATOM 456 O SER A 33 -17.024 9.125 -6.738 1.00 0.00 O ATOM 457 CB SER A 33 -17.139 11.617 -8.540 1.00 0.00 C ATOM 458 OG SER A 33 -17.665 12.867 -8.952 1.00 0.00 O ATOM 0 H SER A 33 -18.314 11.436 -6.118 1.00 0.00 H new ATOM 0 HA SER A 33 -18.987 10.585 -8.876 1.00 0.00 H new ATOM 0 HB2 SER A 33 -16.423 11.767 -7.732 1.00 0.00 H new ATOM 0 HB3 SER A 33 -16.597 11.155 -9.365 1.00 0.00 H new ATOM 0 HG SER A 33 -16.933 13.449 -9.246 1.00 0.00 H new ATOM 464 N THR A 34 -17.989 8.349 -8.614 1.00 0.00 N ATOM 465 CA THR A 34 -17.526 6.987 -8.428 1.00 0.00 C ATOM 466 C THR A 34 -16.007 6.913 -8.530 1.00 0.00 C ATOM 467 O THR A 34 -15.411 7.364 -9.514 1.00 0.00 O ATOM 468 CB THR A 34 -18.144 6.048 -9.477 1.00 0.00 C ATOM 469 OG1 THR A 34 -19.492 6.453 -9.747 1.00 0.00 O ATOM 470 CG2 THR A 34 -18.134 4.607 -8.984 1.00 0.00 C ATOM 0 H THR A 34 -18.548 8.491 -9.455 1.00 0.00 H new ATOM 0 HA THR A 34 -17.838 6.670 -7.433 1.00 0.00 H new ATOM 0 HB THR A 34 -17.550 6.107 -10.389 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.012 6.432 -8.917 1.00 0.00 H new ATOM 0 HG21 THR A 34 -18.576 3.960 -9.742 1.00 0.00 H new ATOM 0 HG22 THR A 34 -17.107 4.295 -8.794 1.00 0.00 H new ATOM 0 HG23 THR A 34 -18.712 4.534 -8.063 1.00 0.00 H new ATOM 478 N SER A 35 -15.389 6.382 -7.495 1.00 0.00 N ATOM 479 CA SER A 35 -13.944 6.231 -7.453 1.00 0.00 C ATOM 480 C SER A 35 -13.576 4.799 -7.073 1.00 0.00 C ATOM 481 O SER A 35 -14.281 4.167 -6.300 1.00 0.00 O ATOM 482 CB SER A 35 -13.354 7.208 -6.439 1.00 0.00 C ATOM 483 OG SER A 35 -11.950 7.044 -6.344 1.00 0.00 O ATOM 0 H SER A 35 -15.869 6.043 -6.661 1.00 0.00 H new ATOM 0 HA SER A 35 -13.535 6.448 -8.440 1.00 0.00 H new ATOM 0 HB2 SER A 35 -13.586 8.231 -6.735 1.00 0.00 H new ATOM 0 HB3 SER A 35 -13.811 7.047 -5.463 1.00 0.00 H new ATOM 0 HG SER A 35 -11.516 7.503 -7.093 1.00 0.00 H new ATOM 489 N VAL A 36 -12.466 4.292 -7.601 1.00 0.00 N ATOM 490 CA VAL A 36 -12.035 2.930 -7.297 1.00 0.00 C ATOM 491 C VAL A 36 -10.507 2.841 -7.228 1.00 0.00 C ATOM 492 O VAL A 36 -9.803 3.453 -8.036 1.00 0.00 O ATOM 493 CB VAL A 36 -12.615 1.922 -8.320 1.00 0.00 C ATOM 494 CG1 VAL A 36 -12.232 2.291 -9.745 1.00 0.00 C ATOM 495 CG2 VAL A 36 -12.193 0.500 -8.000 1.00 0.00 C ATOM 0 H VAL A 36 -11.851 4.799 -8.238 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.426 2.663 -6.315 1.00 0.00 H new ATOM 0 HB VAL A 36 -13.701 1.974 -8.241 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -12.656 1.562 -10.436 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -12.619 3.282 -9.981 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -11.146 2.293 -9.841 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.618 -0.180 -8.738 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -11.106 0.429 -8.025 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -12.552 0.229 -7.007 1.00 0.00 H new ATOM 505 N ILE A 37 -10.003 2.109 -6.234 1.00 0.00 N ATOM 506 CA ILE A 37 -8.566 1.964 -6.024 1.00 0.00 C ATOM 507 C ILE A 37 -8.181 0.506 -5.737 1.00 0.00 C ATOM 508 O ILE A 37 -8.954 -0.241 -5.144 1.00 0.00 O ATOM 509 CB ILE A 37 -8.127 2.865 -4.846 1.00 0.00 C ATOM 510 CG1 ILE A 37 -6.640 2.675 -4.521 1.00 0.00 C ATOM 511 CG2 ILE A 37 -8.995 2.582 -3.624 1.00 0.00 C ATOM 512 CD1 ILE A 37 -6.144 3.550 -3.389 1.00 0.00 C ATOM 0 H ILE A 37 -10.576 1.604 -5.558 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.055 2.268 -6.938 1.00 0.00 H new ATOM 0 HB ILE A 37 -8.263 3.906 -5.139 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -6.465 1.630 -4.264 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -6.053 2.886 -5.415 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -8.680 3.220 -2.798 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.038 2.787 -3.864 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -8.888 1.536 -3.336 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -5.085 3.359 -3.219 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -6.286 4.599 -3.651 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -6.704 3.324 -2.482 1.00 0.00 H new ATOM 524 N ASP A 38 -6.991 0.100 -6.168 1.00 0.00 N ATOM 525 CA ASP A 38 -6.513 -1.264 -5.937 1.00 0.00 C ATOM 526 C ASP A 38 -6.049 -1.452 -4.501 1.00 0.00 C ATOM 527 O ASP A 38 -4.925 -1.092 -4.151 1.00 0.00 O ATOM 528 CB ASP A 38 -5.355 -1.618 -6.870 1.00 0.00 C ATOM 529 CG ASP A 38 -5.809 -2.129 -8.222 1.00 0.00 C ATOM 530 OD1 ASP A 38 -6.436 -3.208 -8.271 1.00 0.00 O ATOM 531 OD2 ASP A 38 -5.502 -1.479 -9.240 1.00 0.00 O ATOM 0 H ASP A 38 -6.338 0.694 -6.679 1.00 0.00 H new ATOM 0 HA ASP A 38 -7.356 -1.925 -6.139 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -4.731 -0.736 -7.014 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -4.732 -2.375 -6.394 1.00 0.00 H new ATOM 536 N LEU A 39 -6.899 -2.043 -3.673 1.00 0.00 N ATOM 537 CA LEU A 39 -6.560 -2.275 -2.284 1.00 0.00 C ATOM 538 C LEU A 39 -5.736 -3.539 -2.127 1.00 0.00 C ATOM 539 O LEU A 39 -5.261 -3.856 -1.039 1.00 0.00 O ATOM 540 CB LEU A 39 -7.817 -2.340 -1.431 1.00 0.00 C ATOM 541 CG LEU A 39 -8.013 -1.114 -0.542 1.00 0.00 C ATOM 542 CD1 LEU A 39 -6.896 -1.027 0.480 1.00 0.00 C ATOM 543 CD2 LEU A 39 -8.039 0.151 -1.376 1.00 0.00 C ATOM 0 H LEU A 39 -7.827 -2.369 -3.943 1.00 0.00 H new ATOM 0 HA LEU A 39 -5.954 -1.437 -1.939 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.684 -2.449 -2.083 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.776 -3.231 -0.804 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.968 -1.215 -0.026 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.046 -0.149 1.109 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.900 -1.923 1.101 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -5.938 -0.946 -0.034 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.180 1.013 -0.725 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.096 0.252 -1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.860 0.099 -2.091 1.00 0.00 H new ATOM 555 N ASN A 40 -5.547 -4.248 -3.228 1.00 0.00 N ATOM 556 CA ASN A 40 -4.746 -5.462 -3.220 1.00 0.00 C ATOM 557 C ASN A 40 -3.281 -5.095 -3.011 1.00 0.00 C ATOM 558 O ASN A 40 -2.437 -5.954 -2.762 1.00 0.00 O ATOM 559 CB ASN A 40 -4.928 -6.247 -4.524 1.00 0.00 C ATOM 560 CG ASN A 40 -4.661 -5.403 -5.755 1.00 0.00 C ATOM 561 OD1 ASN A 40 -3.522 -5.253 -6.192 1.00 0.00 O ATOM 562 ND2 ASN A 40 -5.720 -4.869 -6.331 1.00 0.00 N ATOM 0 H ASN A 40 -5.937 -4.004 -4.138 1.00 0.00 H new ATOM 0 HA ASN A 40 -5.077 -6.102 -2.403 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -4.256 -7.105 -4.524 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -5.944 -6.638 -4.570 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -5.612 -4.305 -7.174 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -6.647 -5.020 -5.934 1.00 0.00 H new ATOM 569 N ARG A 41 -3.000 -3.798 -3.104 1.00 0.00 N ATOM 570 CA ARG A 41 -1.653 -3.282 -2.913 1.00 0.00 C ATOM 571 C ARG A 41 -1.505 -2.651 -1.534 1.00 0.00 C ATOM 572 O ARG A 41 -0.480 -2.049 -1.226 1.00 0.00 O ATOM 573 CB ARG A 41 -1.321 -2.235 -3.974 1.00 0.00 C ATOM 574 CG ARG A 41 -1.143 -2.784 -5.377 1.00 0.00 C ATOM 575 CD ARG A 41 -1.194 -1.663 -6.406 1.00 0.00 C ATOM 576 NE ARG A 41 -0.506 -2.009 -7.649 1.00 0.00 N ATOM 577 CZ ARG A 41 -1.064 -2.675 -8.661 1.00 0.00 C ATOM 578 NH1 ARG A 41 -2.319 -3.105 -8.577 1.00 0.00 N ATOM 579 NH2 ARG A 41 -0.360 -2.910 -9.760 1.00 0.00 N ATOM 0 H ARG A 41 -3.696 -3.082 -3.312 1.00 0.00 H new ATOM 0 HA ARG A 41 -0.964 -4.122 -3.002 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.116 -1.489 -3.989 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -0.406 -1.720 -3.682 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.190 -3.307 -5.449 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -1.924 -3.514 -5.589 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.234 -1.423 -6.626 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.743 -0.766 -5.983 1.00 0.00 H new ATOM 0 HE ARG A 41 0.467 -1.721 -7.749 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.864 -2.926 -7.733 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.737 -3.613 -9.356 1.00 0.00 H new ATOM 0 HH21 ARG A 41 0.603 -2.582 -9.828 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -0.782 -3.419 -10.537 1.00 0.00 H new ATOM 593 N TYR A 42 -2.533 -2.779 -0.717 1.00 0.00 N ATOM 594 CA TYR A 42 -2.500 -2.203 0.627 1.00 0.00 C ATOM 595 C TYR A 42 -2.998 -3.172 1.688 1.00 0.00 C ATOM 596 O TYR A 42 -2.650 -3.047 2.853 1.00 0.00 O ATOM 597 CB TYR A 42 -3.305 -0.906 0.678 1.00 0.00 C ATOM 598 CG TYR A 42 -2.462 0.326 0.447 1.00 0.00 C ATOM 599 CD1 TYR A 42 -2.249 0.822 -0.831 1.00 0.00 C ATOM 600 CD2 TYR A 42 -1.870 0.983 1.516 1.00 0.00 C ATOM 601 CE1 TYR A 42 -1.465 1.943 -1.036 1.00 0.00 C ATOM 602 CE2 TYR A 42 -1.088 2.102 1.321 1.00 0.00 C ATOM 603 CZ TYR A 42 -0.889 2.578 0.044 1.00 0.00 C ATOM 604 OH TYR A 42 -0.106 3.692 -0.152 1.00 0.00 O ATOM 0 H TYR A 42 -3.396 -3.270 -0.950 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.455 -1.986 0.851 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -4.093 -0.945 -0.074 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -3.794 -0.827 1.649 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -2.701 0.326 -1.677 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -2.024 0.612 2.518 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -1.305 2.319 -2.036 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -0.635 2.602 2.164 1.00 0.00 H new ATOM 0 HH TYR A 42 -0.678 4.463 -0.348 1.00 0.00 H new ATOM 614 N LEU A 43 -3.821 -4.120 1.295 1.00 0.00 N ATOM 615 CA LEU A 43 -4.341 -5.099 2.228 1.00 0.00 C ATOM 616 C LEU A 43 -3.666 -6.442 2.021 1.00 0.00 C ATOM 617 O LEU A 43 -3.605 -6.951 0.899 1.00 0.00 O ATOM 618 CB LEU A 43 -5.835 -5.251 2.012 1.00 0.00 C ATOM 619 CG LEU A 43 -6.625 -3.959 2.111 1.00 0.00 C ATOM 620 CD1 LEU A 43 -8.060 -4.192 1.719 1.00 0.00 C ATOM 621 CD2 LEU A 43 -6.520 -3.394 3.512 1.00 0.00 C ATOM 0 H LEU A 43 -4.145 -4.235 0.335 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.142 -4.758 3.244 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.003 -5.689 1.028 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.225 -5.956 2.746 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.206 -3.229 1.419 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -8.614 -3.257 1.795 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -8.102 -4.557 0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.504 -4.932 2.385 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.090 -2.467 3.574 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.920 -4.114 4.226 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.474 -3.194 3.746 1.00 0.00 H new ATOM 633 N SER A 44 -3.168 -6.999 3.101 1.00 0.00 N ATOM 634 CA SER A 44 -2.490 -8.281 3.063 1.00 0.00 C ATOM 635 C SER A 44 -3.128 -9.249 4.044 1.00 0.00 C ATOM 636 O SER A 44 -3.466 -8.878 5.168 1.00 0.00 O ATOM 637 CB SER A 44 -1.016 -8.088 3.428 1.00 0.00 C ATOM 638 OG SER A 44 -0.538 -6.837 2.962 1.00 0.00 O ATOM 0 H SER A 44 -3.219 -6.580 4.030 1.00 0.00 H new ATOM 0 HA SER A 44 -2.573 -8.692 2.057 1.00 0.00 H new ATOM 0 HB2 SER A 44 -0.894 -8.148 4.510 1.00 0.00 H new ATOM 0 HB3 SER A 44 -0.422 -8.893 2.995 1.00 0.00 H new ATOM 0 HG SER A 44 0.318 -6.632 3.394 1.00 0.00 H new ATOM 644 N ASN A 45 -3.329 -10.477 3.597 1.00 0.00 N ATOM 645 CA ASN A 45 -3.895 -11.511 4.433 1.00 0.00 C ATOM 646 C ASN A 45 -2.821 -12.079 5.364 1.00 0.00 C ATOM 647 O ASN A 45 -2.098 -13.010 5.014 1.00 0.00 O ATOM 648 CB ASN A 45 -4.488 -12.630 3.557 1.00 0.00 C ATOM 649 CG ASN A 45 -3.496 -13.263 2.589 1.00 0.00 C ATOM 650 OD1 ASN A 45 -2.643 -12.584 2.016 1.00 0.00 O ATOM 651 ND2 ASN A 45 -3.591 -14.575 2.420 1.00 0.00 N ATOM 0 H ASN A 45 -3.104 -10.780 2.649 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.692 -11.081 5.040 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -4.891 -13.408 4.206 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -5.325 -12.225 2.988 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -2.943 -15.057 1.797 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -4.312 -15.102 2.913 1.00 0.00 H new ATOM 658 N ASP A 46 -2.721 -11.519 6.553 1.00 0.00 N ATOM 659 CA ASP A 46 -1.738 -11.972 7.525 1.00 0.00 C ATOM 660 C ASP A 46 -2.299 -13.126 8.347 1.00 0.00 C ATOM 661 O ASP A 46 -2.891 -12.927 9.410 1.00 0.00 O ATOM 662 CB ASP A 46 -1.303 -10.816 8.431 1.00 0.00 C ATOM 663 CG ASP A 46 -0.225 -11.221 9.417 1.00 0.00 C ATOM 664 OD1 ASP A 46 0.920 -11.481 8.984 1.00 0.00 O ATOM 665 OD2 ASP A 46 -0.509 -11.265 10.629 1.00 0.00 O ATOM 0 H ASP A 46 -3.308 -10.748 6.872 1.00 0.00 H new ATOM 0 HA ASP A 46 -0.858 -12.329 6.989 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -0.937 -9.995 7.815 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -2.169 -10.443 8.978 1.00 0.00 H new ATOM 670 N ASN A 47 -2.126 -14.332 7.807 1.00 0.00 N ATOM 671 CA ASN A 47 -2.593 -15.572 8.430 1.00 0.00 C ATOM 672 C ASN A 47 -4.063 -15.466 8.843 1.00 0.00 C ATOM 673 O ASN A 47 -4.443 -15.845 9.951 1.00 0.00 O ATOM 674 CB ASN A 47 -1.708 -15.948 9.629 1.00 0.00 C ATOM 675 CG ASN A 47 -1.887 -17.397 10.071 1.00 0.00 C ATOM 676 OD1 ASN A 47 -2.113 -18.292 9.254 1.00 0.00 O ATOM 677 ND2 ASN A 47 -1.780 -17.642 11.368 1.00 0.00 N ATOM 0 H ASN A 47 -1.653 -14.478 6.915 1.00 0.00 H new ATOM 0 HA ASN A 47 -2.515 -16.368 7.690 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -0.663 -15.780 9.369 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -1.939 -15.288 10.465 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -1.885 -18.594 11.717 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -1.592 -16.878 12.018 1.00 0.00 H new ATOM 684 N GLY A 48 -4.884 -14.920 7.949 1.00 0.00 N ATOM 685 CA GLY A 48 -6.300 -14.804 8.224 1.00 0.00 C ATOM 686 C GLY A 48 -6.647 -13.540 8.975 1.00 0.00 C ATOM 687 O GLY A 48 -7.530 -13.545 9.819 1.00 0.00 O ATOM 0 H GLY A 48 -4.591 -14.557 7.042 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -6.851 -14.826 7.284 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.625 -15.667 8.805 1.00 0.00 H new ATOM 691 N HIS A 49 -5.928 -12.468 8.679 1.00 0.00 N ATOM 692 CA HIS A 49 -6.143 -11.161 9.306 1.00 0.00 C ATOM 693 C HIS A 49 -5.737 -10.088 8.313 1.00 0.00 C ATOM 694 O HIS A 49 -4.673 -10.179 7.714 1.00 0.00 O ATOM 695 CB HIS A 49 -5.296 -10.994 10.581 1.00 0.00 C ATOM 696 CG HIS A 49 -5.612 -11.954 11.686 1.00 0.00 C ATOM 697 ND1 HIS A 49 -6.509 -11.675 12.694 1.00 0.00 N ATOM 698 CD2 HIS A 49 -5.129 -13.192 11.948 1.00 0.00 C ATOM 699 CE1 HIS A 49 -6.563 -12.698 13.527 1.00 0.00 C ATOM 700 NE2 HIS A 49 -5.736 -13.631 13.096 1.00 0.00 N ATOM 0 H HIS A 49 -5.173 -12.474 7.993 1.00 0.00 H new ATOM 0 HA HIS A 49 -7.194 -11.078 9.583 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -4.244 -11.103 10.316 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -5.427 -9.979 10.955 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -4.401 -13.733 11.361 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -7.180 -12.760 14.411 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -5.574 -14.533 13.544 1.00 0.00 H new ATOM 709 N PHE A 50 -6.576 -9.091 8.113 1.00 0.00 N ATOM 710 CA PHE A 50 -6.253 -8.026 7.176 1.00 0.00 C ATOM 711 C PHE A 50 -5.162 -7.129 7.742 1.00 0.00 C ATOM 712 O PHE A 50 -5.169 -6.805 8.933 1.00 0.00 O ATOM 713 CB PHE A 50 -7.483 -7.174 6.875 1.00 0.00 C ATOM 714 CG PHE A 50 -8.351 -7.691 5.771 1.00 0.00 C ATOM 715 CD1 PHE A 50 -8.126 -7.289 4.467 1.00 0.00 C ATOM 716 CD2 PHE A 50 -9.400 -8.552 6.034 1.00 0.00 C ATOM 717 CE1 PHE A 50 -8.930 -7.740 3.442 1.00 0.00 C ATOM 718 CE2 PHE A 50 -10.210 -9.004 5.013 1.00 0.00 C ATOM 719 CZ PHE A 50 -9.972 -8.598 3.716 1.00 0.00 C ATOM 0 H PHE A 50 -7.478 -8.993 8.580 1.00 0.00 H new ATOM 0 HA PHE A 50 -5.903 -8.493 6.255 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -8.082 -7.094 7.782 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -7.156 -6.166 6.619 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -7.311 -6.614 4.249 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -9.587 -8.874 7.048 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -8.743 -7.421 2.427 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -11.029 -9.674 5.228 1.00 0.00 H new ATOM 0 HZ PHE A 50 -10.603 -8.953 2.915 1.00 0.00 H new ATOM 729 N ARG A 51 -4.241 -6.718 6.888 1.00 0.00 N ATOM 730 CA ARG A 51 -3.142 -5.868 7.309 1.00 0.00 C ATOM 731 C ARG A 51 -2.762 -4.850 6.239 1.00 0.00 C ATOM 732 O ARG A 51 -2.670 -5.184 5.061 1.00 0.00 O ATOM 733 CB ARG A 51 -1.923 -6.726 7.663 1.00 0.00 C ATOM 734 CG ARG A 51 -1.940 -7.244 9.092 1.00 0.00 C ATOM 735 CD ARG A 51 -1.821 -6.096 10.076 1.00 0.00 C ATOM 736 NE ARG A 51 -2.030 -6.512 11.462 1.00 0.00 N ATOM 737 CZ ARG A 51 -1.367 -5.998 12.495 1.00 0.00 C ATOM 738 NH1 ARG A 51 -0.352 -5.169 12.292 1.00 0.00 N ATOM 739 NH2 ARG A 51 -1.698 -6.339 13.732 1.00 0.00 N ATOM 0 H ARG A 51 -4.233 -6.960 5.897 1.00 0.00 H new ATOM 0 HA ARG A 51 -3.475 -5.316 8.188 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -1.874 -7.573 6.979 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.018 -6.138 7.509 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -2.864 -7.793 9.275 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -1.118 -7.945 9.241 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -0.833 -5.644 9.982 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -2.549 -5.327 9.819 1.00 0.00 H new ATOM 0 HE ARG A 51 -2.723 -7.237 11.648 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -0.077 -4.923 11.341 1.00 0.00 H new ATOM 0 HH12 ARG A 51 0.153 -4.777 13.087 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -2.461 -6.996 13.893 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -1.189 -5.945 14.523 1.00 0.00 H new ATOM 753 N TRP A 52 -2.582 -3.607 6.665 1.00 0.00 N ATOM 754 CA TRP A 52 -2.165 -2.528 5.778 1.00 0.00 C ATOM 755 C TRP A 52 -0.683 -2.655 5.454 1.00 0.00 C ATOM 756 O TRP A 52 0.170 -2.345 6.292 1.00 0.00 O ATOM 757 CB TRP A 52 -2.381 -1.151 6.412 1.00 0.00 C ATOM 758 CG TRP A 52 -3.809 -0.732 6.565 1.00 0.00 C ATOM 759 CD1 TRP A 52 -4.521 -0.655 7.728 1.00 0.00 C ATOM 760 CD2 TRP A 52 -4.694 -0.310 5.525 1.00 0.00 C ATOM 761 NE1 TRP A 52 -5.797 -0.217 7.472 1.00 0.00 N ATOM 762 CE2 TRP A 52 -5.927 -0.001 6.126 1.00 0.00 C ATOM 763 CE3 TRP A 52 -4.564 -0.165 4.142 1.00 0.00 C ATOM 764 CZ2 TRP A 52 -7.018 0.442 5.391 1.00 0.00 C ATOM 765 CZ3 TRP A 52 -5.652 0.275 3.415 1.00 0.00 C ATOM 766 CH2 TRP A 52 -6.864 0.573 4.040 1.00 0.00 C ATOM 0 H TRP A 52 -2.721 -3.318 7.633 1.00 0.00 H new ATOM 0 HA TRP A 52 -2.773 -2.612 4.877 1.00 0.00 H new ATOM 0 HB2 TRP A 52 -1.911 -1.145 7.395 1.00 0.00 H new ATOM 0 HB3 TRP A 52 -1.864 -0.406 5.807 1.00 0.00 H new ATOM 0 HD1 TRP A 52 -4.136 -0.903 8.706 1.00 0.00 H new ATOM 0 HE1 TRP A 52 -6.528 -0.076 8.170 1.00 0.00 H new ATOM 0 HE3 TRP A 52 -3.630 -0.393 3.650 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 -7.957 0.675 5.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 -5.564 0.391 2.345 1.00 0.00 H new ATOM 0 HH2 TRP A 52 -7.697 0.914 3.443 1.00 0.00 H new ATOM 777 N VAL A 53 -0.401 -3.111 4.242 1.00 0.00 N ATOM 778 CA VAL A 53 0.962 -3.284 3.737 1.00 0.00 C ATOM 779 C VAL A 53 1.716 -4.403 4.462 1.00 0.00 C ATOM 780 O VAL A 53 2.097 -5.395 3.839 1.00 0.00 O ATOM 781 CB VAL A 53 1.772 -1.968 3.823 1.00 0.00 C ATOM 782 CG1 VAL A 53 3.182 -2.157 3.284 1.00 0.00 C ATOM 783 CG2 VAL A 53 1.062 -0.854 3.069 1.00 0.00 C ATOM 0 H VAL A 53 -1.120 -3.376 3.569 1.00 0.00 H new ATOM 0 HA VAL A 53 0.861 -3.569 2.690 1.00 0.00 H new ATOM 0 HB VAL A 53 1.845 -1.687 4.874 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.728 -1.217 3.357 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.695 -2.921 3.868 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.134 -2.469 2.241 1.00 0.00 H new ATOM 0 HG21 VAL A 53 1.646 0.063 3.140 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.954 -1.135 2.021 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.076 -0.691 3.504 1.00 0.00 H new ATOM 793 N SER A 54 1.905 -4.240 5.773 1.00 0.00 N ATOM 794 CA SER A 54 2.631 -5.201 6.607 1.00 0.00 C ATOM 795 C SER A 54 3.961 -5.565 5.962 1.00 0.00 C ATOM 796 O SER A 54 4.216 -6.717 5.598 1.00 0.00 O ATOM 797 CB SER A 54 1.791 -6.450 6.898 1.00 0.00 C ATOM 798 OG SER A 54 1.362 -7.101 5.712 1.00 0.00 O ATOM 0 H SER A 54 1.557 -3.432 6.289 1.00 0.00 H new ATOM 0 HA SER A 54 2.834 -4.726 7.567 1.00 0.00 H new ATOM 0 HB2 SER A 54 2.376 -7.146 7.500 1.00 0.00 H new ATOM 0 HB3 SER A 54 0.920 -6.169 7.491 1.00 0.00 H new ATOM 0 HG SER A 54 1.858 -6.745 4.946 1.00 0.00 H new ATOM 804 N GLY A 55 4.798 -4.558 5.811 1.00 0.00 N ATOM 805 CA GLY A 55 6.092 -4.743 5.191 1.00 0.00 C ATOM 806 C GLY A 55 6.036 -4.504 3.693 1.00 0.00 C ATOM 807 O GLY A 55 6.855 -3.776 3.143 1.00 0.00 O ATOM 0 H GLY A 55 4.604 -3.602 6.110 1.00 0.00 H new ATOM 0 HA2 GLY A 55 6.812 -4.060 5.642 1.00 0.00 H new ATOM 0 HA3 GLY A 55 6.447 -5.755 5.385 1.00 0.00 H new ATOM 811 N GLY A 56 5.057 -5.112 3.037 1.00 0.00 N ATOM 812 CA GLY A 56 4.910 -4.947 1.603 1.00 0.00 C ATOM 813 C GLY A 56 5.575 -6.061 0.823 1.00 0.00 C ATOM 814 O GLY A 56 5.999 -5.868 -0.317 1.00 0.00 O ATOM 0 H GLY A 56 4.361 -5.717 3.472 1.00 0.00 H new ATOM 0 HA2 GLY A 56 3.850 -4.913 1.351 1.00 0.00 H new ATOM 0 HA3 GLY A 56 5.340 -3.991 1.304 1.00 0.00 H new ATOM 818 N GLY A 57 5.688 -7.226 1.445 1.00 0.00 N ATOM 819 CA GLY A 57 6.300 -8.359 0.783 1.00 0.00 C ATOM 820 C GLY A 57 7.813 -8.282 0.800 1.00 0.00 C ATOM 821 O GLY A 57 8.459 -8.306 -0.250 1.00 0.00 O ATOM 0 H GLY A 57 5.367 -7.406 2.396 1.00 0.00 H new ATOM 0 HA2 GLY A 57 5.979 -9.280 1.271 1.00 0.00 H new ATOM 0 HA3 GLY A 57 5.952 -8.407 -0.249 1.00 0.00 H new ATOM 825 N GLY A 58 8.377 -8.172 1.994 1.00 0.00 N ATOM 826 CA GLY A 58 9.818 -8.097 2.132 1.00 0.00 C ATOM 827 C GLY A 58 10.305 -6.683 2.374 1.00 0.00 C ATOM 828 O GLY A 58 11.486 -6.383 2.186 1.00 0.00 O ATOM 0 H GLY A 58 7.861 -8.133 2.873 1.00 0.00 H new ATOM 0 HA2 GLY A 58 10.134 -8.733 2.959 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.287 -8.490 1.230 1.00 0.00 H new ATOM 832 N GLY A 59 9.398 -5.812 2.787 1.00 0.00 N ATOM 833 CA GLY A 59 9.758 -4.433 3.049 1.00 0.00 C ATOM 834 C GLY A 59 10.342 -4.250 4.434 1.00 0.00 C ATOM 835 O GLY A 59 9.725 -4.632 5.432 1.00 0.00 O ATOM 0 H GLY A 59 8.416 -6.035 2.946 1.00 0.00 H new ATOM 0 HA2 GLY A 59 10.481 -4.100 2.304 1.00 0.00 H new ATOM 0 HA3 GLY A 59 8.876 -3.802 2.942 1.00 0.00 H new ATOM 839 N GLY A 60 11.530 -3.669 4.499 1.00 0.00 N ATOM 840 CA GLY A 60 12.191 -3.455 5.770 1.00 0.00 C ATOM 841 C GLY A 60 13.690 -3.374 5.606 1.00 0.00 C ATOM 842 O GLY A 60 14.225 -3.753 4.559 1.00 0.00 O ATOM 0 H GLY A 60 12.052 -3.339 3.687 1.00 0.00 H new ATOM 0 HA2 GLY A 60 11.823 -2.534 6.223 1.00 0.00 H new ATOM 0 HA3 GLY A 60 11.942 -4.267 6.453 1.00 0.00 H new ATOM 846 N GLY A 61 14.374 -2.895 6.629 1.00 0.00 N ATOM 847 CA GLY A 61 15.812 -2.769 6.561 1.00 0.00 C ATOM 848 C GLY A 61 16.263 -1.337 6.714 1.00 0.00 C ATOM 849 O GLY A 61 15.951 -0.687 7.712 1.00 0.00 O ATOM 0 H GLY A 61 13.958 -2.590 7.509 1.00 0.00 H new ATOM 0 HA2 GLY A 61 16.266 -3.377 7.343 1.00 0.00 H new ATOM 0 HA3 GLY A 61 16.165 -3.160 5.607 1.00 0.00 H new ATOM 853 N THR A 62 16.983 -0.832 5.725 1.00 0.00 N ATOM 854 CA THR A 62 17.478 0.534 5.770 1.00 0.00 C ATOM 855 C THR A 62 17.260 1.258 4.440 1.00 0.00 C ATOM 856 O THR A 62 17.790 0.859 3.402 1.00 0.00 O ATOM 857 CB THR A 62 18.981 0.572 6.132 1.00 0.00 C ATOM 858 OG1 THR A 62 19.213 -0.149 7.351 1.00 0.00 O ATOM 859 CG2 THR A 62 19.466 2.004 6.294 1.00 0.00 C ATOM 0 H THR A 62 17.237 -1.347 4.882 1.00 0.00 H new ATOM 0 HA THR A 62 16.909 1.048 6.545 1.00 0.00 H new ATOM 0 HB THR A 62 19.535 0.104 5.318 1.00 0.00 H new ATOM 0 HG1 THR A 62 20.168 -0.121 7.571 1.00 0.00 H new ATOM 0 HG21 THR A 62 20.526 2.003 6.548 1.00 0.00 H new ATOM 0 HG22 THR A 62 19.318 2.546 5.360 1.00 0.00 H new ATOM 0 HG23 THR A 62 18.903 2.491 7.090 1.00 0.00 H new ATOM 867 N ALA A 63 16.464 2.315 4.491 1.00 0.00 N ATOM 868 CA ALA A 63 16.155 3.140 3.331 1.00 0.00 C ATOM 869 C ALA A 63 16.318 4.611 3.709 1.00 0.00 C ATOM 870 O ALA A 63 16.605 4.924 4.864 1.00 0.00 O ATOM 871 CB ALA A 63 14.742 2.859 2.841 1.00 0.00 C ATOM 0 H ALA A 63 16.009 2.628 5.348 1.00 0.00 H new ATOM 0 HA ALA A 63 16.841 2.901 2.518 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.527 3.483 1.974 1.00 0.00 H new ATOM 0 HB2 ALA A 63 14.656 1.809 2.562 1.00 0.00 H new ATOM 0 HB3 ALA A 63 14.030 3.083 3.635 1.00 0.00 H new ATOM 877 N THR A 64 16.144 5.512 2.755 1.00 0.00 N ATOM 878 CA THR A 64 16.298 6.935 3.028 1.00 0.00 C ATOM 879 C THR A 64 15.103 7.745 2.529 1.00 0.00 C ATOM 880 O THR A 64 14.756 7.690 1.348 1.00 0.00 O ATOM 881 CB THR A 64 17.595 7.480 2.396 1.00 0.00 C ATOM 882 OG1 THR A 64 17.749 6.960 1.068 1.00 0.00 O ATOM 883 CG2 THR A 64 18.813 7.113 3.235 1.00 0.00 C ATOM 0 H THR A 64 15.898 5.287 1.791 1.00 0.00 H new ATOM 0 HA THR A 64 16.353 7.044 4.111 1.00 0.00 H new ATOM 0 HB THR A 64 17.520 8.567 2.357 1.00 0.00 H new ATOM 0 HG1 THR A 64 16.877 6.942 0.621 1.00 0.00 H new ATOM 0 HG21 THR A 64 19.712 7.511 2.764 1.00 0.00 H new ATOM 0 HG22 THR A 64 18.708 7.537 4.234 1.00 0.00 H new ATOM 0 HG23 THR A 64 18.891 6.028 3.308 1.00 0.00 H new ATOM 891 N VAL A 65 14.453 8.471 3.433 1.00 0.00 N ATOM 892 CA VAL A 65 13.310 9.293 3.065 1.00 0.00 C ATOM 893 C VAL A 65 13.630 10.784 3.222 1.00 0.00 C ATOM 894 O VAL A 65 14.408 11.172 4.092 1.00 0.00 O ATOM 895 CB VAL A 65 12.073 8.940 3.916 1.00 0.00 C ATOM 896 CG1 VAL A 65 12.246 9.390 5.358 1.00 0.00 C ATOM 897 CG2 VAL A 65 10.821 9.540 3.304 1.00 0.00 C ATOM 0 H VAL A 65 14.699 8.506 4.422 1.00 0.00 H new ATOM 0 HA VAL A 65 13.088 9.087 2.018 1.00 0.00 H new ATOM 0 HB VAL A 65 11.966 7.855 3.924 1.00 0.00 H new ATOM 0 HG11 VAL A 65 11.357 9.126 5.931 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.116 8.897 5.791 1.00 0.00 H new ATOM 0 HG13 VAL A 65 12.389 10.470 5.387 1.00 0.00 H new ATOM 0 HG21 VAL A 65 9.957 9.282 3.916 1.00 0.00 H new ATOM 0 HG22 VAL A 65 10.922 10.624 3.258 1.00 0.00 H new ATOM 0 HG23 VAL A 65 10.683 9.146 2.297 1.00 0.00 H new ATOM 907 N THR A 66 13.037 11.608 2.366 1.00 0.00 N ATOM 908 CA THR A 66 13.236 13.052 2.413 1.00 0.00 C ATOM 909 C THR A 66 12.188 13.701 3.310 1.00 0.00 C ATOM 910 O THR A 66 10.988 13.441 3.180 1.00 0.00 O ATOM 911 CB THR A 66 13.144 13.661 1.003 1.00 0.00 C ATOM 912 OG1 THR A 66 13.856 12.834 0.070 1.00 0.00 O ATOM 913 CG2 THR A 66 13.727 15.066 0.982 1.00 0.00 C ATOM 0 H THR A 66 12.409 11.297 1.625 1.00 0.00 H new ATOM 0 HA THR A 66 14.230 13.242 2.818 1.00 0.00 H new ATOM 0 HB THR A 66 12.093 13.715 0.720 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.794 13.224 -0.827 1.00 0.00 H new ATOM 0 HG21 THR A 66 13.651 15.476 -0.025 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.174 15.700 1.675 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.775 15.030 1.281 1.00 0.00 H new ATOM 921 N VAL A 67 12.653 14.531 4.225 1.00 0.00 N ATOM 922 CA VAL A 67 11.789 15.229 5.144 1.00 0.00 C ATOM 923 C VAL A 67 11.158 16.411 4.444 1.00 0.00 C ATOM 924 O VAL A 67 11.858 17.165 3.768 1.00 0.00 O ATOM 925 CB VAL A 67 12.560 15.733 6.374 1.00 0.00 C ATOM 926 CG1 VAL A 67 11.617 16.419 7.351 1.00 0.00 C ATOM 927 CG2 VAL A 67 13.304 14.590 7.040 1.00 0.00 C ATOM 0 H VAL A 67 13.644 14.737 4.348 1.00 0.00 H new ATOM 0 HA VAL A 67 11.024 14.529 5.480 1.00 0.00 H new ATOM 0 HB VAL A 67 13.296 16.468 6.047 1.00 0.00 H new ATOM 0 HG11 VAL A 67 12.181 16.769 8.216 1.00 0.00 H new ATOM 0 HG12 VAL A 67 11.140 17.268 6.861 1.00 0.00 H new ATOM 0 HG13 VAL A 67 10.854 15.712 7.677 1.00 0.00 H new ATOM 0 HG21 VAL A 67 13.844 14.965 7.909 1.00 0.00 H new ATOM 0 HG22 VAL A 67 12.592 13.828 7.357 1.00 0.00 H new ATOM 0 HG23 VAL A 67 14.011 14.155 6.333 1.00 0.00 H new ATOM 937 N GLN A 68 9.853 16.560 4.620 1.00 0.00 N ATOM 938 CA GLN A 68 9.099 17.639 4.006 1.00 0.00 C ATOM 939 C GLN A 68 8.770 18.712 5.035 1.00 0.00 C ATOM 940 O GLN A 68 8.977 18.524 6.236 1.00 0.00 O ATOM 941 CB GLN A 68 7.819 17.088 3.385 1.00 0.00 C ATOM 942 CG GLN A 68 7.761 17.226 1.871 1.00 0.00 C ATOM 943 CD GLN A 68 9.031 16.763 1.183 1.00 0.00 C ATOM 944 OE1 GLN A 68 9.935 17.557 0.923 1.00 0.00 O ATOM 945 NE2 GLN A 68 9.121 15.472 0.899 1.00 0.00 N ATOM 0 H GLN A 68 9.288 15.934 5.194 1.00 0.00 H new ATOM 0 HA GLN A 68 9.706 18.092 3.222 1.00 0.00 H new ATOM 0 HB2 GLN A 68 7.723 16.035 3.648 1.00 0.00 H new ATOM 0 HB3 GLN A 68 6.964 17.605 3.820 1.00 0.00 H new ATOM 0 HG2 GLN A 68 6.918 16.649 1.491 1.00 0.00 H new ATOM 0 HG3 GLN A 68 7.575 18.269 1.614 1.00 0.00 H new ATOM 0 HE21 GLN A 68 8.351 14.844 1.130 1.00 0.00 H new ATOM 0 HE22 GLN A 68 9.960 15.106 0.450 1.00 0.00 H new ATOM 954 N GLN A 69 8.280 19.840 4.549 1.00 0.00 N ATOM 955 CA GLN A 69 7.938 20.968 5.406 1.00 0.00 C ATOM 956 C GLN A 69 6.741 20.648 6.289 1.00 0.00 C ATOM 957 O GLN A 69 5.654 20.351 5.794 1.00 0.00 O ATOM 958 CB GLN A 69 7.646 22.206 4.556 1.00 0.00 C ATOM 959 CG GLN A 69 7.432 23.468 5.373 1.00 0.00 C ATOM 960 CD GLN A 69 7.206 24.692 4.510 1.00 0.00 C ATOM 961 OE1 GLN A 69 6.668 24.601 3.409 1.00 0.00 O ATOM 962 NE2 GLN A 69 7.637 25.844 4.996 1.00 0.00 N ATOM 0 H GLN A 69 8.108 20.002 3.557 1.00 0.00 H new ATOM 0 HA GLN A 69 8.792 21.169 6.053 1.00 0.00 H new ATOM 0 HB2 GLN A 69 8.474 22.366 3.866 1.00 0.00 H new ATOM 0 HB3 GLN A 69 6.759 22.020 3.951 1.00 0.00 H new ATOM 0 HG2 GLN A 69 6.574 23.329 6.031 1.00 0.00 H new ATOM 0 HG3 GLN A 69 8.300 23.634 6.012 1.00 0.00 H new ATOM 0 HE21 GLN A 69 8.078 25.877 5.915 1.00 0.00 H new ATOM 0 HE22 GLN A 69 7.528 26.700 4.452 1.00 0.00 H new ATOM 971 N GLY A 70 6.953 20.712 7.596 1.00 0.00 N ATOM 972 CA GLY A 70 5.884 20.442 8.535 1.00 0.00 C ATOM 973 C GLY A 70 5.908 19.023 9.061 1.00 0.00 C ATOM 974 O GLY A 70 4.966 18.593 9.729 1.00 0.00 O ATOM 0 H GLY A 70 7.849 20.947 8.023 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.958 21.136 9.372 1.00 0.00 H new ATOM 0 HA3 GLY A 70 4.926 20.629 8.051 1.00 0.00 H new ATOM 978 N ASP A 71 6.973 18.293 8.764 1.00 0.00 N ATOM 979 CA ASP A 71 7.092 16.914 9.218 1.00 0.00 C ATOM 980 C ASP A 71 8.275 16.737 10.161 1.00 0.00 C ATOM 981 O ASP A 71 9.392 17.149 9.858 1.00 0.00 O ATOM 982 CB ASP A 71 7.245 15.954 8.030 1.00 0.00 C ATOM 983 CG ASP A 71 5.996 15.860 7.172 1.00 0.00 C ATOM 984 OD1 ASP A 71 5.059 15.122 7.548 1.00 0.00 O ATOM 985 OD2 ASP A 71 5.948 16.519 6.116 1.00 0.00 O ATOM 0 H ASP A 71 7.763 18.629 8.214 1.00 0.00 H new ATOM 0 HA ASP A 71 6.174 16.677 9.757 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.079 16.283 7.411 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.497 14.961 8.403 1.00 0.00 H new ATOM 990 N THR A 72 8.011 16.144 11.315 1.00 0.00 N ATOM 991 CA THR A 72 9.039 15.870 12.307 1.00 0.00 C ATOM 992 C THR A 72 9.330 14.377 12.307 1.00 0.00 C ATOM 993 O THR A 72 8.736 13.649 11.512 1.00 0.00 O ATOM 994 CB THR A 72 8.591 16.309 13.712 1.00 0.00 C ATOM 995 OG1 THR A 72 7.394 15.614 14.084 1.00 0.00 O ATOM 996 CG2 THR A 72 8.346 17.811 13.757 1.00 0.00 C ATOM 0 H THR A 72 7.077 15.839 11.590 1.00 0.00 H new ATOM 0 HA THR A 72 9.935 16.434 12.050 1.00 0.00 H new ATOM 0 HB THR A 72 9.386 16.065 14.416 1.00 0.00 H new ATOM 0 HG1 THR A 72 6.630 16.000 13.607 1.00 0.00 H new ATOM 0 HG21 THR A 72 8.030 18.098 14.760 1.00 0.00 H new ATOM 0 HG22 THR A 72 9.266 18.337 13.501 1.00 0.00 H new ATOM 0 HG23 THR A 72 7.567 18.074 13.042 1.00 0.00 H new ATOM 1004 N LEU A 73 10.241 13.908 13.165 1.00 0.00 N ATOM 1005 CA LEU A 73 10.539 12.478 13.223 1.00 0.00 C ATOM 1006 C LEU A 73 9.239 11.705 13.392 1.00 0.00 C ATOM 1007 O LEU A 73 9.006 10.688 12.737 1.00 0.00 O ATOM 1008 CB LEU A 73 11.466 12.116 14.398 1.00 0.00 C ATOM 1009 CG LEU A 73 12.972 12.283 14.170 1.00 0.00 C ATOM 1010 CD1 LEU A 73 13.364 11.820 12.782 1.00 0.00 C ATOM 1011 CD2 LEU A 73 13.403 13.719 14.409 1.00 0.00 C ATOM 0 H LEU A 73 10.774 14.485 13.815 1.00 0.00 H new ATOM 0 HA LEU A 73 11.046 12.216 12.294 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.183 12.728 15.254 1.00 0.00 H new ATOM 0 HB3 LEU A 73 11.277 11.078 14.671 1.00 0.00 H new ATOM 0 HG LEU A 73 13.493 11.654 14.892 1.00 0.00 H new ATOM 0 HD11 LEU A 73 14.438 11.949 12.645 1.00 0.00 H new ATOM 0 HD12 LEU A 73 13.107 10.767 12.663 1.00 0.00 H new ATOM 0 HD13 LEU A 73 12.830 12.410 12.037 1.00 0.00 H new ATOM 0 HD21 LEU A 73 14.476 13.810 14.240 1.00 0.00 H new ATOM 0 HD22 LEU A 73 12.871 14.378 13.723 1.00 0.00 H new ATOM 0 HD23 LEU A 73 13.172 14.002 15.436 1.00 0.00 H new ATOM 1023 N ARG A 74 8.394 12.233 14.271 1.00 0.00 N ATOM 1024 CA ARG A 74 7.102 11.638 14.589 1.00 0.00 C ATOM 1025 C ARG A 74 6.223 11.529 13.353 1.00 0.00 C ATOM 1026 O ARG A 74 5.566 10.510 13.134 1.00 0.00 O ATOM 1027 CB ARG A 74 6.410 12.478 15.679 1.00 0.00 C ATOM 1028 CG ARG A 74 4.975 12.072 16.002 1.00 0.00 C ATOM 1029 CD ARG A 74 3.967 12.777 15.098 1.00 0.00 C ATOM 1030 NE ARG A 74 2.587 12.444 15.443 1.00 0.00 N ATOM 1031 CZ ARG A 74 1.517 12.957 14.829 1.00 0.00 C ATOM 1032 NH1 ARG A 74 1.660 13.768 13.789 1.00 0.00 N ATOM 1033 NH2 ARG A 74 0.299 12.645 15.253 1.00 0.00 N ATOM 0 H ARG A 74 8.588 13.092 14.786 1.00 0.00 H new ATOM 0 HA ARG A 74 7.264 10.626 14.960 1.00 0.00 H new ATOM 0 HB2 ARG A 74 7.002 12.417 16.592 1.00 0.00 H new ATOM 0 HB3 ARG A 74 6.413 13.522 15.367 1.00 0.00 H new ATOM 0 HG2 ARG A 74 4.869 10.993 15.891 1.00 0.00 H new ATOM 0 HG3 ARG A 74 4.756 12.309 17.043 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.108 13.855 15.172 1.00 0.00 H new ATOM 0 HD3 ARG A 74 4.157 12.501 14.061 1.00 0.00 H new ATOM 0 HE ARG A 74 2.431 11.778 16.200 1.00 0.00 H new ATOM 0 HH11 ARG A 74 2.593 14.005 13.451 1.00 0.00 H new ATOM 0 HH12 ARG A 74 0.837 14.155 13.327 1.00 0.00 H new ATOM 0 HH21 ARG A 74 0.181 12.015 16.046 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -0.519 13.036 14.786 1.00 0.00 H new ATOM 1047 N ASP A 75 6.236 12.567 12.537 1.00 0.00 N ATOM 1048 CA ASP A 75 5.411 12.600 11.339 1.00 0.00 C ATOM 1049 C ASP A 75 5.968 11.669 10.283 1.00 0.00 C ATOM 1050 O ASP A 75 5.217 11.004 9.576 1.00 0.00 O ATOM 1051 CB ASP A 75 5.305 14.024 10.801 1.00 0.00 C ATOM 1052 CG ASP A 75 4.714 14.968 11.823 1.00 0.00 C ATOM 1053 OD1 ASP A 75 3.506 14.850 12.123 1.00 0.00 O ATOM 1054 OD2 ASP A 75 5.458 15.822 12.347 1.00 0.00 O ATOM 0 H ASP A 75 6.808 13.399 12.680 1.00 0.00 H new ATOM 0 HA ASP A 75 4.410 12.258 11.601 1.00 0.00 H new ATOM 0 HB2 ASP A 75 6.294 14.377 10.510 1.00 0.00 H new ATOM 0 HB3 ASP A 75 4.688 14.028 9.903 1.00 0.00 H new ATOM 1059 N ILE A 76 7.290 11.618 10.183 1.00 0.00 N ATOM 1060 CA ILE A 76 7.939 10.735 9.225 1.00 0.00 C ATOM 1061 C ILE A 76 7.626 9.288 9.584 1.00 0.00 C ATOM 1062 O ILE A 76 7.202 8.501 8.736 1.00 0.00 O ATOM 1063 CB ILE A 76 9.470 10.944 9.202 1.00 0.00 C ATOM 1064 CG1 ILE A 76 9.799 12.409 8.909 1.00 0.00 C ATOM 1065 CG2 ILE A 76 10.125 10.030 8.170 1.00 0.00 C ATOM 1066 CD1 ILE A 76 9.330 12.886 7.549 1.00 0.00 C ATOM 0 H ILE A 76 7.930 12.174 10.750 1.00 0.00 H new ATOM 0 HA ILE A 76 7.556 10.970 8.232 1.00 0.00 H new ATOM 0 HB ILE A 76 9.869 10.687 10.183 1.00 0.00 H new ATOM 0 HG12 ILE A 76 9.345 13.034 9.678 1.00 0.00 H new ATOM 0 HG13 ILE A 76 10.878 12.550 8.980 1.00 0.00 H new ATOM 0 HG21 ILE A 76 11.203 10.194 8.171 1.00 0.00 H new ATOM 0 HG22 ILE A 76 9.916 8.990 8.420 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.725 10.253 7.181 1.00 0.00 H new ATOM 0 HD11 ILE A 76 9.601 13.934 7.418 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.804 12.288 6.770 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.247 12.780 7.480 1.00 0.00 H new ATOM 1078 N GLY A 77 7.815 8.961 10.860 1.00 0.00 N ATOM 1079 CA GLY A 77 7.539 7.624 11.336 1.00 0.00 C ATOM 1080 C GLY A 77 6.093 7.219 11.116 1.00 0.00 C ATOM 1081 O GLY A 77 5.815 6.141 10.601 1.00 0.00 O ATOM 0 H GLY A 77 8.157 9.605 11.573 1.00 0.00 H new ATOM 0 HA2 GLY A 77 8.193 6.917 10.826 1.00 0.00 H new ATOM 0 HA3 GLY A 77 7.773 7.564 12.399 1.00 0.00 H new ATOM 1085 N ARG A 78 5.176 8.101 11.478 1.00 0.00 N ATOM 1086 CA ARG A 78 3.749 7.826 11.340 1.00 0.00 C ATOM 1087 C ARG A 78 3.319 7.773 9.873 1.00 0.00 C ATOM 1088 O ARG A 78 2.327 7.127 9.529 1.00 0.00 O ATOM 1089 CB ARG A 78 2.949 8.902 12.074 1.00 0.00 C ATOM 1090 CG ARG A 78 1.926 8.352 13.055 1.00 0.00 C ATOM 1091 CD ARG A 78 0.855 7.534 12.355 1.00 0.00 C ATOM 1092 NE ARG A 78 -0.174 7.084 13.287 1.00 0.00 N ATOM 1093 CZ ARG A 78 -1.477 7.297 13.116 1.00 0.00 C ATOM 1094 NH1 ARG A 78 -1.923 7.850 11.993 1.00 0.00 N ATOM 1095 NH2 ARG A 78 -2.343 6.925 14.053 1.00 0.00 N ATOM 0 H ARG A 78 5.392 9.017 11.871 1.00 0.00 H new ATOM 0 HA ARG A 78 3.552 6.848 11.778 1.00 0.00 H new ATOM 0 HB2 ARG A 78 3.641 9.551 12.612 1.00 0.00 H new ATOM 0 HB3 ARG A 78 2.436 9.523 11.340 1.00 0.00 H new ATOM 0 HG2 ARG A 78 2.430 7.732 13.796 1.00 0.00 H new ATOM 0 HG3 ARG A 78 1.459 9.177 13.594 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.397 8.132 11.567 1.00 0.00 H new ATOM 0 HD3 ARG A 78 1.313 6.670 11.873 1.00 0.00 H new ATOM 0 HE ARG A 78 0.123 6.576 14.120 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -1.266 8.113 11.258 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -2.922 8.012 11.866 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -2.010 6.475 14.906 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -3.341 7.089 13.919 1.00 0.00 H new ATOM 1109 N ARG A 79 4.061 8.455 9.014 1.00 0.00 N ATOM 1110 CA ARG A 79 3.740 8.496 7.593 1.00 0.00 C ATOM 1111 C ARG A 79 4.266 7.265 6.849 1.00 0.00 C ATOM 1112 O ARG A 79 3.632 6.791 5.911 1.00 0.00 O ATOM 1113 CB ARG A 79 4.313 9.770 6.957 1.00 0.00 C ATOM 1114 CG ARG A 79 3.893 9.976 5.512 1.00 0.00 C ATOM 1115 CD ARG A 79 4.621 11.152 4.870 1.00 0.00 C ATOM 1116 NE ARG A 79 4.317 12.431 5.516 1.00 0.00 N ATOM 1117 CZ ARG A 79 3.423 13.308 5.056 1.00 0.00 C ATOM 1118 NH1 ARG A 79 2.660 13.003 4.011 1.00 0.00 N ATOM 1119 NH2 ARG A 79 3.287 14.487 5.648 1.00 0.00 N ATOM 0 H ARG A 79 4.890 8.988 9.275 1.00 0.00 H new ATOM 0 HA ARG A 79 2.653 8.498 7.506 1.00 0.00 H new ATOM 0 HB2 ARG A 79 3.996 10.632 7.544 1.00 0.00 H new ATOM 0 HB3 ARG A 79 5.401 9.732 7.007 1.00 0.00 H new ATOM 0 HG2 ARG A 79 4.096 9.069 4.942 1.00 0.00 H new ATOM 0 HG3 ARG A 79 2.817 10.147 5.467 1.00 0.00 H new ATOM 0 HD2 ARG A 79 5.696 10.975 4.913 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.350 11.209 3.816 1.00 0.00 H new ATOM 0 HE ARG A 79 4.821 12.666 6.371 1.00 0.00 H new ATOM 0 HH11 ARG A 79 2.756 12.095 3.557 1.00 0.00 H new ATOM 0 HH12 ARG A 79 1.978 13.677 3.663 1.00 0.00 H new ATOM 0 HH21 ARG A 79 3.866 14.723 6.454 1.00 0.00 H new ATOM 0 HH22 ARG A 79 2.604 15.158 5.297 1.00 0.00 H new ATOM 1133 N PHE A 80 5.418 6.746 7.263 1.00 0.00 N ATOM 1134 CA PHE A 80 6.009 5.592 6.584 1.00 0.00 C ATOM 1135 C PHE A 80 5.980 4.323 7.433 1.00 0.00 C ATOM 1136 O PHE A 80 6.750 3.396 7.193 1.00 0.00 O ATOM 1137 CB PHE A 80 7.436 5.919 6.141 1.00 0.00 C ATOM 1138 CG PHE A 80 7.482 7.083 5.191 1.00 0.00 C ATOM 1139 CD1 PHE A 80 7.223 6.903 3.844 1.00 0.00 C ATOM 1140 CD2 PHE A 80 7.752 8.360 5.652 1.00 0.00 C ATOM 1141 CE1 PHE A 80 7.240 7.972 2.971 1.00 0.00 C ATOM 1142 CE2 PHE A 80 7.767 9.435 4.786 1.00 0.00 C ATOM 1143 CZ PHE A 80 7.509 9.241 3.444 1.00 0.00 C ATOM 0 H PHE A 80 5.957 7.098 8.054 1.00 0.00 H new ATOM 0 HA PHE A 80 5.396 5.386 5.707 1.00 0.00 H new ATOM 0 HB2 PHE A 80 8.044 6.143 7.017 1.00 0.00 H new ATOM 0 HB3 PHE A 80 7.876 5.044 5.663 1.00 0.00 H new ATOM 0 HD1 PHE A 80 7.005 5.913 3.471 1.00 0.00 H new ATOM 0 HD2 PHE A 80 7.953 8.517 6.701 1.00 0.00 H new ATOM 0 HE1 PHE A 80 7.043 7.816 1.921 1.00 0.00 H new ATOM 0 HE2 PHE A 80 7.980 10.426 5.158 1.00 0.00 H new ATOM 0 HZ PHE A 80 7.518 10.081 2.765 1.00 0.00 H new ATOM 1153 N ASP A 81 5.100 4.304 8.428 1.00 0.00 N ATOM 1154 CA ASP A 81 4.926 3.144 9.315 1.00 0.00 C ATOM 1155 C ASP A 81 6.251 2.727 9.972 1.00 0.00 C ATOM 1156 O ASP A 81 6.576 1.543 10.076 1.00 0.00 O ATOM 1157 CB ASP A 81 4.312 1.974 8.534 1.00 0.00 C ATOM 1158 CG ASP A 81 3.685 0.929 9.439 1.00 0.00 C ATOM 1159 OD1 ASP A 81 2.631 1.221 10.044 1.00 0.00 O ATOM 1160 OD2 ASP A 81 4.225 -0.195 9.533 1.00 0.00 O ATOM 0 H ASP A 81 4.485 5.087 8.648 1.00 0.00 H new ATOM 0 HA ASP A 81 4.246 3.431 10.117 1.00 0.00 H new ATOM 0 HB2 ASP A 81 3.555 2.357 7.850 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.084 1.504 7.925 1.00 0.00 H new ATOM 1165 N CYS A 82 7.012 3.715 10.406 1.00 0.00 N ATOM 1166 CA CYS A 82 8.287 3.484 11.064 1.00 0.00 C ATOM 1167 C CYS A 82 8.291 4.184 12.416 1.00 0.00 C ATOM 1168 O CYS A 82 7.363 4.928 12.734 1.00 0.00 O ATOM 1169 CB CYS A 82 9.431 3.984 10.181 1.00 0.00 C ATOM 1170 SG CYS A 82 9.102 5.546 9.341 1.00 0.00 S ATOM 0 H CYS A 82 6.765 4.700 10.313 1.00 0.00 H new ATOM 0 HA CYS A 82 8.430 2.415 11.225 1.00 0.00 H new ATOM 0 HB2 CYS A 82 10.324 4.098 10.796 1.00 0.00 H new ATOM 0 HB3 CYS A 82 9.654 3.224 9.432 1.00 0.00 H new ATOM 0 HG CYS A 82 10.036 5.773 8.466 1.00 0.00 H new ATOM 1176 N ASP A 83 9.298 3.935 13.236 1.00 0.00 N ATOM 1177 CA ASP A 83 9.362 4.586 14.536 1.00 0.00 C ATOM 1178 C ASP A 83 10.287 5.779 14.468 1.00 0.00 C ATOM 1179 O ASP A 83 11.455 5.654 14.102 1.00 0.00 O ATOM 1180 CB ASP A 83 9.838 3.638 15.636 1.00 0.00 C ATOM 1181 CG ASP A 83 9.450 4.145 17.011 1.00 0.00 C ATOM 1182 OD1 ASP A 83 10.054 5.129 17.479 1.00 0.00 O ATOM 1183 OD2 ASP A 83 8.530 3.567 17.625 1.00 0.00 O ATOM 0 H ASP A 83 10.069 3.300 13.032 1.00 0.00 H new ATOM 0 HA ASP A 83 8.351 4.906 14.787 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.408 2.649 15.477 1.00 0.00 H new ATOM 0 HB3 ASP A 83 10.921 3.528 15.580 1.00 0.00 H new ATOM 1188 N PHE A 84 9.735 6.933 14.823 1.00 0.00 N ATOM 1189 CA PHE A 84 10.454 8.202 14.834 1.00 0.00 C ATOM 1190 C PHE A 84 11.773 8.106 15.601 1.00 0.00 C ATOM 1191 O PHE A 84 12.735 8.809 15.296 1.00 0.00 O ATOM 1192 CB PHE A 84 9.562 9.289 15.447 1.00 0.00 C ATOM 1193 CG PHE A 84 8.739 8.843 16.629 1.00 0.00 C ATOM 1194 CD1 PHE A 84 9.241 8.930 17.916 1.00 0.00 C ATOM 1195 CD2 PHE A 84 7.455 8.348 16.449 1.00 0.00 C ATOM 1196 CE1 PHE A 84 8.483 8.531 19.001 1.00 0.00 C ATOM 1197 CE2 PHE A 84 6.693 7.946 17.530 1.00 0.00 C ATOM 1198 CZ PHE A 84 7.208 8.037 18.807 1.00 0.00 C ATOM 0 H PHE A 84 8.761 7.015 15.116 1.00 0.00 H new ATOM 0 HA PHE A 84 10.698 8.460 13.804 1.00 0.00 H new ATOM 0 HB2 PHE A 84 10.191 10.124 15.755 1.00 0.00 H new ATOM 0 HB3 PHE A 84 8.890 9.665 14.676 1.00 0.00 H new ATOM 0 HD1 PHE A 84 10.238 9.315 18.075 1.00 0.00 H new ATOM 0 HD2 PHE A 84 7.046 8.276 15.452 1.00 0.00 H new ATOM 0 HE1 PHE A 84 8.888 8.606 20.000 1.00 0.00 H new ATOM 0 HE2 PHE A 84 5.696 7.561 17.375 1.00 0.00 H new ATOM 0 HZ PHE A 84 6.615 7.722 19.653 1.00 0.00 H new ATOM 1208 N HIS A 85 11.795 7.234 16.598 1.00 0.00 N ATOM 1209 CA HIS A 85 12.978 7.015 17.420 1.00 0.00 C ATOM 1210 C HIS A 85 14.083 6.375 16.592 1.00 0.00 C ATOM 1211 O HIS A 85 15.242 6.767 16.691 1.00 0.00 O ATOM 1212 CB HIS A 85 12.650 6.115 18.612 1.00 0.00 C ATOM 1213 CG HIS A 85 13.493 6.386 19.824 1.00 0.00 C ATOM 1214 ND1 HIS A 85 12.977 6.872 21.006 1.00 0.00 N ATOM 1215 CD2 HIS A 85 14.821 6.223 20.040 1.00 0.00 C ATOM 1216 CE1 HIS A 85 13.947 6.994 21.891 1.00 0.00 C ATOM 1217 NE2 HIS A 85 15.075 6.609 21.331 1.00 0.00 N ATOM 0 H HIS A 85 10.995 6.658 16.861 1.00 0.00 H new ATOM 0 HA HIS A 85 13.316 7.983 17.790 1.00 0.00 H new ATOM 0 HB2 HIS A 85 11.600 6.244 18.875 1.00 0.00 H new ATOM 0 HB3 HIS A 85 12.779 5.074 18.316 1.00 0.00 H new ATOM 0 HD2 HIS A 85 15.545 5.857 19.327 1.00 0.00 H new ATOM 0 HE1 HIS A 85 13.835 7.350 22.905 1.00 0.00 H new ATOM 0 HE2 HIS A 85 15.989 6.599 21.784 1.00 0.00 H new ATOM 1226 N GLU A 86 13.721 5.381 15.781 1.00 0.00 N ATOM 1227 CA GLU A 86 14.693 4.704 14.931 1.00 0.00 C ATOM 1228 C GLU A 86 15.243 5.674 13.906 1.00 0.00 C ATOM 1229 O GLU A 86 16.449 5.764 13.714 1.00 0.00 O ATOM 1230 CB GLU A 86 14.083 3.503 14.209 1.00 0.00 C ATOM 1231 CG GLU A 86 13.936 2.263 15.070 1.00 0.00 C ATOM 1232 CD GLU A 86 13.690 1.025 14.233 1.00 0.00 C ATOM 1233 OE1 GLU A 86 14.641 0.556 13.569 1.00 0.00 O ATOM 1234 OE2 GLU A 86 12.544 0.531 14.216 1.00 0.00 O ATOM 0 H GLU A 86 12.767 5.030 15.697 1.00 0.00 H new ATOM 0 HA GLU A 86 15.493 4.341 15.576 1.00 0.00 H new ATOM 0 HB2 GLU A 86 13.101 3.784 13.827 1.00 0.00 H new ATOM 0 HB3 GLU A 86 14.703 3.260 13.346 1.00 0.00 H new ATOM 0 HG2 GLU A 86 14.838 2.125 15.667 1.00 0.00 H new ATOM 0 HG3 GLU A 86 13.110 2.400 15.768 1.00 0.00 H new ATOM 1241 N ILE A 87 14.337 6.390 13.253 1.00 0.00 N ATOM 1242 CA ILE A 87 14.702 7.381 12.246 1.00 0.00 C ATOM 1243 C ILE A 87 15.774 8.297 12.804 1.00 0.00 C ATOM 1244 O ILE A 87 16.819 8.518 12.189 1.00 0.00 O ATOM 1245 CB ILE A 87 13.498 8.249 11.846 1.00 0.00 C ATOM 1246 CG1 ILE A 87 12.226 7.404 11.744 1.00 0.00 C ATOM 1247 CG2 ILE A 87 13.781 8.946 10.527 1.00 0.00 C ATOM 1248 CD1 ILE A 87 11.021 8.175 11.261 1.00 0.00 C ATOM 0 H ILE A 87 13.332 6.302 13.405 1.00 0.00 H new ATOM 0 HA ILE A 87 15.061 6.843 11.369 1.00 0.00 H new ATOM 0 HB ILE A 87 13.340 9.002 12.618 1.00 0.00 H new ATOM 0 HG12 ILE A 87 12.408 6.570 11.066 1.00 0.00 H new ATOM 0 HG13 ILE A 87 12.005 6.977 12.722 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.924 9.560 10.249 1.00 0.00 H new ATOM 0 HG22 ILE A 87 14.662 9.579 10.632 1.00 0.00 H new ATOM 0 HG23 ILE A 87 13.960 8.200 9.752 1.00 0.00 H new ATOM 0 HD11 ILE A 87 10.158 7.510 11.214 1.00 0.00 H new ATOM 0 HD12 ILE A 87 10.812 8.993 11.951 1.00 0.00 H new ATOM 0 HD13 ILE A 87 11.221 8.579 10.269 1.00 0.00 H new ATOM 1260 N ALA A 88 15.495 8.806 13.992 1.00 0.00 N ATOM 1261 CA ALA A 88 16.407 9.673 14.687 1.00 0.00 C ATOM 1262 C ALA A 88 17.704 8.948 15.036 1.00 0.00 C ATOM 1263 O ALA A 88 18.786 9.425 14.721 1.00 0.00 O ATOM 1264 CB ALA A 88 15.730 10.168 15.944 1.00 0.00 C ATOM 0 H ALA A 88 14.627 8.624 14.495 1.00 0.00 H new ATOM 0 HA ALA A 88 16.667 10.512 14.042 1.00 0.00 H new ATOM 0 HB1 ALA A 88 16.407 10.828 16.486 1.00 0.00 H new ATOM 0 HB2 ALA A 88 14.825 10.715 15.679 1.00 0.00 H new ATOM 0 HB3 ALA A 88 15.469 9.319 16.575 1.00 0.00 H new ATOM 1270 N ARG A 89 17.579 7.780 15.651 1.00 0.00 N ATOM 1271 CA ARG A 89 18.731 6.982 16.068 1.00 0.00 C ATOM 1272 C ARG A 89 19.667 6.658 14.901 1.00 0.00 C ATOM 1273 O ARG A 89 20.889 6.661 15.059 1.00 0.00 O ATOM 1274 CB ARG A 89 18.241 5.688 16.729 1.00 0.00 C ATOM 1275 CG ARG A 89 19.355 4.748 17.155 1.00 0.00 C ATOM 1276 CD ARG A 89 18.808 3.547 17.911 1.00 0.00 C ATOM 1277 NE ARG A 89 19.844 2.556 18.191 1.00 0.00 N ATOM 1278 CZ ARG A 89 20.061 2.020 19.391 1.00 0.00 C ATOM 1279 NH1 ARG A 89 19.324 2.385 20.434 1.00 0.00 N ATOM 1280 NH2 ARG A 89 21.022 1.121 19.547 1.00 0.00 N ATOM 0 H ARG A 89 16.679 7.357 15.876 1.00 0.00 H new ATOM 0 HA ARG A 89 19.305 7.572 16.782 1.00 0.00 H new ATOM 0 HB2 ARG A 89 17.642 5.944 17.603 1.00 0.00 H new ATOM 0 HB3 ARG A 89 17.584 5.164 16.034 1.00 0.00 H new ATOM 0 HG2 ARG A 89 19.903 4.408 16.276 1.00 0.00 H new ATOM 0 HG3 ARG A 89 20.065 5.284 17.785 1.00 0.00 H new ATOM 0 HD2 ARG A 89 18.363 3.881 18.849 1.00 0.00 H new ATOM 0 HD3 ARG A 89 18.012 3.084 17.328 1.00 0.00 H new ATOM 0 HE ARG A 89 20.439 2.255 17.419 1.00 0.00 H new ATOM 0 HH11 ARG A 89 18.586 3.080 20.319 1.00 0.00 H new ATOM 0 HH12 ARG A 89 19.496 1.970 21.350 1.00 0.00 H new ATOM 0 HH21 ARG A 89 21.593 0.841 18.749 1.00 0.00 H new ATOM 0 HH22 ARG A 89 21.191 0.709 20.465 1.00 0.00 H new ATOM 1294 N ARG A 90 19.097 6.397 13.730 1.00 0.00 N ATOM 1295 CA ARG A 90 19.893 6.063 12.552 1.00 0.00 C ATOM 1296 C ARG A 90 20.591 7.300 11.994 1.00 0.00 C ATOM 1297 O ARG A 90 21.664 7.205 11.403 1.00 0.00 O ATOM 1298 CB ARG A 90 19.015 5.428 11.468 1.00 0.00 C ATOM 1299 CG ARG A 90 18.198 4.246 11.962 1.00 0.00 C ATOM 1300 CD ARG A 90 17.449 3.564 10.829 1.00 0.00 C ATOM 1301 NE ARG A 90 16.632 2.444 11.303 1.00 0.00 N ATOM 1302 CZ ARG A 90 16.281 1.405 10.548 1.00 0.00 C ATOM 1303 NH1 ARG A 90 16.700 1.332 9.291 1.00 0.00 N ATOM 1304 NH2 ARG A 90 15.518 0.439 11.044 1.00 0.00 N ATOM 0 H ARG A 90 18.090 6.410 13.570 1.00 0.00 H new ATOM 0 HA ARG A 90 20.653 5.344 12.858 1.00 0.00 H new ATOM 0 HB2 ARG A 90 18.339 6.185 11.070 1.00 0.00 H new ATOM 0 HB3 ARG A 90 19.649 5.102 10.644 1.00 0.00 H new ATOM 0 HG2 ARG A 90 18.857 3.526 12.447 1.00 0.00 H new ATOM 0 HG3 ARG A 90 17.487 4.585 12.715 1.00 0.00 H new ATOM 0 HD2 ARG A 90 16.810 4.291 10.328 1.00 0.00 H new ATOM 0 HD3 ARG A 90 18.163 3.203 10.089 1.00 0.00 H new ATOM 0 HE ARG A 90 16.312 2.461 12.271 1.00 0.00 H new ATOM 0 HH11 ARG A 90 17.289 2.070 8.906 1.00 0.00 H new ATOM 0 HH12 ARG A 90 16.433 0.537 8.710 1.00 0.00 H new ATOM 0 HH21 ARG A 90 15.196 0.489 12.010 1.00 0.00 H new ATOM 0 HH22 ARG A 90 15.254 -0.353 10.459 1.00 0.00 H new ATOM 1318 N ASN A 91 19.975 8.455 12.186 1.00 0.00 N ATOM 1319 CA ASN A 91 20.539 9.715 11.698 1.00 0.00 C ATOM 1320 C ASN A 91 21.384 10.393 12.778 1.00 0.00 C ATOM 1321 O ASN A 91 22.003 11.429 12.531 1.00 0.00 O ATOM 1322 CB ASN A 91 19.422 10.647 11.214 1.00 0.00 C ATOM 1323 CG ASN A 91 19.944 11.844 10.433 1.00 0.00 C ATOM 1324 OD1 ASN A 91 20.173 12.915 10.990 1.00 0.00 O ATOM 1325 ND2 ASN A 91 20.133 11.668 9.133 1.00 0.00 N ATOM 0 H ASN A 91 19.085 8.552 12.675 1.00 0.00 H new ATOM 0 HA ASN A 91 21.193 9.493 10.855 1.00 0.00 H new ATOM 0 HB2 ASN A 91 18.732 10.083 10.586 1.00 0.00 H new ATOM 0 HB3 ASN A 91 18.853 11.001 12.074 1.00 0.00 H new ATOM 0 HD21 ASN A 91 20.480 12.437 8.559 1.00 0.00 H new ATOM 0 HD22 ASN A 91 19.932 10.764 8.706 1.00 0.00 H new ATOM 1332 N ASN A 92 21.377 9.803 13.975 1.00 0.00 N ATOM 1333 CA ASN A 92 22.128 10.307 15.135 1.00 0.00 C ATOM 1334 C ASN A 92 21.407 11.473 15.804 1.00 0.00 C ATOM 1335 O ASN A 92 21.974 12.170 16.643 1.00 0.00 O ATOM 1336 CB ASN A 92 23.564 10.708 14.769 1.00 0.00 C ATOM 1337 CG ASN A 92 24.432 9.520 14.407 1.00 0.00 C ATOM 1338 OD1 ASN A 92 24.261 8.420 14.939 1.00 0.00 O ATOM 1339 ND2 ASN A 92 25.362 9.726 13.487 1.00 0.00 N ATOM 0 H ASN A 92 20.846 8.954 14.172 1.00 0.00 H new ATOM 0 HA ASN A 92 22.186 9.482 15.846 1.00 0.00 H new ATOM 0 HB2 ASN A 92 23.539 11.403 13.930 1.00 0.00 H new ATOM 0 HB3 ASN A 92 24.013 11.238 15.609 1.00 0.00 H new ATOM 0 HD21 ASN A 92 25.969 8.960 13.195 1.00 0.00 H new ATOM 0 HD22 ASN A 92 25.472 10.651 13.071 1.00 0.00 H new ATOM 1346 N ILE A 93 20.155 11.676 15.429 1.00 0.00 N ATOM 1347 CA ILE A 93 19.337 12.733 16.010 1.00 0.00 C ATOM 1348 C ILE A 93 18.372 12.119 17.016 1.00 0.00 C ATOM 1349 O ILE A 93 18.401 10.909 17.246 1.00 0.00 O ATOM 1350 CB ILE A 93 18.545 13.501 14.928 1.00 0.00 C ATOM 1351 CG1 ILE A 93 17.615 12.563 14.148 1.00 0.00 C ATOM 1352 CG2 ILE A 93 19.502 14.224 13.991 1.00 0.00 C ATOM 1353 CD1 ILE A 93 16.919 13.224 12.983 1.00 0.00 C ATOM 0 H ILE A 93 19.678 11.119 14.720 1.00 0.00 H new ATOM 0 HA ILE A 93 19.997 13.446 16.505 1.00 0.00 H new ATOM 0 HB ILE A 93 17.919 14.242 15.424 1.00 0.00 H new ATOM 0 HG12 ILE A 93 18.194 11.716 13.780 1.00 0.00 H new ATOM 0 HG13 ILE A 93 16.863 12.163 14.829 1.00 0.00 H new ATOM 0 HG21 ILE A 93 18.932 14.762 13.233 1.00 0.00 H new ATOM 0 HG22 ILE A 93 20.105 14.931 14.561 1.00 0.00 H new ATOM 0 HG23 ILE A 93 20.155 13.498 13.507 1.00 0.00 H new ATOM 0 HD11 ILE A 93 16.280 12.498 12.481 1.00 0.00 H new ATOM 0 HD12 ILE A 93 16.311 14.053 13.345 1.00 0.00 H new ATOM 0 HD13 ILE A 93 17.663 13.599 12.280 1.00 0.00 H new ATOM 1365 N GLN A 94 17.556 12.939 17.652 1.00 0.00 N ATOM 1366 CA GLN A 94 16.582 12.433 18.609 1.00 0.00 C ATOM 1367 C GLN A 94 15.189 12.486 18.003 1.00 0.00 C ATOM 1368 O GLN A 94 14.953 13.245 17.072 1.00 0.00 O ATOM 1369 CB GLN A 94 16.606 13.230 19.921 1.00 0.00 C ATOM 1370 CG GLN A 94 17.744 12.879 20.873 1.00 0.00 C ATOM 1371 CD GLN A 94 19.114 13.291 20.371 1.00 0.00 C ATOM 1372 OE1 GLN A 94 19.557 14.417 20.593 1.00 0.00 O ATOM 1373 NE2 GLN A 94 19.808 12.375 19.722 1.00 0.00 N ATOM 0 H GLN A 94 17.545 13.951 17.527 1.00 0.00 H new ATOM 0 HA GLN A 94 16.847 11.401 18.839 1.00 0.00 H new ATOM 0 HB2 GLN A 94 16.668 14.292 19.682 1.00 0.00 H new ATOM 0 HB3 GLN A 94 15.660 13.075 20.439 1.00 0.00 H new ATOM 0 HG2 GLN A 94 17.561 13.358 21.835 1.00 0.00 H new ATOM 0 HG3 GLN A 94 17.740 11.803 21.047 1.00 0.00 H new ATOM 0 HE21 GLN A 94 19.406 11.452 19.557 1.00 0.00 H new ATOM 0 HE22 GLN A 94 20.746 12.590 19.385 1.00 0.00 H new ATOM 1382 N ASN A 95 14.277 11.658 18.485 1.00 0.00 N ATOM 1383 CA ASN A 95 12.913 11.666 17.962 1.00 0.00 C ATOM 1384 C ASN A 95 12.333 13.082 18.111 1.00 0.00 C ATOM 1385 O ASN A 95 11.979 13.759 17.132 1.00 0.00 O ATOM 1386 CB ASN A 95 12.039 10.623 18.681 1.00 0.00 C ATOM 1387 CG ASN A 95 12.188 10.626 20.192 1.00 0.00 C ATOM 1388 OD1 ASN A 95 13.080 9.980 20.734 1.00 0.00 O ATOM 1389 ND2 ASN A 95 11.303 11.324 20.882 1.00 0.00 N ATOM 0 H ASN A 95 14.448 10.979 19.227 1.00 0.00 H new ATOM 0 HA ASN A 95 12.926 11.394 16.907 1.00 0.00 H new ATOM 0 HB2 ASN A 95 10.994 10.804 18.429 1.00 0.00 H new ATOM 0 HB3 ASN A 95 12.290 9.632 18.304 1.00 0.00 H new ATOM 0 HD21 ASN A 95 11.347 11.338 21.901 1.00 0.00 H new ATOM 0 HD22 ASN A 95 10.576 11.849 20.396 1.00 0.00 H new ATOM 1396 N GLU A 96 12.349 13.565 19.341 1.00 0.00 N ATOM 1397 CA GLU A 96 11.836 14.886 19.669 1.00 0.00 C ATOM 1398 C GLU A 96 12.827 15.983 19.279 1.00 0.00 C ATOM 1399 O GLU A 96 12.673 17.139 19.676 1.00 0.00 O ATOM 1400 CB GLU A 96 11.501 14.947 21.156 1.00 0.00 C ATOM 1401 CG GLU A 96 12.640 14.510 22.058 1.00 0.00 C ATOM 1402 CD GLU A 96 12.163 14.170 23.449 1.00 0.00 C ATOM 1403 OE1 GLU A 96 11.687 15.078 24.152 1.00 0.00 O ATOM 1404 OE2 GLU A 96 12.240 12.984 23.833 1.00 0.00 O ATOM 0 H GLU A 96 12.718 13.053 20.142 1.00 0.00 H new ATOM 0 HA GLU A 96 10.927 15.061 19.094 1.00 0.00 H new ATOM 0 HB2 GLU A 96 11.217 15.967 21.413 1.00 0.00 H new ATOM 0 HB3 GLU A 96 10.634 14.316 21.350 1.00 0.00 H new ATOM 0 HG2 GLU A 96 13.134 13.642 21.622 1.00 0.00 H new ATOM 0 HG3 GLU A 96 13.383 15.305 22.114 1.00 0.00 H new ATOM 1411 N ASP A 97 13.845 15.611 18.503 1.00 0.00 N ATOM 1412 CA ASP A 97 14.843 16.566 18.032 1.00 0.00 C ATOM 1413 C ASP A 97 14.172 17.553 17.109 1.00 0.00 C ATOM 1414 O ASP A 97 14.511 18.736 17.093 1.00 0.00 O ATOM 1415 CB ASP A 97 15.944 15.868 17.234 1.00 0.00 C ATOM 1416 CG ASP A 97 17.288 16.556 17.341 1.00 0.00 C ATOM 1417 OD1 ASP A 97 17.441 17.677 16.814 1.00 0.00 O ATOM 1418 OD2 ASP A 97 18.206 15.966 17.948 1.00 0.00 O ATOM 0 H ASP A 97 13.999 14.653 18.188 1.00 0.00 H new ATOM 0 HA ASP A 97 15.281 17.056 18.902 1.00 0.00 H new ATOM 0 HB2 ASP A 97 16.041 14.840 17.584 1.00 0.00 H new ATOM 0 HB3 ASP A 97 15.650 15.822 16.186 1.00 0.00 H new ATOM 1423 N LEU A 98 13.192 17.037 16.358 1.00 0.00 N ATOM 1424 CA LEU A 98 12.461 17.836 15.380 1.00 0.00 C ATOM 1425 C LEU A 98 13.361 18.165 14.194 1.00 0.00 C ATOM 1426 O LEU A 98 14.366 18.870 14.310 1.00 0.00 O ATOM 1427 CB LEU A 98 11.870 19.107 15.992 1.00 0.00 C ATOM 1428 CG LEU A 98 10.422 18.977 16.460 1.00 0.00 C ATOM 1429 CD1 LEU A 98 10.287 17.899 17.521 1.00 0.00 C ATOM 1430 CD2 LEU A 98 9.920 20.309 16.980 1.00 0.00 C ATOM 0 H LEU A 98 12.889 16.065 16.413 1.00 0.00 H new ATOM 0 HA LEU A 98 11.619 17.239 15.030 1.00 0.00 H new ATOM 0 HB2 LEU A 98 12.486 19.406 16.840 1.00 0.00 H new ATOM 0 HB3 LEU A 98 11.929 19.909 15.257 1.00 0.00 H new ATOM 0 HG LEU A 98 9.810 18.682 15.608 1.00 0.00 H new ATOM 0 HD11 LEU A 98 9.246 17.827 17.837 1.00 0.00 H new ATOM 0 HD12 LEU A 98 10.608 16.942 17.110 1.00 0.00 H new ATOM 0 HD13 LEU A 98 10.910 18.153 18.379 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.887 20.204 17.311 1.00 0.00 H new ATOM 0 HD22 LEU A 98 10.539 20.629 17.818 1.00 0.00 H new ATOM 0 HD23 LEU A 98 9.973 21.053 16.185 1.00 0.00 H new ATOM 1442 N ILE A 99 12.973 17.635 13.057 1.00 0.00 N ATOM 1443 CA ILE A 99 13.706 17.798 11.809 1.00 0.00 C ATOM 1444 C ILE A 99 13.150 18.953 10.979 1.00 0.00 C ATOM 1445 O ILE A 99 12.184 19.605 11.383 1.00 0.00 O ATOM 1446 CB ILE A 99 13.617 16.494 10.997 1.00 0.00 C ATOM 1447 CG1 ILE A 99 12.147 16.113 10.796 1.00 0.00 C ATOM 1448 CG2 ILE A 99 14.367 15.379 11.712 1.00 0.00 C ATOM 1449 CD1 ILE A 99 11.934 14.734 10.217 1.00 0.00 C ATOM 0 H ILE A 99 12.129 17.070 12.965 1.00 0.00 H new ATOM 0 HA ILE A 99 14.744 18.026 12.050 1.00 0.00 H new ATOM 0 HB ILE A 99 14.078 16.645 10.021 1.00 0.00 H new ATOM 0 HG12 ILE A 99 11.634 16.174 11.756 1.00 0.00 H new ATOM 0 HG13 ILE A 99 11.681 16.846 10.138 1.00 0.00 H new ATOM 0 HG21 ILE A 99 14.297 14.461 11.128 1.00 0.00 H new ATOM 0 HG22 ILE A 99 15.414 15.659 11.824 1.00 0.00 H new ATOM 0 HG23 ILE A 99 13.927 15.217 12.696 1.00 0.00 H new ATOM 0 HD11 ILE A 99 10.866 14.546 10.108 1.00 0.00 H new ATOM 0 HD12 ILE A 99 12.415 14.671 9.241 1.00 0.00 H new ATOM 0 HD13 ILE A 99 12.367 13.989 10.884 1.00 0.00 H new ATOM 1461 N TYR A 100 13.768 19.205 9.829 1.00 0.00 N ATOM 1462 CA TYR A 100 13.348 20.288 8.944 1.00 0.00 C ATOM 1463 C TYR A 100 13.196 19.779 7.511 1.00 0.00 C ATOM 1464 O TYR A 100 13.789 18.765 7.137 1.00 0.00 O ATOM 1465 CB TYR A 100 14.358 21.440 8.986 1.00 0.00 C ATOM 1466 CG TYR A 100 14.645 21.955 10.377 1.00 0.00 C ATOM 1467 CD1 TYR A 100 13.709 22.720 11.062 1.00 0.00 C ATOM 1468 CD2 TYR A 100 15.847 21.664 11.010 1.00 0.00 C ATOM 1469 CE1 TYR A 100 13.968 23.184 12.337 1.00 0.00 C ATOM 1470 CE2 TYR A 100 16.110 22.123 12.284 1.00 0.00 C ATOM 1471 CZ TYR A 100 15.168 22.881 12.942 1.00 0.00 C ATOM 1472 OH TYR A 100 15.423 23.332 14.217 1.00 0.00 O ATOM 0 H TYR A 100 14.566 18.671 9.486 1.00 0.00 H new ATOM 0 HA TYR A 100 12.382 20.656 9.291 1.00 0.00 H new ATOM 0 HB2 TYR A 100 15.292 21.108 8.533 1.00 0.00 H new ATOM 0 HB3 TYR A 100 13.982 22.261 8.376 1.00 0.00 H new ATOM 0 HD1 TYR A 100 12.766 22.955 10.591 1.00 0.00 H new ATOM 0 HD2 TYR A 100 16.587 21.069 10.496 1.00 0.00 H new ATOM 0 HE1 TYR A 100 13.234 23.781 12.857 1.00 0.00 H new ATOM 0 HE2 TYR A 100 17.050 21.889 12.762 1.00 0.00 H new ATOM 0 HH TYR A 100 16.312 23.031 14.499 1.00 0.00 H new ATOM 1482 N PRO A 101 12.412 20.497 6.691 1.00 0.00 N ATOM 1483 CA PRO A 101 12.141 20.119 5.299 1.00 0.00 C ATOM 1484 C PRO A 101 13.364 20.145 4.390 1.00 0.00 C ATOM 1485 O PRO A 101 14.206 21.041 4.477 1.00 0.00 O ATOM 1486 CB PRO A 101 11.137 21.169 4.821 1.00 0.00 C ATOM 1487 CG PRO A 101 11.273 22.317 5.759 1.00 0.00 C ATOM 1488 CD PRO A 101 11.725 21.742 7.070 1.00 0.00 C ATOM 0 HA PRO A 101 11.787 19.089 5.257 1.00 0.00 H new ATOM 0 HB2 PRO A 101 11.349 21.474 3.796 1.00 0.00 H new ATOM 0 HB3 PRO A 101 10.122 20.773 4.832 1.00 0.00 H new ATOM 0 HG2 PRO A 101 11.995 23.042 5.383 1.00 0.00 H new ATOM 0 HG3 PRO A 101 10.324 22.841 5.871 1.00 0.00 H new ATOM 0 HD2 PRO A 101 12.394 22.423 7.596 1.00 0.00 H new ATOM 0 HD3 PRO A 101 10.882 21.548 7.733 1.00 0.00 H new ATOM 1496 N GLY A 102 13.455 19.142 3.524 1.00 0.00 N ATOM 1497 CA GLY A 102 14.541 19.070 2.580 1.00 0.00 C ATOM 1498 C GLY A 102 15.686 18.246 3.100 1.00 0.00 C ATOM 1499 O GLY A 102 16.815 18.370 2.630 1.00 0.00 O ATOM 0 H GLY A 102 12.787 18.374 3.464 1.00 0.00 H new ATOM 0 HA2 GLY A 102 14.181 18.641 1.645 1.00 0.00 H new ATOM 0 HA3 GLY A 102 14.892 20.077 2.354 1.00 0.00 H new ATOM 1503 N GLN A 103 15.401 17.405 4.077 1.00 0.00 N ATOM 1504 CA GLN A 103 16.439 16.555 4.652 1.00 0.00 C ATOM 1505 C GLN A 103 16.216 15.112 4.260 1.00 0.00 C ATOM 1506 O GLN A 103 15.187 14.775 3.705 1.00 0.00 O ATOM 1507 CB GLN A 103 16.477 16.702 6.171 1.00 0.00 C ATOM 1508 CG GLN A 103 16.995 18.055 6.621 1.00 0.00 C ATOM 1509 CD GLN A 103 17.010 18.217 8.126 1.00 0.00 C ATOM 1510 OE1 GLN A 103 16.869 19.449 8.585 1.00 0.00 O flip ATOM 1511 NE2 GLN A 103 17.158 17.251 8.873 1.00 0.00 N flip ATOM 0 H GLN A 103 14.474 17.289 4.488 1.00 0.00 H new ATOM 0 HA GLN A 103 17.403 16.874 4.257 1.00 0.00 H new ATOM 0 HB2 GLN A 103 15.474 16.551 6.571 1.00 0.00 H new ATOM 0 HB3 GLN A 103 17.108 15.919 6.591 1.00 0.00 H new ATOM 0 HG2 GLN A 103 18.005 18.196 6.237 1.00 0.00 H new ATOM 0 HG3 GLN A 103 16.375 18.838 6.184 1.00 0.00 H new ATOM 0 HE21 GLN A 103 17.264 16.315 8.482 1.00 0.00 H new ATOM 0 HE22 GLN A 103 17.175 17.386 9.884 1.00 0.00 H new ATOM 1520 N VAL A 104 17.195 14.273 4.503 1.00 0.00 N ATOM 1521 CA VAL A 104 17.084 12.864 4.187 1.00 0.00 C ATOM 1522 C VAL A 104 17.395 12.026 5.421 1.00 0.00 C ATOM 1523 O VAL A 104 18.528 11.998 5.900 1.00 0.00 O ATOM 1524 CB VAL A 104 18.038 12.470 3.040 1.00 0.00 C ATOM 1525 CG1 VAL A 104 17.930 10.984 2.727 1.00 0.00 C ATOM 1526 CG2 VAL A 104 17.757 13.298 1.795 1.00 0.00 C ATOM 0 H VAL A 104 18.085 14.542 4.922 1.00 0.00 H new ATOM 0 HA VAL A 104 16.061 12.673 3.863 1.00 0.00 H new ATOM 0 HB VAL A 104 19.057 12.676 3.367 1.00 0.00 H new ATOM 0 HG11 VAL A 104 18.613 10.733 1.915 1.00 0.00 H new ATOM 0 HG12 VAL A 104 18.191 10.406 3.613 1.00 0.00 H new ATOM 0 HG13 VAL A 104 16.909 10.748 2.428 1.00 0.00 H new ATOM 0 HG21 VAL A 104 18.441 13.003 1.000 1.00 0.00 H new ATOM 0 HG22 VAL A 104 16.730 13.130 1.471 1.00 0.00 H new ATOM 0 HG23 VAL A 104 17.898 14.355 2.021 1.00 0.00 H new ATOM 1536 N LEU A 105 16.379 11.358 5.933 1.00 0.00 N ATOM 1537 CA LEU A 105 16.521 10.520 7.117 1.00 0.00 C ATOM 1538 C LEU A 105 16.466 9.049 6.740 1.00 0.00 C ATOM 1539 O LEU A 105 15.829 8.678 5.757 1.00 0.00 O ATOM 1540 CB LEU A 105 15.417 10.825 8.121 1.00 0.00 C ATOM 1541 CG LEU A 105 15.385 12.257 8.643 1.00 0.00 C ATOM 1542 CD1 LEU A 105 14.247 12.418 9.627 1.00 0.00 C ATOM 1543 CD2 LEU A 105 16.707 12.630 9.296 1.00 0.00 C ATOM 0 H LEU A 105 15.436 11.378 5.546 1.00 0.00 H new ATOM 0 HA LEU A 105 17.489 10.737 7.569 1.00 0.00 H new ATOM 0 HB2 LEU A 105 14.456 10.604 7.657 1.00 0.00 H new ATOM 0 HB3 LEU A 105 15.524 10.149 8.970 1.00 0.00 H new ATOM 0 HG LEU A 105 15.227 12.929 7.800 1.00 0.00 H new ATOM 0 HD11 LEU A 105 14.228 13.443 9.997 1.00 0.00 H new ATOM 0 HD12 LEU A 105 13.303 12.194 9.131 1.00 0.00 H new ATOM 0 HD13 LEU A 105 14.389 11.733 10.463 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.656 13.656 9.659 1.00 0.00 H new ATOM 0 HD22 LEU A 105 16.902 11.958 10.132 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.511 12.543 8.565 1.00 0.00 H new ATOM 1555 N GLN A 106 17.128 8.212 7.521 1.00 0.00 N ATOM 1556 CA GLN A 106 17.139 6.791 7.243 1.00 0.00 C ATOM 1557 C GLN A 106 16.011 6.082 7.954 1.00 0.00 C ATOM 1558 O GLN A 106 15.980 5.982 9.180 1.00 0.00 O ATOM 1559 CB GLN A 106 18.482 6.172 7.613 1.00 0.00 C ATOM 1560 CG GLN A 106 19.636 6.805 6.865 1.00 0.00 C ATOM 1561 CD GLN A 106 20.905 5.984 6.937 1.00 0.00 C ATOM 1562 OE1 GLN A 106 21.709 6.138 7.853 1.00 0.00 O ATOM 1563 NE2 GLN A 106 21.095 5.110 5.962 1.00 0.00 N ATOM 0 H GLN A 106 17.660 8.491 8.345 1.00 0.00 H new ATOM 0 HA GLN A 106 16.989 6.666 6.171 1.00 0.00 H new ATOM 0 HB2 GLN A 106 18.645 6.280 8.685 1.00 0.00 H new ATOM 0 HB3 GLN A 106 18.457 5.103 7.400 1.00 0.00 H new ATOM 0 HG2 GLN A 106 19.355 6.940 5.820 1.00 0.00 H new ATOM 0 HG3 GLN A 106 19.827 7.797 7.274 1.00 0.00 H new ATOM 0 HE21 GLN A 106 20.401 5.014 5.220 1.00 0.00 H new ATOM 0 HE22 GLN A 106 21.935 4.532 5.952 1.00 0.00 H new ATOM 1572 N VAL A 107 15.091 5.600 7.150 1.00 0.00 N ATOM 1573 CA VAL A 107 13.931 4.881 7.630 1.00 0.00 C ATOM 1574 C VAL A 107 13.981 3.445 7.128 1.00 0.00 C ATOM 1575 O VAL A 107 14.566 3.169 6.091 1.00 0.00 O ATOM 1576 CB VAL A 107 12.613 5.536 7.187 1.00 0.00 C ATOM 1577 CG1 VAL A 107 12.448 6.896 7.843 1.00 0.00 C ATOM 1578 CG2 VAL A 107 12.550 5.658 5.676 1.00 0.00 C ATOM 0 H VAL A 107 15.126 5.696 6.135 1.00 0.00 H new ATOM 0 HA VAL A 107 13.957 4.904 8.719 1.00 0.00 H new ATOM 0 HB VAL A 107 11.790 4.897 7.508 1.00 0.00 H new ATOM 0 HG11 VAL A 107 11.510 7.345 7.518 1.00 0.00 H new ATOM 0 HG12 VAL A 107 12.438 6.778 8.927 1.00 0.00 H new ATOM 0 HG13 VAL A 107 13.278 7.542 7.556 1.00 0.00 H new ATOM 0 HG21 VAL A 107 11.608 6.124 5.388 1.00 0.00 H new ATOM 0 HG22 VAL A 107 13.381 6.271 5.325 1.00 0.00 H new ATOM 0 HG23 VAL A 107 12.616 4.667 5.228 1.00 0.00 H new ATOM 1588 N PRO A 108 13.382 2.515 7.870 1.00 0.00 N ATOM 1589 CA PRO A 108 13.393 1.089 7.523 1.00 0.00 C ATOM 1590 C PRO A 108 12.647 0.747 6.234 1.00 0.00 C ATOM 1591 O PRO A 108 12.901 -0.291 5.627 1.00 0.00 O ATOM 1592 CB PRO A 108 12.718 0.428 8.720 1.00 0.00 C ATOM 1593 CG PRO A 108 11.892 1.501 9.340 1.00 0.00 C ATOM 1594 CD PRO A 108 12.630 2.782 9.102 1.00 0.00 C ATOM 0 HA PRO A 108 14.410 0.748 7.330 1.00 0.00 H new ATOM 0 HB2 PRO A 108 12.101 -0.415 8.409 1.00 0.00 H new ATOM 0 HB3 PRO A 108 13.455 0.041 9.424 1.00 0.00 H new ATOM 0 HG2 PRO A 108 10.898 1.535 8.894 1.00 0.00 H new ATOM 0 HG3 PRO A 108 11.756 1.322 10.407 1.00 0.00 H new ATOM 0 HD2 PRO A 108 11.947 3.623 8.982 1.00 0.00 H new ATOM 0 HD3 PRO A 108 13.292 3.025 9.933 1.00 0.00 H new ATOM 1602 N THR A 109 11.730 1.604 5.816 1.00 0.00 N ATOM 1603 CA THR A 109 10.970 1.351 4.600 1.00 0.00 C ATOM 1604 C THR A 109 10.597 2.655 3.909 1.00 0.00 C ATOM 1605 O THR A 109 10.458 3.694 4.554 1.00 0.00 O ATOM 1606 CB THR A 109 9.684 0.544 4.900 1.00 0.00 C ATOM 1607 OG1 THR A 109 9.084 0.089 3.678 1.00 0.00 O ATOM 1608 CG2 THR A 109 8.676 1.386 5.662 1.00 0.00 C ATOM 0 H THR A 109 11.494 2.473 6.294 1.00 0.00 H new ATOM 0 HA THR A 109 11.608 0.765 3.938 1.00 0.00 H new ATOM 0 HB THR A 109 9.967 -0.312 5.513 1.00 0.00 H new ATOM 0 HG1 THR A 109 8.273 -0.421 3.882 1.00 0.00 H new ATOM 0 HG21 THR A 109 7.782 0.794 5.859 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.113 1.710 6.607 1.00 0.00 H new ATOM 0 HG23 THR A 109 8.408 2.260 5.068 1.00 0.00 H new ATOM 1616 N LYS A 110 10.456 2.598 2.594 1.00 0.00 N ATOM 1617 CA LYS A 110 10.075 3.764 1.819 1.00 0.00 C ATOM 1618 C LYS A 110 8.572 3.767 1.586 1.00 0.00 C ATOM 1619 O LYS A 110 7.896 2.768 1.835 1.00 0.00 O ATOM 1620 CB LYS A 110 10.799 3.798 0.477 1.00 0.00 C ATOM 1621 CG LYS A 110 12.271 4.164 0.583 1.00 0.00 C ATOM 1622 CD LYS A 110 12.465 5.475 1.336 1.00 0.00 C ATOM 1623 CE LYS A 110 11.864 6.655 0.585 1.00 0.00 C ATOM 1624 NZ LYS A 110 12.707 7.086 -0.561 1.00 0.00 N ATOM 0 H LYS A 110 10.601 1.753 2.041 1.00 0.00 H new ATOM 0 HA LYS A 110 10.360 4.650 2.386 1.00 0.00 H new ATOM 0 HB2 LYS A 110 10.710 2.821 0.002 1.00 0.00 H new ATOM 0 HB3 LYS A 110 10.302 4.516 -0.175 1.00 0.00 H new ATOM 0 HG2 LYS A 110 12.810 3.366 1.094 1.00 0.00 H new ATOM 0 HG3 LYS A 110 12.699 4.249 -0.416 1.00 0.00 H new ATOM 0 HD2 LYS A 110 12.005 5.399 2.321 1.00 0.00 H new ATOM 0 HD3 LYS A 110 13.529 5.649 1.494 1.00 0.00 H new ATOM 0 HE2 LYS A 110 10.873 6.384 0.222 1.00 0.00 H new ATOM 0 HE3 LYS A 110 11.734 7.491 1.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 12.248 7.880 -1.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 13.640 7.387 -0.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 12.824 6.293 -1.223 1.00 0.00 H new ATOM 1638 N GLY A 111 8.061 4.881 1.089 1.00 0.00 N ATOM 1639 CA GLY A 111 6.640 4.995 0.839 1.00 0.00 C ATOM 1640 C GLY A 111 6.288 4.831 -0.623 1.00 0.00 C ATOM 1641 O GLY A 111 5.815 5.770 -1.262 1.00 0.00 O ATOM 0 H GLY A 111 8.606 5.711 0.854 1.00 0.00 H new ATOM 0 HA2 GLY A 111 6.111 4.241 1.422 1.00 0.00 H new ATOM 0 HA3 GLY A 111 6.292 5.968 1.185 1.00 0.00 H new ATOM 1645 N GLY A 112 6.526 3.644 -1.156 1.00 0.00 N ATOM 1646 CA GLY A 112 6.218 3.382 -2.546 1.00 0.00 C ATOM 1647 C GLY A 112 6.859 2.104 -3.035 1.00 0.00 C ATOM 1648 O GLY A 112 8.000 1.805 -2.682 1.00 0.00 O ATOM 0 H GLY A 112 6.928 2.855 -0.650 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.137 3.317 -2.672 1.00 0.00 H new ATOM 0 HA3 GLY A 112 6.561 4.217 -3.157 1.00 0.00 H new ATOM 1652 N SER A 113 6.130 1.344 -3.836 1.00 0.00 N ATOM 1653 CA SER A 113 6.636 0.092 -4.368 1.00 0.00 C ATOM 1654 C SER A 113 6.218 -0.081 -5.826 1.00 0.00 C ATOM 1655 O SER A 113 7.036 0.060 -6.736 1.00 0.00 O ATOM 1656 CB SER A 113 6.131 -1.078 -3.519 1.00 0.00 C ATOM 1657 OG SER A 113 4.729 -0.980 -3.306 1.00 0.00 O ATOM 0 H SER A 113 5.182 1.575 -4.132 1.00 0.00 H new ATOM 0 HA SER A 113 7.725 0.109 -4.329 1.00 0.00 H new ATOM 0 HB2 SER A 113 6.363 -2.020 -4.016 1.00 0.00 H new ATOM 0 HB3 SER A 113 6.649 -1.087 -2.560 1.00 0.00 H new ATOM 0 HG SER A 113 4.427 -1.738 -2.763 1.00 0.00 H new ATOM 1663 N GLY A 114 4.940 -0.361 -6.040 1.00 0.00 N ATOM 1664 CA GLY A 114 4.433 -0.539 -7.383 1.00 0.00 C ATOM 1665 C GLY A 114 3.274 -1.511 -7.429 1.00 0.00 C ATOM 1666 O GLY A 114 2.122 -1.112 -7.596 1.00 0.00 O ATOM 0 H GLY A 114 4.243 -0.468 -5.303 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.114 0.424 -7.780 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.234 -0.900 -8.028 1.00 0.00 H new ATOM 1670 N GLY A 115 3.569 -2.789 -7.266 1.00 0.00 N ATOM 1671 CA GLY A 115 2.532 -3.796 -7.294 1.00 0.00 C ATOM 1672 C GLY A 115 2.874 -4.989 -6.433 1.00 0.00 C ATOM 1673 O GLY A 115 4.035 -5.391 -6.361 1.00 0.00 O ATOM 0 H GLY A 115 4.511 -3.148 -7.114 1.00 0.00 H new ATOM 0 HA2 GLY A 115 1.594 -3.359 -6.951 1.00 0.00 H new ATOM 0 HA3 GLY A 115 2.374 -4.124 -8.321 1.00 0.00 H new ATOM 1677 N GLY A 116 1.869 -5.545 -5.776 1.00 0.00 N ATOM 1678 CA GLY A 116 2.076 -6.695 -4.925 1.00 0.00 C ATOM 1679 C GLY A 116 2.632 -6.322 -3.575 1.00 0.00 C ATOM 1680 O GLY A 116 3.737 -6.721 -3.213 1.00 0.00 O ATOM 0 H GLY A 116 0.905 -5.216 -5.818 1.00 0.00 H new ATOM 0 HA2 GLY A 116 1.130 -7.220 -4.792 1.00 0.00 H new ATOM 0 HA3 GLY A 116 2.759 -7.388 -5.416 1.00 0.00 H new ATOM 1684 N ALA A 117 1.867 -5.541 -2.830 1.00 0.00 N ATOM 1685 CA ALA A 117 2.286 -5.126 -1.507 1.00 0.00 C ATOM 1686 C ALA A 117 1.444 -5.826 -0.457 1.00 0.00 C ATOM 1687 O ALA A 117 1.902 -6.096 0.651 1.00 0.00 O ATOM 1688 CB ALA A 117 2.181 -3.620 -1.356 1.00 0.00 C ATOM 0 H ALA A 117 0.956 -5.184 -3.120 1.00 0.00 H new ATOM 0 HA ALA A 117 3.330 -5.406 -1.368 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.501 -3.332 -0.355 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.819 -3.135 -2.095 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.147 -3.310 -1.510 1.00 0.00 H new ATOM 1694 N GLY A 118 0.205 -6.114 -0.824 1.00 0.00 N ATOM 1695 CA GLY A 118 -0.693 -6.786 0.080 1.00 0.00 C ATOM 1696 C GLY A 118 -0.983 -8.201 -0.368 1.00 0.00 C ATOM 1697 O GLY A 118 -0.555 -9.166 0.270 1.00 0.00 O ATOM 0 H GLY A 118 -0.193 -5.892 -1.737 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -0.258 -6.803 1.079 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -1.626 -6.227 0.148 1.00 0.00 H new ATOM 1701 N ASN A 119 -1.725 -8.311 -1.470 1.00 0.00 N ATOM 1702 CA ASN A 119 -2.079 -9.596 -2.065 1.00 0.00 C ATOM 1703 C ASN A 119 -3.081 -10.361 -1.219 1.00 0.00 C ATOM 1704 O ASN A 119 -3.114 -11.591 -1.258 1.00 0.00 O ATOM 1705 CB ASN A 119 -0.841 -10.466 -2.307 1.00 0.00 C ATOM 1706 CG ASN A 119 0.048 -9.922 -3.406 1.00 0.00 C ATOM 1707 OD1 ASN A 119 0.998 -9.181 -3.149 1.00 0.00 O ATOM 1708 ND2 ASN A 119 -0.266 -10.269 -4.644 1.00 0.00 N ATOM 0 H ASN A 119 -2.098 -7.507 -1.976 1.00 0.00 H new ATOM 0 HA ASN A 119 -2.543 -9.369 -3.025 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -0.267 -10.539 -1.383 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.157 -11.476 -2.567 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.287 -9.920 -5.427 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -1.061 -10.885 -4.815 1.00 0.00 H new ATOM 1715 N PHE A 120 -3.892 -9.648 -0.445 1.00 0.00 N ATOM 1716 CA PHE A 120 -4.899 -10.308 0.373 1.00 0.00 C ATOM 1717 C PHE A 120 -5.857 -11.093 -0.526 1.00 0.00 C ATOM 1718 O PHE A 120 -6.231 -12.219 -0.218 1.00 0.00 O ATOM 1719 CB PHE A 120 -5.688 -9.291 1.214 1.00 0.00 C ATOM 1720 CG PHE A 120 -6.726 -8.511 0.446 1.00 0.00 C ATOM 1721 CD1 PHE A 120 -6.363 -7.460 -0.379 1.00 0.00 C ATOM 1722 CD2 PHE A 120 -8.069 -8.839 0.551 1.00 0.00 C ATOM 1723 CE1 PHE A 120 -7.316 -6.751 -1.083 1.00 0.00 C ATOM 1724 CE2 PHE A 120 -9.026 -8.134 -0.149 1.00 0.00 C ATOM 1725 CZ PHE A 120 -8.650 -7.087 -0.966 1.00 0.00 C ATOM 0 H PHE A 120 -3.873 -8.631 -0.368 1.00 0.00 H new ATOM 0 HA PHE A 120 -4.392 -10.990 1.056 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.180 -9.819 2.031 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -4.986 -8.590 1.665 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -5.321 -7.191 -0.473 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -8.370 -9.657 1.189 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -7.018 -5.935 -1.724 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -10.068 -8.401 -0.058 1.00 0.00 H new ATOM 0 HZ PHE A 120 -9.398 -6.532 -1.513 1.00 0.00 H new ATOM 1735 N TRP A 121 -6.185 -10.484 -1.668 1.00 0.00 N ATOM 1736 CA TRP A 121 -7.114 -11.046 -2.648 1.00 0.00 C ATOM 1737 C TRP A 121 -6.619 -12.367 -3.218 1.00 0.00 C ATOM 1738 O TRP A 121 -7.421 -13.228 -3.581 1.00 0.00 O ATOM 1739 CB TRP A 121 -7.319 -10.034 -3.775 1.00 0.00 C ATOM 1740 CG TRP A 121 -8.169 -10.519 -4.916 1.00 0.00 C ATOM 1741 CD1 TRP A 121 -7.824 -10.528 -6.238 1.00 0.00 C ATOM 1742 CD2 TRP A 121 -9.494 -11.061 -4.846 1.00 0.00 C ATOM 1743 NE1 TRP A 121 -8.853 -11.038 -6.990 1.00 0.00 N ATOM 1744 CE2 TRP A 121 -9.887 -11.373 -6.162 1.00 0.00 C ATOM 1745 CE3 TRP A 121 -10.390 -11.316 -3.802 1.00 0.00 C ATOM 1746 CZ2 TRP A 121 -11.130 -11.923 -6.461 1.00 0.00 C ATOM 1747 CZ3 TRP A 121 -11.624 -11.863 -4.103 1.00 0.00 C ATOM 1748 CH2 TRP A 121 -11.982 -12.160 -5.421 1.00 0.00 C ATOM 0 H TRP A 121 -5.808 -9.576 -1.940 1.00 0.00 H new ATOM 0 HA TRP A 121 -8.058 -11.250 -2.143 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -7.775 -9.136 -3.358 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -6.343 -9.745 -4.166 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -6.880 -10.184 -6.634 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -8.847 -11.149 -8.004 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -10.123 -11.090 -2.780 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -11.410 -12.154 -7.478 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -12.324 -12.064 -3.305 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -12.954 -12.586 -5.621 1.00 0.00 H new ATOM 1759 N ASP A 122 -5.303 -12.531 -3.286 1.00 0.00 N ATOM 1760 CA ASP A 122 -4.713 -13.753 -3.819 1.00 0.00 C ATOM 1761 C ASP A 122 -5.226 -14.974 -3.067 1.00 0.00 C ATOM 1762 O ASP A 122 -5.301 -16.070 -3.625 1.00 0.00 O ATOM 1763 CB ASP A 122 -3.186 -13.699 -3.765 1.00 0.00 C ATOM 1764 CG ASP A 122 -2.600 -12.797 -4.831 1.00 0.00 C ATOM 1765 OD1 ASP A 122 -2.698 -11.561 -4.694 1.00 0.00 O ATOM 1766 OD2 ASP A 122 -2.041 -13.321 -5.817 1.00 0.00 O ATOM 0 H ASP A 122 -4.625 -11.834 -2.979 1.00 0.00 H new ATOM 0 HA ASP A 122 -5.013 -13.837 -4.863 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -2.873 -13.346 -2.782 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -2.785 -14.706 -3.885 1.00 0.00 H new ATOM 1771 N SER A 123 -5.586 -14.784 -1.804 1.00 0.00 N ATOM 1772 CA SER A 123 -6.118 -15.866 -1.004 1.00 0.00 C ATOM 1773 C SER A 123 -7.341 -15.399 -0.220 1.00 0.00 C ATOM 1774 O SER A 123 -7.616 -15.892 0.870 1.00 0.00 O ATOM 1775 CB SER A 123 -5.051 -16.410 -0.055 1.00 0.00 C ATOM 1776 OG SER A 123 -3.802 -16.555 -0.714 1.00 0.00 O ATOM 0 H SER A 123 -5.517 -13.890 -1.317 1.00 0.00 H new ATOM 0 HA SER A 123 -6.423 -16.670 -1.674 1.00 0.00 H new ATOM 0 HB2 SER A 123 -4.940 -15.737 0.795 1.00 0.00 H new ATOM 0 HB3 SER A 123 -5.370 -17.374 0.341 1.00 0.00 H new ATOM 0 HG SER A 123 -3.138 -16.903 -0.083 1.00 0.00 H new ATOM 1782 N ALA A 124 -8.060 -14.421 -0.762 1.00 0.00 N ATOM 1783 CA ALA A 124 -9.262 -13.918 -0.106 1.00 0.00 C ATOM 1784 C ALA A 124 -10.503 -14.306 -0.889 1.00 0.00 C ATOM 1785 O ALA A 124 -10.483 -14.351 -2.119 1.00 0.00 O ATOM 1786 CB ALA A 124 -9.213 -12.408 0.059 1.00 0.00 C ATOM 0 H ALA A 124 -7.834 -13.964 -1.646 1.00 0.00 H new ATOM 0 HA ALA A 124 -9.307 -14.372 0.884 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -10.124 -12.066 0.551 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -8.349 -12.136 0.665 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -9.131 -11.937 -0.921 1.00 0.00 H new ATOM 1792 N ARG A 125 -11.575 -14.592 -0.176 1.00 0.00 N ATOM 1793 CA ARG A 125 -12.829 -14.959 -0.808 1.00 0.00 C ATOM 1794 C ARG A 125 -13.976 -14.244 -0.112 1.00 0.00 C ATOM 1795 O ARG A 125 -13.887 -13.944 1.080 1.00 0.00 O ATOM 1796 CB ARG A 125 -13.048 -16.473 -0.748 1.00 0.00 C ATOM 1797 CG ARG A 125 -13.997 -16.989 -1.818 1.00 0.00 C ATOM 1798 CD ARG A 125 -14.384 -18.438 -1.573 1.00 0.00 C ATOM 1799 NE ARG A 125 -15.368 -18.565 -0.498 1.00 0.00 N ATOM 1800 CZ ARG A 125 -15.608 -19.691 0.177 1.00 0.00 C ATOM 1801 NH1 ARG A 125 -14.882 -20.781 -0.044 1.00 0.00 N ATOM 1802 NH2 ARG A 125 -16.564 -19.720 1.092 1.00 0.00 N ATOM 0 H ARG A 125 -11.603 -14.577 0.843 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.791 -14.660 -1.856 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -12.087 -16.976 -0.852 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -13.441 -16.737 0.234 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -14.894 -16.371 -1.838 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -13.526 -16.898 -2.797 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -14.790 -18.865 -2.490 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -13.494 -19.014 -1.320 1.00 0.00 H new ATOM 0 HE ARG A 125 -15.907 -17.736 -0.247 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -14.132 -20.763 -0.735 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -15.074 -21.636 0.478 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -17.116 -18.883 1.280 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -16.749 -20.580 1.609 1.00 0.00 H new ATOM 1816 N ASP A 126 -15.032 -13.954 -0.870 1.00 0.00 N ATOM 1817 CA ASP A 126 -16.220 -13.280 -0.341 1.00 0.00 C ATOM 1818 C ASP A 126 -15.865 -11.916 0.241 1.00 0.00 C ATOM 1819 O ASP A 126 -16.314 -11.554 1.331 1.00 0.00 O ATOM 1820 CB ASP A 126 -16.914 -14.138 0.722 1.00 0.00 C ATOM 1821 CG ASP A 126 -17.561 -15.378 0.144 1.00 0.00 C ATOM 1822 OD1 ASP A 126 -18.724 -15.297 -0.297 1.00 0.00 O ATOM 1823 OD2 ASP A 126 -16.914 -16.448 0.142 1.00 0.00 O ATOM 0 H ASP A 126 -15.090 -14.178 -1.863 1.00 0.00 H new ATOM 0 HA ASP A 126 -16.909 -13.134 -1.173 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -16.185 -14.432 1.477 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -17.672 -13.540 1.227 1.00 0.00 H new ATOM 1828 N VAL A 127 -15.059 -11.164 -0.493 1.00 0.00 N ATOM 1829 CA VAL A 127 -14.637 -9.841 -0.059 1.00 0.00 C ATOM 1830 C VAL A 127 -15.776 -8.848 -0.220 1.00 0.00 C ATOM 1831 O VAL A 127 -16.295 -8.657 -1.321 1.00 0.00 O ATOM 1832 CB VAL A 127 -13.422 -9.346 -0.862 1.00 0.00 C ATOM 1833 CG1 VAL A 127 -12.876 -8.063 -0.265 1.00 0.00 C ATOM 1834 CG2 VAL A 127 -12.346 -10.418 -0.935 1.00 0.00 C ATOM 0 H VAL A 127 -14.682 -11.449 -1.397 1.00 0.00 H new ATOM 0 HA VAL A 127 -14.354 -9.916 0.991 1.00 0.00 H new ATOM 0 HB VAL A 127 -13.748 -9.134 -1.880 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -12.017 -7.728 -0.846 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -13.649 -7.295 -0.284 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -12.569 -8.243 0.765 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -11.498 -10.044 -1.508 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -12.019 -10.674 0.073 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -12.749 -11.306 -1.422 1.00 0.00 H new ATOM 1844 N ARG A 128 -16.166 -8.226 0.877 1.00 0.00 N ATOM 1845 CA ARG A 128 -17.254 -7.262 0.862 1.00 0.00 C ATOM 1846 C ARG A 128 -16.999 -6.134 1.854 1.00 0.00 C ATOM 1847 O ARG A 128 -16.495 -6.360 2.955 1.00 0.00 O ATOM 1848 CB ARG A 128 -18.577 -7.961 1.193 1.00 0.00 C ATOM 1849 CG ARG A 128 -18.564 -8.699 2.522 1.00 0.00 C ATOM 1850 CD ARG A 128 -19.885 -9.401 2.788 1.00 0.00 C ATOM 1851 NE ARG A 128 -19.878 -10.114 4.063 1.00 0.00 N ATOM 1852 CZ ARG A 128 -20.793 -11.011 4.424 1.00 0.00 C ATOM 1853 NH1 ARG A 128 -21.788 -11.327 3.604 1.00 0.00 N ATOM 1854 NH2 ARG A 128 -20.696 -11.604 5.606 1.00 0.00 N ATOM 0 H ARG A 128 -15.744 -8.371 1.794 1.00 0.00 H new ATOM 0 HA ARG A 128 -17.314 -6.830 -0.137 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -19.376 -7.219 1.207 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -18.813 -8.668 0.398 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -17.756 -9.431 2.524 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -18.358 -7.994 3.328 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -20.692 -8.668 2.787 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -20.091 -10.104 1.981 1.00 0.00 H new ATOM 0 HE ARG A 128 -19.123 -9.912 4.719 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -21.856 -10.881 2.689 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -22.485 -12.015 3.889 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -19.924 -11.372 6.231 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -21.393 -12.292 5.890 1.00 0.00 H new ATOM 1868 N LEU A 129 -17.341 -4.920 1.460 1.00 0.00 N ATOM 1869 CA LEU A 129 -17.163 -3.768 2.332 1.00 0.00 C ATOM 1870 C LEU A 129 -18.378 -3.611 3.221 1.00 0.00 C ATOM 1871 O LEU A 129 -19.513 -3.561 2.741 1.00 0.00 O ATOM 1872 CB LEU A 129 -16.946 -2.491 1.527 1.00 0.00 C ATOM 1873 CG LEU A 129 -15.562 -2.328 0.906 1.00 0.00 C ATOM 1874 CD1 LEU A 129 -15.551 -1.150 -0.026 1.00 0.00 C ATOM 1875 CD2 LEU A 129 -14.508 -2.150 1.986 1.00 0.00 C ATOM 0 H LEU A 129 -17.742 -4.705 0.547 1.00 0.00 H new ATOM 0 HA LEU A 129 -16.276 -3.938 2.943 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -17.688 -2.455 0.730 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -17.135 -1.637 2.177 1.00 0.00 H new ATOM 0 HG LEU A 129 -15.328 -3.230 0.341 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -14.559 -1.042 -0.464 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -16.283 -1.306 -0.819 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -15.804 -0.246 0.528 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -13.528 -2.035 1.523 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -14.737 -1.262 2.575 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -14.502 -3.025 2.636 1.00 0.00 H new ATOM 1887 N VAL A 130 -18.135 -3.532 4.512 1.00 0.00 N ATOM 1888 CA VAL A 130 -19.201 -3.408 5.482 1.00 0.00 C ATOM 1889 C VAL A 130 -19.058 -2.121 6.283 1.00 0.00 C ATOM 1890 O VAL A 130 -18.015 -1.465 6.248 1.00 0.00 O ATOM 1891 CB VAL A 130 -19.217 -4.618 6.447 1.00 0.00 C ATOM 1892 CG1 VAL A 130 -19.459 -5.913 5.683 1.00 0.00 C ATOM 1893 CG2 VAL A 130 -17.918 -4.697 7.233 1.00 0.00 C ATOM 0 H VAL A 130 -17.199 -3.552 4.916 1.00 0.00 H new ATOM 0 HA VAL A 130 -20.142 -3.382 4.933 1.00 0.00 H new ATOM 0 HB VAL A 130 -20.036 -4.478 7.153 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -19.466 -6.751 6.380 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -20.419 -5.859 5.170 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -18.665 -6.057 4.951 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -17.951 -5.555 7.905 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -17.082 -4.808 6.543 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -17.789 -3.785 7.815 1.00 0.00 H new ATOM 1903 N ASP A 131 -20.145 -1.738 6.941 1.00 0.00 N ATOM 1904 CA ASP A 131 -20.192 -0.544 7.787 1.00 0.00 C ATOM 1905 C ASP A 131 -20.032 0.727 6.966 1.00 0.00 C ATOM 1906 O ASP A 131 -19.876 1.818 7.512 1.00 0.00 O ATOM 1907 CB ASP A 131 -19.125 -0.607 8.887 1.00 0.00 C ATOM 1908 CG ASP A 131 -19.474 -1.586 9.986 1.00 0.00 C ATOM 1909 OD1 ASP A 131 -19.224 -2.798 9.817 1.00 0.00 O ATOM 1910 OD2 ASP A 131 -20.003 -1.147 11.032 1.00 0.00 O ATOM 0 H ASP A 131 -21.027 -2.249 6.905 1.00 0.00 H new ATOM 0 HA ASP A 131 -21.174 -0.519 8.259 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -18.170 -0.890 8.445 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -18.995 0.386 9.318 1.00 0.00 H new ATOM 1915 N GLY A 132 -20.070 0.585 5.650 1.00 0.00 N ATOM 1916 CA GLY A 132 -19.939 1.729 4.784 1.00 0.00 C ATOM 1917 C GLY A 132 -18.516 1.960 4.314 1.00 0.00 C ATOM 1918 O GLY A 132 -18.104 3.101 4.158 1.00 0.00 O ATOM 0 H GLY A 132 -20.190 -0.306 5.169 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -20.585 1.596 3.916 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -20.290 2.617 5.309 1.00 0.00 H new ATOM 1922 N GLY A 133 -17.743 0.888 4.152 1.00 0.00 N ATOM 1923 CA GLY A 133 -16.373 1.038 3.648 1.00 0.00 C ATOM 1924 C GLY A 133 -15.356 1.317 4.763 1.00 0.00 C ATOM 1925 O GLY A 133 -14.113 1.241 4.597 1.00 0.00 O ATOM 0 H GLY A 133 -18.028 -0.070 4.355 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -16.084 0.130 3.118 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -16.344 1.852 2.924 1.00 0.00 H new ATOM 1929 N LYS A 134 -15.875 1.659 5.917 1.00 0.00 N ATOM 1930 CA LYS A 134 -15.017 1.908 7.055 1.00 0.00 C ATOM 1931 C LYS A 134 -14.471 0.578 7.557 1.00 0.00 C ATOM 1932 O LYS A 134 -13.542 0.532 8.341 1.00 0.00 O ATOM 1933 CB LYS A 134 -15.747 2.672 8.155 1.00 0.00 C ATOM 1934 CG LYS A 134 -16.933 1.933 8.721 1.00 0.00 C ATOM 1935 CD LYS A 134 -17.601 2.712 9.844 1.00 0.00 C ATOM 1936 CE LYS A 134 -18.140 4.047 9.353 1.00 0.00 C ATOM 1937 NZ LYS A 134 -18.831 4.801 10.434 1.00 0.00 N ATOM 0 H LYS A 134 -16.873 1.771 6.095 1.00 0.00 H new ATOM 0 HA LYS A 134 -14.186 2.543 6.747 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -15.046 2.888 8.961 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -16.083 3.630 7.758 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -17.657 1.746 7.928 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -16.611 0.961 9.095 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -18.416 2.122 10.263 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -16.884 2.881 10.647 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -17.319 4.647 8.960 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -18.833 3.877 8.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -19.183 5.704 10.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -19.630 4.240 10.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -18.163 4.986 11.210 1.00 0.00 H new ATOM 1951 N VAL A 135 -15.082 -0.508 7.092 1.00 0.00 N ATOM 1952 CA VAL A 135 -14.649 -1.858 7.431 1.00 0.00 C ATOM 1953 C VAL A 135 -14.783 -2.767 6.201 1.00 0.00 C ATOM 1954 O VAL A 135 -15.745 -2.679 5.445 1.00 0.00 O ATOM 1955 CB VAL A 135 -15.451 -2.471 8.610 1.00 0.00 C ATOM 1956 CG1 VAL A 135 -14.838 -3.798 9.033 1.00 0.00 C ATOM 1957 CG2 VAL A 135 -15.513 -1.522 9.797 1.00 0.00 C ATOM 0 H VAL A 135 -15.890 -0.476 6.470 1.00 0.00 H new ATOM 0 HA VAL A 135 -13.608 -1.788 7.748 1.00 0.00 H new ATOM 0 HB VAL A 135 -16.470 -2.641 8.263 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -15.411 -4.216 9.861 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -14.856 -4.492 8.192 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -13.807 -3.638 9.349 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -16.082 -1.985 10.603 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -14.502 -1.306 10.144 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -15.999 -0.594 9.496 1.00 0.00 H new ATOM 1967 N LEU A 136 -13.797 -3.619 5.994 1.00 0.00 N ATOM 1968 CA LEU A 136 -13.778 -4.551 4.884 1.00 0.00 C ATOM 1969 C LEU A 136 -13.722 -5.959 5.430 1.00 0.00 C ATOM 1970 O LEU A 136 -12.821 -6.285 6.186 1.00 0.00 O ATOM 1971 CB LEU A 136 -12.572 -4.297 3.986 1.00 0.00 C ATOM 1972 CG LEU A 136 -12.316 -5.365 2.923 1.00 0.00 C ATOM 1973 CD1 LEU A 136 -13.543 -5.560 2.059 1.00 0.00 C ATOM 1974 CD2 LEU A 136 -11.123 -4.986 2.066 1.00 0.00 C ATOM 0 H LEU A 136 -12.978 -3.684 6.599 1.00 0.00 H new ATOM 0 HA LEU A 136 -14.680 -4.416 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -12.706 -3.336 3.488 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -11.684 -4.211 4.613 1.00 0.00 H new ATOM 0 HG LEU A 136 -12.096 -6.305 3.428 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -13.342 -6.324 1.308 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -14.380 -5.875 2.682 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -13.792 -4.621 1.564 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -10.955 -5.757 1.315 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -11.318 -4.034 1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -10.238 -4.894 2.695 1.00 0.00 H new ATOM 1986 N GLU A 137 -14.656 -6.783 5.019 1.00 0.00 N ATOM 1987 CA GLU A 137 -14.747 -8.148 5.498 1.00 0.00 C ATOM 1988 C GLU A 137 -14.497 -9.139 4.369 1.00 0.00 C ATOM 1989 O GLU A 137 -15.067 -9.011 3.285 1.00 0.00 O ATOM 1990 CB GLU A 137 -16.134 -8.381 6.094 1.00 0.00 C ATOM 1991 CG GLU A 137 -16.263 -9.688 6.842 1.00 0.00 C ATOM 1992 CD GLU A 137 -17.696 -9.999 7.208 1.00 0.00 C ATOM 1993 OE1 GLU A 137 -18.152 -9.561 8.284 1.00 0.00 O ATOM 1994 OE2 GLU A 137 -18.369 -10.686 6.417 1.00 0.00 O ATOM 0 H GLU A 137 -15.376 -6.529 4.343 1.00 0.00 H new ATOM 0 HA GLU A 137 -13.984 -8.303 6.261 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -16.371 -7.560 6.771 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.873 -8.357 5.293 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -15.863 -10.496 6.229 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -15.659 -9.647 7.749 1.00 0.00 H new ATOM 2001 N ALA A 138 -13.651 -10.120 4.630 1.00 0.00 N ATOM 2002 CA ALA A 138 -13.329 -11.143 3.646 1.00 0.00 C ATOM 2003 C ALA A 138 -12.726 -12.352 4.326 1.00 0.00 C ATOM 2004 O ALA A 138 -12.204 -12.252 5.437 1.00 0.00 O ATOM 2005 CB ALA A 138 -12.360 -10.600 2.614 1.00 0.00 C ATOM 0 H ALA A 138 -13.170 -10.231 5.523 1.00 0.00 H new ATOM 0 HA ALA A 138 -14.250 -11.438 3.144 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -12.130 -11.378 1.886 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -12.811 -9.748 2.105 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -11.442 -10.283 3.108 1.00 0.00 H new ATOM 2011 N GLU A 139 -12.789 -13.490 3.664 1.00 0.00 N ATOM 2012 CA GLU A 139 -12.218 -14.696 4.217 1.00 0.00 C ATOM 2013 C GLU A 139 -10.813 -14.875 3.677 1.00 0.00 C ATOM 2014 O GLU A 139 -10.616 -15.177 2.503 1.00 0.00 O ATOM 2015 CB GLU A 139 -13.077 -15.921 3.901 1.00 0.00 C ATOM 2016 CG GLU A 139 -14.480 -15.833 4.473 1.00 0.00 C ATOM 2017 CD GLU A 139 -15.161 -17.182 4.556 1.00 0.00 C ATOM 2018 OE1 GLU A 139 -15.369 -17.818 3.507 1.00 0.00 O ATOM 2019 OE2 GLU A 139 -15.490 -17.619 5.679 1.00 0.00 O ATOM 0 H GLU A 139 -13.227 -13.602 2.750 1.00 0.00 H new ATOM 0 HA GLU A 139 -12.183 -14.599 5.302 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -13.140 -16.043 2.820 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -12.587 -16.811 4.294 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -14.435 -15.391 5.468 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -15.079 -15.165 3.854 1.00 0.00 H new ATOM 2026 N LEU A 140 -9.848 -14.632 4.542 1.00 0.00 N ATOM 2027 CA LEU A 140 -8.447 -14.749 4.202 1.00 0.00 C ATOM 2028 C LEU A 140 -7.952 -16.162 4.469 1.00 0.00 C ATOM 2029 O LEU A 140 -8.077 -16.671 5.585 1.00 0.00 O ATOM 2030 CB LEU A 140 -7.636 -13.751 5.034 1.00 0.00 C ATOM 2031 CG LEU A 140 -7.417 -12.367 4.420 1.00 0.00 C ATOM 2032 CD1 LEU A 140 -8.534 -11.955 3.487 1.00 0.00 C ATOM 2033 CD2 LEU A 140 -7.250 -11.335 5.518 1.00 0.00 C ATOM 0 H LEU A 140 -10.017 -14.346 5.506 1.00 0.00 H new ATOM 0 HA LEU A 140 -8.321 -14.530 3.142 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -8.135 -13.623 5.994 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -6.660 -14.191 5.239 1.00 0.00 H new ATOM 0 HG LEU A 140 -6.508 -12.424 3.821 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.323 -10.965 3.082 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -8.609 -12.673 2.670 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -9.476 -11.930 4.036 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.094 -10.352 5.073 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.146 -11.315 6.138 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.389 -11.595 6.134 1.00 0.00 H new ATOM 2045 N ARG A 141 -7.414 -16.791 3.440 1.00 0.00 N ATOM 2046 CA ARG A 141 -6.882 -18.126 3.550 1.00 0.00 C ATOM 2047 C ARG A 141 -5.626 -18.101 4.395 1.00 0.00 C ATOM 2048 O ARG A 141 -4.824 -17.168 4.293 1.00 0.00 O ATOM 2049 CB ARG A 141 -6.545 -18.658 2.170 1.00 0.00 C ATOM 2050 CG ARG A 141 -6.217 -20.132 2.158 1.00 0.00 C ATOM 2051 CD ARG A 141 -5.769 -20.587 0.784 1.00 0.00 C ATOM 2052 NE ARG A 141 -5.451 -22.018 0.765 1.00 0.00 N ATOM 2053 CZ ARG A 141 -5.652 -22.824 -0.279 1.00 0.00 C ATOM 2054 NH1 ARG A 141 -6.163 -22.353 -1.409 1.00 0.00 N ATOM 2055 NH2 ARG A 141 -5.353 -24.113 -0.192 1.00 0.00 N ATOM 0 H ARG A 141 -7.336 -16.386 2.507 1.00 0.00 H new ATOM 0 HA ARG A 141 -7.626 -18.771 4.017 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -7.388 -18.476 1.503 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -5.697 -18.102 1.772 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -5.431 -20.337 2.885 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -7.093 -20.704 2.465 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -6.554 -20.379 0.057 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -4.893 -20.015 0.479 1.00 0.00 H new ATOM 0 HE ARG A 141 -5.048 -22.426 1.609 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -6.406 -21.365 -1.486 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -6.312 -22.978 -2.201 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -4.969 -24.490 0.674 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -5.507 -24.727 -0.991 1.00 0.00 H new ATOM 2069 N TYR A 142 -5.462 -19.110 5.228 1.00 0.00 N ATOM 2070 CA TYR A 142 -4.312 -19.177 6.096 1.00 0.00 C ATOM 2071 C TYR A 142 -4.004 -20.611 6.501 1.00 0.00 C ATOM 2072 O TYR A 142 -4.594 -21.553 5.962 1.00 0.00 O ATOM 2073 CB TYR A 142 -4.552 -18.291 7.317 1.00 0.00 C ATOM 2074 CG TYR A 142 -5.548 -18.816 8.335 1.00 0.00 C ATOM 2075 CD1 TYR A 142 -6.873 -19.058 7.994 1.00 0.00 C ATOM 2076 CD2 TYR A 142 -5.161 -19.048 9.650 1.00 0.00 C ATOM 2077 CE1 TYR A 142 -7.777 -19.519 8.932 1.00 0.00 C ATOM 2078 CE2 TYR A 142 -6.058 -19.509 10.591 1.00 0.00 C ATOM 2079 CZ TYR A 142 -7.365 -19.741 10.227 1.00 0.00 C ATOM 2080 OH TYR A 142 -8.263 -20.201 11.162 1.00 0.00 O ATOM 0 H TYR A 142 -6.111 -19.891 5.319 1.00 0.00 H new ATOM 0 HA TYR A 142 -3.438 -18.810 5.557 1.00 0.00 H new ATOM 0 HB2 TYR A 142 -3.598 -18.133 7.820 1.00 0.00 H new ATOM 0 HB3 TYR A 142 -4.895 -17.316 6.972 1.00 0.00 H new ATOM 0 HD1 TYR A 142 -7.202 -18.883 6.980 1.00 0.00 H new ATOM 0 HD2 TYR A 142 -4.137 -18.864 9.941 1.00 0.00 H new ATOM 0 HE1 TYR A 142 -8.803 -19.705 8.650 1.00 0.00 H new ATOM 0 HE2 TYR A 142 -5.737 -19.687 11.607 1.00 0.00 H new ATOM 0 HH TYR A 142 -7.811 -20.306 12.025 1.00 0.00 H new ATOM 2090 N SER A 143 -3.095 -20.767 7.448 1.00 0.00 N ATOM 2091 CA SER A 143 -2.687 -22.080 7.929 1.00 0.00 C ATOM 2092 C SER A 143 -3.877 -22.896 8.452 1.00 0.00 C ATOM 2093 O SER A 143 -3.880 -24.126 8.393 1.00 0.00 O ATOM 2094 CB SER A 143 -1.647 -21.900 9.031 1.00 0.00 C ATOM 2095 OG SER A 143 -0.714 -20.886 8.682 1.00 0.00 O ATOM 0 H SER A 143 -2.618 -19.990 7.906 1.00 0.00 H new ATOM 0 HA SER A 143 -2.261 -22.636 7.094 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.142 -21.639 9.966 1.00 0.00 H new ATOM 0 HB3 SER A 143 -1.123 -22.841 9.200 1.00 0.00 H new ATOM 0 HG SER A 143 -1.052 -20.015 8.976 1.00 0.00 H new ATOM 2101 N GLY A 144 -4.902 -22.204 8.933 1.00 0.00 N ATOM 2102 CA GLY A 144 -6.069 -22.885 9.465 1.00 0.00 C ATOM 2103 C GLY A 144 -7.221 -22.953 8.481 1.00 0.00 C ATOM 2104 O GLY A 144 -8.362 -23.205 8.870 1.00 0.00 O ATOM 0 H GLY A 144 -4.947 -21.185 8.965 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -5.789 -23.897 9.757 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -6.401 -22.372 10.368 1.00 0.00 H new ATOM 2108 N GLY A 145 -6.934 -22.730 7.210 1.00 0.00 N ATOM 2109 CA GLY A 145 -7.973 -22.780 6.201 1.00 0.00 C ATOM 2110 C GLY A 145 -8.399 -21.398 5.756 1.00 0.00 C ATOM 2111 O GLY A 145 -7.650 -20.708 5.073 1.00 0.00 O ATOM 0 H GLY A 145 -6.001 -22.515 6.857 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -7.615 -23.344 5.340 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -8.836 -23.316 6.596 1.00 0.00 H new ATOM 2115 N TRP A 146 -9.593 -20.982 6.158 1.00 0.00 N ATOM 2116 CA TRP A 146 -10.110 -19.666 5.791 1.00 0.00 C ATOM 2117 C TRP A 146 -10.608 -18.923 7.022 1.00 0.00 C ATOM 2118 O TRP A 146 -11.405 -19.455 7.796 1.00 0.00 O ATOM 2119 CB TRP A 146 -11.248 -19.795 4.773 1.00 0.00 C ATOM 2120 CG TRP A 146 -10.812 -20.324 3.440 1.00 0.00 C ATOM 2121 CD1 TRP A 146 -10.693 -21.633 3.077 1.00 0.00 C ATOM 2122 CD2 TRP A 146 -10.454 -19.553 2.288 1.00 0.00 C ATOM 2123 NE1 TRP A 146 -10.272 -21.723 1.774 1.00 0.00 N ATOM 2124 CE2 TRP A 146 -10.116 -20.461 1.270 1.00 0.00 C ATOM 2125 CE3 TRP A 146 -10.378 -18.185 2.022 1.00 0.00 C ATOM 2126 CZ2 TRP A 146 -9.713 -20.043 0.004 1.00 0.00 C ATOM 2127 CZ3 TRP A 146 -9.976 -17.773 0.765 1.00 0.00 C ATOM 2128 CH2 TRP A 146 -9.648 -18.699 -0.227 1.00 0.00 C ATOM 0 H TRP A 146 -10.223 -21.535 6.738 1.00 0.00 H new ATOM 0 HA TRP A 146 -9.295 -19.100 5.340 1.00 0.00 H new ATOM 0 HB2 TRP A 146 -12.015 -20.453 5.181 1.00 0.00 H new ATOM 0 HB3 TRP A 146 -11.709 -18.817 4.632 1.00 0.00 H new ATOM 0 HD1 TRP A 146 -10.900 -22.475 3.721 1.00 0.00 H new ATOM 0 HE1 TRP A 146 -10.103 -22.590 1.264 1.00 0.00 H new ATOM 0 HE3 TRP A 146 -10.629 -17.462 2.784 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 -9.461 -20.756 -0.767 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 -9.915 -16.717 0.547 1.00 0.00 H new ATOM 0 HH2 TRP A 146 -9.336 -18.344 -1.198 1.00 0.00 H new ATOM 2139 N ASN A 147 -10.134 -17.699 7.210 1.00 0.00 N ATOM 2140 CA ASN A 147 -10.541 -16.897 8.355 1.00 0.00 C ATOM 2141 C ASN A 147 -11.188 -15.597 7.894 1.00 0.00 C ATOM 2142 O ASN A 147 -10.552 -14.778 7.227 1.00 0.00 O ATOM 2143 CB ASN A 147 -9.338 -16.585 9.261 1.00 0.00 C ATOM 2144 CG ASN A 147 -9.741 -15.955 10.586 1.00 0.00 C ATOM 2145 OD1 ASN A 147 -10.769 -15.289 10.691 1.00 0.00 O ATOM 2146 ND2 ASN A 147 -8.922 -16.146 11.606 1.00 0.00 N ATOM 0 H ASN A 147 -9.469 -17.241 6.586 1.00 0.00 H new ATOM 0 HA ASN A 147 -11.268 -17.474 8.926 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -8.788 -17.506 9.455 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -8.659 -15.912 8.736 1.00 0.00 H new ATOM 0 HD21 ASN A 147 -9.135 -15.735 12.515 1.00 0.00 H new ATOM 0 HD22 ASN A 147 -8.077 -16.704 11.484 1.00 0.00 H new ATOM 2153 N ARG A 148 -12.461 -15.428 8.232 1.00 0.00 N ATOM 2154 CA ARG A 148 -13.190 -14.222 7.875 1.00 0.00 C ATOM 2155 C ARG A 148 -12.752 -13.066 8.771 1.00 0.00 C ATOM 2156 O ARG A 148 -13.261 -12.892 9.882 1.00 0.00 O ATOM 2157 CB ARG A 148 -14.701 -14.438 8.012 1.00 0.00 C ATOM 2158 CG ARG A 148 -15.518 -13.219 7.615 1.00 0.00 C ATOM 2159 CD ARG A 148 -16.968 -13.336 8.062 1.00 0.00 C ATOM 2160 NE ARG A 148 -17.689 -14.409 7.381 1.00 0.00 N ATOM 2161 CZ ARG A 148 -18.995 -14.635 7.541 1.00 0.00 C ATOM 2162 NH1 ARG A 148 -19.712 -13.844 8.330 1.00 0.00 N ATOM 2163 NH2 ARG A 148 -19.583 -15.640 6.908 1.00 0.00 N ATOM 0 H ARG A 148 -13.008 -16.113 8.753 1.00 0.00 H new ATOM 0 HA ARG A 148 -12.967 -13.981 6.836 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -14.998 -15.284 7.393 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -14.932 -14.702 9.044 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -15.074 -12.326 8.054 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -15.481 -13.094 6.533 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -16.998 -13.511 9.137 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -17.477 -12.390 7.878 1.00 0.00 H new ATOM 0 HE ARG A 148 -17.167 -15.017 6.750 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -19.265 -13.065 8.813 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -20.710 -14.015 8.453 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -19.037 -16.246 6.295 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -20.581 -15.808 7.034 1.00 0.00 H new ATOM 2177 N SER A 149 -11.804 -12.289 8.287 1.00 0.00 N ATOM 2178 CA SER A 149 -11.290 -11.154 9.030 1.00 0.00 C ATOM 2179 C SER A 149 -11.693 -9.856 8.358 1.00 0.00 C ATOM 2180 O SER A 149 -12.282 -9.869 7.272 1.00 0.00 O ATOM 2181 CB SER A 149 -9.777 -11.252 9.203 1.00 0.00 C ATOM 2182 OG SER A 149 -9.469 -12.041 10.337 1.00 0.00 O ATOM 0 H SER A 149 -11.370 -12.424 7.374 1.00 0.00 H new ATOM 0 HA SER A 149 -11.730 -11.165 10.027 1.00 0.00 H new ATOM 0 HB2 SER A 149 -9.329 -11.691 8.312 1.00 0.00 H new ATOM 0 HB3 SER A 149 -9.350 -10.255 9.317 1.00 0.00 H new ATOM 0 HG SER A 149 -8.982 -12.843 10.055 1.00 0.00 H new ATOM 2188 N ARG A 150 -11.392 -8.736 9.001 1.00 0.00 N ATOM 2189 CA ARG A 150 -11.783 -7.439 8.463 1.00 0.00 C ATOM 2190 C ARG A 150 -10.713 -6.375 8.700 1.00 0.00 C ATOM 2191 O ARG A 150 -9.795 -6.564 9.499 1.00 0.00 O ATOM 2192 CB ARG A 150 -13.107 -6.963 9.082 1.00 0.00 C ATOM 2193 CG ARG A 150 -14.174 -8.037 9.199 1.00 0.00 C ATOM 2194 CD ARG A 150 -15.391 -7.535 9.957 1.00 0.00 C ATOM 2195 NE ARG A 150 -16.431 -8.555 10.044 1.00 0.00 N ATOM 2196 CZ ARG A 150 -16.658 -9.302 11.118 1.00 0.00 C ATOM 2197 NH1 ARG A 150 -15.915 -9.151 12.209 1.00 0.00 N ATOM 2198 NH2 ARG A 150 -17.631 -10.204 11.092 1.00 0.00 N ATOM 0 H ARG A 150 -10.885 -8.698 9.885 1.00 0.00 H new ATOM 0 HA ARG A 150 -11.907 -7.574 7.389 1.00 0.00 H new ATOM 0 HB2 ARG A 150 -12.905 -6.561 10.075 1.00 0.00 H new ATOM 0 HB3 ARG A 150 -13.500 -6.143 8.480 1.00 0.00 H new ATOM 0 HG2 ARG A 150 -14.474 -8.363 8.203 1.00 0.00 H new ATOM 0 HG3 ARG A 150 -13.761 -8.908 9.708 1.00 0.00 H new ATOM 0 HD2 ARG A 150 -15.095 -7.231 10.961 1.00 0.00 H new ATOM 0 HD3 ARG A 150 -15.790 -6.650 9.461 1.00 0.00 H new ATOM 0 HE ARG A 150 -17.022 -8.704 9.226 1.00 0.00 H new ATOM 0 HH11 ARG A 150 -15.166 -8.459 12.224 1.00 0.00 H new ATOM 0 HH12 ARG A 150 -16.094 -9.727 13.031 1.00 0.00 H new ATOM 0 HH21 ARG A 150 -18.197 -10.319 10.252 1.00 0.00 H new ATOM 0 HH22 ARG A 150 -17.812 -10.782 11.912 1.00 0.00 H new ATOM 2212 N ILE A 151 -10.854 -5.260 7.993 1.00 0.00 N ATOM 2213 CA ILE A 151 -9.937 -4.132 8.104 1.00 0.00 C ATOM 2214 C ILE A 151 -10.713 -2.829 7.926 1.00 0.00 C ATOM 2215 O ILE A 151 -11.819 -2.846 7.425 1.00 0.00 O ATOM 2216 CB ILE A 151 -8.799 -4.221 7.064 1.00 0.00 C ATOM 2217 CG1 ILE A 151 -7.734 -3.176 7.391 1.00 0.00 C ATOM 2218 CG2 ILE A 151 -9.329 -4.034 5.639 1.00 0.00 C ATOM 2219 CD1 ILE A 151 -6.379 -3.472 6.807 1.00 0.00 C ATOM 0 H ILE A 151 -11.610 -5.112 7.324 1.00 0.00 H new ATOM 0 HA ILE A 151 -9.480 -4.157 9.093 1.00 0.00 H new ATOM 0 HB ILE A 151 -8.355 -5.215 7.113 1.00 0.00 H new ATOM 0 HG12 ILE A 151 -8.070 -2.205 7.027 1.00 0.00 H new ATOM 0 HG13 ILE A 151 -7.641 -3.095 8.474 1.00 0.00 H new ATOM 0 HG21 ILE A 151 -8.503 -4.102 4.932 1.00 0.00 H new ATOM 0 HG22 ILE A 151 -10.061 -4.811 5.418 1.00 0.00 H new ATOM 0 HG23 ILE A 151 -9.801 -3.055 5.552 1.00 0.00 H new ATOM 0 HD11 ILE A 151 -5.682 -2.682 7.086 1.00 0.00 H new ATOM 0 HD12 ILE A 151 -6.018 -4.426 7.190 1.00 0.00 H new ATOM 0 HD13 ILE A 151 -6.454 -3.522 5.721 1.00 0.00 H new ATOM 2231 N TYR A 152 -10.151 -1.716 8.343 1.00 0.00 N ATOM 2232 CA TYR A 152 -10.830 -0.436 8.231 1.00 0.00 C ATOM 2233 C TYR A 152 -10.261 0.408 7.092 1.00 0.00 C ATOM 2234 O TYR A 152 -9.178 0.964 7.214 1.00 0.00 O ATOM 2235 CB TYR A 152 -10.694 0.324 9.549 1.00 0.00 C ATOM 2236 CG TYR A 152 -11.477 -0.266 10.702 1.00 0.00 C ATOM 2237 CD1 TYR A 152 -11.174 -1.523 11.206 1.00 0.00 C ATOM 2238 CD2 TYR A 152 -12.515 0.440 11.289 1.00 0.00 C ATOM 2239 CE1 TYR A 152 -11.884 -2.060 12.259 1.00 0.00 C ATOM 2240 CE2 TYR A 152 -13.231 -0.086 12.345 1.00 0.00 C ATOM 2241 CZ TYR A 152 -12.911 -1.336 12.827 1.00 0.00 C ATOM 2242 OH TYR A 152 -13.619 -1.864 13.883 1.00 0.00 O ATOM 0 H TYR A 152 -9.223 -1.667 8.764 1.00 0.00 H new ATOM 0 HA TYR A 152 -11.880 -0.627 8.011 1.00 0.00 H new ATOM 0 HB2 TYR A 152 -9.640 0.361 9.824 1.00 0.00 H new ATOM 0 HB3 TYR A 152 -11.020 1.353 9.395 1.00 0.00 H new ATOM 0 HD1 TYR A 152 -10.368 -2.091 10.766 1.00 0.00 H new ATOM 0 HD2 TYR A 152 -12.768 1.420 10.913 1.00 0.00 H new ATOM 0 HE1 TYR A 152 -11.637 -3.041 12.636 1.00 0.00 H new ATOM 0 HE2 TYR A 152 -14.037 0.479 12.790 1.00 0.00 H new ATOM 0 HH TYR A 152 -14.307 -1.227 14.167 1.00 0.00 H new ATOM 2252 N LEU A 153 -10.979 0.495 5.973 1.00 0.00 N ATOM 2253 CA LEU A 153 -10.508 1.302 4.846 1.00 0.00 C ATOM 2254 C LEU A 153 -10.481 2.769 5.224 1.00 0.00 C ATOM 2255 O LEU A 153 -9.575 3.503 4.829 1.00 0.00 O ATOM 2256 CB LEU A 153 -11.374 1.093 3.605 1.00 0.00 C ATOM 2257 CG LEU A 153 -11.025 -0.127 2.746 1.00 0.00 C ATOM 2258 CD1 LEU A 153 -9.700 0.091 2.052 1.00 0.00 C ATOM 2259 CD2 LEU A 153 -10.968 -1.388 3.585 1.00 0.00 C ATOM 0 H LEU A 153 -11.873 0.027 5.822 1.00 0.00 H new ATOM 0 HA LEU A 153 -9.496 0.976 4.605 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -12.414 1.006 3.921 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -11.304 1.985 2.982 1.00 0.00 H new ATOM 0 HG LEU A 153 -11.808 -0.251 1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -9.460 -0.781 1.444 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -9.764 0.972 1.414 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -8.919 0.239 2.798 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -10.718 -2.237 2.949 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -10.207 -1.277 4.357 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -11.938 -1.558 4.053 1.00 0.00 H new ATOM 2271 N ASP A 154 -11.458 3.187 6.017 1.00 0.00 N ATOM 2272 CA ASP A 154 -11.540 4.583 6.474 1.00 0.00 C ATOM 2273 C ASP A 154 -10.272 5.027 7.223 1.00 0.00 C ATOM 2274 O ASP A 154 -10.084 6.225 7.472 1.00 0.00 O ATOM 2275 CB ASP A 154 -12.752 4.771 7.384 1.00 0.00 C ATOM 2276 CG ASP A 154 -12.549 4.177 8.764 1.00 0.00 C ATOM 2277 OD1 ASP A 154 -12.266 2.976 8.856 1.00 0.00 O ATOM 2278 OD2 ASP A 154 -12.691 4.916 9.761 1.00 0.00 O ATOM 0 H ASP A 154 -12.208 2.587 6.361 1.00 0.00 H new ATOM 0 HA ASP A 154 -11.640 5.203 5.583 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -12.967 5.835 7.480 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -13.624 4.310 6.920 1.00 0.00 H new ATOM 2283 N GLU A 155 -9.403 4.076 7.576 1.00 0.00 N ATOM 2284 CA GLU A 155 -8.172 4.392 8.291 1.00 0.00 C ATOM 2285 C GLU A 155 -7.208 5.170 7.443 1.00 0.00 C ATOM 2286 O GLU A 155 -6.758 6.231 7.831 1.00 0.00 O ATOM 2287 CB GLU A 155 -7.433 3.152 8.757 1.00 0.00 C ATOM 2288 CG GLU A 155 -8.240 2.282 9.664 1.00 0.00 C ATOM 2289 CD GLU A 155 -7.413 1.192 10.316 1.00 0.00 C ATOM 2290 OE1 GLU A 155 -6.859 1.437 11.407 1.00 0.00 O ATOM 2291 OE2 GLU A 155 -7.304 0.089 9.736 1.00 0.00 O ATOM 0 H GLU A 155 -9.532 3.084 7.377 1.00 0.00 H new ATOM 0 HA GLU A 155 -8.498 4.983 9.147 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -7.129 2.572 7.886 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -6.522 3.454 9.273 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -8.698 2.897 10.438 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -9.052 1.827 9.097 1.00 0.00 H new ATOM 2298 N HIS A 156 -6.881 4.637 6.291 1.00 0.00 N ATOM 2299 CA HIS A 156 -5.910 5.296 5.434 1.00 0.00 C ATOM 2300 C HIS A 156 -6.477 5.634 4.069 1.00 0.00 C ATOM 2301 O HIS A 156 -5.760 6.110 3.200 1.00 0.00 O ATOM 2302 CB HIS A 156 -4.650 4.441 5.275 1.00 0.00 C ATOM 2303 CG HIS A 156 -3.801 4.365 6.511 1.00 0.00 C ATOM 2304 ND1 HIS A 156 -2.845 5.304 6.826 1.00 0.00 N ATOM 2305 CD2 HIS A 156 -3.762 3.447 7.506 1.00 0.00 C ATOM 2306 CE1 HIS A 156 -2.257 4.972 7.957 1.00 0.00 C ATOM 2307 NE2 HIS A 156 -2.794 3.847 8.394 1.00 0.00 N ATOM 0 H HIS A 156 -7.262 3.765 5.925 1.00 0.00 H new ATOM 0 HA HIS A 156 -5.650 6.233 5.926 1.00 0.00 H new ATOM 0 HB2 HIS A 156 -4.943 3.432 4.986 1.00 0.00 H new ATOM 0 HB3 HIS A 156 -4.050 4.845 4.459 1.00 0.00 H new ATOM 0 HD1 HIS A 156 -2.626 6.130 6.269 1.00 0.00 H new ATOM 0 HD2 HIS A 156 -4.378 2.564 7.586 1.00 0.00 H new ATOM 0 HE1 HIS A 156 -1.469 5.526 8.445 1.00 0.00 H new ATOM 2316 N ILE A 157 -7.746 5.370 3.860 1.00 0.00 N ATOM 2317 CA ILE A 157 -8.356 5.688 2.584 1.00 0.00 C ATOM 2318 C ILE A 157 -9.227 6.932 2.702 1.00 0.00 C ATOM 2319 O ILE A 157 -10.219 6.928 3.431 1.00 0.00 O ATOM 2320 CB ILE A 157 -9.201 4.517 2.079 1.00 0.00 C ATOM 2321 CG1 ILE A 157 -8.324 3.280 1.853 1.00 0.00 C ATOM 2322 CG2 ILE A 157 -9.934 4.898 0.805 1.00 0.00 C ATOM 2323 CD1 ILE A 157 -7.194 3.499 0.868 1.00 0.00 C ATOM 0 H ILE A 157 -8.371 4.942 4.544 1.00 0.00 H new ATOM 0 HA ILE A 157 -7.555 5.879 1.870 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.944 4.274 2.839 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.904 2.965 2.808 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -8.951 2.463 1.496 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -10.530 4.052 0.461 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -10.589 5.747 1.002 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -9.210 5.169 0.036 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -6.620 2.579 0.762 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -7.606 3.783 -0.101 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -6.542 4.293 1.232 1.00 0.00 H new ATOM 2335 N GLY A 158 -8.832 8.003 2.026 1.00 0.00 N ATOM 2336 CA GLY A 158 -9.600 9.236 2.065 1.00 0.00 C ATOM 2337 C GLY A 158 -10.192 9.615 0.716 1.00 0.00 C ATOM 2338 O GLY A 158 -9.944 8.953 -0.289 1.00 0.00 O ATOM 0 H GLY A 158 -7.991 8.041 1.449 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -10.406 9.132 2.792 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -8.959 10.045 2.414 1.00 0.00 H new ATOM 2342 N ASN A 159 -10.978 10.686 0.701 1.00 0.00 N ATOM 2343 CA ASN A 159 -11.610 11.178 -0.524 1.00 0.00 C ATOM 2344 C ASN A 159 -11.106 12.582 -0.845 1.00 0.00 C ATOM 2345 O ASN A 159 -11.112 13.466 0.015 1.00 0.00 O ATOM 2346 CB ASN A 159 -13.148 11.175 -0.380 1.00 0.00 C ATOM 2347 CG ASN A 159 -13.847 12.205 -1.260 1.00 0.00 C ATOM 2348 OD1 ASN A 159 -13.463 12.449 -2.404 1.00 0.00 O ATOM 2349 ND2 ASN A 159 -14.882 12.825 -0.718 1.00 0.00 N ATOM 0 H ASN A 159 -11.196 11.237 1.531 1.00 0.00 H new ATOM 0 HA ASN A 159 -11.343 10.513 -1.346 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -13.525 10.183 -0.627 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -13.407 11.364 0.662 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -15.390 13.531 -1.251 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -15.172 12.597 0.233 1.00 0.00 H new ATOM 2356 N ARG A 160 -10.660 12.774 -2.079 1.00 0.00 N ATOM 2357 CA ARG A 160 -10.158 14.065 -2.520 1.00 0.00 C ATOM 2358 C ARG A 160 -10.906 14.539 -3.765 1.00 0.00 C ATOM 2359 O ARG A 160 -10.504 14.248 -4.889 1.00 0.00 O ATOM 2360 CB ARG A 160 -8.654 13.993 -2.802 1.00 0.00 C ATOM 2361 CG ARG A 160 -8.068 15.299 -3.319 1.00 0.00 C ATOM 2362 CD ARG A 160 -6.604 15.153 -3.692 1.00 0.00 C ATOM 2363 NE ARG A 160 -5.736 15.027 -2.521 1.00 0.00 N ATOM 2364 CZ ARG A 160 -4.416 14.847 -2.589 1.00 0.00 C ATOM 2365 NH1 ARG A 160 -3.821 14.678 -3.764 1.00 0.00 N ATOM 2366 NH2 ARG A 160 -3.698 14.816 -1.476 1.00 0.00 N ATOM 0 H ARG A 160 -10.636 12.047 -2.794 1.00 0.00 H new ATOM 0 HA ARG A 160 -10.327 14.785 -1.719 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -8.134 13.708 -1.887 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -8.467 13.206 -3.533 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -8.633 15.631 -4.190 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -8.173 16.071 -2.557 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -6.480 14.276 -4.328 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -6.294 16.018 -4.278 1.00 0.00 H new ATOM 0 HE ARG A 160 -6.166 15.080 -1.598 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -4.374 14.685 -4.621 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -2.811 14.541 -3.809 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -4.155 14.930 -0.571 1.00 0.00 H new ATOM 0 HH22 ARG A 160 -2.688 14.679 -1.524 1.00 0.00 H new ATOM 2380 N ASN A 161 -12.012 15.238 -3.548 1.00 0.00 N ATOM 2381 CA ASN A 161 -12.824 15.787 -4.634 1.00 0.00 C ATOM 2382 C ASN A 161 -13.208 14.752 -5.693 1.00 0.00 C ATOM 2383 O ASN A 161 -13.096 15.006 -6.893 1.00 0.00 O ATOM 2384 CB ASN A 161 -12.099 16.964 -5.290 1.00 0.00 C ATOM 2385 CG ASN A 161 -12.543 18.299 -4.730 1.00 0.00 C ATOM 2386 OD1 ASN A 161 -13.709 18.481 -4.377 1.00 0.00 O ATOM 2387 ND2 ASN A 161 -11.617 19.239 -4.634 1.00 0.00 N ATOM 0 H ASN A 161 -12.374 15.442 -2.617 1.00 0.00 H new ATOM 0 HA ASN A 161 -13.756 16.126 -4.181 1.00 0.00 H new ATOM 0 HB2 ASN A 161 -11.024 16.852 -5.146 1.00 0.00 H new ATOM 0 HB3 ASN A 161 -12.280 16.945 -6.365 1.00 0.00 H new ATOM 0 HD21 ASN A 161 -11.858 20.155 -4.256 1.00 0.00 H new ATOM 0 HD22 ASN A 161 -10.662 19.047 -4.938 1.00 0.00 H new ATOM 2394 N GLY A 162 -13.660 13.588 -5.254 1.00 0.00 N ATOM 2395 CA GLY A 162 -14.099 12.572 -6.193 1.00 0.00 C ATOM 2396 C GLY A 162 -13.128 11.426 -6.398 1.00 0.00 C ATOM 2397 O GLY A 162 -13.475 10.439 -7.045 1.00 0.00 O ATOM 0 H GLY A 162 -13.732 13.327 -4.271 1.00 0.00 H new ATOM 0 HA2 GLY A 162 -15.049 12.166 -5.847 1.00 0.00 H new ATOM 0 HA3 GLY A 162 -14.287 13.046 -7.156 1.00 0.00 H new ATOM 2401 N GLU A 163 -11.925 11.534 -5.868 1.00 0.00 N ATOM 2402 CA GLU A 163 -10.949 10.463 -6.023 1.00 0.00 C ATOM 2403 C GLU A 163 -10.635 9.825 -4.678 1.00 0.00 C ATOM 2404 O GLU A 163 -10.661 10.485 -3.638 1.00 0.00 O ATOM 2405 CB GLU A 163 -9.669 10.958 -6.705 1.00 0.00 C ATOM 2406 CG GLU A 163 -8.882 11.984 -5.909 1.00 0.00 C ATOM 2407 CD GLU A 163 -7.644 12.462 -6.640 1.00 0.00 C ATOM 2408 OE1 GLU A 163 -7.767 13.338 -7.520 1.00 0.00 O ATOM 2409 OE2 GLU A 163 -6.539 11.964 -6.338 1.00 0.00 O ATOM 0 H GLU A 163 -11.599 12.339 -5.333 1.00 0.00 H new ATOM 0 HA GLU A 163 -11.390 9.705 -6.670 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -9.025 10.101 -6.904 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -9.932 11.391 -7.670 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -9.523 12.838 -5.690 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -8.590 11.551 -4.952 1.00 0.00 H new ATOM 2416 N LEU A 164 -10.369 8.531 -4.706 1.00 0.00 N ATOM 2417 CA LEU A 164 -10.059 7.774 -3.506 1.00 0.00 C ATOM 2418 C LEU A 164 -8.554 7.773 -3.275 1.00 0.00 C ATOM 2419 O LEU A 164 -7.801 7.115 -3.996 1.00 0.00 O ATOM 2420 CB LEU A 164 -10.598 6.347 -3.660 1.00 0.00 C ATOM 2421 CG LEU A 164 -11.204 5.723 -2.405 1.00 0.00 C ATOM 2422 CD1 LEU A 164 -12.060 6.741 -1.671 1.00 0.00 C ATOM 2423 CD2 LEU A 164 -12.045 4.510 -2.779 1.00 0.00 C ATOM 0 H LEU A 164 -10.362 7.975 -5.561 1.00 0.00 H new ATOM 0 HA LEU A 164 -10.533 8.233 -2.638 1.00 0.00 H new ATOM 0 HB2 LEU A 164 -11.356 6.348 -4.444 1.00 0.00 H new ATOM 0 HB3 LEU A 164 -9.785 5.708 -4.004 1.00 0.00 H new ATOM 0 HG LEU A 164 -10.395 5.405 -1.747 1.00 0.00 H new ATOM 0 HD11 LEU A 164 -12.486 6.282 -0.778 1.00 0.00 H new ATOM 0 HD12 LEU A 164 -11.445 7.593 -1.383 1.00 0.00 H new ATOM 0 HD13 LEU A 164 -12.865 7.079 -2.324 1.00 0.00 H new ATOM 0 HD21 LEU A 164 -12.473 4.072 -1.877 1.00 0.00 H new ATOM 0 HD22 LEU A 164 -12.848 4.817 -3.450 1.00 0.00 H new ATOM 0 HD23 LEU A 164 -11.417 3.772 -3.278 1.00 0.00 H new ATOM 2435 N ILE A 165 -8.122 8.529 -2.280 1.00 0.00 N ATOM 2436 CA ILE A 165 -6.710 8.649 -1.967 1.00 0.00 C ATOM 2437 C ILE A 165 -6.310 7.784 -0.783 1.00 0.00 C ATOM 2438 O ILE A 165 -7.150 7.177 -0.121 1.00 0.00 O ATOM 2439 CB ILE A 165 -6.316 10.112 -1.681 1.00 0.00 C ATOM 2440 CG1 ILE A 165 -7.158 10.679 -0.536 1.00 0.00 C ATOM 2441 CG2 ILE A 165 -6.468 10.955 -2.940 1.00 0.00 C ATOM 2442 CD1 ILE A 165 -6.798 12.099 -0.160 1.00 0.00 C ATOM 0 H ILE A 165 -8.735 9.072 -1.672 1.00 0.00 H new ATOM 0 HA ILE A 165 -6.175 8.299 -2.850 1.00 0.00 H new ATOM 0 HB ILE A 165 -5.270 10.141 -1.376 1.00 0.00 H new ATOM 0 HG12 ILE A 165 -8.210 10.643 -0.819 1.00 0.00 H new ATOM 0 HG13 ILE A 165 -7.041 10.040 0.340 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -6.187 11.986 -2.724 1.00 0.00 H new ATOM 0 HG22 ILE A 165 -5.822 10.559 -3.723 1.00 0.00 H new ATOM 0 HG23 ILE A 165 -7.505 10.925 -3.275 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -7.437 12.432 0.658 1.00 0.00 H new ATOM 0 HD12 ILE A 165 -5.755 12.139 0.155 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -6.942 12.751 -1.021 1.00 0.00 H new ATOM 2454 N HIS A 166 -5.015 7.743 -0.532 1.00 0.00 N ATOM 2455 CA HIS A 166 -4.459 6.960 0.559 1.00 0.00 C ATOM 2456 C HIS A 166 -3.581 7.840 1.436 1.00 0.00 C ATOM 2457 O HIS A 166 -2.715 8.557 0.933 1.00 0.00 O ATOM 2458 CB HIS A 166 -3.661 5.769 0.009 1.00 0.00 C ATOM 2459 CG HIS A 166 -2.597 6.145 -0.986 1.00 0.00 C ATOM 2460 ND1 HIS A 166 -1.270 6.369 -0.829 1.00 0.00 N flip ATOM 2461 CD2 HIS A 166 -2.853 6.326 -2.329 1.00 0.00 C flip ATOM 2462 CE1 HIS A 166 -0.757 6.674 -2.065 1.00 0.00 C flip ATOM 2463 NE2 HIS A 166 -1.734 6.641 -2.948 1.00 0.00 N flip ATOM 0 H HIS A 166 -4.318 8.251 -1.077 1.00 0.00 H new ATOM 0 HA HIS A 166 -5.275 6.570 1.167 1.00 0.00 H new ATOM 0 HB2 HIS A 166 -3.194 5.243 0.842 1.00 0.00 H new ATOM 0 HB3 HIS A 166 -4.352 5.070 -0.462 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -3.820 6.225 -2.800 1.00 0.00 H new ATOM 0 HE1 HIS A 166 0.277 6.903 -2.278 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -1.639 6.828 -3.946 1.00 0.00 H new ATOM 2472 N CYS A 167 -3.814 7.791 2.734 1.00 0.00 N ATOM 2473 CA CYS A 167 -3.065 8.582 3.683 1.00 0.00 C ATOM 2474 C CYS A 167 -3.046 7.869 5.028 1.00 0.00 C ATOM 2475 O CYS A 167 -1.969 7.409 5.455 1.00 0.00 O ATOM 2476 CB CYS A 167 -3.700 9.969 3.804 1.00 0.00 C ATOM 2477 SG CYS A 167 -5.449 9.940 4.254 1.00 0.00 S ATOM 2478 OXT CYS A 167 -4.129 7.710 5.623 1.00 0.00 O ATOM 0 H CYS A 167 -4.529 7.200 3.157 1.00 0.00 H new ATOM 0 HA CYS A 167 -2.037 8.704 3.342 1.00 0.00 H new ATOM 0 HB2 CYS A 167 -3.153 10.544 4.551 1.00 0.00 H new ATOM 0 HB3 CYS A 167 -3.588 10.492 2.854 1.00 0.00 H new ATOM 0 HG CYS A 167 -5.673 8.945 5.061 1.00 0.00 H new TER 2484 CYS A 167