USER MOD reduce.3.24.130724 H: found=0, std=0, add=1077, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1073 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 129 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 131 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 65 SER OG : rot 45:sc= 0.615 USER MOD Set 2.2: A 74 HIS : no HD1:sc= -3.31! C(o=-2.7!,f=-5.2!) USER MOD Set 3.1: A 26 HIS : no HE2:sc= -7.42! C(o=-7.5!,f=-5.8!) USER MOD Set 3.2: A 96 THR OG1 : rot 180:sc= -0.0896 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 160:sc= -0.122 (180deg=-0.784) USER MOD Single : A 13 GLN : amide:sc= -2.69! X(o=-2.7!,f=-2.7) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 SER OG : rot 12:sc= 0.0368 USER MOD Single : A 29 TYR OH : rot 180:sc= -0.0555 USER MOD Single : A 33 MET CE :methyl -170:sc= -0.65 (180deg=-1.2) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 81:sc= 1.25 USER MOD Single : A 54 GLN : amide:sc= -5.4! C(o=-5.4!,f=-4.6!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= -0.0282 (180deg=-0.0282) USER MOD Single : A 68 TYR OH : rot -120:sc= 1.11 USER MOD Single : A 69 ASN : amide:sc= 0.00508 X(o=0.0051,f=-0.052) USER MOD Single : A 73 LYS NZ :NH3+ -120:sc= 0.763 (180deg=-0.134) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 154:sc= 0 (180deg=-0.315) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 170:sc= -0.89 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 60:sc= -0.185 USER MOD Single : A 103 GLN : amide:sc= -3.62! K(o=-3.6!,f=-1.2) USER MOD Single : A 104 GLN : amide:sc= -0.0885 K(o=-0.089,f=-1.6!) USER MOD Single : A 105 ASN : amide:sc= -15.2! C(o=-15!,f=-17!) USER MOD Single : A 106 SER OG : rot 31:sc= 0.0674 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 CYS SG : rot -107:sc= -0.7 USER MOD Single : A 112 LYS NZ :NH3+ 163:sc= -0.0166 (180deg=-0.17) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 82:sc= 0.145! USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -2.84! C(o=-2.8!,f=-4.8!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -120:sc= 0.0142 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 47:sc= 0.983 USER MOD Single : A 137 SER OG : rot 180:sc= -0.021 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 55.866 -1.533 -17.081 1.00 0.00 N ATOM 2 CA GLY A 1 54.929 -2.583 -17.436 1.00 0.00 C ATOM 3 C GLY A 1 54.344 -3.273 -16.219 1.00 0.00 C ATOM 4 O GLY A 1 55.072 -3.862 -15.421 1.00 0.00 O ATOM 0 H1 GLY A 1 56.238 -1.092 -17.947 1.00 0.00 H new ATOM 0 H2 GLY A 1 55.381 -0.814 -16.507 1.00 0.00 H new ATOM 0 H3 GLY A 1 56.652 -1.939 -16.534 1.00 0.00 H new ATOM 0 HA2 GLY A 1 54.121 -2.159 -18.033 1.00 0.00 H new ATOM 0 HA3 GLY A 1 55.433 -3.320 -18.061 1.00 0.00 H new ATOM 8 N SER A 2 53.024 -3.198 -16.076 1.00 0.00 N ATOM 9 CA SER A 2 52.342 -3.816 -14.945 1.00 0.00 C ATOM 10 C SER A 2 51.515 -5.015 -15.398 1.00 0.00 C ATOM 11 O SER A 2 51.409 -5.295 -16.592 1.00 0.00 O ATOM 12 CB SER A 2 51.442 -2.796 -14.246 1.00 0.00 C ATOM 13 OG SER A 2 51.195 -3.170 -12.902 1.00 0.00 O ATOM 0 H SER A 2 52.406 -2.716 -16.729 1.00 0.00 H new ATOM 0 HA SER A 2 53.099 -4.164 -14.242 1.00 0.00 H new ATOM 0 HB2 SER A 2 51.912 -1.813 -14.273 1.00 0.00 H new ATOM 0 HB3 SER A 2 50.497 -2.712 -14.783 1.00 0.00 H new ATOM 0 HG SER A 2 50.619 -2.501 -12.477 1.00 0.00 H new ATOM 19 N SER A 3 50.931 -5.721 -14.435 1.00 0.00 N ATOM 20 CA SER A 3 50.116 -6.893 -14.734 1.00 0.00 C ATOM 21 C SER A 3 49.088 -7.134 -13.632 1.00 0.00 C ATOM 22 O SER A 3 49.090 -6.456 -12.606 1.00 0.00 O ATOM 23 CB SER A 3 51.003 -8.128 -14.899 1.00 0.00 C ATOM 24 OG SER A 3 50.336 -9.140 -15.634 1.00 0.00 O ATOM 0 H SER A 3 51.007 -5.502 -13.442 1.00 0.00 H new ATOM 0 HA SER A 3 49.586 -6.708 -15.668 1.00 0.00 H new ATOM 0 HB2 SER A 3 51.926 -7.852 -15.409 1.00 0.00 H new ATOM 0 HB3 SER A 3 51.284 -8.512 -13.918 1.00 0.00 H new ATOM 0 HG SER A 3 50.924 -9.918 -15.727 1.00 0.00 H new ATOM 30 N GLY A 4 48.209 -8.107 -13.854 1.00 0.00 N ATOM 31 CA GLY A 4 47.187 -8.422 -12.873 1.00 0.00 C ATOM 32 C GLY A 4 45.795 -8.445 -13.473 1.00 0.00 C ATOM 33 O GLY A 4 45.625 -8.757 -14.652 1.00 0.00 O ATOM 0 H GLY A 4 48.187 -8.683 -14.696 1.00 0.00 H new ATOM 0 HA2 GLY A 4 47.403 -9.393 -12.427 1.00 0.00 H new ATOM 0 HA3 GLY A 4 47.221 -7.687 -12.069 1.00 0.00 H new ATOM 37 N SER A 5 44.796 -8.117 -12.660 1.00 0.00 N ATOM 38 CA SER A 5 43.411 -8.107 -13.116 1.00 0.00 C ATOM 39 C SER A 5 42.994 -9.487 -13.617 1.00 0.00 C ATOM 40 O SER A 5 42.364 -9.614 -14.666 1.00 0.00 O ATOM 41 CB SER A 5 43.225 -7.071 -14.227 1.00 0.00 C ATOM 42 OG SER A 5 43.168 -5.759 -13.695 1.00 0.00 O ATOM 0 H SER A 5 44.920 -7.855 -11.682 1.00 0.00 H new ATOM 0 HA SER A 5 42.778 -7.840 -12.270 1.00 0.00 H new ATOM 0 HB2 SER A 5 44.048 -7.143 -14.938 1.00 0.00 H new ATOM 0 HB3 SER A 5 42.309 -7.284 -14.778 1.00 0.00 H new ATOM 0 HG SER A 5 43.051 -5.115 -14.424 1.00 0.00 H new ATOM 48 N SER A 6 43.352 -10.518 -12.858 1.00 0.00 N ATOM 49 CA SER A 6 43.019 -11.889 -13.226 1.00 0.00 C ATOM 50 C SER A 6 42.504 -12.665 -12.017 1.00 0.00 C ATOM 51 O SER A 6 43.124 -12.665 -10.955 1.00 0.00 O ATOM 52 CB SER A 6 44.243 -12.593 -13.814 1.00 0.00 C ATOM 53 OG SER A 6 43.961 -13.951 -14.103 1.00 0.00 O ATOM 0 H SER A 6 43.872 -10.430 -11.985 1.00 0.00 H new ATOM 0 HA SER A 6 42.231 -11.857 -13.979 1.00 0.00 H new ATOM 0 HB2 SER A 6 44.558 -12.082 -14.724 1.00 0.00 H new ATOM 0 HB3 SER A 6 45.074 -12.533 -13.111 1.00 0.00 H new ATOM 0 HG SER A 6 44.759 -14.378 -14.479 1.00 0.00 H new ATOM 59 N GLY A 7 41.363 -13.327 -12.189 1.00 0.00 N ATOM 60 CA GLY A 7 40.783 -14.098 -11.106 1.00 0.00 C ATOM 61 C GLY A 7 40.060 -15.336 -11.598 1.00 0.00 C ATOM 62 O GLY A 7 40.499 -15.985 -12.548 1.00 0.00 O ATOM 0 H GLY A 7 40.831 -13.343 -13.059 1.00 0.00 H new ATOM 0 HA2 GLY A 7 41.570 -14.392 -10.412 1.00 0.00 H new ATOM 0 HA3 GLY A 7 40.086 -13.471 -10.550 1.00 0.00 H new ATOM 66 N LYS A 8 38.948 -15.667 -10.950 1.00 0.00 N ATOM 67 CA LYS A 8 38.162 -16.836 -11.326 1.00 0.00 C ATOM 68 C LYS A 8 36.701 -16.459 -11.550 1.00 0.00 C ATOM 69 O LYS A 8 36.249 -15.401 -11.113 1.00 0.00 O ATOM 70 CB LYS A 8 38.262 -17.913 -10.243 1.00 0.00 C ATOM 71 CG LYS A 8 37.619 -17.513 -8.926 1.00 0.00 C ATOM 72 CD LYS A 8 38.613 -16.819 -8.010 1.00 0.00 C ATOM 73 CE LYS A 8 39.333 -17.813 -7.113 1.00 0.00 C ATOM 74 NZ LYS A 8 40.531 -18.394 -7.779 1.00 0.00 N ATOM 0 H LYS A 8 38.571 -15.142 -10.161 1.00 0.00 H new ATOM 0 HA LYS A 8 38.565 -17.230 -12.259 1.00 0.00 H new ATOM 0 HB2 LYS A 8 37.790 -18.826 -10.606 1.00 0.00 H new ATOM 0 HB3 LYS A 8 39.313 -18.145 -10.069 1.00 0.00 H new ATOM 0 HG2 LYS A 8 36.775 -16.850 -9.118 1.00 0.00 H new ATOM 0 HG3 LYS A 8 37.222 -18.399 -8.430 1.00 0.00 H new ATOM 0 HD2 LYS A 8 39.342 -16.274 -8.609 1.00 0.00 H new ATOM 0 HD3 LYS A 8 38.092 -16.084 -7.396 1.00 0.00 H new ATOM 0 HE2 LYS A 8 39.635 -17.317 -6.190 1.00 0.00 H new ATOM 0 HE3 LYS A 8 38.648 -18.614 -6.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 41.172 -18.786 -7.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 40.235 -19.150 -8.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 41.025 -17.652 -8.315 1.00 0.00 H new ATOM 88 N ALA A 9 35.967 -17.333 -12.232 1.00 0.00 N ATOM 89 CA ALA A 9 34.557 -17.093 -12.510 1.00 0.00 C ATOM 90 C ALA A 9 33.675 -18.108 -11.791 1.00 0.00 C ATOM 91 O ALA A 9 33.889 -19.315 -11.898 1.00 0.00 O ATOM 92 CB ALA A 9 34.300 -17.137 -14.009 1.00 0.00 C ATOM 0 H ALA A 9 36.326 -18.213 -12.602 1.00 0.00 H new ATOM 0 HA ALA A 9 34.303 -16.101 -12.137 1.00 0.00 H new ATOM 0 HB1 ALA A 9 33.243 -16.956 -14.202 1.00 0.00 H new ATOM 0 HB2 ALA A 9 34.896 -16.369 -14.503 1.00 0.00 H new ATOM 0 HB3 ALA A 9 34.577 -18.117 -14.397 1.00 0.00 H new ATOM 98 N GLU A 10 32.683 -17.610 -11.058 1.00 0.00 N ATOM 99 CA GLU A 10 31.771 -18.475 -10.320 1.00 0.00 C ATOM 100 C GLU A 10 30.323 -18.205 -10.719 1.00 0.00 C ATOM 101 O GLU A 10 29.937 -17.061 -10.960 1.00 0.00 O ATOM 102 CB GLU A 10 31.943 -18.268 -8.814 1.00 0.00 C ATOM 103 CG GLU A 10 33.094 -19.061 -8.219 1.00 0.00 C ATOM 104 CD GLU A 10 33.362 -18.703 -6.770 1.00 0.00 C ATOM 105 OE1 GLU A 10 33.015 -17.574 -6.365 1.00 0.00 O ATOM 106 OE2 GLU A 10 33.918 -19.551 -6.041 1.00 0.00 O ATOM 0 H GLU A 10 32.491 -16.613 -10.960 1.00 0.00 H new ATOM 0 HA GLU A 10 32.012 -19.509 -10.567 1.00 0.00 H new ATOM 0 HB2 GLU A 10 32.103 -17.208 -8.617 1.00 0.00 H new ATOM 0 HB3 GLU A 10 31.019 -18.550 -8.309 1.00 0.00 H new ATOM 0 HG2 GLU A 10 32.872 -20.126 -8.291 1.00 0.00 H new ATOM 0 HG3 GLU A 10 33.995 -18.883 -8.806 1.00 0.00 H new ATOM 113 N ALA A 11 29.526 -19.266 -10.788 1.00 0.00 N ATOM 114 CA ALA A 11 28.121 -19.145 -11.156 1.00 0.00 C ATOM 115 C ALA A 11 27.223 -19.818 -10.124 1.00 0.00 C ATOM 116 O ALA A 11 27.704 -20.508 -9.226 1.00 0.00 O ATOM 117 CB ALA A 11 27.883 -19.742 -12.535 1.00 0.00 C ATOM 0 H ALA A 11 29.830 -20.220 -10.594 1.00 0.00 H new ATOM 0 HA ALA A 11 27.868 -18.085 -11.183 1.00 0.00 H new ATOM 0 HB1 ALA A 11 26.829 -19.645 -12.797 1.00 0.00 H new ATOM 0 HB2 ALA A 11 28.490 -19.213 -13.270 1.00 0.00 H new ATOM 0 HB3 ALA A 11 28.159 -20.796 -12.528 1.00 0.00 H new ATOM 123 N GLU A 12 25.917 -19.611 -10.258 1.00 0.00 N ATOM 124 CA GLU A 12 24.952 -20.197 -9.335 1.00 0.00 C ATOM 125 C GLU A 12 23.689 -20.634 -10.072 1.00 0.00 C ATOM 126 O GLU A 12 22.943 -19.804 -10.590 1.00 0.00 O ATOM 127 CB GLU A 12 24.593 -19.197 -8.234 1.00 0.00 C ATOM 128 CG GLU A 12 25.588 -19.172 -7.086 1.00 0.00 C ATOM 129 CD GLU A 12 25.410 -20.338 -6.133 1.00 0.00 C ATOM 130 OE1 GLU A 12 25.395 -21.494 -6.607 1.00 0.00 O ATOM 131 OE2 GLU A 12 25.284 -20.096 -4.915 1.00 0.00 O ATOM 0 H GLU A 12 25.503 -19.042 -10.996 1.00 0.00 H new ATOM 0 HA GLU A 12 25.410 -21.076 -8.882 1.00 0.00 H new ATOM 0 HB2 GLU A 12 24.527 -18.199 -8.668 1.00 0.00 H new ATOM 0 HB3 GLU A 12 23.605 -19.440 -7.842 1.00 0.00 H new ATOM 0 HG2 GLU A 12 26.601 -19.188 -7.488 1.00 0.00 H new ATOM 0 HG3 GLU A 12 25.478 -18.238 -6.535 1.00 0.00 H new ATOM 138 N GLN A 13 23.458 -21.942 -10.115 1.00 0.00 N ATOM 139 CA GLN A 13 22.287 -22.489 -10.790 1.00 0.00 C ATOM 140 C GLN A 13 21.030 -22.285 -9.950 1.00 0.00 C ATOM 141 O GLN A 13 21.109 -21.970 -8.763 1.00 0.00 O ATOM 142 CB GLN A 13 22.486 -23.978 -11.077 1.00 0.00 C ATOM 143 CG GLN A 13 21.758 -24.461 -12.320 1.00 0.00 C ATOM 144 CD GLN A 13 20.354 -24.947 -12.022 1.00 0.00 C ATOM 145 OE1 GLN A 13 20.148 -25.784 -11.143 1.00 0.00 O ATOM 146 NE2 GLN A 13 19.378 -24.425 -12.756 1.00 0.00 N ATOM 0 H GLN A 13 24.066 -22.642 -9.691 1.00 0.00 H new ATOM 0 HA GLN A 13 22.162 -21.958 -11.734 1.00 0.00 H new ATOM 0 HB2 GLN A 13 23.551 -24.178 -11.189 1.00 0.00 H new ATOM 0 HB3 GLN A 13 22.142 -24.554 -10.218 1.00 0.00 H new ATOM 0 HG2 GLN A 13 21.711 -23.650 -13.047 1.00 0.00 H new ATOM 0 HG3 GLN A 13 22.328 -25.268 -12.780 1.00 0.00 H new ATOM 0 HE21 GLN A 13 19.594 -23.734 -13.474 1.00 0.00 H new ATOM 0 HE22 GLN A 13 18.412 -24.715 -12.601 1.00 0.00 H new ATOM 155 N ASN A 14 19.871 -22.465 -10.575 1.00 0.00 N ATOM 156 CA ASN A 14 18.597 -22.299 -9.885 1.00 0.00 C ATOM 157 C ASN A 14 17.767 -23.577 -9.961 1.00 0.00 C ATOM 158 O ASN A 14 17.189 -23.893 -11.001 1.00 0.00 O ATOM 159 CB ASN A 14 17.814 -21.133 -10.490 1.00 0.00 C ATOM 160 CG ASN A 14 18.663 -19.887 -10.650 1.00 0.00 C ATOM 161 OD1 ASN A 14 19.280 -19.672 -11.694 1.00 0.00 O ATOM 162 ND2 ASN A 14 18.699 -19.059 -9.612 1.00 0.00 N ATOM 0 H ASN A 14 19.788 -22.726 -11.558 1.00 0.00 H new ATOM 0 HA ASN A 14 18.805 -22.083 -8.837 1.00 0.00 H new ATOM 0 HB2 ASN A 14 17.421 -21.429 -11.463 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.957 -20.906 -9.856 1.00 0.00 H new ATOM 0 HD21 ASN A 14 19.254 -18.205 -9.660 1.00 0.00 H new ATOM 0 HD22 ASN A 14 18.172 -19.278 -8.767 1.00 0.00 H new ATOM 169 N TRP A 15 17.714 -24.308 -8.853 1.00 0.00 N ATOM 170 CA TRP A 15 16.954 -25.552 -8.794 1.00 0.00 C ATOM 171 C TRP A 15 15.778 -25.425 -7.833 1.00 0.00 C ATOM 172 O TRP A 15 15.536 -26.312 -7.013 1.00 0.00 O ATOM 173 CB TRP A 15 17.860 -26.706 -8.362 1.00 0.00 C ATOM 174 CG TRP A 15 18.614 -26.429 -7.097 1.00 0.00 C ATOM 175 CD1 TRP A 15 18.197 -26.685 -5.822 1.00 0.00 C ATOM 176 CD2 TRP A 15 19.914 -25.840 -6.985 1.00 0.00 C ATOM 177 NE1 TRP A 15 19.160 -26.291 -4.924 1.00 0.00 N ATOM 178 CE2 TRP A 15 20.223 -25.770 -5.613 1.00 0.00 C ATOM 179 CE3 TRP A 15 20.848 -25.367 -7.911 1.00 0.00 C ATOM 180 CZ2 TRP A 15 21.426 -25.246 -5.147 1.00 0.00 C ATOM 181 CZ3 TRP A 15 22.041 -24.846 -7.447 1.00 0.00 C ATOM 182 CH2 TRP A 15 22.322 -24.790 -6.076 1.00 0.00 C ATOM 0 H TRP A 15 18.188 -24.061 -7.984 1.00 0.00 H new ATOM 0 HA TRP A 15 16.564 -25.759 -9.790 1.00 0.00 H new ATOM 0 HB2 TRP A 15 17.255 -27.602 -8.227 1.00 0.00 H new ATOM 0 HB3 TRP A 15 18.571 -26.919 -9.161 1.00 0.00 H new ATOM 0 HD1 TRP A 15 17.250 -27.131 -5.558 1.00 0.00 H new ATOM 0 HE1 TRP A 15 19.094 -26.373 -3.909 1.00 0.00 H new ATOM 0 HE3 TRP A 15 20.641 -25.408 -8.970 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 21.644 -25.201 -4.090 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 22.769 -24.476 -8.154 1.00 0.00 H new ATOM 0 HH2 TRP A 15 23.264 -24.379 -5.745 1.00 0.00 H new ATOM 193 N TRP A 16 15.049 -24.320 -7.938 1.00 0.00 N ATOM 194 CA TRP A 16 13.897 -24.079 -7.077 1.00 0.00 C ATOM 195 C TRP A 16 12.608 -24.533 -7.753 1.00 0.00 C ATOM 196 O TRP A 16 12.517 -24.559 -8.980 1.00 0.00 O ATOM 197 CB TRP A 16 13.804 -22.595 -6.718 1.00 0.00 C ATOM 198 CG TRP A 16 12.979 -22.331 -5.495 1.00 0.00 C ATOM 199 CD1 TRP A 16 11.750 -21.736 -5.448 1.00 0.00 C ATOM 200 CD2 TRP A 16 13.324 -22.650 -4.143 1.00 0.00 C ATOM 201 NE1 TRP A 16 11.311 -21.667 -4.148 1.00 0.00 N ATOM 202 CE2 TRP A 16 12.258 -22.221 -3.328 1.00 0.00 C ATOM 203 CE3 TRP A 16 14.429 -23.258 -3.541 1.00 0.00 C ATOM 204 CZ2 TRP A 16 12.268 -22.381 -1.945 1.00 0.00 C ATOM 205 CZ3 TRP A 16 14.437 -23.416 -2.168 1.00 0.00 C ATOM 206 CH2 TRP A 16 13.362 -22.979 -1.382 1.00 0.00 C ATOM 0 H TRP A 16 15.235 -23.576 -8.611 1.00 0.00 H new ATOM 0 HA TRP A 16 14.030 -24.659 -6.164 1.00 0.00 H new ATOM 0 HB2 TRP A 16 14.809 -22.203 -6.561 1.00 0.00 H new ATOM 0 HB3 TRP A 16 13.377 -22.051 -7.560 1.00 0.00 H new ATOM 0 HD1 TRP A 16 11.204 -21.373 -6.306 1.00 0.00 H new ATOM 0 HE1 TRP A 16 10.423 -21.268 -3.843 1.00 0.00 H new ATOM 0 HE3 TRP A 16 15.262 -23.598 -4.138 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 11.441 -22.045 -1.338 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 15.286 -23.884 -1.693 1.00 0.00 H new ATOM 0 HH2 TRP A 16 13.398 -23.117 -0.311 1.00 0.00 H new ATOM 217 N GLU A 17 11.614 -24.888 -6.945 1.00 0.00 N ATOM 218 CA GLU A 17 10.330 -25.341 -7.468 1.00 0.00 C ATOM 219 C GLU A 17 9.747 -24.318 -8.439 1.00 0.00 C ATOM 220 O GLU A 17 9.031 -24.673 -9.375 1.00 0.00 O ATOM 221 CB GLU A 17 9.347 -25.591 -6.322 1.00 0.00 C ATOM 222 CG GLU A 17 8.789 -24.317 -5.710 1.00 0.00 C ATOM 223 CD GLU A 17 9.651 -23.787 -4.581 1.00 0.00 C ATOM 224 OE1 GLU A 17 10.829 -24.194 -4.492 1.00 0.00 O ATOM 225 OE2 GLU A 17 9.149 -22.966 -3.785 1.00 0.00 O ATOM 0 H GLU A 17 11.673 -24.871 -5.927 1.00 0.00 H new ATOM 0 HA GLU A 17 10.494 -26.275 -8.006 1.00 0.00 H new ATOM 0 HB2 GLU A 17 8.521 -26.200 -6.689 1.00 0.00 H new ATOM 0 HB3 GLU A 17 9.847 -26.169 -5.545 1.00 0.00 H new ATOM 0 HG2 GLU A 17 8.701 -23.555 -6.484 1.00 0.00 H new ATOM 0 HG3 GLU A 17 7.783 -24.508 -5.336 1.00 0.00 H new ATOM 232 N GLY A 18 10.058 -23.047 -8.208 1.00 0.00 N ATOM 233 CA GLY A 18 9.557 -21.992 -9.069 1.00 0.00 C ATOM 234 C GLY A 18 9.204 -20.734 -8.300 1.00 0.00 C ATOM 235 O GLY A 18 8.965 -20.765 -7.093 1.00 0.00 O ATOM 0 H GLY A 18 10.648 -22.729 -7.440 1.00 0.00 H new ATOM 0 HA2 GLY A 18 10.308 -21.755 -9.822 1.00 0.00 H new ATOM 0 HA3 GLY A 18 8.675 -22.349 -9.600 1.00 0.00 H new ATOM 239 N PRO A 19 9.168 -19.594 -9.007 1.00 0.00 N ATOM 240 CA PRO A 19 8.844 -18.299 -8.402 1.00 0.00 C ATOM 241 C PRO A 19 7.380 -18.202 -7.988 1.00 0.00 C ATOM 242 O PRO A 19 6.522 -18.940 -8.475 1.00 0.00 O ATOM 243 CB PRO A 19 9.150 -17.299 -9.521 1.00 0.00 C ATOM 244 CG PRO A 19 9.003 -18.083 -10.780 1.00 0.00 C ATOM 245 CD PRO A 19 9.442 -19.483 -10.449 1.00 0.00 C ATOM 0 HA PRO A 19 9.410 -18.124 -7.487 1.00 0.00 H new ATOM 0 HB2 PRO A 19 8.461 -16.455 -9.497 1.00 0.00 H new ATOM 0 HB3 PRO A 19 10.156 -16.891 -9.424 1.00 0.00 H new ATOM 0 HG2 PRO A 19 7.971 -18.070 -11.130 1.00 0.00 H new ATOM 0 HG3 PRO A 19 9.615 -17.660 -11.577 1.00 0.00 H new ATOM 0 HD2 PRO A 19 8.886 -20.225 -11.022 1.00 0.00 H new ATOM 0 HD3 PRO A 19 10.498 -19.636 -10.670 1.00 0.00 H new ATOM 253 N PRO A 20 7.084 -17.272 -7.068 1.00 0.00 N ATOM 254 CA PRO A 20 5.722 -17.057 -6.569 1.00 0.00 C ATOM 255 C PRO A 20 4.808 -16.445 -7.625 1.00 0.00 C ATOM 256 O PRO A 20 5.164 -16.374 -8.800 1.00 0.00 O ATOM 257 CB PRO A 20 5.921 -16.085 -5.404 1.00 0.00 C ATOM 258 CG PRO A 20 7.187 -15.367 -5.722 1.00 0.00 C ATOM 259 CD PRO A 20 8.056 -16.359 -6.444 1.00 0.00 C ATOM 0 HA PRO A 20 5.239 -17.992 -6.284 1.00 0.00 H new ATOM 0 HB2 PRO A 20 5.084 -15.392 -5.319 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.994 -16.615 -4.454 1.00 0.00 H new ATOM 0 HG2 PRO A 20 6.994 -14.492 -6.343 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.673 -15.011 -4.813 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.687 -15.874 -7.189 1.00 0.00 H new ATOM 0 HD3 PRO A 20 8.720 -16.886 -5.758 1.00 0.00 H new ATOM 267 N GLN A 21 3.630 -16.003 -7.196 1.00 0.00 N ATOM 268 CA GLN A 21 2.665 -15.397 -8.106 1.00 0.00 C ATOM 269 C GLN A 21 3.318 -14.298 -8.938 1.00 0.00 C ATOM 270 O GLN A 21 4.503 -14.006 -8.778 1.00 0.00 O ATOM 271 CB GLN A 21 1.483 -14.825 -7.322 1.00 0.00 C ATOM 272 CG GLN A 21 0.792 -15.846 -6.432 1.00 0.00 C ATOM 273 CD GLN A 21 -0.685 -15.556 -6.249 1.00 0.00 C ATOM 274 OE1 GLN A 21 -1.482 -15.727 -7.172 1.00 0.00 O ATOM 275 NE2 GLN A 21 -1.058 -15.114 -5.054 1.00 0.00 N ATOM 0 H GLN A 21 3.321 -16.053 -6.225 1.00 0.00 H new ATOM 0 HA GLN A 21 2.303 -16.172 -8.781 1.00 0.00 H new ATOM 0 HB2 GLN A 21 1.833 -13.996 -6.706 1.00 0.00 H new ATOM 0 HB3 GLN A 21 0.756 -14.416 -8.024 1.00 0.00 H new ATOM 0 HG2 GLN A 21 0.913 -16.839 -6.864 1.00 0.00 H new ATOM 0 HG3 GLN A 21 1.279 -15.861 -5.457 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -0.364 -14.987 -4.318 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -2.039 -14.902 -4.872 1.00 0.00 H new ATOM 284 N ASP A 22 2.537 -13.692 -9.826 1.00 0.00 N ATOM 285 CA ASP A 22 3.039 -12.625 -10.683 1.00 0.00 C ATOM 286 C ASP A 22 2.768 -11.258 -10.063 1.00 0.00 C ATOM 287 O ASP A 22 1.839 -10.555 -10.464 1.00 0.00 O ATOM 288 CB ASP A 22 2.395 -12.708 -12.068 1.00 0.00 C ATOM 289 CG ASP A 22 0.895 -12.921 -11.996 1.00 0.00 C ATOM 290 OD1 ASP A 22 0.290 -12.537 -10.974 1.00 0.00 O ATOM 291 OD2 ASP A 22 0.327 -13.471 -12.963 1.00 0.00 O ATOM 0 H ASP A 22 1.554 -13.922 -9.971 1.00 0.00 H new ATOM 0 HA ASP A 22 4.117 -12.751 -10.785 1.00 0.00 H new ATOM 0 HB2 ASP A 22 2.603 -11.790 -12.618 1.00 0.00 H new ATOM 0 HB3 ASP A 22 2.849 -13.525 -12.628 1.00 0.00 H new ATOM 296 N LEU A 23 3.585 -10.886 -9.083 1.00 0.00 N ATOM 297 CA LEU A 23 3.433 -9.602 -8.407 1.00 0.00 C ATOM 298 C LEU A 23 4.403 -8.571 -8.972 1.00 0.00 C ATOM 299 O LEU A 23 4.166 -7.366 -8.883 1.00 0.00 O ATOM 300 CB LEU A 23 3.664 -9.766 -6.903 1.00 0.00 C ATOM 301 CG LEU A 23 2.874 -10.884 -6.221 1.00 0.00 C ATOM 302 CD1 LEU A 23 3.311 -11.038 -4.772 1.00 0.00 C ATOM 303 CD2 LEU A 23 1.380 -10.608 -6.303 1.00 0.00 C ATOM 0 H LEU A 23 4.359 -11.455 -8.739 1.00 0.00 H new ATOM 0 HA LEU A 23 2.416 -9.248 -8.577 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.726 -9.945 -6.736 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.419 -8.824 -6.413 1.00 0.00 H new ATOM 0 HG LEU A 23 3.079 -11.819 -6.743 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.738 -11.838 -4.302 1.00 0.00 H new ATOM 0 HD12 LEU A 23 4.373 -11.282 -4.736 1.00 0.00 H new ATOM 0 HD13 LEU A 23 3.135 -10.104 -4.238 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.834 -11.414 -5.813 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.157 -9.664 -5.807 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.078 -10.549 -7.349 1.00 0.00 H new ATOM 315 N SER A 24 5.497 -9.051 -9.556 1.00 0.00 N ATOM 316 CA SER A 24 6.504 -8.170 -10.135 1.00 0.00 C ATOM 317 C SER A 24 5.890 -7.273 -11.205 1.00 0.00 C ATOM 318 O SER A 24 6.315 -6.133 -11.395 1.00 0.00 O ATOM 319 CB SER A 24 7.646 -8.993 -10.736 1.00 0.00 C ATOM 320 OG SER A 24 8.625 -9.296 -9.758 1.00 0.00 O ATOM 0 H SER A 24 5.708 -10.045 -9.640 1.00 0.00 H new ATOM 0 HA SER A 24 6.900 -7.538 -9.340 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.250 -9.917 -11.157 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.105 -8.440 -11.556 1.00 0.00 H new ATOM 0 HG SER A 24 8.275 -9.084 -8.868 1.00 0.00 H new ATOM 326 N VAL A 25 4.887 -7.796 -11.904 1.00 0.00 N ATOM 327 CA VAL A 25 4.213 -7.043 -12.954 1.00 0.00 C ATOM 328 C VAL A 25 3.714 -5.700 -12.434 1.00 0.00 C ATOM 329 O VAL A 25 3.635 -4.723 -13.180 1.00 0.00 O ATOM 330 CB VAL A 25 3.024 -7.831 -13.534 1.00 0.00 C ATOM 331 CG1 VAL A 25 3.475 -9.200 -14.020 1.00 0.00 C ATOM 332 CG2 VAL A 25 1.916 -7.962 -12.499 1.00 0.00 C ATOM 0 H VAL A 25 4.524 -8.738 -11.761 1.00 0.00 H new ATOM 0 HA VAL A 25 4.946 -6.873 -13.742 1.00 0.00 H new ATOM 0 HB VAL A 25 2.629 -7.281 -14.388 1.00 0.00 H new ATOM 0 HG11 VAL A 25 2.621 -9.741 -14.426 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.231 -9.080 -14.796 1.00 0.00 H new ATOM 0 HG13 VAL A 25 3.897 -9.761 -13.186 1.00 0.00 H new ATOM 0 HG21 VAL A 25 1.084 -8.522 -12.926 1.00 0.00 H new ATOM 0 HG22 VAL A 25 2.296 -8.488 -11.624 1.00 0.00 H new ATOM 0 HG23 VAL A 25 1.573 -6.970 -12.205 1.00 0.00 H new ATOM 342 N HIS A 26 3.377 -5.657 -11.149 1.00 0.00 N ATOM 343 CA HIS A 26 2.885 -4.433 -10.527 1.00 0.00 C ATOM 344 C HIS A 26 3.974 -3.364 -10.496 1.00 0.00 C ATOM 345 O HIS A 26 5.118 -3.618 -10.876 1.00 0.00 O ATOM 346 CB HIS A 26 2.394 -4.718 -9.108 1.00 0.00 C ATOM 347 CG HIS A 26 1.534 -5.940 -9.006 1.00 0.00 C ATOM 348 ND1 HIS A 26 0.429 -6.151 -9.804 1.00 0.00 N ATOM 349 CD2 HIS A 26 1.623 -7.020 -8.195 1.00 0.00 C ATOM 350 CE1 HIS A 26 -0.125 -7.308 -9.486 1.00 0.00 C ATOM 351 NE2 HIS A 26 0.580 -7.855 -8.513 1.00 0.00 N ATOM 0 H HIS A 26 3.436 -6.456 -10.518 1.00 0.00 H new ATOM 0 HA HIS A 26 2.052 -4.061 -11.123 1.00 0.00 H new ATOM 0 HB2 HIS A 26 3.256 -4.834 -8.451 1.00 0.00 H new ATOM 0 HB3 HIS A 26 1.832 -3.857 -8.747 1.00 0.00 H new ATOM 0 HD1 HIS A 26 0.092 -5.514 -10.526 1.00 0.00 H new ATOM 0 HD2 HIS A 26 2.374 -7.193 -7.439 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.005 -7.734 -9.944 1.00 0.00 H new ATOM 359 N LEU A 27 3.611 -2.170 -10.043 1.00 0.00 N ATOM 360 CA LEU A 27 4.557 -1.062 -9.963 1.00 0.00 C ATOM 361 C LEU A 27 5.142 -0.946 -8.559 1.00 0.00 C ATOM 362 O LEU A 27 6.361 -0.916 -8.385 1.00 0.00 O ATOM 363 CB LEU A 27 3.872 0.249 -10.352 1.00 0.00 C ATOM 364 CG LEU A 27 3.503 0.401 -11.829 1.00 0.00 C ATOM 365 CD1 LEU A 27 2.637 1.633 -12.038 1.00 0.00 C ATOM 366 CD2 LEU A 27 4.757 0.476 -12.687 1.00 0.00 C ATOM 0 H LEU A 27 2.669 -1.944 -9.725 1.00 0.00 H new ATOM 0 HA LEU A 27 5.371 -1.260 -10.661 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.963 0.351 -9.759 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.528 1.074 -10.075 1.00 0.00 H new ATOM 0 HG LEU A 27 2.931 -0.476 -12.133 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.384 1.725 -13.094 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.722 1.538 -11.453 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.183 2.520 -11.717 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.475 0.584 -13.734 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.356 1.334 -12.382 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.340 -0.436 -12.560 1.00 0.00 H new ATOM 378 N TRP A 28 4.267 -0.882 -7.563 1.00 0.00 N ATOM 379 CA TRP A 28 4.697 -0.772 -6.174 1.00 0.00 C ATOM 380 C TRP A 28 5.574 -1.955 -5.779 1.00 0.00 C ATOM 381 O TRP A 28 6.351 -1.874 -4.828 1.00 0.00 O ATOM 382 CB TRP A 28 3.483 -0.690 -5.247 1.00 0.00 C ATOM 383 CG TRP A 28 2.289 -1.432 -5.766 1.00 0.00 C ATOM 384 CD1 TRP A 28 1.234 -0.907 -6.457 1.00 0.00 C ATOM 385 CD2 TRP A 28 2.027 -2.833 -5.635 1.00 0.00 C ATOM 386 NE1 TRP A 28 0.332 -1.897 -6.762 1.00 0.00 N ATOM 387 CE2 TRP A 28 0.795 -3.088 -6.270 1.00 0.00 C ATOM 388 CE3 TRP A 28 2.713 -3.898 -5.045 1.00 0.00 C ATOM 389 CZ2 TRP A 28 0.239 -4.363 -6.329 1.00 0.00 C ATOM 390 CZ3 TRP A 28 2.159 -5.162 -5.104 1.00 0.00 C ATOM 391 CH2 TRP A 28 0.932 -5.387 -5.743 1.00 0.00 C ATOM 0 H TRP A 28 3.255 -0.904 -7.691 1.00 0.00 H new ATOM 0 HA TRP A 28 5.284 0.141 -6.074 1.00 0.00 H new ATOM 0 HB2 TRP A 28 3.753 -1.089 -4.270 1.00 0.00 H new ATOM 0 HB3 TRP A 28 3.216 0.357 -5.101 1.00 0.00 H new ATOM 0 HD1 TRP A 28 1.125 0.134 -6.724 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -0.541 -1.766 -7.272 1.00 0.00 H new ATOM 0 HE3 TRP A 28 3.660 -3.736 -4.551 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.707 -4.538 -6.820 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.681 -5.992 -4.650 1.00 0.00 H new ATOM 0 HH2 TRP A 28 0.526 -6.387 -5.773 1.00 0.00 H new ATOM 402 N TYR A 29 5.445 -3.053 -6.516 1.00 0.00 N ATOM 403 CA TYR A 29 6.225 -4.253 -6.241 1.00 0.00 C ATOM 404 C TYR A 29 7.686 -4.055 -6.633 1.00 0.00 C ATOM 405 O TYR A 29 8.015 -3.949 -7.814 1.00 0.00 O ATOM 406 CB TYR A 29 5.641 -5.450 -6.995 1.00 0.00 C ATOM 407 CG TYR A 29 6.050 -6.786 -6.419 1.00 0.00 C ATOM 408 CD1 TYR A 29 5.296 -7.395 -5.423 1.00 0.00 C ATOM 409 CD2 TYR A 29 7.190 -7.440 -6.870 1.00 0.00 C ATOM 410 CE1 TYR A 29 5.666 -8.616 -4.894 1.00 0.00 C ATOM 411 CE2 TYR A 29 7.567 -8.662 -6.347 1.00 0.00 C ATOM 412 CZ TYR A 29 6.802 -9.246 -5.359 1.00 0.00 C ATOM 413 OH TYR A 29 7.174 -10.462 -4.834 1.00 0.00 O ATOM 0 H TYR A 29 4.808 -3.136 -7.308 1.00 0.00 H new ATOM 0 HA TYR A 29 6.178 -4.448 -5.170 1.00 0.00 H new ATOM 0 HB2 TYR A 29 4.553 -5.378 -6.987 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.956 -5.401 -8.037 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.406 -6.905 -5.057 1.00 0.00 H new ATOM 0 HD2 TYR A 29 7.792 -6.985 -7.643 1.00 0.00 H new ATOM 0 HE1 TYR A 29 5.069 -9.075 -4.120 1.00 0.00 H new ATOM 0 HE2 TYR A 29 8.456 -9.157 -6.710 1.00 0.00 H new ATOM 0 HH TYR A 29 7.995 -10.770 -5.271 1.00 0.00 H new ATOM 423 N ALA A 30 8.559 -4.008 -5.631 1.00 0.00 N ATOM 424 CA ALA A 30 9.985 -3.825 -5.869 1.00 0.00 C ATOM 425 C ALA A 30 10.779 -5.042 -5.405 1.00 0.00 C ATOM 426 O ALA A 30 11.896 -4.913 -4.905 1.00 0.00 O ATOM 427 CB ALA A 30 10.481 -2.570 -5.167 1.00 0.00 C ATOM 0 H ALA A 30 8.303 -4.094 -4.647 1.00 0.00 H new ATOM 0 HA ALA A 30 10.137 -3.711 -6.942 1.00 0.00 H new ATOM 0 HB1 ALA A 30 11.548 -2.446 -5.354 1.00 0.00 H new ATOM 0 HB2 ALA A 30 9.943 -1.703 -5.549 1.00 0.00 H new ATOM 0 HB3 ALA A 30 10.308 -2.661 -4.095 1.00 0.00 H new ATOM 433 N GLY A 31 10.194 -6.224 -5.573 1.00 0.00 N ATOM 434 CA GLY A 31 10.861 -7.446 -5.165 1.00 0.00 C ATOM 435 C GLY A 31 11.643 -7.278 -3.877 1.00 0.00 C ATOM 436 O GLY A 31 11.346 -6.412 -3.054 1.00 0.00 O ATOM 0 H GLY A 31 9.270 -6.357 -5.984 1.00 0.00 H new ATOM 0 HA2 GLY A 31 10.120 -8.235 -5.036 1.00 0.00 H new ATOM 0 HA3 GLY A 31 11.537 -7.769 -5.957 1.00 0.00 H new ATOM 440 N PRO A 32 12.666 -8.124 -3.686 1.00 0.00 N ATOM 441 CA PRO A 32 13.513 -8.086 -2.490 1.00 0.00 C ATOM 442 C PRO A 32 14.401 -6.846 -2.448 1.00 0.00 C ATOM 443 O PRO A 32 15.446 -6.798 -3.096 1.00 0.00 O ATOM 444 CB PRO A 32 14.366 -9.350 -2.619 1.00 0.00 C ATOM 445 CG PRO A 32 14.403 -9.635 -4.081 1.00 0.00 C ATOM 446 CD PRO A 32 13.077 -9.182 -4.625 1.00 0.00 C ATOM 0 HA PRO A 32 12.923 -8.045 -1.574 1.00 0.00 H new ATOM 0 HB2 PRO A 32 15.368 -9.193 -2.221 1.00 0.00 H new ATOM 0 HB3 PRO A 32 13.929 -10.181 -2.065 1.00 0.00 H new ATOM 0 HG2 PRO A 32 15.224 -9.103 -4.562 1.00 0.00 H new ATOM 0 HG3 PRO A 32 14.559 -10.698 -4.268 1.00 0.00 H new ATOM 0 HD2 PRO A 32 13.169 -8.803 -5.643 1.00 0.00 H new ATOM 0 HD3 PRO A 32 12.354 -9.998 -4.653 1.00 0.00 H new ATOM 454 N MET A 33 13.977 -5.847 -1.680 1.00 0.00 N ATOM 455 CA MET A 33 14.736 -4.608 -1.553 1.00 0.00 C ATOM 456 C MET A 33 14.971 -4.264 -0.085 1.00 0.00 C ATOM 457 O MET A 33 14.082 -4.429 0.750 1.00 0.00 O ATOM 458 CB MET A 33 14.000 -3.461 -2.247 1.00 0.00 C ATOM 459 CG MET A 33 14.743 -2.136 -2.184 1.00 0.00 C ATOM 460 SD MET A 33 14.259 -1.005 -3.502 1.00 0.00 S ATOM 461 CE MET A 33 12.528 -0.756 -3.117 1.00 0.00 C ATOM 0 H MET A 33 13.114 -5.871 -1.137 1.00 0.00 H new ATOM 0 HA MET A 33 15.704 -4.752 -2.034 1.00 0.00 H new ATOM 0 HB2 MET A 33 13.834 -3.726 -3.291 1.00 0.00 H new ATOM 0 HB3 MET A 33 13.018 -3.340 -1.789 1.00 0.00 H new ATOM 0 HG2 MET A 33 14.556 -1.665 -1.219 1.00 0.00 H new ATOM 0 HG3 MET A 33 15.815 -2.322 -2.246 1.00 0.00 H new ATOM 0 HE1 MET A 33 12.045 -0.225 -3.938 1.00 0.00 H new ATOM 0 HE2 MET A 33 12.044 -1.722 -2.976 1.00 0.00 H new ATOM 0 HE3 MET A 33 12.439 -0.169 -2.203 1.00 0.00 H new ATOM 471 N GLU A 34 16.173 -3.785 0.220 1.00 0.00 N ATOM 472 CA GLU A 34 16.523 -3.418 1.588 1.00 0.00 C ATOM 473 C GLU A 34 15.782 -2.157 2.020 1.00 0.00 C ATOM 474 O GLU A 34 15.292 -1.395 1.186 1.00 0.00 O ATOM 475 CB GLU A 34 18.033 -3.203 1.710 1.00 0.00 C ATOM 476 CG GLU A 34 18.823 -4.493 1.850 1.00 0.00 C ATOM 477 CD GLU A 34 20.243 -4.259 2.327 1.00 0.00 C ATOM 478 OE1 GLU A 34 20.422 -3.522 3.319 1.00 0.00 O ATOM 479 OE2 GLU A 34 21.176 -4.813 1.708 1.00 0.00 O ATOM 0 H GLU A 34 16.920 -3.642 -0.460 1.00 0.00 H new ATOM 0 HA GLU A 34 16.225 -4.236 2.244 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.387 -2.664 0.831 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.232 -2.569 2.574 1.00 0.00 H new ATOM 0 HG2 GLU A 34 18.312 -5.153 2.551 1.00 0.00 H new ATOM 0 HG3 GLU A 34 18.847 -5.006 0.889 1.00 0.00 H new ATOM 486 N ARG A 35 15.703 -1.943 3.329 1.00 0.00 N ATOM 487 CA ARG A 35 15.020 -0.776 3.873 1.00 0.00 C ATOM 488 C ARG A 35 15.562 0.509 3.254 1.00 0.00 C ATOM 489 O ARG A 35 14.800 1.351 2.780 1.00 0.00 O ATOM 490 CB ARG A 35 15.178 -0.728 5.394 1.00 0.00 C ATOM 491 CG ARG A 35 14.381 0.384 6.055 1.00 0.00 C ATOM 492 CD ARG A 35 14.644 0.444 7.552 1.00 0.00 C ATOM 493 NE ARG A 35 15.940 1.044 7.855 1.00 0.00 N ATOM 494 CZ ARG A 35 16.225 1.634 9.011 1.00 0.00 C ATOM 495 NH1 ARG A 35 15.309 1.702 9.968 1.00 0.00 N ATOM 496 NH2 ARG A 35 17.428 2.156 9.213 1.00 0.00 N ATOM 0 H ARG A 35 16.104 -2.563 4.033 1.00 0.00 H new ATOM 0 HA ARG A 35 13.961 -0.859 3.627 1.00 0.00 H new ATOM 0 HB2 ARG A 35 14.867 -1.685 5.813 1.00 0.00 H new ATOM 0 HB3 ARG A 35 16.233 -0.601 5.637 1.00 0.00 H new ATOM 0 HG2 ARG A 35 14.641 1.340 5.600 1.00 0.00 H new ATOM 0 HG3 ARG A 35 13.317 0.226 5.877 1.00 0.00 H new ATOM 0 HD2 ARG A 35 13.855 1.020 8.036 1.00 0.00 H new ATOM 0 HD3 ARG A 35 14.604 -0.563 7.968 1.00 0.00 H new ATOM 0 HE ARG A 35 16.667 1.008 7.140 1.00 0.00 H new ATOM 0 HH11 ARG A 35 14.383 1.301 9.817 1.00 0.00 H new ATOM 0 HH12 ARG A 35 15.530 2.155 10.854 1.00 0.00 H new ATOM 0 HH21 ARG A 35 18.136 2.105 8.480 1.00 0.00 H new ATOM 0 HH22 ARG A 35 17.645 2.609 10.101 1.00 0.00 H new ATOM 510 N ALA A 36 16.883 0.652 3.263 1.00 0.00 N ATOM 511 CA ALA A 36 17.527 1.833 2.701 1.00 0.00 C ATOM 512 C ALA A 36 16.918 2.201 1.352 1.00 0.00 C ATOM 513 O ALA A 36 16.322 3.267 1.200 1.00 0.00 O ATOM 514 CB ALA A 36 19.024 1.601 2.560 1.00 0.00 C ATOM 0 H ALA A 36 17.528 -0.035 3.653 1.00 0.00 H new ATOM 0 HA ALA A 36 17.362 2.666 3.384 1.00 0.00 H new ATOM 0 HB1 ALA A 36 19.492 2.491 2.139 1.00 0.00 H new ATOM 0 HB2 ALA A 36 19.454 1.394 3.540 1.00 0.00 H new ATOM 0 HB3 ALA A 36 19.200 0.752 1.900 1.00 0.00 H new ATOM 520 N GLY A 37 17.072 1.312 0.376 1.00 0.00 N ATOM 521 CA GLY A 37 16.532 1.563 -0.948 1.00 0.00 C ATOM 522 C GLY A 37 15.170 2.228 -0.902 1.00 0.00 C ATOM 523 O GLY A 37 14.948 3.248 -1.553 1.00 0.00 O ATOM 0 H GLY A 37 17.561 0.423 0.478 1.00 0.00 H new ATOM 0 HA2 GLY A 37 17.223 2.196 -1.505 1.00 0.00 H new ATOM 0 HA3 GLY A 37 16.455 0.621 -1.490 1.00 0.00 H new ATOM 527 N ALA A 38 14.256 1.647 -0.132 1.00 0.00 N ATOM 528 CA ALA A 38 12.909 2.190 -0.004 1.00 0.00 C ATOM 529 C ALA A 38 12.934 3.576 0.630 1.00 0.00 C ATOM 530 O ALA A 38 12.137 4.444 0.276 1.00 0.00 O ATOM 531 CB ALA A 38 12.037 1.249 0.814 1.00 0.00 C ATOM 0 H ALA A 38 14.423 0.801 0.412 1.00 0.00 H new ATOM 0 HA ALA A 38 12.485 2.284 -1.004 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.034 1.667 0.902 1.00 0.00 H new ATOM 0 HB2 ALA A 38 11.984 0.279 0.319 1.00 0.00 H new ATOM 0 HB3 ALA A 38 12.467 1.126 1.808 1.00 0.00 H new ATOM 537 N GLU A 39 13.853 3.776 1.569 1.00 0.00 N ATOM 538 CA GLU A 39 13.979 5.058 2.253 1.00 0.00 C ATOM 539 C GLU A 39 14.682 6.081 1.366 1.00 0.00 C ATOM 540 O GLU A 39 14.528 7.289 1.550 1.00 0.00 O ATOM 541 CB GLU A 39 14.751 4.888 3.564 1.00 0.00 C ATOM 542 CG GLU A 39 14.008 4.068 4.605 1.00 0.00 C ATOM 543 CD GLU A 39 14.529 4.300 6.011 1.00 0.00 C ATOM 544 OE1 GLU A 39 15.668 3.878 6.299 1.00 0.00 O ATOM 545 OE2 GLU A 39 13.796 4.905 6.821 1.00 0.00 O ATOM 0 H GLU A 39 14.521 3.068 1.873 1.00 0.00 H new ATOM 0 HA GLU A 39 12.976 5.423 2.474 1.00 0.00 H new ATOM 0 HB2 GLU A 39 15.708 4.411 3.353 1.00 0.00 H new ATOM 0 HB3 GLU A 39 14.970 5.873 3.977 1.00 0.00 H new ATOM 0 HG2 GLU A 39 12.947 4.317 4.569 1.00 0.00 H new ATOM 0 HG3 GLU A 39 14.096 3.010 4.359 1.00 0.00 H new ATOM 552 N SER A 40 15.454 5.589 0.403 1.00 0.00 N ATOM 553 CA SER A 40 16.185 6.460 -0.511 1.00 0.00 C ATOM 554 C SER A 40 15.396 6.680 -1.799 1.00 0.00 C ATOM 555 O SER A 40 15.583 7.681 -2.490 1.00 0.00 O ATOM 556 CB SER A 40 17.555 5.861 -0.835 1.00 0.00 C ATOM 557 OG SER A 40 18.270 6.683 -1.741 1.00 0.00 O ATOM 0 H SER A 40 15.590 4.592 0.235 1.00 0.00 H new ATOM 0 HA SER A 40 16.325 7.424 -0.021 1.00 0.00 H new ATOM 0 HB2 SER A 40 18.130 5.742 0.084 1.00 0.00 H new ATOM 0 HB3 SER A 40 17.428 4.867 -1.263 1.00 0.00 H new ATOM 0 HG SER A 40 19.142 6.279 -1.931 1.00 0.00 H new ATOM 563 N ILE A 41 14.515 5.736 -2.114 1.00 0.00 N ATOM 564 CA ILE A 41 13.697 5.826 -3.317 1.00 0.00 C ATOM 565 C ILE A 41 12.563 6.829 -3.137 1.00 0.00 C ATOM 566 O ILE A 41 12.438 7.786 -3.902 1.00 0.00 O ATOM 567 CB ILE A 41 13.102 4.458 -3.697 1.00 0.00 C ATOM 568 CG1 ILE A 41 14.198 3.530 -4.227 1.00 0.00 C ATOM 569 CG2 ILE A 41 12.000 4.628 -4.731 1.00 0.00 C ATOM 570 CD1 ILE A 41 13.915 2.063 -3.989 1.00 0.00 C ATOM 0 H ILE A 41 14.350 4.900 -1.553 1.00 0.00 H new ATOM 0 HA ILE A 41 14.353 6.163 -4.120 1.00 0.00 H new ATOM 0 HB ILE A 41 12.669 4.006 -2.804 1.00 0.00 H new ATOM 0 HG12 ILE A 41 14.320 3.699 -5.297 1.00 0.00 H new ATOM 0 HG13 ILE A 41 15.144 3.791 -3.753 1.00 0.00 H new ATOM 0 HG21 ILE A 41 11.590 3.652 -4.989 1.00 0.00 H new ATOM 0 HG22 ILE A 41 11.210 5.257 -4.321 1.00 0.00 H new ATOM 0 HG23 ILE A 41 12.410 5.097 -5.625 1.00 0.00 H new ATOM 0 HD11 ILE A 41 14.733 1.465 -4.390 1.00 0.00 H new ATOM 0 HD12 ILE A 41 13.822 1.879 -2.919 1.00 0.00 H new ATOM 0 HD13 ILE A 41 12.985 1.786 -4.486 1.00 0.00 H new ATOM 582 N LEU A 42 11.739 6.605 -2.119 1.00 0.00 N ATOM 583 CA LEU A 42 10.614 7.490 -1.836 1.00 0.00 C ATOM 584 C LEU A 42 11.092 8.791 -1.199 1.00 0.00 C ATOM 585 O LEU A 42 10.329 9.747 -1.068 1.00 0.00 O ATOM 586 CB LEU A 42 9.612 6.795 -0.913 1.00 0.00 C ATOM 587 CG LEU A 42 9.243 5.358 -1.283 1.00 0.00 C ATOM 588 CD1 LEU A 42 8.500 4.686 -0.140 1.00 0.00 C ATOM 589 CD2 LEU A 42 8.406 5.333 -2.554 1.00 0.00 C ATOM 0 H LEU A 42 11.829 5.818 -1.476 1.00 0.00 H new ATOM 0 HA LEU A 42 10.124 7.728 -2.780 1.00 0.00 H new ATOM 0 HB2 LEU A 42 10.019 6.795 0.098 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.698 7.389 -0.889 1.00 0.00 H new ATOM 0 HG LEU A 42 10.163 4.803 -1.466 1.00 0.00 H new ATOM 0 HD11 LEU A 42 8.246 3.664 -0.422 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.134 4.671 0.747 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.587 5.240 0.076 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.152 4.302 -2.802 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.491 5.904 -2.398 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.974 5.774 -3.373 1.00 0.00 H new ATOM 601 N ALA A 43 12.362 8.820 -0.805 1.00 0.00 N ATOM 602 CA ALA A 43 12.943 10.004 -0.186 1.00 0.00 C ATOM 603 C ALA A 43 12.642 11.255 -1.004 1.00 0.00 C ATOM 604 O ALA A 43 12.177 12.261 -0.469 1.00 0.00 O ATOM 605 CB ALA A 43 14.445 9.829 -0.019 1.00 0.00 C ATOM 0 H ALA A 43 13.007 8.036 -0.904 1.00 0.00 H new ATOM 0 HA ALA A 43 12.491 10.128 0.798 1.00 0.00 H new ATOM 0 HB1 ALA A 43 14.866 10.721 0.445 1.00 0.00 H new ATOM 0 HB2 ALA A 43 14.642 8.964 0.614 1.00 0.00 H new ATOM 0 HB3 ALA A 43 14.904 9.677 -0.996 1.00 0.00 H new ATOM 611 N ASN A 44 12.910 11.186 -2.304 1.00 0.00 N ATOM 612 CA ASN A 44 12.669 12.314 -3.196 1.00 0.00 C ATOM 613 C ASN A 44 11.225 12.318 -3.689 1.00 0.00 C ATOM 614 O ASN A 44 10.646 13.376 -3.936 1.00 0.00 O ATOM 615 CB ASN A 44 13.627 12.262 -4.388 1.00 0.00 C ATOM 616 CG ASN A 44 15.033 12.693 -4.019 1.00 0.00 C ATOM 617 OD1 ASN A 44 15.406 13.853 -4.199 1.00 0.00 O ATOM 618 ND2 ASN A 44 15.821 11.759 -3.500 1.00 0.00 N ATOM 0 H ASN A 44 13.294 10.360 -2.763 1.00 0.00 H new ATOM 0 HA ASN A 44 12.846 13.233 -2.636 1.00 0.00 H new ATOM 0 HB2 ASN A 44 13.653 11.247 -4.785 1.00 0.00 H new ATOM 0 HB3 ASN A 44 13.249 12.906 -5.182 1.00 0.00 H new ATOM 0 HD21 ASN A 44 16.778 11.990 -3.232 1.00 0.00 H new ATOM 0 HD22 ASN A 44 15.470 10.810 -3.369 1.00 0.00 H new ATOM 625 N ARG A 45 10.650 11.129 -3.829 1.00 0.00 N ATOM 626 CA ARG A 45 9.274 10.995 -4.292 1.00 0.00 C ATOM 627 C ARG A 45 8.350 11.942 -3.533 1.00 0.00 C ATOM 628 O ARG A 45 8.770 12.611 -2.589 1.00 0.00 O ATOM 629 CB ARG A 45 8.794 9.553 -4.123 1.00 0.00 C ATOM 630 CG ARG A 45 9.577 8.549 -4.954 1.00 0.00 C ATOM 631 CD ARG A 45 9.346 8.757 -6.442 1.00 0.00 C ATOM 632 NE ARG A 45 7.997 8.369 -6.846 1.00 0.00 N ATOM 633 CZ ARG A 45 7.380 8.860 -7.915 1.00 0.00 C ATOM 634 NH1 ARG A 45 7.989 9.753 -8.684 1.00 0.00 N ATOM 635 NH2 ARG A 45 6.153 8.457 -8.218 1.00 0.00 N ATOM 0 H ARG A 45 11.116 10.244 -3.628 1.00 0.00 H new ATOM 0 HA ARG A 45 9.246 11.258 -5.349 1.00 0.00 H new ATOM 0 HB2 ARG A 45 8.866 9.276 -3.071 1.00 0.00 H new ATOM 0 HB3 ARG A 45 7.740 9.495 -4.397 1.00 0.00 H new ATOM 0 HG2 ARG A 45 10.640 8.643 -4.733 1.00 0.00 H new ATOM 0 HG3 ARG A 45 9.282 7.537 -4.677 1.00 0.00 H new ATOM 0 HD2 ARG A 45 9.512 9.805 -6.692 1.00 0.00 H new ATOM 0 HD3 ARG A 45 10.075 8.176 -7.007 1.00 0.00 H new ATOM 0 HE ARG A 45 7.502 7.683 -6.276 1.00 0.00 H new ATOM 0 HH11 ARG A 45 8.933 10.064 -8.455 1.00 0.00 H new ATOM 0 HH12 ARG A 45 7.513 10.129 -9.504 1.00 0.00 H new ATOM 0 HH21 ARG A 45 5.682 7.769 -7.630 1.00 0.00 H new ATOM 0 HH22 ARG A 45 5.680 8.835 -9.039 1.00 0.00 H new ATOM 649 N SER A 46 7.089 11.994 -3.952 1.00 0.00 N ATOM 650 CA SER A 46 6.107 12.863 -3.314 1.00 0.00 C ATOM 651 C SER A 46 5.347 12.114 -2.223 1.00 0.00 C ATOM 652 O SER A 46 4.971 10.954 -2.397 1.00 0.00 O ATOM 653 CB SER A 46 5.125 13.407 -4.354 1.00 0.00 C ATOM 654 OG SER A 46 5.543 14.672 -4.837 1.00 0.00 O ATOM 0 H SER A 46 6.724 11.445 -4.730 1.00 0.00 H new ATOM 0 HA SER A 46 6.639 13.697 -2.855 1.00 0.00 H new ATOM 0 HB2 SER A 46 5.044 12.706 -5.184 1.00 0.00 H new ATOM 0 HB3 SER A 46 4.132 13.493 -3.912 1.00 0.00 H new ATOM 0 HG SER A 46 4.900 14.997 -5.501 1.00 0.00 H new ATOM 660 N ASP A 47 5.125 12.785 -1.099 1.00 0.00 N ATOM 661 CA ASP A 47 4.410 12.185 0.021 1.00 0.00 C ATOM 662 C ASP A 47 3.223 11.362 -0.470 1.00 0.00 C ATOM 663 O ASP A 47 2.389 11.849 -1.232 1.00 0.00 O ATOM 664 CB ASP A 47 3.928 13.270 0.986 1.00 0.00 C ATOM 665 CG ASP A 47 3.204 12.696 2.188 1.00 0.00 C ATOM 666 OD1 ASP A 47 2.336 11.820 1.994 1.00 0.00 O ATOM 667 OD2 ASP A 47 3.505 13.123 3.322 1.00 0.00 O ATOM 0 H ASP A 47 5.430 13.745 -0.939 1.00 0.00 H new ATOM 0 HA ASP A 47 5.098 11.522 0.545 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.782 13.856 1.326 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.263 13.953 0.457 1.00 0.00 H new ATOM 672 N GLY A 48 3.155 10.109 -0.029 1.00 0.00 N ATOM 673 CA GLY A 48 2.069 9.237 -0.435 1.00 0.00 C ATOM 674 C GLY A 48 2.540 8.090 -1.307 1.00 0.00 C ATOM 675 O GLY A 48 1.858 7.072 -1.431 1.00 0.00 O ATOM 0 H GLY A 48 3.833 9.683 0.602 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.578 8.837 0.452 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.324 9.819 -0.977 1.00 0.00 H new ATOM 679 N THR A 49 3.711 8.254 -1.915 1.00 0.00 N ATOM 680 CA THR A 49 4.272 7.225 -2.782 1.00 0.00 C ATOM 681 C THR A 49 4.607 5.965 -1.994 1.00 0.00 C ATOM 682 O THR A 49 5.579 5.932 -1.239 1.00 0.00 O ATOM 683 CB THR A 49 5.543 7.724 -3.495 1.00 0.00 C ATOM 684 OG1 THR A 49 5.284 8.976 -4.140 1.00 0.00 O ATOM 685 CG2 THR A 49 6.021 6.708 -4.522 1.00 0.00 C ATOM 0 H THR A 49 4.289 9.089 -1.823 1.00 0.00 H new ATOM 0 HA THR A 49 3.513 6.992 -3.529 1.00 0.00 H new ATOM 0 HB THR A 49 6.324 7.857 -2.747 1.00 0.00 H new ATOM 0 HG1 THR A 49 5.332 9.700 -3.481 1.00 0.00 H new ATOM 0 HG21 THR A 49 6.920 7.082 -5.013 1.00 0.00 H new ATOM 0 HG22 THR A 49 6.245 5.765 -4.024 1.00 0.00 H new ATOM 0 HG23 THR A 49 5.241 6.548 -5.266 1.00 0.00 H new ATOM 693 N PHE A 50 3.796 4.927 -2.174 1.00 0.00 N ATOM 694 CA PHE A 50 4.007 3.662 -1.478 1.00 0.00 C ATOM 695 C PHE A 50 4.800 2.690 -2.346 1.00 0.00 C ATOM 696 O PHE A 50 4.772 2.772 -3.575 1.00 0.00 O ATOM 697 CB PHE A 50 2.664 3.039 -1.091 1.00 0.00 C ATOM 698 CG PHE A 50 1.922 2.445 -2.253 1.00 0.00 C ATOM 699 CD1 PHE A 50 1.166 3.247 -3.093 1.00 0.00 C ATOM 700 CD2 PHE A 50 1.980 1.084 -2.507 1.00 0.00 C ATOM 701 CE1 PHE A 50 0.481 2.703 -4.163 1.00 0.00 C ATOM 702 CE2 PHE A 50 1.297 0.534 -3.575 1.00 0.00 C ATOM 703 CZ PHE A 50 0.548 1.344 -4.405 1.00 0.00 C ATOM 0 H PHE A 50 2.987 4.937 -2.795 1.00 0.00 H new ATOM 0 HA PHE A 50 4.580 3.864 -0.573 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.834 2.264 -0.344 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.040 3.801 -0.623 1.00 0.00 H new ATOM 0 HD1 PHE A 50 1.111 4.310 -2.909 1.00 0.00 H new ATOM 0 HD2 PHE A 50 2.566 0.445 -1.863 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -0.106 3.339 -4.809 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.349 -0.529 -3.760 1.00 0.00 H new ATOM 0 HZ PHE A 50 0.016 0.916 -5.242 1.00 0.00 H new ATOM 713 N LEU A 51 5.507 1.770 -1.699 1.00 0.00 N ATOM 714 CA LEU A 51 6.310 0.781 -2.411 1.00 0.00 C ATOM 715 C LEU A 51 6.435 -0.504 -1.599 1.00 0.00 C ATOM 716 O LEU A 51 6.831 -0.478 -0.433 1.00 0.00 O ATOM 717 CB LEU A 51 7.699 1.345 -2.713 1.00 0.00 C ATOM 718 CG LEU A 51 8.784 1.047 -1.678 1.00 0.00 C ATOM 719 CD1 LEU A 51 9.367 -0.340 -1.900 1.00 0.00 C ATOM 720 CD2 LEU A 51 9.879 2.103 -1.733 1.00 0.00 C ATOM 0 H LEU A 51 5.541 1.688 -0.683 1.00 0.00 H new ATOM 0 HA LEU A 51 5.808 0.548 -3.350 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.027 0.954 -3.676 1.00 0.00 H new ATOM 0 HB3 LEU A 51 7.615 2.426 -2.820 1.00 0.00 H new ATOM 0 HG LEU A 51 8.331 1.074 -0.687 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.138 -0.534 -1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.577 -1.086 -1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.805 -0.395 -2.897 1.00 0.00 H new ATOM 0 HD21 LEU A 51 10.643 1.875 -0.989 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.329 2.109 -2.726 1.00 0.00 H new ATOM 0 HD23 LEU A 51 9.450 3.083 -1.523 1.00 0.00 H new ATOM 732 N VAL A 52 6.098 -1.628 -2.223 1.00 0.00 N ATOM 733 CA VAL A 52 6.177 -2.924 -1.560 1.00 0.00 C ATOM 734 C VAL A 52 7.485 -3.632 -1.892 1.00 0.00 C ATOM 735 O VAL A 52 7.962 -3.580 -3.025 1.00 0.00 O ATOM 736 CB VAL A 52 4.998 -3.831 -1.961 1.00 0.00 C ATOM 737 CG1 VAL A 52 4.955 -5.071 -1.081 1.00 0.00 C ATOM 738 CG2 VAL A 52 3.686 -3.066 -1.883 1.00 0.00 C ATOM 0 H VAL A 52 5.768 -1.667 -3.187 1.00 0.00 H new ATOM 0 HA VAL A 52 6.132 -2.735 -0.487 1.00 0.00 H new ATOM 0 HB VAL A 52 5.144 -4.152 -2.993 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.116 -5.700 -1.379 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.884 -5.629 -1.193 1.00 0.00 H new ATOM 0 HG13 VAL A 52 4.834 -4.774 -0.039 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.864 -3.722 -2.170 1.00 0.00 H new ATOM 0 HG22 VAL A 52 3.530 -2.714 -0.863 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.722 -2.213 -2.560 1.00 0.00 H new ATOM 748 N ARG A 53 8.061 -4.296 -0.894 1.00 0.00 N ATOM 749 CA ARG A 53 9.316 -5.015 -1.079 1.00 0.00 C ATOM 750 C ARG A 53 9.345 -6.284 -0.232 1.00 0.00 C ATOM 751 O ARG A 53 8.508 -6.471 0.650 1.00 0.00 O ATOM 752 CB ARG A 53 10.501 -4.118 -0.715 1.00 0.00 C ATOM 753 CG ARG A 53 10.697 -3.947 0.783 1.00 0.00 C ATOM 754 CD ARG A 53 11.225 -2.562 1.120 1.00 0.00 C ATOM 755 NE ARG A 53 10.849 -2.146 2.469 1.00 0.00 N ATOM 756 CZ ARG A 53 9.591 -1.978 2.862 1.00 0.00 C ATOM 757 NH1 ARG A 53 8.594 -2.189 2.014 1.00 0.00 N ATOM 758 NH2 ARG A 53 9.329 -1.599 4.106 1.00 0.00 N ATOM 0 H ARG A 53 7.679 -4.351 0.050 1.00 0.00 H new ATOM 0 HA ARG A 53 9.393 -5.298 -2.129 1.00 0.00 H new ATOM 0 HB2 ARG A 53 11.410 -4.538 -1.146 1.00 0.00 H new ATOM 0 HB3 ARG A 53 10.356 -3.137 -1.168 1.00 0.00 H new ATOM 0 HG2 ARG A 53 9.750 -4.111 1.296 1.00 0.00 H new ATOM 0 HG3 ARG A 53 11.393 -4.702 1.149 1.00 0.00 H new ATOM 0 HD2 ARG A 53 12.311 -2.556 1.028 1.00 0.00 H new ATOM 0 HD3 ARG A 53 10.840 -1.842 0.398 1.00 0.00 H new ATOM 0 HE ARG A 53 11.593 -1.975 3.146 1.00 0.00 H new ATOM 0 HH11 ARG A 53 8.792 -2.481 1.057 1.00 0.00 H new ATOM 0 HH12 ARG A 53 7.629 -2.059 2.319 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.094 -1.436 4.761 1.00 0.00 H new ATOM 0 HH22 ARG A 53 8.363 -1.470 4.407 1.00 0.00 H new ATOM 772 N GLN A 54 10.314 -7.151 -0.508 1.00 0.00 N ATOM 773 CA GLN A 54 10.451 -8.402 0.228 1.00 0.00 C ATOM 774 C GLN A 54 11.585 -8.315 1.244 1.00 0.00 C ATOM 775 O GLN A 54 12.308 -7.319 1.299 1.00 0.00 O ATOM 776 CB GLN A 54 10.704 -9.561 -0.738 1.00 0.00 C ATOM 777 CG GLN A 54 10.177 -10.896 -0.238 1.00 0.00 C ATOM 778 CD GLN A 54 9.770 -11.823 -1.366 1.00 0.00 C ATOM 779 OE1 GLN A 54 10.618 -12.362 -2.078 1.00 0.00 O ATOM 780 NE2 GLN A 54 8.467 -12.013 -1.536 1.00 0.00 N ATOM 0 H GLN A 54 11.015 -7.010 -1.235 1.00 0.00 H new ATOM 0 HA GLN A 54 9.520 -8.582 0.765 1.00 0.00 H new ATOM 0 HB2 GLN A 54 10.238 -9.332 -1.697 1.00 0.00 H new ATOM 0 HB3 GLN A 54 11.776 -9.647 -0.917 1.00 0.00 H new ATOM 0 HG2 GLN A 54 10.943 -11.381 0.367 1.00 0.00 H new ATOM 0 HG3 GLN A 54 9.319 -10.723 0.412 1.00 0.00 H new ATOM 0 HE21 GLN A 54 7.799 -11.546 -0.922 1.00 0.00 H new ATOM 0 HE22 GLN A 54 8.134 -12.626 -2.280 1.00 0.00 H new ATOM 789 N ARG A 55 11.734 -9.362 2.048 1.00 0.00 N ATOM 790 CA ARG A 55 12.779 -9.403 3.064 1.00 0.00 C ATOM 791 C ARG A 55 13.996 -10.173 2.562 1.00 0.00 C ATOM 792 O ARG A 55 14.322 -11.244 3.075 1.00 0.00 O ATOM 793 CB ARG A 55 12.248 -10.047 4.347 1.00 0.00 C ATOM 794 CG ARG A 55 12.912 -9.524 5.610 1.00 0.00 C ATOM 795 CD ARG A 55 12.535 -8.076 5.880 1.00 0.00 C ATOM 796 NE ARG A 55 13.139 -7.573 7.111 1.00 0.00 N ATOM 797 CZ ARG A 55 13.371 -6.286 7.344 1.00 0.00 C ATOM 798 NH1 ARG A 55 13.051 -5.376 6.434 1.00 0.00 N ATOM 799 NH2 ARG A 55 13.923 -5.907 8.489 1.00 0.00 N ATOM 0 H ARG A 55 11.144 -10.194 2.016 1.00 0.00 H new ATOM 0 HA ARG A 55 13.082 -8.378 3.278 1.00 0.00 H new ATOM 0 HB2 ARG A 55 11.174 -9.874 4.413 1.00 0.00 H new ATOM 0 HB3 ARG A 55 12.394 -11.126 4.290 1.00 0.00 H new ATOM 0 HG2 ARG A 55 12.619 -10.142 6.459 1.00 0.00 H new ATOM 0 HG3 ARG A 55 13.995 -9.607 5.514 1.00 0.00 H new ATOM 0 HD2 ARG A 55 12.852 -7.456 5.041 1.00 0.00 H new ATOM 0 HD3 ARG A 55 11.450 -7.990 5.947 1.00 0.00 H new ATOM 0 HE ARG A 55 13.397 -8.247 7.832 1.00 0.00 H new ATOM 0 HH11 ARG A 55 12.626 -5.664 5.553 1.00 0.00 H new ATOM 0 HH12 ARG A 55 13.230 -4.388 6.615 1.00 0.00 H new ATOM 0 HH21 ARG A 55 14.170 -6.604 9.192 1.00 0.00 H new ATOM 0 HH22 ARG A 55 14.101 -4.918 8.667 1.00 0.00 H new ATOM 813 N VAL A 56 14.665 -9.621 1.554 1.00 0.00 N ATOM 814 CA VAL A 56 15.846 -10.256 0.982 1.00 0.00 C ATOM 815 C VAL A 56 15.707 -11.774 0.978 1.00 0.00 C ATOM 816 O VAL A 56 16.663 -12.497 1.258 1.00 0.00 O ATOM 817 CB VAL A 56 17.121 -9.871 1.757 1.00 0.00 C ATOM 818 CG1 VAL A 56 18.356 -10.418 1.058 1.00 0.00 C ATOM 819 CG2 VAL A 56 17.212 -8.360 1.913 1.00 0.00 C ATOM 0 H VAL A 56 14.409 -8.736 1.117 1.00 0.00 H new ATOM 0 HA VAL A 56 15.931 -9.899 -0.044 1.00 0.00 H new ATOM 0 HB VAL A 56 17.070 -10.314 2.751 1.00 0.00 H new ATOM 0 HG11 VAL A 56 19.247 -10.136 1.620 1.00 0.00 H new ATOM 0 HG12 VAL A 56 18.291 -11.505 1.002 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.417 -10.006 0.051 1.00 0.00 H new ATOM 0 HG21 VAL A 56 18.118 -8.105 2.463 1.00 0.00 H new ATOM 0 HG22 VAL A 56 17.241 -7.894 0.928 1.00 0.00 H new ATOM 0 HG23 VAL A 56 16.342 -7.998 2.460 1.00 0.00 H new ATOM 829 N LYS A 57 14.510 -12.252 0.657 1.00 0.00 N ATOM 830 CA LYS A 57 14.243 -13.685 0.614 1.00 0.00 C ATOM 831 C LYS A 57 13.020 -13.985 -0.246 1.00 0.00 C ATOM 832 O LYS A 57 12.118 -13.156 -0.370 1.00 0.00 O ATOM 833 CB LYS A 57 14.031 -14.228 2.029 1.00 0.00 C ATOM 834 CG LYS A 57 15.320 -14.633 2.724 1.00 0.00 C ATOM 835 CD LYS A 57 15.046 -15.482 3.954 1.00 0.00 C ATOM 836 CE LYS A 57 16.322 -15.761 4.734 1.00 0.00 C ATOM 837 NZ LYS A 57 16.235 -17.032 5.504 1.00 0.00 N ATOM 0 H LYS A 57 13.708 -11.667 0.422 1.00 0.00 H new ATOM 0 HA LYS A 57 15.108 -14.177 0.169 1.00 0.00 H new ATOM 0 HB2 LYS A 57 13.527 -13.470 2.629 1.00 0.00 H new ATOM 0 HB3 LYS A 57 13.366 -15.091 1.982 1.00 0.00 H new ATOM 0 HG2 LYS A 57 15.950 -15.189 2.030 1.00 0.00 H new ATOM 0 HG3 LYS A 57 15.875 -13.740 3.013 1.00 0.00 H new ATOM 0 HD2 LYS A 57 14.329 -14.972 4.597 1.00 0.00 H new ATOM 0 HD3 LYS A 57 14.589 -16.425 3.652 1.00 0.00 H new ATOM 0 HE2 LYS A 57 17.165 -15.811 4.045 1.00 0.00 H new ATOM 0 HE3 LYS A 57 16.518 -14.935 5.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 17.124 -17.186 6.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 15.446 -16.975 6.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 16.074 -17.824 4.850 1.00 0.00 H new ATOM 851 N ASP A 58 12.995 -15.175 -0.836 1.00 0.00 N ATOM 852 CA ASP A 58 11.880 -15.586 -1.682 1.00 0.00 C ATOM 853 C ASP A 58 10.577 -15.611 -0.889 1.00 0.00 C ATOM 854 O ASP A 58 10.531 -16.113 0.233 1.00 0.00 O ATOM 855 CB ASP A 58 12.151 -16.965 -2.286 1.00 0.00 C ATOM 856 CG ASP A 58 13.385 -16.979 -3.166 1.00 0.00 C ATOM 857 OD1 ASP A 58 14.506 -16.929 -2.617 1.00 0.00 O ATOM 858 OD2 ASP A 58 13.231 -17.038 -4.404 1.00 0.00 O ATOM 0 H ASP A 58 13.734 -15.872 -0.744 1.00 0.00 H new ATOM 0 HA ASP A 58 11.780 -14.859 -2.488 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.272 -17.692 -1.483 1.00 0.00 H new ATOM 0 HB3 ASP A 58 11.287 -17.278 -2.872 1.00 0.00 H new ATOM 863 N ALA A 59 9.520 -15.066 -1.482 1.00 0.00 N ATOM 864 CA ALA A 59 8.215 -15.027 -0.832 1.00 0.00 C ATOM 865 C ALA A 59 8.359 -14.857 0.677 1.00 0.00 C ATOM 866 O ALA A 59 7.685 -15.533 1.454 1.00 0.00 O ATOM 867 CB ALA A 59 7.429 -16.290 -1.150 1.00 0.00 C ATOM 0 H ALA A 59 9.541 -14.645 -2.411 1.00 0.00 H new ATOM 0 HA ALA A 59 7.669 -14.166 -1.218 1.00 0.00 H new ATOM 0 HB1 ALA A 59 6.457 -16.247 -0.658 1.00 0.00 H new ATOM 0 HB2 ALA A 59 7.287 -16.369 -2.228 1.00 0.00 H new ATOM 0 HB3 ALA A 59 7.979 -17.160 -0.792 1.00 0.00 H new ATOM 873 N ALA A 60 9.242 -13.952 1.085 1.00 0.00 N ATOM 874 CA ALA A 60 9.473 -13.693 2.500 1.00 0.00 C ATOM 875 C ALA A 60 8.426 -12.735 3.061 1.00 0.00 C ATOM 876 O ALA A 60 7.483 -12.357 2.367 1.00 0.00 O ATOM 877 CB ALA A 60 10.871 -13.133 2.713 1.00 0.00 C ATOM 0 H ALA A 60 9.810 -13.385 0.455 1.00 0.00 H new ATOM 0 HA ALA A 60 9.387 -14.638 3.036 1.00 0.00 H new ATOM 0 HB1 ALA A 60 11.029 -12.944 3.775 1.00 0.00 H new ATOM 0 HB2 ALA A 60 11.609 -13.852 2.358 1.00 0.00 H new ATOM 0 HB3 ALA A 60 10.978 -12.200 2.159 1.00 0.00 H new ATOM 883 N GLU A 61 8.600 -12.348 4.321 1.00 0.00 N ATOM 884 CA GLU A 61 7.669 -11.436 4.974 1.00 0.00 C ATOM 885 C GLU A 61 7.615 -10.097 4.243 1.00 0.00 C ATOM 886 O GLU A 61 8.376 -9.179 4.550 1.00 0.00 O ATOM 887 CB GLU A 61 8.073 -11.217 6.433 1.00 0.00 C ATOM 888 CG GLU A 61 8.057 -12.487 7.267 1.00 0.00 C ATOM 889 CD GLU A 61 8.300 -12.222 8.740 1.00 0.00 C ATOM 890 OE1 GLU A 61 9.164 -11.378 9.056 1.00 0.00 O ATOM 891 OE2 GLU A 61 7.626 -12.859 9.576 1.00 0.00 O ATOM 0 H GLU A 61 9.376 -12.652 4.909 1.00 0.00 H new ATOM 0 HA GLU A 61 6.677 -11.887 4.943 1.00 0.00 H new ATOM 0 HB2 GLU A 61 9.073 -10.785 6.463 1.00 0.00 H new ATOM 0 HB3 GLU A 61 7.398 -10.489 6.883 1.00 0.00 H new ATOM 0 HG2 GLU A 61 7.095 -12.985 7.145 1.00 0.00 H new ATOM 0 HG3 GLU A 61 8.819 -13.171 6.894 1.00 0.00 H new ATOM 898 N PHE A 62 6.712 -9.994 3.274 1.00 0.00 N ATOM 899 CA PHE A 62 6.559 -8.769 2.498 1.00 0.00 C ATOM 900 C PHE A 62 6.452 -7.554 3.414 1.00 0.00 C ATOM 901 O PHE A 62 6.134 -7.681 4.596 1.00 0.00 O ATOM 902 CB PHE A 62 5.322 -8.858 1.603 1.00 0.00 C ATOM 903 CG PHE A 62 5.437 -9.895 0.522 1.00 0.00 C ATOM 904 CD1 PHE A 62 5.208 -11.233 0.800 1.00 0.00 C ATOM 905 CD2 PHE A 62 5.772 -9.531 -0.772 1.00 0.00 C ATOM 906 CE1 PHE A 62 5.314 -12.189 -0.192 1.00 0.00 C ATOM 907 CE2 PHE A 62 5.879 -10.483 -1.769 1.00 0.00 C ATOM 908 CZ PHE A 62 5.649 -11.813 -1.479 1.00 0.00 C ATOM 0 H PHE A 62 6.075 -10.744 3.007 1.00 0.00 H new ATOM 0 HA PHE A 62 7.444 -8.653 1.872 1.00 0.00 H new ATOM 0 HB2 PHE A 62 4.452 -9.083 2.220 1.00 0.00 H new ATOM 0 HB3 PHE A 62 5.144 -7.885 1.145 1.00 0.00 H new ATOM 0 HD1 PHE A 62 4.944 -11.532 1.804 1.00 0.00 H new ATOM 0 HD2 PHE A 62 5.952 -8.492 -1.005 1.00 0.00 H new ATOM 0 HE1 PHE A 62 5.135 -13.229 0.038 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.142 -10.186 -2.774 1.00 0.00 H new ATOM 0 HZ PHE A 62 5.731 -12.558 -2.256 1.00 0.00 H new ATOM 918 N ALA A 63 6.721 -6.377 2.860 1.00 0.00 N ATOM 919 CA ALA A 63 6.653 -5.139 3.626 1.00 0.00 C ATOM 920 C ALA A 63 6.303 -3.956 2.729 1.00 0.00 C ATOM 921 O ALA A 63 6.782 -3.860 1.599 1.00 0.00 O ATOM 922 CB ALA A 63 7.972 -4.888 4.341 1.00 0.00 C ATOM 0 H ALA A 63 6.988 -6.255 1.883 1.00 0.00 H new ATOM 0 HA ALA A 63 5.863 -5.244 4.369 1.00 0.00 H new ATOM 0 HB1 ALA A 63 7.907 -3.960 4.909 1.00 0.00 H new ATOM 0 HB2 ALA A 63 8.181 -5.715 5.019 1.00 0.00 H new ATOM 0 HB3 ALA A 63 8.774 -4.809 3.607 1.00 0.00 H new ATOM 928 N ILE A 64 5.465 -3.060 3.239 1.00 0.00 N ATOM 929 CA ILE A 64 5.051 -1.885 2.483 1.00 0.00 C ATOM 930 C ILE A 64 5.675 -0.616 3.054 1.00 0.00 C ATOM 931 O ILE A 64 5.568 -0.344 4.250 1.00 0.00 O ATOM 932 CB ILE A 64 3.519 -1.731 2.475 1.00 0.00 C ATOM 933 CG1 ILE A 64 2.858 -3.019 1.978 1.00 0.00 C ATOM 934 CG2 ILE A 64 3.109 -0.551 1.607 1.00 0.00 C ATOM 935 CD1 ILE A 64 1.368 -3.070 2.233 1.00 0.00 C ATOM 0 H ILE A 64 5.059 -3.125 4.173 1.00 0.00 H new ATOM 0 HA ILE A 64 5.399 -2.030 1.460 1.00 0.00 H new ATOM 0 HB ILE A 64 3.183 -1.541 3.494 1.00 0.00 H new ATOM 0 HG12 ILE A 64 3.039 -3.121 0.908 1.00 0.00 H new ATOM 0 HG13 ILE A 64 3.331 -3.872 2.464 1.00 0.00 H new ATOM 0 HG21 ILE A 64 2.023 -0.456 1.612 1.00 0.00 H new ATOM 0 HG22 ILE A 64 3.555 0.362 2.000 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.454 -0.713 0.586 1.00 0.00 H new ATOM 0 HD11 ILE A 64 0.966 -4.010 1.855 1.00 0.00 H new ATOM 0 HD12 ILE A 64 1.180 -2.999 3.304 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.883 -2.237 1.724 1.00 0.00 H new ATOM 947 N SER A 65 6.325 0.158 2.191 1.00 0.00 N ATOM 948 CA SER A 65 6.968 1.398 2.610 1.00 0.00 C ATOM 949 C SER A 65 6.532 2.562 1.726 1.00 0.00 C ATOM 950 O SER A 65 6.584 2.476 0.498 1.00 0.00 O ATOM 951 CB SER A 65 8.490 1.249 2.564 1.00 0.00 C ATOM 952 OG SER A 65 9.123 2.225 3.373 1.00 0.00 O ATOM 0 H SER A 65 6.420 -0.052 1.197 1.00 0.00 H new ATOM 0 HA SER A 65 6.662 1.609 3.635 1.00 0.00 H new ATOM 0 HB2 SER A 65 8.771 0.252 2.904 1.00 0.00 H new ATOM 0 HB3 SER A 65 8.837 1.344 1.535 1.00 0.00 H new ATOM 0 HG SER A 65 8.662 2.283 4.236 1.00 0.00 H new ATOM 958 N ILE A 66 6.104 3.649 2.358 1.00 0.00 N ATOM 959 CA ILE A 66 5.660 4.831 1.629 1.00 0.00 C ATOM 960 C ILE A 66 6.211 6.105 2.260 1.00 0.00 C ATOM 961 O ILE A 66 6.765 6.078 3.359 1.00 0.00 O ATOM 962 CB ILE A 66 4.123 4.918 1.580 1.00 0.00 C ATOM 963 CG1 ILE A 66 3.604 5.792 2.724 1.00 0.00 C ATOM 964 CG2 ILE A 66 3.511 3.527 1.648 1.00 0.00 C ATOM 965 CD1 ILE A 66 4.086 5.350 4.088 1.00 0.00 C ATOM 0 H ILE A 66 6.055 3.736 3.373 1.00 0.00 H new ATOM 0 HA ILE A 66 6.043 4.737 0.613 1.00 0.00 H new ATOM 0 HB ILE A 66 3.829 5.376 0.636 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.916 6.822 2.554 1.00 0.00 H new ATOM 0 HG13 ILE A 66 2.514 5.783 2.712 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.424 3.605 1.612 1.00 0.00 H new ATOM 0 HG22 ILE A 66 3.860 2.934 0.802 1.00 0.00 H new ATOM 0 HG23 ILE A 66 3.809 3.043 2.578 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.679 6.014 4.850 1.00 0.00 H new ATOM 0 HD12 ILE A 66 3.751 4.330 4.279 1.00 0.00 H new ATOM 0 HD13 ILE A 66 5.175 5.386 4.118 1.00 0.00 H new ATOM 977 N LYS A 67 6.053 7.222 1.558 1.00 0.00 N ATOM 978 CA LYS A 67 6.531 8.509 2.050 1.00 0.00 C ATOM 979 C LYS A 67 5.438 9.234 2.829 1.00 0.00 C ATOM 980 O LYS A 67 4.400 9.593 2.274 1.00 0.00 O ATOM 981 CB LYS A 67 7.003 9.380 0.884 1.00 0.00 C ATOM 982 CG LYS A 67 7.696 10.659 1.321 1.00 0.00 C ATOM 983 CD LYS A 67 9.048 10.373 1.952 1.00 0.00 C ATOM 984 CE LYS A 67 9.505 11.524 2.836 1.00 0.00 C ATOM 985 NZ LYS A 67 9.864 12.728 2.038 1.00 0.00 N ATOM 0 H LYS A 67 5.597 7.262 0.646 1.00 0.00 H new ATOM 0 HA LYS A 67 7.370 8.324 2.721 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.686 8.801 0.262 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.145 9.636 0.262 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.827 11.315 0.461 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.066 11.190 2.034 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.989 9.460 2.544 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.786 10.198 1.169 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.712 11.778 3.540 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.366 11.209 3.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.170 13.489 2.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.638 12.493 1.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.035 13.044 1.495 1.00 0.00 H new ATOM 999 N TYR A 68 5.680 9.446 4.118 1.00 0.00 N ATOM 1000 CA TYR A 68 4.715 10.127 4.974 1.00 0.00 C ATOM 1001 C TYR A 68 5.424 10.989 6.014 1.00 0.00 C ATOM 1002 O TYR A 68 6.474 10.616 6.536 1.00 0.00 O ATOM 1003 CB TYR A 68 3.811 9.109 5.670 1.00 0.00 C ATOM 1004 CG TYR A 68 2.497 9.689 6.142 1.00 0.00 C ATOM 1005 CD1 TYR A 68 2.376 10.246 7.409 1.00 0.00 C ATOM 1006 CD2 TYR A 68 1.376 9.679 5.322 1.00 0.00 C ATOM 1007 CE1 TYR A 68 1.177 10.777 7.845 1.00 0.00 C ATOM 1008 CE2 TYR A 68 0.173 10.208 5.749 1.00 0.00 C ATOM 1009 CZ TYR A 68 0.079 10.756 7.011 1.00 0.00 C ATOM 1010 OH TYR A 68 -1.117 11.283 7.440 1.00 0.00 O ATOM 0 H TYR A 68 6.535 9.157 4.593 1.00 0.00 H new ATOM 0 HA TYR A 68 4.104 10.775 4.346 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.610 8.286 4.984 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.341 8.689 6.525 1.00 0.00 H new ATOM 0 HD1 TYR A 68 3.234 10.264 8.065 1.00 0.00 H new ATOM 0 HD2 TYR A 68 1.446 9.250 4.333 1.00 0.00 H new ATOM 0 HE1 TYR A 68 1.100 11.206 8.833 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -0.689 10.192 5.098 1.00 0.00 H new ATOM 0 HH TYR A 68 -1.804 10.584 7.431 1.00 0.00 H new ATOM 1020 N ASN A 69 4.840 12.146 6.311 1.00 0.00 N ATOM 1021 CA ASN A 69 5.415 13.063 7.289 1.00 0.00 C ATOM 1022 C ASN A 69 6.884 13.335 6.983 1.00 0.00 C ATOM 1023 O ASN A 69 7.694 13.526 7.890 1.00 0.00 O ATOM 1024 CB ASN A 69 5.275 12.489 8.701 1.00 0.00 C ATOM 1025 CG ASN A 69 5.120 13.572 9.752 1.00 0.00 C ATOM 1026 OD1 ASN A 69 4.187 14.372 9.702 1.00 0.00 O ATOM 1027 ND2 ASN A 69 6.039 13.601 10.711 1.00 0.00 N ATOM 0 H ASN A 69 3.970 12.470 5.889 1.00 0.00 H new ATOM 0 HA ASN A 69 4.870 14.005 7.230 1.00 0.00 H new ATOM 0 HB2 ASN A 69 4.411 11.825 8.737 1.00 0.00 H new ATOM 0 HB3 ASN A 69 6.151 11.884 8.933 1.00 0.00 H new ATOM 0 HD21 ASN A 69 5.988 14.307 11.445 1.00 0.00 H new ATOM 0 HD22 ASN A 69 6.796 12.917 10.713 1.00 0.00 H new ATOM 1034 N VAL A 70 7.222 13.351 5.697 1.00 0.00 N ATOM 1035 CA VAL A 70 8.593 13.602 5.269 1.00 0.00 C ATOM 1036 C VAL A 70 9.524 12.483 5.726 1.00 0.00 C ATOM 1037 O VAL A 70 10.726 12.690 5.883 1.00 0.00 O ATOM 1038 CB VAL A 70 9.115 14.944 5.816 1.00 0.00 C ATOM 1039 CG1 VAL A 70 7.970 15.928 5.998 1.00 0.00 C ATOM 1040 CG2 VAL A 70 9.861 14.732 7.124 1.00 0.00 C ATOM 0 H VAL A 70 6.564 13.193 4.933 1.00 0.00 H new ATOM 0 HA VAL A 70 8.583 13.641 4.180 1.00 0.00 H new ATOM 0 HB VAL A 70 9.812 15.365 5.092 1.00 0.00 H new ATOM 0 HG11 VAL A 70 8.358 16.870 6.385 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.484 16.103 5.038 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.246 15.517 6.702 1.00 0.00 H new ATOM 0 HG21 VAL A 70 10.223 15.691 7.496 1.00 0.00 H new ATOM 0 HG22 VAL A 70 9.189 14.288 7.858 1.00 0.00 H new ATOM 0 HG23 VAL A 70 10.707 14.065 6.957 1.00 0.00 H new ATOM 1050 N GLU A 71 8.958 11.299 5.936 1.00 0.00 N ATOM 1051 CA GLU A 71 9.738 10.148 6.375 1.00 0.00 C ATOM 1052 C GLU A 71 9.229 8.865 5.723 1.00 0.00 C ATOM 1053 O GLU A 71 8.023 8.661 5.587 1.00 0.00 O ATOM 1054 CB GLU A 71 9.680 10.015 7.898 1.00 0.00 C ATOM 1055 CG GLU A 71 8.346 10.429 8.495 1.00 0.00 C ATOM 1056 CD GLU A 71 8.376 10.482 10.011 1.00 0.00 C ATOM 1057 OE1 GLU A 71 9.481 10.400 10.586 1.00 0.00 O ATOM 1058 OE2 GLU A 71 7.293 10.606 10.621 1.00 0.00 O ATOM 0 H GLU A 71 7.963 11.112 5.809 1.00 0.00 H new ATOM 0 HA GLU A 71 10.773 10.306 6.070 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.885 8.980 8.172 1.00 0.00 H new ATOM 0 HB3 GLU A 71 10.470 10.624 8.338 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.067 11.408 8.106 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.576 9.727 8.175 1.00 0.00 H new ATOM 1065 N VAL A 72 10.159 8.005 5.320 1.00 0.00 N ATOM 1066 CA VAL A 72 9.806 6.742 4.682 1.00 0.00 C ATOM 1067 C VAL A 72 9.386 5.703 5.715 1.00 0.00 C ATOM 1068 O VAL A 72 10.227 5.051 6.335 1.00 0.00 O ATOM 1069 CB VAL A 72 10.980 6.183 3.856 1.00 0.00 C ATOM 1070 CG1 VAL A 72 10.594 4.865 3.203 1.00 0.00 C ATOM 1071 CG2 VAL A 72 11.425 7.195 2.811 1.00 0.00 C ATOM 0 H VAL A 72 11.162 8.160 5.424 1.00 0.00 H new ATOM 0 HA VAL A 72 8.968 6.947 4.016 1.00 0.00 H new ATOM 0 HB VAL A 72 11.818 5.996 4.528 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.436 4.486 2.624 1.00 0.00 H new ATOM 0 HG12 VAL A 72 10.328 4.141 3.974 1.00 0.00 H new ATOM 0 HG13 VAL A 72 9.741 5.022 2.543 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.255 6.784 2.237 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.594 7.415 2.141 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.745 8.112 3.306 1.00 0.00 H new ATOM 1081 N LYS A 73 8.078 5.552 5.897 1.00 0.00 N ATOM 1082 CA LYS A 73 7.544 4.590 6.854 1.00 0.00 C ATOM 1083 C LYS A 73 7.481 3.193 6.244 1.00 0.00 C ATOM 1084 O LYS A 73 7.450 3.072 5.021 1.00 0.00 O ATOM 1085 CB LYS A 73 6.150 5.020 7.316 1.00 0.00 C ATOM 1086 CG LYS A 73 6.061 6.488 7.696 1.00 0.00 C ATOM 1087 CD LYS A 73 6.634 6.742 9.080 1.00 0.00 C ATOM 1088 CE LYS A 73 5.928 7.898 9.772 1.00 0.00 C ATOM 1089 NZ LYS A 73 6.314 8.004 11.207 1.00 0.00 N ATOM 0 H LYS A 73 7.368 6.084 5.394 1.00 0.00 H new ATOM 0 HA LYS A 73 8.213 4.561 7.714 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.434 4.815 6.520 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.857 4.413 8.173 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.600 7.088 6.963 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.020 6.810 7.668 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.538 5.841 9.686 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.699 6.960 9.000 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.170 8.830 9.261 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.849 7.763 9.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.468 7.899 11.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.996 7.254 11.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.748 8.933 11.382 1.00 0.00 H new ATOM 1103 N HIS A 74 7.462 2.182 7.099 1.00 0.00 N ATOM 1104 CA HIS A 74 7.401 0.807 6.632 1.00 0.00 C ATOM 1105 C HIS A 74 6.262 0.073 7.343 1.00 0.00 C ATOM 1106 O HIS A 74 5.842 0.431 8.444 1.00 0.00 O ATOM 1107 CB HIS A 74 8.753 0.114 6.805 1.00 0.00 C ATOM 1108 CG HIS A 74 9.939 0.986 6.468 1.00 0.00 C ATOM 1109 ND1 HIS A 74 10.681 0.827 5.311 1.00 0.00 N ATOM 1110 CD2 HIS A 74 10.501 2.027 7.146 1.00 0.00 C ATOM 1111 CE1 HIS A 74 11.645 1.736 5.304 1.00 0.00 C ATOM 1112 NE2 HIS A 74 11.532 2.478 6.443 1.00 0.00 N ATOM 0 H HIS A 74 7.488 2.287 8.113 1.00 0.00 H new ATOM 0 HA HIS A 74 7.185 0.791 5.564 1.00 0.00 H new ATOM 0 HB2 HIS A 74 8.846 -0.225 7.837 1.00 0.00 H new ATOM 0 HB3 HIS A 74 8.778 -0.774 6.174 1.00 0.00 H new ATOM 0 HD2 HIS A 74 10.164 2.418 8.095 1.00 0.00 H new ATOM 0 HE1 HIS A 74 12.389 1.866 4.532 1.00 0.00 H new ATOM 0 HE2 HIS A 74 12.140 3.252 6.710 1.00 0.00 H new ATOM 1120 N ILE A 75 5.768 -0.969 6.684 1.00 0.00 N ATOM 1121 CA ILE A 75 4.681 -1.772 7.230 1.00 0.00 C ATOM 1122 C ILE A 75 4.923 -3.259 6.993 1.00 0.00 C ATOM 1123 O ILE A 75 5.159 -3.690 5.864 1.00 0.00 O ATOM 1124 CB ILE A 75 3.326 -1.380 6.612 1.00 0.00 C ATOM 1125 CG1 ILE A 75 3.062 0.114 6.813 1.00 0.00 C ATOM 1126 CG2 ILE A 75 2.206 -2.208 7.222 1.00 0.00 C ATOM 1127 CD1 ILE A 75 1.696 0.555 6.339 1.00 0.00 C ATOM 0 H ILE A 75 6.103 -1.277 5.771 1.00 0.00 H new ATOM 0 HA ILE A 75 4.653 -1.577 8.302 1.00 0.00 H new ATOM 0 HB ILE A 75 3.359 -1.583 5.542 1.00 0.00 H new ATOM 0 HG12 ILE A 75 3.165 0.354 7.871 1.00 0.00 H new ATOM 0 HG13 ILE A 75 3.824 0.684 6.281 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.255 -1.919 6.775 1.00 0.00 H new ATOM 0 HG22 ILE A 75 2.390 -3.265 7.032 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.169 -2.034 8.297 1.00 0.00 H new ATOM 0 HD11 ILE A 75 1.578 1.625 6.513 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.596 0.347 5.274 1.00 0.00 H new ATOM 0 HD13 ILE A 75 0.927 0.012 6.889 1.00 0.00 H new ATOM 1139 N LYS A 76 4.862 -4.041 8.066 1.00 0.00 N ATOM 1140 CA LYS A 76 5.072 -5.481 7.977 1.00 0.00 C ATOM 1141 C LYS A 76 3.843 -6.174 7.397 1.00 0.00 C ATOM 1142 O LYS A 76 2.710 -5.848 7.750 1.00 0.00 O ATOM 1143 CB LYS A 76 5.390 -6.057 9.359 1.00 0.00 C ATOM 1144 CG LYS A 76 5.328 -7.574 9.414 1.00 0.00 C ATOM 1145 CD LYS A 76 5.994 -8.114 10.669 1.00 0.00 C ATOM 1146 CE LYS A 76 6.593 -9.492 10.433 1.00 0.00 C ATOM 1147 NZ LYS A 76 7.021 -10.136 11.706 1.00 0.00 N ATOM 0 H LYS A 76 4.669 -3.701 9.008 1.00 0.00 H new ATOM 0 HA LYS A 76 5.917 -5.660 7.312 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.386 -5.731 9.659 1.00 0.00 H new ATOM 0 HB3 LYS A 76 4.688 -5.646 10.085 1.00 0.00 H new ATOM 0 HG2 LYS A 76 4.288 -7.898 9.385 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.816 -7.991 8.533 1.00 0.00 H new ATOM 0 HD2 LYS A 76 6.776 -7.427 10.992 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.263 -8.167 11.476 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.860 -10.126 9.934 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.449 -9.406 9.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.424 -11.073 11.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.739 -9.544 12.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.200 -10.241 12.335 1.00 0.00 H new ATOM 1161 N ILE A 77 4.076 -7.133 6.506 1.00 0.00 N ATOM 1162 CA ILE A 77 2.988 -7.873 5.880 1.00 0.00 C ATOM 1163 C ILE A 77 2.959 -9.320 6.361 1.00 0.00 C ATOM 1164 O ILE A 77 3.983 -10.003 6.367 1.00 0.00 O ATOM 1165 CB ILE A 77 3.107 -7.857 4.344 1.00 0.00 C ATOM 1166 CG1 ILE A 77 2.980 -6.427 3.816 1.00 0.00 C ATOM 1167 CG2 ILE A 77 2.048 -8.754 3.721 1.00 0.00 C ATOM 1168 CD1 ILE A 77 3.247 -6.305 2.332 1.00 0.00 C ATOM 0 H ILE A 77 5.008 -7.415 6.202 1.00 0.00 H new ATOM 0 HA ILE A 77 2.062 -7.377 6.170 1.00 0.00 H new ATOM 0 HB ILE A 77 4.089 -8.241 4.066 1.00 0.00 H new ATOM 0 HG12 ILE A 77 1.977 -6.058 4.028 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.676 -5.786 4.356 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.145 -8.732 2.636 1.00 0.00 H new ATOM 0 HG22 ILE A 77 2.182 -9.776 4.077 1.00 0.00 H new ATOM 0 HG23 ILE A 77 1.057 -8.398 4.004 1.00 0.00 H new ATOM 0 HD11 ILE A 77 3.139 -5.264 2.027 1.00 0.00 H new ATOM 0 HD12 ILE A 77 4.260 -6.643 2.116 1.00 0.00 H new ATOM 0 HD13 ILE A 77 2.534 -6.920 1.782 1.00 0.00 H new ATOM 1180 N MET A 78 1.779 -9.781 6.762 1.00 0.00 N ATOM 1181 CA MET A 78 1.616 -11.148 7.243 1.00 0.00 C ATOM 1182 C MET A 78 0.889 -12.004 6.210 1.00 0.00 C ATOM 1183 O MET A 78 0.187 -11.485 5.341 1.00 0.00 O ATOM 1184 CB MET A 78 0.846 -11.159 8.564 1.00 0.00 C ATOM 1185 CG MET A 78 1.321 -10.106 9.553 1.00 0.00 C ATOM 1186 SD MET A 78 0.899 -10.514 11.258 1.00 0.00 S ATOM 1187 CE MET A 78 -0.691 -9.705 11.416 1.00 0.00 C ATOM 0 H MET A 78 0.922 -9.228 6.763 1.00 0.00 H new ATOM 0 HA MET A 78 2.608 -11.570 7.406 1.00 0.00 H new ATOM 0 HB2 MET A 78 -0.213 -11.002 8.359 1.00 0.00 H new ATOM 0 HB3 MET A 78 0.940 -12.144 9.022 1.00 0.00 H new ATOM 0 HG2 MET A 78 2.402 -9.994 9.467 1.00 0.00 H new ATOM 0 HG3 MET A 78 0.879 -9.144 9.294 1.00 0.00 H new ATOM 0 HE1 MET A 78 -1.281 -10.209 12.181 1.00 0.00 H new ATOM 0 HE2 MET A 78 -0.543 -8.663 11.700 1.00 0.00 H new ATOM 0 HE3 MET A 78 -1.218 -9.749 10.463 1.00 0.00 H new ATOM 1197 N THR A 79 1.061 -13.318 6.311 1.00 0.00 N ATOM 1198 CA THR A 79 0.423 -14.246 5.385 1.00 0.00 C ATOM 1199 C THR A 79 -0.206 -15.418 6.128 1.00 0.00 C ATOM 1200 O THR A 79 0.368 -15.941 7.082 1.00 0.00 O ATOM 1201 CB THR A 79 1.427 -14.787 4.351 1.00 0.00 C ATOM 1202 OG1 THR A 79 2.711 -14.963 4.960 1.00 0.00 O ATOM 1203 CG2 THR A 79 1.548 -13.841 3.166 1.00 0.00 C ATOM 0 H THR A 79 1.637 -13.764 7.025 1.00 0.00 H new ATOM 0 HA THR A 79 -0.356 -13.689 4.866 1.00 0.00 H new ATOM 0 HB THR A 79 1.061 -15.749 3.992 1.00 0.00 H new ATOM 0 HG1 THR A 79 3.343 -15.309 4.296 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.263 -14.245 2.449 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.575 -13.733 2.686 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.893 -12.867 3.512 1.00 0.00 H new ATOM 1211 N ALA A 80 -1.390 -15.827 5.684 1.00 0.00 N ATOM 1212 CA ALA A 80 -2.096 -16.941 6.306 1.00 0.00 C ATOM 1213 C ALA A 80 -3.123 -17.542 5.351 1.00 0.00 C ATOM 1214 O ALA A 80 -4.005 -16.843 4.855 1.00 0.00 O ATOM 1215 CB ALA A 80 -2.771 -16.486 7.591 1.00 0.00 C ATOM 0 H ALA A 80 -1.880 -15.404 4.896 1.00 0.00 H new ATOM 0 HA ALA A 80 -1.366 -17.714 6.546 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.294 -17.328 8.045 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.018 -16.110 8.284 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.485 -15.694 7.366 1.00 0.00 H new ATOM 1221 N GLU A 81 -2.999 -18.841 5.099 1.00 0.00 N ATOM 1222 CA GLU A 81 -3.917 -19.535 4.202 1.00 0.00 C ATOM 1223 C GLU A 81 -3.754 -19.039 2.768 1.00 0.00 C ATOM 1224 O GLU A 81 -4.679 -19.125 1.962 1.00 0.00 O ATOM 1225 CB GLU A 81 -5.362 -19.336 4.662 1.00 0.00 C ATOM 1226 CG GLU A 81 -5.539 -19.417 6.169 1.00 0.00 C ATOM 1227 CD GLU A 81 -6.994 -19.365 6.590 1.00 0.00 C ATOM 1228 OE1 GLU A 81 -7.695 -18.412 6.189 1.00 0.00 O ATOM 1229 OE2 GLU A 81 -7.433 -20.277 7.320 1.00 0.00 O ATOM 0 H GLU A 81 -2.273 -19.434 5.502 1.00 0.00 H new ATOM 0 HA GLU A 81 -3.678 -20.598 4.230 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.714 -18.364 4.315 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -5.992 -20.090 4.190 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -5.092 -20.342 6.534 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.999 -18.595 6.639 1.00 0.00 H new ATOM 1236 N GLY A 82 -2.571 -18.518 2.459 1.00 0.00 N ATOM 1237 CA GLY A 82 -2.308 -18.015 1.123 1.00 0.00 C ATOM 1238 C GLY A 82 -2.807 -16.597 0.929 1.00 0.00 C ATOM 1239 O GLY A 82 -3.029 -16.158 -0.200 1.00 0.00 O ATOM 0 H GLY A 82 -1.790 -18.435 3.110 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -1.236 -18.049 0.930 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.785 -18.668 0.392 1.00 0.00 H new ATOM 1243 N LEU A 83 -2.985 -15.878 2.032 1.00 0.00 N ATOM 1244 CA LEU A 83 -3.462 -14.501 1.979 1.00 0.00 C ATOM 1245 C LEU A 83 -2.381 -13.531 2.447 1.00 0.00 C ATOM 1246 O LEU A 83 -1.327 -13.946 2.929 1.00 0.00 O ATOM 1247 CB LEU A 83 -4.715 -14.341 2.843 1.00 0.00 C ATOM 1248 CG LEU A 83 -5.860 -15.312 2.551 1.00 0.00 C ATOM 1249 CD1 LEU A 83 -6.683 -15.558 3.806 1.00 0.00 C ATOM 1250 CD2 LEU A 83 -6.739 -14.778 1.430 1.00 0.00 C ATOM 0 H LEU A 83 -2.806 -16.226 2.974 1.00 0.00 H new ATOM 0 HA LEU A 83 -3.709 -14.268 0.943 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.428 -14.453 3.889 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -5.088 -13.324 2.722 1.00 0.00 H new ATOM 0 HG LEU A 83 -5.433 -16.262 2.229 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.493 -16.251 3.580 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -6.046 -15.985 4.581 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -7.100 -14.615 4.158 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -7.548 -15.482 1.236 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -7.158 -13.815 1.723 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -6.142 -14.654 0.527 1.00 0.00 H new ATOM 1262 N TYR A 84 -2.651 -12.239 2.302 1.00 0.00 N ATOM 1263 CA TYR A 84 -1.702 -11.210 2.710 1.00 0.00 C ATOM 1264 C TYR A 84 -2.403 -10.095 3.480 1.00 0.00 C ATOM 1265 O TYR A 84 -3.372 -9.508 2.999 1.00 0.00 O ATOM 1266 CB TYR A 84 -0.990 -10.630 1.486 1.00 0.00 C ATOM 1267 CG TYR A 84 -0.191 -11.651 0.710 1.00 0.00 C ATOM 1268 CD1 TYR A 84 -0.823 -12.589 -0.097 1.00 0.00 C ATOM 1269 CD2 TYR A 84 1.196 -11.680 0.784 1.00 0.00 C ATOM 1270 CE1 TYR A 84 -0.097 -13.525 -0.808 1.00 0.00 C ATOM 1271 CE2 TYR A 84 1.931 -12.611 0.075 1.00 0.00 C ATOM 1272 CZ TYR A 84 1.280 -13.532 -0.719 1.00 0.00 C ATOM 1273 OH TYR A 84 2.008 -14.462 -1.425 1.00 0.00 O ATOM 0 H TYR A 84 -3.519 -11.879 1.905 1.00 0.00 H new ATOM 0 HA TYR A 84 -0.965 -11.672 3.367 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.731 -10.181 0.824 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.325 -9.829 1.809 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.901 -12.586 -0.170 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.709 -10.962 1.407 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.604 -14.247 -1.430 1.00 0.00 H new ATOM 0 HE2 TYR A 84 3.009 -12.617 0.142 1.00 0.00 H new ATOM 0 HH TYR A 84 2.963 -14.329 -1.253 1.00 0.00 H new ATOM 1283 N ARG A 85 -1.906 -9.810 4.679 1.00 0.00 N ATOM 1284 CA ARG A 85 -2.484 -8.766 5.517 1.00 0.00 C ATOM 1285 C ARG A 85 -1.501 -8.334 6.601 1.00 0.00 C ATOM 1286 O ARG A 85 -0.956 -9.166 7.327 1.00 0.00 O ATOM 1287 CB ARG A 85 -3.783 -9.259 6.158 1.00 0.00 C ATOM 1288 CG ARG A 85 -3.672 -10.645 6.771 1.00 0.00 C ATOM 1289 CD ARG A 85 -4.797 -10.909 7.759 1.00 0.00 C ATOM 1290 NE ARG A 85 -4.374 -11.783 8.851 1.00 0.00 N ATOM 1291 CZ ARG A 85 -4.338 -13.107 8.760 1.00 0.00 C ATOM 1292 NH1 ARG A 85 -4.697 -13.708 7.633 1.00 0.00 N ATOM 1293 NH2 ARG A 85 -3.941 -13.834 9.796 1.00 0.00 N ATOM 0 H ARG A 85 -1.105 -10.287 5.092 1.00 0.00 H new ATOM 0 HA ARG A 85 -2.703 -7.905 4.885 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -4.088 -8.553 6.930 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -4.570 -9.266 5.404 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -3.696 -11.396 5.981 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.711 -10.745 7.277 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -5.149 -9.962 8.168 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -5.639 -11.363 7.237 1.00 0.00 H new ATOM 0 HE ARG A 85 -4.091 -11.352 9.731 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -5.002 -13.153 6.834 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -4.668 -14.725 7.566 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -3.663 -13.376 10.664 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -3.914 -14.851 9.725 1.00 0.00 H new ATOM 1307 N ILE A 86 -1.280 -7.027 6.705 1.00 0.00 N ATOM 1308 CA ILE A 86 -0.364 -6.485 7.701 1.00 0.00 C ATOM 1309 C ILE A 86 -0.954 -6.587 9.103 1.00 0.00 C ATOM 1310 O ILE A 86 -0.230 -6.537 10.099 1.00 0.00 O ATOM 1311 CB ILE A 86 -0.021 -5.013 7.406 1.00 0.00 C ATOM 1312 CG1 ILE A 86 -1.247 -4.125 7.631 1.00 0.00 C ATOM 1313 CG2 ILE A 86 0.494 -4.863 5.982 1.00 0.00 C ATOM 1314 CD1 ILE A 86 -0.910 -2.760 8.189 1.00 0.00 C ATOM 0 H ILE A 86 -1.723 -6.325 6.112 1.00 0.00 H new ATOM 0 HA ILE A 86 0.548 -7.080 7.649 1.00 0.00 H new ATOM 0 HB ILE A 86 0.765 -4.695 8.091 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.775 -4.002 6.685 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.930 -4.629 8.314 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.732 -3.817 5.789 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.391 -5.469 5.854 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.272 -5.196 5.281 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.826 -2.185 8.323 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.409 -2.873 9.150 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.251 -2.236 7.496 1.00 0.00 H new ATOM 1326 N THR A 87 -2.273 -6.731 9.176 1.00 0.00 N ATOM 1327 CA THR A 87 -2.961 -6.841 10.456 1.00 0.00 C ATOM 1328 C THR A 87 -4.030 -7.927 10.415 1.00 0.00 C ATOM 1329 O THR A 87 -4.591 -8.218 9.359 1.00 0.00 O ATOM 1330 CB THR A 87 -3.616 -5.507 10.859 1.00 0.00 C ATOM 1331 OG1 THR A 87 -4.325 -5.662 12.093 1.00 0.00 O ATOM 1332 CG2 THR A 87 -4.571 -5.025 9.777 1.00 0.00 C ATOM 0 H THR A 87 -2.887 -6.774 8.363 1.00 0.00 H new ATOM 0 HA THR A 87 -2.207 -7.105 11.197 1.00 0.00 H new ATOM 0 HB THR A 87 -2.828 -4.764 10.984 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.601 -4.782 12.425 1.00 0.00 H new ATOM 0 HG21 THR A 87 -5.022 -4.081 10.084 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.023 -4.880 8.846 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.354 -5.768 9.625 1.00 0.00 H new ATOM 1340 N GLU A 88 -4.307 -8.523 11.570 1.00 0.00 N ATOM 1341 CA GLU A 88 -5.310 -9.577 11.664 1.00 0.00 C ATOM 1342 C GLU A 88 -6.718 -8.989 11.687 1.00 0.00 C ATOM 1343 O GLU A 88 -7.548 -9.364 12.515 1.00 0.00 O ATOM 1344 CB GLU A 88 -5.079 -10.422 12.919 1.00 0.00 C ATOM 1345 CG GLU A 88 -5.249 -9.647 14.215 1.00 0.00 C ATOM 1346 CD GLU A 88 -3.968 -8.970 14.663 1.00 0.00 C ATOM 1347 OE1 GLU A 88 -3.065 -9.677 15.157 1.00 0.00 O ATOM 1348 OE2 GLU A 88 -3.869 -7.734 14.519 1.00 0.00 O ATOM 0 H GLU A 88 -3.851 -8.294 12.453 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.214 -10.212 10.784 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.774 -11.262 12.914 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.073 -10.840 12.885 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -6.027 -8.894 14.084 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.590 -10.325 14.997 1.00 0.00 H new ATOM 1355 N LYS A 89 -6.980 -8.062 10.771 1.00 0.00 N ATOM 1356 CA LYS A 89 -8.287 -7.421 10.683 1.00 0.00 C ATOM 1357 C LYS A 89 -9.008 -7.829 9.403 1.00 0.00 C ATOM 1358 O LYS A 89 -10.226 -8.009 9.395 1.00 0.00 O ATOM 1359 CB LYS A 89 -8.135 -5.899 10.733 1.00 0.00 C ATOM 1360 CG LYS A 89 -7.639 -5.380 12.072 1.00 0.00 C ATOM 1361 CD LYS A 89 -7.850 -3.881 12.202 1.00 0.00 C ATOM 1362 CE LYS A 89 -9.301 -3.548 12.516 1.00 0.00 C ATOM 1363 NZ LYS A 89 -9.593 -3.660 13.972 1.00 0.00 N ATOM 0 H LYS A 89 -6.304 -7.738 10.079 1.00 0.00 H new ATOM 0 HA LYS A 89 -8.883 -7.749 11.535 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -7.442 -5.586 9.952 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -9.097 -5.439 10.508 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -8.162 -5.893 12.879 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -6.579 -5.610 12.182 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -7.207 -3.489 12.990 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -7.555 -3.389 11.275 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -9.523 -2.536 12.178 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -9.956 -4.220 11.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -10.591 -3.425 14.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -9.406 -4.632 14.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -8.986 -3.001 14.500 1.00 0.00 H new ATOM 1377 N LYS A 90 -8.250 -7.975 8.322 1.00 0.00 N ATOM 1378 CA LYS A 90 -8.815 -8.364 7.036 1.00 0.00 C ATOM 1379 C LYS A 90 -7.733 -8.901 6.105 1.00 0.00 C ATOM 1380 O LYS A 90 -6.690 -8.272 5.924 1.00 0.00 O ATOM 1381 CB LYS A 90 -9.520 -7.173 6.384 1.00 0.00 C ATOM 1382 CG LYS A 90 -9.967 -7.438 4.956 1.00 0.00 C ATOM 1383 CD LYS A 90 -11.375 -8.007 4.909 1.00 0.00 C ATOM 1384 CE LYS A 90 -12.095 -7.608 3.631 1.00 0.00 C ATOM 1385 NZ LYS A 90 -13.421 -8.275 3.510 1.00 0.00 N ATOM 0 H LYS A 90 -7.241 -7.829 8.311 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.542 -9.156 7.212 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.389 -6.903 6.984 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.848 -6.315 6.392 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.929 -6.511 4.384 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.276 -8.134 4.481 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.332 -9.094 4.979 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -11.940 -7.654 5.772 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -12.229 -6.526 3.612 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.478 -7.867 2.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -13.880 -7.977 2.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.291 -9.307 3.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -14.019 -8.008 4.318 1.00 0.00 H new ATOM 1399 N ALA A 91 -7.988 -10.065 5.517 1.00 0.00 N ATOM 1400 CA ALA A 91 -7.036 -10.683 4.603 1.00 0.00 C ATOM 1401 C ALA A 91 -7.566 -10.678 3.173 1.00 0.00 C ATOM 1402 O ALA A 91 -8.772 -10.572 2.948 1.00 0.00 O ATOM 1403 CB ALA A 91 -6.724 -12.105 5.047 1.00 0.00 C ATOM 0 H ALA A 91 -8.846 -10.599 5.657 1.00 0.00 H new ATOM 0 HA ALA A 91 -6.117 -10.098 4.625 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -6.012 -12.554 4.355 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.295 -12.087 6.049 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.642 -12.693 5.056 1.00 0.00 H new ATOM 1409 N PHE A 92 -6.658 -10.794 2.210 1.00 0.00 N ATOM 1410 CA PHE A 92 -7.035 -10.800 0.801 1.00 0.00 C ATOM 1411 C PHE A 92 -6.238 -11.849 0.030 1.00 0.00 C ATOM 1412 O PHE A 92 -5.168 -12.275 0.466 1.00 0.00 O ATOM 1413 CB PHE A 92 -6.810 -9.418 0.184 1.00 0.00 C ATOM 1414 CG PHE A 92 -7.367 -8.295 1.012 1.00 0.00 C ATOM 1415 CD1 PHE A 92 -6.877 -8.044 2.283 1.00 0.00 C ATOM 1416 CD2 PHE A 92 -8.381 -7.490 0.518 1.00 0.00 C ATOM 1417 CE1 PHE A 92 -7.388 -7.012 3.046 1.00 0.00 C ATOM 1418 CE2 PHE A 92 -8.897 -6.456 1.276 1.00 0.00 C ATOM 1419 CZ PHE A 92 -8.399 -6.216 2.542 1.00 0.00 C ATOM 0 H PHE A 92 -5.656 -10.885 2.379 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.094 -11.051 0.735 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.740 -9.261 0.045 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.267 -9.391 -0.805 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.086 -8.662 2.682 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -8.773 -7.673 -0.472 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.998 -6.827 4.036 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -9.688 -5.837 0.879 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.799 -5.408 3.137 1.00 0.00 H new ATOM 1429 N ARG A 93 -6.768 -12.261 -1.117 1.00 0.00 N ATOM 1430 CA ARG A 93 -6.108 -13.260 -1.948 1.00 0.00 C ATOM 1431 C ARG A 93 -4.614 -12.972 -2.063 1.00 0.00 C ATOM 1432 O ARG A 93 -3.781 -13.804 -1.707 1.00 0.00 O ATOM 1433 CB ARG A 93 -6.740 -13.295 -3.341 1.00 0.00 C ATOM 1434 CG ARG A 93 -8.213 -13.670 -3.331 1.00 0.00 C ATOM 1435 CD ARG A 93 -9.097 -12.452 -3.112 1.00 0.00 C ATOM 1436 NE ARG A 93 -10.361 -12.555 -3.836 1.00 0.00 N ATOM 1437 CZ ARG A 93 -10.447 -12.620 -5.160 1.00 0.00 C ATOM 1438 NH1 ARG A 93 -9.347 -12.593 -5.900 1.00 0.00 N ATOM 1439 NH2 ARG A 93 -11.634 -12.713 -5.745 1.00 0.00 N ATOM 0 H ARG A 93 -7.653 -11.918 -1.492 1.00 0.00 H new ATOM 0 HA ARG A 93 -6.237 -14.233 -1.473 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.626 -12.316 -3.807 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -6.196 -14.009 -3.960 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.475 -14.146 -4.276 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -8.398 -14.401 -2.544 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -9.298 -12.337 -2.047 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -8.566 -11.556 -3.435 1.00 0.00 H new ATOM 0 HE ARG A 93 -11.226 -12.578 -3.295 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.433 -12.522 -5.453 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -9.415 -12.643 -6.917 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -12.482 -12.735 -5.178 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -11.699 -12.763 -6.762 1.00 0.00 H new ATOM 1453 N GLY A 94 -4.283 -11.786 -2.565 1.00 0.00 N ATOM 1454 CA GLY A 94 -2.890 -11.408 -2.719 1.00 0.00 C ATOM 1455 C GLY A 94 -2.655 -9.936 -2.449 1.00 0.00 C ATOM 1456 O GLY A 94 -3.588 -9.199 -2.127 1.00 0.00 O ATOM 0 H GLY A 94 -4.954 -11.080 -2.868 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -2.279 -12.001 -2.039 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -2.562 -11.645 -3.731 1.00 0.00 H new ATOM 1460 N LEU A 95 -1.405 -9.504 -2.578 1.00 0.00 N ATOM 1461 CA LEU A 95 -1.049 -8.109 -2.344 1.00 0.00 C ATOM 1462 C LEU A 95 -1.984 -7.174 -3.104 1.00 0.00 C ATOM 1463 O LEU A 95 -2.668 -6.341 -2.507 1.00 0.00 O ATOM 1464 CB LEU A 95 0.399 -7.854 -2.766 1.00 0.00 C ATOM 1465 CG LEU A 95 1.466 -8.135 -1.707 1.00 0.00 C ATOM 1466 CD1 LEU A 95 1.579 -6.968 -0.740 1.00 0.00 C ATOM 1467 CD2 LEU A 95 1.148 -9.422 -0.959 1.00 0.00 C ATOM 0 H LEU A 95 -0.621 -10.100 -2.843 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.151 -7.907 -1.278 1.00 0.00 H new ATOM 0 HB2 LEU A 95 0.614 -8.466 -3.642 1.00 0.00 H new ATOM 0 HB3 LEU A 95 0.488 -6.813 -3.076 1.00 0.00 H new ATOM 0 HG LEU A 95 2.426 -8.257 -2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 95 2.343 -7.186 0.006 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.854 -6.067 -1.288 1.00 0.00 H new ATOM 0 HD13 LEU A 95 0.621 -6.813 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 95 1.917 -9.607 -0.209 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.179 -9.328 -0.469 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.120 -10.254 -1.662 1.00 0.00 H new ATOM 1479 N THR A 96 -2.012 -7.317 -4.425 1.00 0.00 N ATOM 1480 CA THR A 96 -2.864 -6.487 -5.267 1.00 0.00 C ATOM 1481 C THR A 96 -4.156 -6.118 -4.547 1.00 0.00 C ATOM 1482 O THR A 96 -4.558 -4.955 -4.533 1.00 0.00 O ATOM 1483 CB THR A 96 -3.211 -7.197 -6.589 1.00 0.00 C ATOM 1484 OG1 THR A 96 -2.023 -7.727 -7.187 1.00 0.00 O ATOM 1485 CG2 THR A 96 -3.887 -6.238 -7.557 1.00 0.00 C ATOM 0 H THR A 96 -1.453 -8.001 -4.935 1.00 0.00 H new ATOM 0 HA THR A 96 -2.302 -5.579 -5.488 1.00 0.00 H new ATOM 0 HB THR A 96 -3.901 -8.012 -6.368 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.252 -8.178 -8.026 1.00 0.00 H new ATOM 0 HG21 THR A 96 -4.123 -6.762 -8.483 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.806 -5.859 -7.111 1.00 0.00 H new ATOM 0 HG23 THR A 96 -3.217 -5.405 -7.771 1.00 0.00 H new ATOM 1493 N GLU A 97 -4.800 -7.115 -3.949 1.00 0.00 N ATOM 1494 CA GLU A 97 -6.048 -6.893 -3.228 1.00 0.00 C ATOM 1495 C GLU A 97 -5.794 -6.154 -1.917 1.00 0.00 C ATOM 1496 O GLU A 97 -6.298 -5.050 -1.706 1.00 0.00 O ATOM 1497 CB GLU A 97 -6.745 -8.226 -2.947 1.00 0.00 C ATOM 1498 CG GLU A 97 -7.060 -9.024 -4.201 1.00 0.00 C ATOM 1499 CD GLU A 97 -8.061 -8.325 -5.101 1.00 0.00 C ATOM 1500 OE1 GLU A 97 -8.983 -7.673 -4.567 1.00 0.00 O ATOM 1501 OE2 GLU A 97 -7.923 -8.429 -6.337 1.00 0.00 O ATOM 0 H GLU A 97 -4.479 -8.083 -3.949 1.00 0.00 H new ATOM 0 HA GLU A 97 -6.695 -6.278 -3.854 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -6.112 -8.827 -2.294 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -7.672 -8.035 -2.406 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -6.139 -9.200 -4.756 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.452 -10.000 -3.917 1.00 0.00 H new ATOM 1508 N LEU A 98 -5.009 -6.770 -1.040 1.00 0.00 N ATOM 1509 CA LEU A 98 -4.688 -6.172 0.251 1.00 0.00 C ATOM 1510 C LEU A 98 -4.419 -4.677 0.107 1.00 0.00 C ATOM 1511 O LEU A 98 -4.974 -3.862 0.845 1.00 0.00 O ATOM 1512 CB LEU A 98 -3.470 -6.863 0.867 1.00 0.00 C ATOM 1513 CG LEU A 98 -3.072 -6.399 2.269 1.00 0.00 C ATOM 1514 CD1 LEU A 98 -2.072 -5.256 2.188 1.00 0.00 C ATOM 1515 CD2 LEU A 98 -4.302 -5.980 3.061 1.00 0.00 C ATOM 0 H LEU A 98 -4.583 -7.683 -1.199 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.546 -6.307 0.909 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.665 -7.935 0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -2.619 -6.716 0.202 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.598 -7.233 2.787 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.800 -4.939 3.195 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -1.179 -5.590 1.659 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -2.519 -4.419 1.652 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -4.000 -5.653 4.056 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -4.804 -5.161 2.547 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.984 -6.826 3.149 1.00 0.00 H new ATOM 1527 N VAL A 99 -3.567 -4.324 -0.849 1.00 0.00 N ATOM 1528 CA VAL A 99 -3.227 -2.927 -1.093 1.00 0.00 C ATOM 1529 C VAL A 99 -4.443 -2.141 -1.569 1.00 0.00 C ATOM 1530 O VAL A 99 -4.673 -1.012 -1.135 1.00 0.00 O ATOM 1531 CB VAL A 99 -2.103 -2.797 -2.138 1.00 0.00 C ATOM 1532 CG1 VAL A 99 -1.736 -1.336 -2.348 1.00 0.00 C ATOM 1533 CG2 VAL A 99 -0.887 -3.606 -1.716 1.00 0.00 C ATOM 0 H VAL A 99 -3.099 -4.986 -1.468 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.880 -2.515 -0.145 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.464 -3.196 -3.086 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.940 -1.264 -3.090 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.610 -0.788 -2.699 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.394 -0.908 -1.406 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.103 -3.502 -2.466 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.522 -3.240 -0.756 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.163 -4.656 -1.623 1.00 0.00 H new ATOM 1543 N GLU A 100 -5.219 -2.745 -2.463 1.00 0.00 N ATOM 1544 CA GLU A 100 -6.412 -2.100 -2.999 1.00 0.00 C ATOM 1545 C GLU A 100 -7.305 -1.587 -1.873 1.00 0.00 C ATOM 1546 O GLU A 100 -7.940 -0.540 -1.997 1.00 0.00 O ATOM 1547 CB GLU A 100 -7.194 -3.076 -3.880 1.00 0.00 C ATOM 1548 CG GLU A 100 -6.826 -2.996 -5.352 1.00 0.00 C ATOM 1549 CD GLU A 100 -7.991 -3.329 -6.264 1.00 0.00 C ATOM 1550 OE1 GLU A 100 -9.151 -3.168 -5.829 1.00 0.00 O ATOM 1551 OE2 GLU A 100 -7.743 -3.751 -7.413 1.00 0.00 O ATOM 0 H GLU A 100 -5.043 -3.680 -2.831 1.00 0.00 H new ATOM 0 HA GLU A 100 -6.094 -1.251 -3.604 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -7.020 -4.092 -3.525 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -8.260 -2.878 -3.769 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -6.467 -1.992 -5.579 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -6.003 -3.682 -5.555 1.00 0.00 H new ATOM 1558 N PHE A 101 -7.348 -2.333 -0.774 1.00 0.00 N ATOM 1559 CA PHE A 101 -8.164 -1.956 0.375 1.00 0.00 C ATOM 1560 C PHE A 101 -7.534 -0.788 1.129 1.00 0.00 C ATOM 1561 O PHE A 101 -8.150 0.266 1.290 1.00 0.00 O ATOM 1562 CB PHE A 101 -8.341 -3.149 1.315 1.00 0.00 C ATOM 1563 CG PHE A 101 -9.462 -2.975 2.301 1.00 0.00 C ATOM 1564 CD1 PHE A 101 -10.782 -3.086 1.896 1.00 0.00 C ATOM 1565 CD2 PHE A 101 -9.194 -2.699 3.632 1.00 0.00 C ATOM 1566 CE1 PHE A 101 -11.815 -2.926 2.800 1.00 0.00 C ATOM 1567 CE2 PHE A 101 -10.223 -2.538 4.541 1.00 0.00 C ATOM 1568 CZ PHE A 101 -11.535 -2.651 4.124 1.00 0.00 C ATOM 0 H PHE A 101 -6.828 -3.202 -0.655 1.00 0.00 H new ATOM 0 HA PHE A 101 -9.142 -1.644 0.008 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.526 -4.045 0.722 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -7.411 -3.313 1.860 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -11.007 -3.300 0.862 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -8.170 -2.609 3.963 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -12.840 -3.016 2.471 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -10.001 -2.324 5.576 1.00 0.00 H new ATOM 0 HZ PHE A 101 -12.340 -2.524 4.832 1.00 0.00 H new ATOM 1578 N TYR A 102 -6.304 -0.985 1.590 1.00 0.00 N ATOM 1579 CA TYR A 102 -5.591 0.049 2.330 1.00 0.00 C ATOM 1580 C TYR A 102 -5.520 1.344 1.526 1.00 0.00 C ATOM 1581 O TYR A 102 -5.160 2.396 2.054 1.00 0.00 O ATOM 1582 CB TYR A 102 -4.179 -0.425 2.680 1.00 0.00 C ATOM 1583 CG TYR A 102 -4.154 -1.598 3.634 1.00 0.00 C ATOM 1584 CD1 TYR A 102 -5.200 -1.820 4.521 1.00 0.00 C ATOM 1585 CD2 TYR A 102 -3.084 -2.484 3.649 1.00 0.00 C ATOM 1586 CE1 TYR A 102 -5.181 -2.890 5.395 1.00 0.00 C ATOM 1587 CE2 TYR A 102 -3.056 -3.557 4.519 1.00 0.00 C ATOM 1588 CZ TYR A 102 -4.107 -3.755 5.390 1.00 0.00 C ATOM 1589 OH TYR A 102 -4.084 -4.822 6.258 1.00 0.00 O ATOM 0 H TYR A 102 -5.780 -1.851 1.464 1.00 0.00 H new ATOM 0 HA TYR A 102 -6.140 0.244 3.251 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -3.660 -0.702 1.763 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -3.625 0.404 3.121 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -6.043 -1.144 4.527 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -2.259 -2.331 2.968 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -6.002 -3.048 6.078 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -2.216 -4.236 4.517 1.00 0.00 H new ATOM 0 HH TYR A 102 -4.857 -5.400 6.087 1.00 0.00 H new ATOM 1599 N GLN A 103 -5.865 1.257 0.246 1.00 0.00 N ATOM 1600 CA GLN A 103 -5.841 2.421 -0.632 1.00 0.00 C ATOM 1601 C GLN A 103 -7.002 3.360 -0.324 1.00 0.00 C ATOM 1602 O GLN A 103 -6.948 4.550 -0.633 1.00 0.00 O ATOM 1603 CB GLN A 103 -5.899 1.983 -2.097 1.00 0.00 C ATOM 1604 CG GLN A 103 -4.540 1.629 -2.680 1.00 0.00 C ATOM 1605 CD GLN A 103 -4.636 1.073 -4.087 1.00 0.00 C ATOM 1606 OE1 GLN A 103 -5.593 1.349 -4.812 1.00 0.00 O ATOM 1607 NE2 GLN A 103 -3.643 0.285 -4.482 1.00 0.00 N ATOM 0 H GLN A 103 -6.164 0.393 -0.206 1.00 0.00 H new ATOM 0 HA GLN A 103 -4.908 2.957 -0.457 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -6.558 1.119 -2.184 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -6.342 2.783 -2.690 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -3.909 2.518 -2.687 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -4.052 0.897 -2.036 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -2.870 0.083 -3.849 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -3.654 -0.118 -5.419 1.00 0.00 H new ATOM 1616 N GLN A 104 -8.050 2.817 0.286 1.00 0.00 N ATOM 1617 CA GLN A 104 -9.225 3.607 0.635 1.00 0.00 C ATOM 1618 C GLN A 104 -9.402 3.680 2.148 1.00 0.00 C ATOM 1619 O GLN A 104 -10.233 4.436 2.649 1.00 0.00 O ATOM 1620 CB GLN A 104 -10.477 3.009 -0.009 1.00 0.00 C ATOM 1621 CG GLN A 104 -10.926 1.705 0.629 1.00 0.00 C ATOM 1622 CD GLN A 104 -11.797 0.874 -0.292 1.00 0.00 C ATOM 1623 OE1 GLN A 104 -11.690 0.964 -1.516 1.00 0.00 O ATOM 1624 NE2 GLN A 104 -12.667 0.058 0.292 1.00 0.00 N ATOM 0 H GLN A 104 -8.110 1.833 0.549 1.00 0.00 H new ATOM 0 HA GLN A 104 -9.078 4.618 0.256 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -11.289 3.733 0.054 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -10.284 2.838 -1.068 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -10.049 1.124 0.915 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -11.476 1.923 1.544 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -12.722 0.015 1.310 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -13.280 -0.526 -0.277 1.00 0.00 H new ATOM 1633 N ASN A 105 -8.616 2.888 2.870 1.00 0.00 N ATOM 1634 CA ASN A 105 -8.687 2.862 4.326 1.00 0.00 C ATOM 1635 C ASN A 105 -7.309 3.087 4.942 1.00 0.00 C ATOM 1636 O ASN A 105 -6.384 2.306 4.722 1.00 0.00 O ATOM 1637 CB ASN A 105 -9.261 1.528 4.806 1.00 0.00 C ATOM 1638 CG ASN A 105 -9.060 0.415 3.796 1.00 0.00 C ATOM 1639 OD1 ASN A 105 -8.082 -0.330 3.863 1.00 0.00 O ATOM 1640 ND2 ASN A 105 -9.987 0.299 2.852 1.00 0.00 N ATOM 0 H ASN A 105 -7.923 2.256 2.470 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.345 3.669 4.647 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -8.788 1.250 5.748 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -10.326 1.645 5.006 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -9.905 -0.430 2.144 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -10.781 0.939 2.835 1.00 0.00 H new ATOM 1647 N SER A 106 -7.181 4.161 5.716 1.00 0.00 N ATOM 1648 CA SER A 106 -5.916 4.491 6.362 1.00 0.00 C ATOM 1649 C SER A 106 -5.311 3.261 7.032 1.00 0.00 C ATOM 1650 O SER A 106 -6.030 2.369 7.485 1.00 0.00 O ATOM 1651 CB SER A 106 -6.121 5.600 7.396 1.00 0.00 C ATOM 1652 OG SER A 106 -4.905 5.918 8.050 1.00 0.00 O ATOM 0 H SER A 106 -7.938 4.817 5.911 1.00 0.00 H new ATOM 0 HA SER A 106 -5.226 4.842 5.595 1.00 0.00 H new ATOM 0 HB2 SER A 106 -6.518 6.489 6.906 1.00 0.00 H new ATOM 0 HB3 SER A 106 -6.861 5.284 8.131 1.00 0.00 H new ATOM 0 HG SER A 106 -4.155 5.770 7.437 1.00 0.00 H new ATOM 1658 N LEU A 107 -3.985 3.220 7.091 1.00 0.00 N ATOM 1659 CA LEU A 107 -3.281 2.100 7.706 1.00 0.00 C ATOM 1660 C LEU A 107 -3.341 2.188 9.228 1.00 0.00 C ATOM 1661 O LEU A 107 -2.990 1.239 9.930 1.00 0.00 O ATOM 1662 CB LEU A 107 -1.823 2.073 7.243 1.00 0.00 C ATOM 1663 CG LEU A 107 -1.579 1.565 5.822 1.00 0.00 C ATOM 1664 CD1 LEU A 107 -1.615 0.045 5.785 1.00 0.00 C ATOM 1665 CD2 LEU A 107 -2.608 2.147 4.864 1.00 0.00 C ATOM 0 H LEU A 107 -3.375 3.949 6.721 1.00 0.00 H new ATOM 0 HA LEU A 107 -3.773 1.179 7.394 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -1.419 3.083 7.321 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -1.255 1.449 7.933 1.00 0.00 H new ATOM 0 HG LEU A 107 -0.589 1.893 5.505 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -1.439 -0.298 4.766 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -0.841 -0.353 6.441 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -2.591 -0.304 6.122 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -2.419 1.775 3.857 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -3.608 1.849 5.179 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -2.535 3.235 4.868 1.00 0.00 H new ATOM 1677 N LYS A 108 -3.791 3.332 9.732 1.00 0.00 N ATOM 1678 CA LYS A 108 -3.903 3.543 11.170 1.00 0.00 C ATOM 1679 C LYS A 108 -4.490 2.315 11.857 1.00 0.00 C ATOM 1680 O LYS A 108 -4.228 2.065 13.034 1.00 0.00 O ATOM 1681 CB LYS A 108 -4.773 4.768 11.460 1.00 0.00 C ATOM 1682 CG LYS A 108 -6.263 4.470 11.456 1.00 0.00 C ATOM 1683 CD LYS A 108 -7.073 5.672 11.912 1.00 0.00 C ATOM 1684 CE LYS A 108 -8.535 5.543 11.512 1.00 0.00 C ATOM 1685 NZ LYS A 108 -9.385 6.565 12.182 1.00 0.00 N ATOM 0 H LYS A 108 -4.084 4.128 9.165 1.00 0.00 H new ATOM 0 HA LYS A 108 -2.902 3.714 11.566 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -4.496 5.179 12.431 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -4.563 5.537 10.717 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -6.574 4.180 10.453 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -6.467 3.623 12.111 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -6.998 5.773 12.995 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -6.655 6.580 11.478 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -8.626 5.647 10.431 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -8.895 4.547 11.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -10.374 6.444 11.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -9.318 6.450 13.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -9.058 7.516 11.918 1.00 0.00 H new ATOM 1699 N ASP A 109 -5.283 1.550 11.115 1.00 0.00 N ATOM 1700 CA ASP A 109 -5.906 0.346 11.652 1.00 0.00 C ATOM 1701 C ASP A 109 -4.878 -0.523 12.371 1.00 0.00 C ATOM 1702 O ASP A 109 -5.165 -1.103 13.418 1.00 0.00 O ATOM 1703 CB ASP A 109 -6.572 -0.453 10.531 1.00 0.00 C ATOM 1704 CG ASP A 109 -7.875 0.172 10.071 1.00 0.00 C ATOM 1705 OD1 ASP A 109 -7.863 1.364 9.700 1.00 0.00 O ATOM 1706 OD2 ASP A 109 -8.906 -0.532 10.081 1.00 0.00 O ATOM 0 H ASP A 109 -5.510 1.742 10.139 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.666 0.650 12.372 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.889 -0.526 9.685 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.762 -1.469 10.876 1.00 0.00 H new ATOM 1711 N CYS A 110 -3.681 -0.608 11.801 1.00 0.00 N ATOM 1712 CA CYS A 110 -2.610 -1.407 12.386 1.00 0.00 C ATOM 1713 C CYS A 110 -1.653 -0.531 13.186 1.00 0.00 C ATOM 1714 O CYS A 110 -1.090 -0.965 14.192 1.00 0.00 O ATOM 1715 CB CYS A 110 -1.845 -2.152 11.291 1.00 0.00 C ATOM 1716 SG CYS A 110 -0.757 -3.457 11.908 1.00 0.00 S ATOM 0 H CYS A 110 -3.428 -0.133 10.934 1.00 0.00 H new ATOM 0 HA CYS A 110 -3.060 -2.133 13.063 1.00 0.00 H new ATOM 0 HB2 CYS A 110 -2.561 -2.590 10.596 1.00 0.00 H new ATOM 0 HB3 CYS A 110 -1.250 -1.435 10.726 1.00 0.00 H new ATOM 0 HG CYS A 110 0.481 -3.072 11.811 1.00 0.00 H new ATOM 1722 N PHE A 111 -1.470 0.705 12.733 1.00 0.00 N ATOM 1723 CA PHE A 111 -0.578 1.642 13.405 1.00 0.00 C ATOM 1724 C PHE A 111 -1.245 3.005 13.570 1.00 0.00 C ATOM 1725 O PHE A 111 -1.076 3.897 12.738 1.00 0.00 O ATOM 1726 CB PHE A 111 0.726 1.792 12.619 1.00 0.00 C ATOM 1727 CG PHE A 111 1.492 0.507 12.478 1.00 0.00 C ATOM 1728 CD1 PHE A 111 2.352 0.085 13.479 1.00 0.00 C ATOM 1729 CD2 PHE A 111 1.351 -0.278 11.345 1.00 0.00 C ATOM 1730 CE1 PHE A 111 3.058 -1.096 13.351 1.00 0.00 C ATOM 1731 CE2 PHE A 111 2.054 -1.460 11.212 1.00 0.00 C ATOM 1732 CZ PHE A 111 2.908 -1.870 12.217 1.00 0.00 C ATOM 0 H PHE A 111 -1.928 1.081 11.903 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.354 1.244 14.395 1.00 0.00 H new ATOM 0 HB2 PHE A 111 0.500 2.182 11.626 1.00 0.00 H new ATOM 0 HB3 PHE A 111 1.357 2.529 13.115 1.00 0.00 H new ATOM 0 HD1 PHE A 111 2.472 0.685 14.369 1.00 0.00 H new ATOM 0 HD2 PHE A 111 0.684 0.038 10.557 1.00 0.00 H new ATOM 0 HE1 PHE A 111 3.727 -1.414 14.137 1.00 0.00 H new ATOM 0 HE2 PHE A 111 1.936 -2.062 10.323 1.00 0.00 H new ATOM 0 HZ PHE A 111 3.458 -2.794 12.116 1.00 0.00 H new ATOM 1742 N LYS A 112 -2.005 3.158 14.649 1.00 0.00 N ATOM 1743 CA LYS A 112 -2.698 4.411 14.926 1.00 0.00 C ATOM 1744 C LYS A 112 -1.768 5.603 14.722 1.00 0.00 C ATOM 1745 O LYS A 112 -2.215 6.699 14.382 1.00 0.00 O ATOM 1746 CB LYS A 112 -3.239 4.413 16.357 1.00 0.00 C ATOM 1747 CG LYS A 112 -2.177 4.677 17.410 1.00 0.00 C ATOM 1748 CD LYS A 112 -2.751 5.411 18.610 1.00 0.00 C ATOM 1749 CE LYS A 112 -1.682 6.212 19.337 1.00 0.00 C ATOM 1750 NZ LYS A 112 -1.265 7.413 18.562 1.00 0.00 N ATOM 0 H LYS A 112 -2.157 2.429 15.347 1.00 0.00 H new ATOM 0 HA LYS A 112 -3.531 4.498 14.229 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -4.018 5.171 16.441 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -3.708 3.450 16.560 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -1.742 3.732 17.735 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -1.370 5.266 16.974 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -3.548 6.079 18.282 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -3.199 4.693 19.297 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -2.060 6.522 20.311 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -0.814 5.578 19.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -0.767 8.076 19.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -0.631 7.125 17.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -2.106 7.879 18.164 1.00 0.00 H new ATOM 1764 N SER A 113 -0.474 5.382 14.930 1.00 0.00 N ATOM 1765 CA SER A 113 0.517 6.439 14.770 1.00 0.00 C ATOM 1766 C SER A 113 0.733 6.763 13.295 1.00 0.00 C ATOM 1767 O SER A 113 0.987 7.912 12.930 1.00 0.00 O ATOM 1768 CB SER A 113 1.843 6.025 15.413 1.00 0.00 C ATOM 1769 OG SER A 113 2.524 5.076 14.611 1.00 0.00 O ATOM 0 H SER A 113 -0.088 4.480 15.210 1.00 0.00 H new ATOM 0 HA SER A 113 0.143 7.333 15.269 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.472 6.904 15.555 1.00 0.00 H new ATOM 0 HB3 SER A 113 1.656 5.604 16.401 1.00 0.00 H new ATOM 0 HG SER A 113 3.369 4.829 15.042 1.00 0.00 H new ATOM 1775 N LEU A 114 0.631 5.743 12.451 1.00 0.00 N ATOM 1776 CA LEU A 114 0.815 5.917 11.014 1.00 0.00 C ATOM 1777 C LEU A 114 -0.530 6.014 10.301 1.00 0.00 C ATOM 1778 O LEU A 114 -1.117 5.000 9.923 1.00 0.00 O ATOM 1779 CB LEU A 114 1.628 4.756 10.439 1.00 0.00 C ATOM 1780 CG LEU A 114 1.906 4.810 8.937 1.00 0.00 C ATOM 1781 CD1 LEU A 114 2.351 6.205 8.526 1.00 0.00 C ATOM 1782 CD2 LEU A 114 2.956 3.778 8.551 1.00 0.00 C ATOM 0 H LEU A 114 0.422 4.786 12.736 1.00 0.00 H new ATOM 0 HA LEU A 114 1.359 6.848 10.852 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.583 4.712 10.963 1.00 0.00 H new ATOM 0 HB3 LEU A 114 1.102 3.827 10.658 1.00 0.00 H new ATOM 0 HG LEU A 114 0.983 4.575 8.408 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.544 6.224 7.453 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.567 6.923 8.766 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.262 6.470 9.064 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.141 3.831 7.478 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.882 3.982 9.089 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.598 2.781 8.809 1.00 0.00 H new ATOM 1794 N ASP A 115 -1.010 7.239 10.117 1.00 0.00 N ATOM 1795 CA ASP A 115 -2.284 7.468 9.446 1.00 0.00 C ATOM 1796 C ASP A 115 -2.066 7.862 7.988 1.00 0.00 C ATOM 1797 O ASP A 115 -2.168 9.036 7.629 1.00 0.00 O ATOM 1798 CB ASP A 115 -3.077 8.558 10.169 1.00 0.00 C ATOM 1799 CG ASP A 115 -2.180 9.544 10.891 1.00 0.00 C ATOM 1800 OD1 ASP A 115 -1.045 9.770 10.419 1.00 0.00 O ATOM 1801 OD2 ASP A 115 -2.612 10.090 11.927 1.00 0.00 O ATOM 0 H ASP A 115 -0.536 8.089 10.423 1.00 0.00 H new ATOM 0 HA ASP A 115 -2.853 6.539 9.472 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -3.694 9.094 9.447 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -3.755 8.095 10.886 1.00 0.00 H new ATOM 1806 N THR A 116 -1.766 6.873 7.152 1.00 0.00 N ATOM 1807 CA THR A 116 -1.532 7.116 5.734 1.00 0.00 C ATOM 1808 C THR A 116 -2.337 6.152 4.870 1.00 0.00 C ATOM 1809 O THR A 116 -3.112 5.343 5.381 1.00 0.00 O ATOM 1810 CB THR A 116 -0.039 6.981 5.379 1.00 0.00 C ATOM 1811 OG1 THR A 116 0.186 7.414 4.033 1.00 0.00 O ATOM 1812 CG2 THR A 116 0.427 5.542 5.539 1.00 0.00 C ATOM 0 H THR A 116 -1.679 5.896 7.433 1.00 0.00 H new ATOM 0 HA THR A 116 -1.855 8.137 5.532 1.00 0.00 H new ATOM 0 HB THR A 116 0.532 7.609 6.062 1.00 0.00 H new ATOM 0 HG1 THR A 116 0.251 8.392 4.010 1.00 0.00 H new ATOM 0 HG21 THR A 116 1.484 5.471 5.283 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.282 5.225 6.572 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.151 4.897 4.877 1.00 0.00 H new ATOM 1820 N THR A 117 -2.149 6.242 3.557 1.00 0.00 N ATOM 1821 CA THR A 117 -2.858 5.378 2.623 1.00 0.00 C ATOM 1822 C THR A 117 -2.060 5.185 1.338 1.00 0.00 C ATOM 1823 O THR A 117 -1.313 6.071 0.920 1.00 0.00 O ATOM 1824 CB THR A 117 -4.245 5.948 2.271 1.00 0.00 C ATOM 1825 OG1 THR A 117 -4.174 7.374 2.162 1.00 0.00 O ATOM 1826 CG2 THR A 117 -5.271 5.565 3.327 1.00 0.00 C ATOM 0 H THR A 117 -1.511 6.905 3.117 1.00 0.00 H new ATOM 0 HA THR A 117 -2.984 4.415 3.118 1.00 0.00 H new ATOM 0 HB THR A 117 -4.556 5.526 1.315 1.00 0.00 H new ATOM 0 HG1 THR A 117 -5.059 7.729 1.936 1.00 0.00 H new ATOM 0 HG21 THR A 117 -6.243 5.979 3.057 1.00 0.00 H new ATOM 0 HG22 THR A 117 -5.343 4.479 3.387 1.00 0.00 H new ATOM 0 HG23 THR A 117 -4.963 5.963 4.294 1.00 0.00 H new ATOM 1834 N LEU A 118 -2.222 4.023 0.715 1.00 0.00 N ATOM 1835 CA LEU A 118 -1.517 3.715 -0.524 1.00 0.00 C ATOM 1836 C LEU A 118 -1.936 4.666 -1.641 1.00 0.00 C ATOM 1837 O LEU A 118 -2.894 4.403 -2.366 1.00 0.00 O ATOM 1838 CB LEU A 118 -1.789 2.268 -0.943 1.00 0.00 C ATOM 1839 CG LEU A 118 -1.303 1.188 0.024 1.00 0.00 C ATOM 1840 CD1 LEU A 118 0.174 1.374 0.334 1.00 0.00 C ATOM 1841 CD2 LEU A 118 -2.126 1.208 1.304 1.00 0.00 C ATOM 0 H LEU A 118 -2.835 3.279 1.047 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.449 3.841 -0.346 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.863 2.147 -1.082 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.321 2.097 -1.912 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.433 0.216 -0.452 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.502 0.596 1.024 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.751 1.307 -0.589 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.330 2.352 0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.766 0.433 1.980 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -2.029 2.182 1.784 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.174 1.024 1.066 1.00 0.00 H new ATOM 1853 N GLN A 119 -1.209 5.771 -1.773 1.00 0.00 N ATOM 1854 CA GLN A 119 -1.504 6.760 -2.802 1.00 0.00 C ATOM 1855 C GLN A 119 -1.079 6.259 -4.178 1.00 0.00 C ATOM 1856 O GLN A 119 -1.916 5.907 -5.009 1.00 0.00 O ATOM 1857 CB GLN A 119 -0.800 8.081 -2.487 1.00 0.00 C ATOM 1858 CG GLN A 119 -0.908 8.496 -1.029 1.00 0.00 C ATOM 1859 CD GLN A 119 -0.958 10.001 -0.852 1.00 0.00 C ATOM 1860 OE1 GLN A 119 -0.848 10.755 -1.820 1.00 0.00 O ATOM 1861 NE2 GLN A 119 -1.126 10.446 0.387 1.00 0.00 N ATOM 0 H GLN A 119 -0.412 6.003 -1.180 1.00 0.00 H new ATOM 0 HA GLN A 119 -2.581 6.924 -2.813 1.00 0.00 H new ATOM 0 HB2 GLN A 119 0.253 7.994 -2.754 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -1.224 8.867 -3.112 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -1.804 8.053 -0.595 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -0.056 8.097 -0.478 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -1.213 9.785 1.159 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -1.169 11.449 0.567 1.00 0.00 H new ATOM 1870 N PHE A 120 0.229 6.229 -4.413 1.00 0.00 N ATOM 1871 CA PHE A 120 0.767 5.771 -5.689 1.00 0.00 C ATOM 1872 C PHE A 120 2.047 4.968 -5.483 1.00 0.00 C ATOM 1873 O PHE A 120 2.791 5.172 -4.524 1.00 0.00 O ATOM 1874 CB PHE A 120 1.042 6.964 -6.608 1.00 0.00 C ATOM 1875 CG PHE A 120 0.143 8.139 -6.349 1.00 0.00 C ATOM 1876 CD1 PHE A 120 -1.197 8.094 -6.696 1.00 0.00 C ATOM 1877 CD2 PHE A 120 0.640 9.291 -5.759 1.00 0.00 C ATOM 1878 CE1 PHE A 120 -2.026 9.174 -6.459 1.00 0.00 C ATOM 1879 CE2 PHE A 120 -0.184 10.373 -5.519 1.00 0.00 C ATOM 1880 CZ PHE A 120 -1.519 10.316 -5.870 1.00 0.00 C ATOM 0 H PHE A 120 0.936 6.516 -3.736 1.00 0.00 H new ATOM 0 HA PHE A 120 0.025 5.124 -6.157 1.00 0.00 H new ATOM 0 HB2 PHE A 120 2.079 7.276 -6.485 1.00 0.00 H new ATOM 0 HB3 PHE A 120 0.925 6.649 -7.645 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.599 7.204 -7.157 1.00 0.00 H new ATOM 0 HD2 PHE A 120 1.683 9.343 -5.484 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -3.069 9.125 -6.734 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.215 11.264 -5.057 1.00 0.00 H new ATOM 0 HZ PHE A 120 -2.164 11.162 -5.684 1.00 0.00 H new ATOM 1890 N PRO A 121 2.311 4.029 -6.405 1.00 0.00 N ATOM 1891 CA PRO A 121 3.501 3.176 -6.347 1.00 0.00 C ATOM 1892 C PRO A 121 4.785 3.950 -6.626 1.00 0.00 C ATOM 1893 O PRO A 121 4.748 5.062 -7.154 1.00 0.00 O ATOM 1894 CB PRO A 121 3.250 2.142 -7.448 1.00 0.00 C ATOM 1895 CG PRO A 121 2.334 2.823 -8.405 1.00 0.00 C ATOM 1896 CD PRO A 121 1.468 3.731 -7.575 1.00 0.00 C ATOM 0 HA PRO A 121 3.642 2.741 -5.358 1.00 0.00 H new ATOM 0 HB2 PRO A 121 4.180 1.846 -7.933 1.00 0.00 H new ATOM 0 HB3 PRO A 121 2.799 1.236 -7.045 1.00 0.00 H new ATOM 0 HG2 PRO A 121 2.896 3.391 -9.147 1.00 0.00 H new ATOM 0 HG3 PRO A 121 1.729 2.098 -8.950 1.00 0.00 H new ATOM 0 HD2 PRO A 121 1.199 4.637 -8.118 1.00 0.00 H new ATOM 0 HD3 PRO A 121 0.536 3.244 -7.286 1.00 0.00 H new ATOM 1904 N PHE A 122 5.918 3.356 -6.268 1.00 0.00 N ATOM 1905 CA PHE A 122 7.214 3.991 -6.479 1.00 0.00 C ATOM 1906 C PHE A 122 7.625 3.913 -7.947 1.00 0.00 C ATOM 1907 O PHE A 122 8.258 4.827 -8.476 1.00 0.00 O ATOM 1908 CB PHE A 122 8.279 3.329 -5.603 1.00 0.00 C ATOM 1909 CG PHE A 122 8.752 2.005 -6.132 1.00 0.00 C ATOM 1910 CD1 PHE A 122 7.969 0.870 -5.996 1.00 0.00 C ATOM 1911 CD2 PHE A 122 9.979 1.895 -6.767 1.00 0.00 C ATOM 1912 CE1 PHE A 122 8.402 -0.349 -6.481 1.00 0.00 C ATOM 1913 CE2 PHE A 122 10.417 0.678 -7.254 1.00 0.00 C ATOM 1914 CZ PHE A 122 9.626 -0.445 -7.112 1.00 0.00 C ATOM 0 H PHE A 122 5.965 2.436 -5.830 1.00 0.00 H new ATOM 0 HA PHE A 122 7.126 5.041 -6.200 1.00 0.00 H new ATOM 0 HB2 PHE A 122 9.132 4.001 -5.512 1.00 0.00 H new ATOM 0 HB3 PHE A 122 7.877 3.188 -4.600 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.009 0.939 -5.505 1.00 0.00 H new ATOM 0 HD2 PHE A 122 10.600 2.771 -6.883 1.00 0.00 H new ATOM 0 HE1 PHE A 122 7.783 -1.227 -6.366 1.00 0.00 H new ATOM 0 HE2 PHE A 122 11.376 0.605 -7.745 1.00 0.00 H new ATOM 0 HZ PHE A 122 9.964 -1.397 -7.494 1.00 0.00 H new ATOM 1924 N LYS A 123 7.261 2.814 -8.599 1.00 0.00 N ATOM 1925 CA LYS A 123 7.590 2.614 -10.005 1.00 0.00 C ATOM 1926 C LYS A 123 6.760 3.535 -10.894 1.00 0.00 C ATOM 1927 O LYS A 123 7.155 3.849 -12.016 1.00 0.00 O ATOM 1928 CB LYS A 123 7.354 1.156 -10.403 1.00 0.00 C ATOM 1929 CG LYS A 123 8.574 0.270 -10.219 1.00 0.00 C ATOM 1930 CD LYS A 123 8.489 -0.981 -11.077 1.00 0.00 C ATOM 1931 CE LYS A 123 9.178 -2.162 -10.411 1.00 0.00 C ATOM 1932 NZ LYS A 123 9.351 -3.305 -11.349 1.00 0.00 N ATOM 0 H LYS A 123 6.738 2.048 -8.176 1.00 0.00 H new ATOM 0 HA LYS A 123 8.644 2.856 -10.144 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.532 0.755 -9.811 1.00 0.00 H new ATOM 0 HB3 LYS A 123 7.043 1.119 -11.447 1.00 0.00 H new ATOM 0 HG2 LYS A 123 9.473 0.829 -10.478 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.665 -0.013 -9.170 1.00 0.00 H new ATOM 0 HD2 LYS A 123 7.443 -1.226 -11.262 1.00 0.00 H new ATOM 0 HD3 LYS A 123 8.948 -0.790 -12.047 1.00 0.00 H new ATOM 0 HE2 LYS A 123 10.153 -1.849 -10.036 1.00 0.00 H new ATOM 0 HE3 LYS A 123 8.593 -2.485 -9.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 9.824 -4.089 -10.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 8.420 -3.620 -11.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 9.930 -3.005 -12.159 1.00 0.00 H new ATOM 1946 N GLU A 124 5.610 3.965 -10.384 1.00 0.00 N ATOM 1947 CA GLU A 124 4.727 4.851 -11.133 1.00 0.00 C ATOM 1948 C GLU A 124 5.529 5.784 -12.035 1.00 0.00 C ATOM 1949 O GLU A 124 6.529 6.374 -11.628 1.00 0.00 O ATOM 1950 CB GLU A 124 3.859 5.670 -10.176 1.00 0.00 C ATOM 1951 CG GLU A 124 2.429 5.854 -10.656 1.00 0.00 C ATOM 1952 CD GLU A 124 2.255 7.094 -11.510 1.00 0.00 C ATOM 1953 OE1 GLU A 124 2.953 8.096 -11.251 1.00 0.00 O ATOM 1954 OE2 GLU A 124 1.419 7.062 -12.438 1.00 0.00 O ATOM 0 H GLU A 124 5.269 3.714 -9.456 1.00 0.00 H new ATOM 0 HA GLU A 124 4.082 4.235 -11.760 1.00 0.00 H new ATOM 0 HB2 GLU A 124 3.846 5.181 -9.202 1.00 0.00 H new ATOM 0 HB3 GLU A 124 4.315 6.650 -10.034 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.127 4.978 -11.229 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.765 5.915 -9.793 1.00 0.00 H new ATOM 1961 N PRO A 125 5.081 5.921 -13.292 1.00 0.00 N ATOM 1962 CA PRO A 125 5.741 6.780 -14.279 1.00 0.00 C ATOM 1963 C PRO A 125 5.581 8.262 -13.957 1.00 0.00 C ATOM 1964 O PRO A 125 4.578 8.675 -13.376 1.00 0.00 O ATOM 1965 CB PRO A 125 5.023 6.437 -15.586 1.00 0.00 C ATOM 1966 CG PRO A 125 3.682 5.942 -15.163 1.00 0.00 C ATOM 1967 CD PRO A 125 3.894 5.247 -13.846 1.00 0.00 C ATOM 0 HA PRO A 125 6.817 6.610 -14.311 1.00 0.00 H new ATOM 0 HB2 PRO A 125 4.937 7.311 -16.232 1.00 0.00 H new ATOM 0 HB3 PRO A 125 5.566 5.678 -16.149 1.00 0.00 H new ATOM 0 HG2 PRO A 125 2.976 6.766 -15.060 1.00 0.00 H new ATOM 0 HG3 PRO A 125 3.267 5.258 -15.903 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.029 5.354 -13.191 1.00 0.00 H new ATOM 0 HD3 PRO A 125 4.064 4.178 -13.978 1.00 0.00 H new ATOM 1975 N GLU A 126 6.577 9.056 -14.337 1.00 0.00 N ATOM 1976 CA GLU A 126 6.545 10.493 -14.087 1.00 0.00 C ATOM 1977 C GLU A 126 5.121 11.031 -14.184 1.00 0.00 C ATOM 1978 O GLU A 126 4.338 10.599 -15.031 1.00 0.00 O ATOM 1979 CB GLU A 126 7.448 11.226 -15.082 1.00 0.00 C ATOM 1980 CG GLU A 126 7.621 12.703 -14.772 1.00 0.00 C ATOM 1981 CD GLU A 126 8.595 13.386 -15.712 1.00 0.00 C ATOM 1982 OE1 GLU A 126 8.287 13.480 -16.919 1.00 0.00 O ATOM 1983 OE2 GLU A 126 9.665 13.826 -15.242 1.00 0.00 O ATOM 0 H GLU A 126 7.415 8.730 -14.818 1.00 0.00 H new ATOM 0 HA GLU A 126 6.912 10.668 -13.076 1.00 0.00 H new ATOM 0 HB2 GLU A 126 8.428 10.748 -15.091 1.00 0.00 H new ATOM 0 HB3 GLU A 126 7.032 11.120 -16.084 1.00 0.00 H new ATOM 0 HG2 GLU A 126 6.653 13.199 -14.835 1.00 0.00 H new ATOM 0 HG3 GLU A 126 7.972 12.817 -13.746 1.00 0.00 H new ATOM 1990 N LYS A 127 4.790 11.975 -13.310 1.00 0.00 N ATOM 1991 CA LYS A 127 3.461 12.574 -13.296 1.00 0.00 C ATOM 1992 C LYS A 127 3.116 13.166 -14.659 1.00 0.00 C ATOM 1993 O LYS A 127 2.039 12.916 -15.200 1.00 0.00 O ATOM 1994 CB LYS A 127 3.380 13.660 -12.221 1.00 0.00 C ATOM 1995 CG LYS A 127 3.736 13.167 -10.829 1.00 0.00 C ATOM 1996 CD LYS A 127 2.691 12.202 -10.295 1.00 0.00 C ATOM 1997 CE LYS A 127 3.251 11.337 -9.177 1.00 0.00 C ATOM 1998 NZ LYS A 127 2.300 10.262 -8.778 1.00 0.00 N ATOM 0 H LYS A 127 5.425 12.342 -12.601 1.00 0.00 H new ATOM 0 HA LYS A 127 2.739 11.790 -13.067 1.00 0.00 H new ATOM 0 HB2 LYS A 127 4.050 14.476 -12.490 1.00 0.00 H new ATOM 0 HB3 LYS A 127 2.370 14.069 -12.205 1.00 0.00 H new ATOM 0 HG2 LYS A 127 4.708 12.675 -10.854 1.00 0.00 H new ATOM 0 HG3 LYS A 127 3.827 14.017 -10.153 1.00 0.00 H new ATOM 0 HD2 LYS A 127 1.831 12.762 -9.927 1.00 0.00 H new ATOM 0 HD3 LYS A 127 2.334 11.566 -11.105 1.00 0.00 H new ATOM 0 HE2 LYS A 127 4.191 10.889 -9.500 1.00 0.00 H new ATOM 0 HE3 LYS A 127 3.476 11.962 -8.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 2.052 10.373 -7.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.438 10.329 -9.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 2.745 9.333 -8.925 1.00 0.00 H new ATOM 2012 N ARG A 128 4.037 13.950 -15.209 1.00 0.00 N ATOM 2013 CA ARG A 128 3.830 14.577 -16.509 1.00 0.00 C ATOM 2014 C ARG A 128 3.861 13.537 -17.625 1.00 0.00 C ATOM 2015 O ARG A 128 4.854 13.409 -18.343 1.00 0.00 O ATOM 2016 CB ARG A 128 4.898 15.643 -16.760 1.00 0.00 C ATOM 2017 CG ARG A 128 4.540 17.008 -16.196 1.00 0.00 C ATOM 2018 CD ARG A 128 4.472 16.983 -14.677 1.00 0.00 C ATOM 2019 NE ARG A 128 4.289 18.318 -14.115 1.00 0.00 N ATOM 2020 CZ ARG A 128 3.700 18.550 -12.947 1.00 0.00 C ATOM 2021 NH1 ARG A 128 3.240 17.540 -12.221 1.00 0.00 N ATOM 2022 NH2 ARG A 128 3.571 19.793 -12.503 1.00 0.00 N ATOM 0 H ARG A 128 4.934 14.166 -14.775 1.00 0.00 H new ATOM 0 HA ARG A 128 2.848 15.050 -16.505 1.00 0.00 H new ATOM 0 HB2 ARG A 128 5.839 15.313 -16.320 1.00 0.00 H new ATOM 0 HB3 ARG A 128 5.063 15.735 -17.834 1.00 0.00 H new ATOM 0 HG2 ARG A 128 5.281 17.741 -16.516 1.00 0.00 H new ATOM 0 HG3 ARG A 128 3.579 17.329 -16.599 1.00 0.00 H new ATOM 0 HD2 ARG A 128 3.649 16.341 -14.362 1.00 0.00 H new ATOM 0 HD3 ARG A 128 5.388 16.545 -14.280 1.00 0.00 H new ATOM 0 HE ARG A 128 4.632 19.117 -14.649 1.00 0.00 H new ATOM 0 HH11 ARG A 128 3.338 16.583 -12.559 1.00 0.00 H new ATOM 0 HH12 ARG A 128 2.788 17.721 -11.325 1.00 0.00 H new ATOM 0 HH21 ARG A 128 3.924 20.572 -13.058 1.00 0.00 H new ATOM 0 HH22 ARG A 128 3.119 19.970 -11.606 1.00 0.00 H new ATOM 2036 N THR A 129 2.768 12.794 -17.766 1.00 0.00 N ATOM 2037 CA THR A 129 2.670 11.764 -18.792 1.00 0.00 C ATOM 2038 C THR A 129 1.245 11.647 -19.319 1.00 0.00 C ATOM 2039 O THR A 129 0.327 11.293 -18.579 1.00 0.00 O ATOM 2040 CB THR A 129 3.123 10.393 -18.257 1.00 0.00 C ATOM 2041 OG1 THR A 129 3.017 9.405 -19.289 1.00 0.00 O ATOM 2042 CG2 THR A 129 2.282 9.975 -17.060 1.00 0.00 C ATOM 0 H THR A 129 1.937 12.887 -17.182 1.00 0.00 H new ATOM 0 HA THR A 129 3.331 12.064 -19.605 1.00 0.00 H new ATOM 0 HB THR A 129 4.162 10.477 -17.940 1.00 0.00 H new ATOM 0 HG1 THR A 129 3.308 8.536 -18.941 1.00 0.00 H new ATOM 0 HG21 THR A 129 2.620 9.004 -16.699 1.00 0.00 H new ATOM 0 HG22 THR A 129 2.387 10.714 -16.266 1.00 0.00 H new ATOM 0 HG23 THR A 129 1.235 9.908 -17.357 1.00 0.00 H new ATOM 2050 N ILE A 130 1.067 11.945 -20.602 1.00 0.00 N ATOM 2051 CA ILE A 130 -0.248 11.870 -21.227 1.00 0.00 C ATOM 2052 C ILE A 130 -0.723 10.425 -21.338 1.00 0.00 C ATOM 2053 O ILE A 130 -0.540 9.779 -22.370 1.00 0.00 O ATOM 2054 CB ILE A 130 -0.240 12.505 -22.630 1.00 0.00 C ATOM 2055 CG1 ILE A 130 0.185 13.973 -22.547 1.00 0.00 C ATOM 2056 CG2 ILE A 130 -1.613 12.383 -23.275 1.00 0.00 C ATOM 2057 CD1 ILE A 130 0.722 14.521 -23.851 1.00 0.00 C ATOM 0 H ILE A 130 1.816 12.240 -21.228 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.934 12.427 -20.588 1.00 0.00 H new ATOM 0 HB ILE A 130 0.481 11.971 -23.250 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -0.670 14.573 -22.234 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.948 14.079 -21.776 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -1.591 12.836 -24.266 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.881 11.330 -23.364 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -2.352 12.895 -22.658 1.00 0.00 H new ATOM 0 HD11 ILE A 130 1.004 15.566 -23.718 1.00 0.00 H new ATOM 0 HD12 ILE A 130 1.596 13.945 -24.155 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -0.046 14.447 -24.621 1.00 0.00 H new ATOM 2069 N SER A 131 -1.335 9.925 -20.270 1.00 0.00 N ATOM 2070 CA SER A 131 -1.835 8.556 -20.246 1.00 0.00 C ATOM 2071 C SER A 131 -3.090 8.450 -19.385 1.00 0.00 C ATOM 2072 O SER A 131 -3.522 9.429 -18.776 1.00 0.00 O ATOM 2073 CB SER A 131 -0.758 7.606 -19.716 1.00 0.00 C ATOM 2074 OG SER A 131 -0.308 8.010 -18.435 1.00 0.00 O ATOM 0 H SER A 131 -1.497 10.448 -19.409 1.00 0.00 H new ATOM 0 HA SER A 131 -2.091 8.272 -21.267 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.157 6.593 -19.662 1.00 0.00 H new ATOM 0 HB3 SER A 131 0.083 7.581 -20.409 1.00 0.00 H new ATOM 0 HG SER A 131 0.378 7.386 -18.118 1.00 0.00 H new ATOM 2080 N ARG A 132 -3.671 7.256 -19.341 1.00 0.00 N ATOM 2081 CA ARG A 132 -4.877 7.022 -18.557 1.00 0.00 C ATOM 2082 C ARG A 132 -4.611 6.021 -17.436 1.00 0.00 C ATOM 2083 O ARG A 132 -4.576 4.812 -17.664 1.00 0.00 O ATOM 2084 CB ARG A 132 -6.004 6.509 -19.455 1.00 0.00 C ATOM 2085 CG ARG A 132 -7.334 6.353 -18.736 1.00 0.00 C ATOM 2086 CD ARG A 132 -7.904 7.701 -18.322 1.00 0.00 C ATOM 2087 NE ARG A 132 -9.364 7.686 -18.276 1.00 0.00 N ATOM 2088 CZ ARG A 132 -10.084 8.516 -17.530 1.00 0.00 C ATOM 2089 NH1 ARG A 132 -9.483 9.422 -16.771 1.00 0.00 N ATOM 2090 NH2 ARG A 132 -11.409 8.441 -17.541 1.00 0.00 N ATOM 0 H ARG A 132 -3.326 6.436 -19.839 1.00 0.00 H new ATOM 0 HA ARG A 132 -5.179 7.970 -18.111 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -6.132 7.196 -20.292 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -5.713 5.546 -19.875 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -8.043 5.841 -19.387 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -7.201 5.726 -17.854 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -7.513 7.975 -17.342 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -7.571 8.466 -19.023 1.00 0.00 H new ATOM 0 HE ARG A 132 -9.857 7.001 -18.848 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -8.465 9.483 -16.759 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -10.039 10.058 -16.199 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -11.876 7.745 -18.123 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -11.961 9.079 -16.968 1.00 0.00 H new ATOM 2104 N SER A 133 -4.424 6.534 -16.224 1.00 0.00 N ATOM 2105 CA SER A 133 -4.157 5.686 -15.068 1.00 0.00 C ATOM 2106 C SER A 133 -5.035 6.086 -13.886 1.00 0.00 C ATOM 2107 O SER A 133 -5.170 7.268 -13.570 1.00 0.00 O ATOM 2108 CB SER A 133 -2.681 5.775 -14.674 1.00 0.00 C ATOM 2109 OG SER A 133 -2.352 7.077 -14.222 1.00 0.00 O ATOM 0 H SER A 133 -4.452 7.532 -16.017 1.00 0.00 H new ATOM 0 HA SER A 133 -4.392 4.657 -15.341 1.00 0.00 H new ATOM 0 HB2 SER A 133 -2.466 5.049 -13.890 1.00 0.00 H new ATOM 0 HB3 SER A 133 -2.057 5.515 -15.529 1.00 0.00 H new ATOM 0 HG SER A 133 -1.404 7.108 -13.975 1.00 0.00 H new ATOM 2115 N GLY A 134 -5.632 5.091 -13.237 1.00 0.00 N ATOM 2116 CA GLY A 134 -6.491 5.359 -12.097 1.00 0.00 C ATOM 2117 C GLY A 134 -6.563 4.187 -11.139 1.00 0.00 C ATOM 2118 O GLY A 134 -6.799 3.045 -11.536 1.00 0.00 O ATOM 0 H GLY A 134 -5.537 4.105 -13.480 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -6.122 6.237 -11.566 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -7.494 5.598 -12.450 1.00 0.00 H new ATOM 2122 N PRO A 135 -6.356 4.463 -9.843 1.00 0.00 N ATOM 2123 CA PRO A 135 -6.392 3.436 -8.798 1.00 0.00 C ATOM 2124 C PRO A 135 -7.801 2.902 -8.560 1.00 0.00 C ATOM 2125 O PRO A 135 -7.977 1.780 -8.085 1.00 0.00 O ATOM 2126 CB PRO A 135 -5.883 4.173 -7.557 1.00 0.00 C ATOM 2127 CG PRO A 135 -6.198 5.606 -7.812 1.00 0.00 C ATOM 2128 CD PRO A 135 -6.069 5.801 -9.298 1.00 0.00 C ATOM 0 HA PRO A 135 -5.797 2.562 -9.065 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -6.376 3.814 -6.653 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -4.813 4.022 -7.418 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -7.204 5.851 -7.472 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -5.512 6.258 -7.272 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -6.774 6.546 -9.668 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -5.071 6.142 -9.574 1.00 0.00 H new ATOM 2136 N SER A 136 -8.800 3.712 -8.892 1.00 0.00 N ATOM 2137 CA SER A 136 -10.194 3.322 -8.711 1.00 0.00 C ATOM 2138 C SER A 136 -10.964 3.436 -10.023 1.00 0.00 C ATOM 2139 O SER A 136 -11.434 4.513 -10.388 1.00 0.00 O ATOM 2140 CB SER A 136 -10.854 4.194 -7.641 1.00 0.00 C ATOM 2141 OG SER A 136 -10.856 5.558 -8.024 1.00 0.00 O ATOM 0 H SER A 136 -8.671 4.643 -9.288 1.00 0.00 H new ATOM 0 HA SER A 136 -10.216 2.282 -8.386 1.00 0.00 H new ATOM 0 HB2 SER A 136 -11.878 3.858 -7.475 1.00 0.00 H new ATOM 0 HB3 SER A 136 -10.323 4.079 -6.696 1.00 0.00 H new ATOM 0 HG SER A 136 -11.167 5.637 -8.950 1.00 0.00 H new ATOM 2147 N SER A 137 -11.090 2.315 -10.727 1.00 0.00 N ATOM 2148 CA SER A 137 -11.801 2.288 -12.000 1.00 0.00 C ATOM 2149 C SER A 137 -13.155 2.980 -11.881 1.00 0.00 C ATOM 2150 O SER A 137 -13.537 3.773 -12.741 1.00 0.00 O ATOM 2151 CB SER A 137 -11.992 0.845 -12.470 1.00 0.00 C ATOM 2152 OG SER A 137 -12.740 0.096 -11.528 1.00 0.00 O ATOM 0 H SER A 137 -10.709 1.414 -10.437 1.00 0.00 H new ATOM 0 HA SER A 137 -11.202 2.826 -12.735 1.00 0.00 H new ATOM 0 HB2 SER A 137 -12.503 0.838 -13.433 1.00 0.00 H new ATOM 0 HB3 SER A 137 -11.019 0.377 -12.621 1.00 0.00 H new ATOM 0 HG SER A 137 -12.849 -0.822 -11.853 1.00 0.00 H new ATOM 2158 N GLY A 138 -13.877 2.674 -10.808 1.00 0.00 N ATOM 2159 CA GLY A 138 -15.181 3.274 -10.595 1.00 0.00 C ATOM 2160 C GLY A 138 -16.071 3.176 -11.818 1.00 0.00 C ATOM 2161 O GLY A 138 -17.260 2.880 -11.707 1.00 0.00 O ATOM 0 H GLY A 138 -13.582 2.021 -10.082 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -15.670 2.784 -9.753 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -15.055 4.322 -10.324 1.00 0.00 H new TER 2165 GLY A 138