USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1069 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 108 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 130 SER OG : rot -170:sc= -0.461 USER MOD Set 2.1: A 91 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Set 2.2: A 95 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 42 SER OG : rot -95:sc= 1.48 USER MOD Set 3.2: A 66 THR OG1 : rot -91:sc= 1.48 USER MOD Set 4.1: A 61 GLN : amide:sc= 0.17 K(o=0.35,f=-1.3) USER MOD Set 4.2: A 63 TYR OH : rot -17:sc= 0.178 USER MOD Set 5.1: A 11 GLN : amide:sc= -0.59 K(o=-0.62,f=0.39!) USER MOD Set 5.2: A 20 LYS NZ :NH3+ -165:sc= -0.0292 (180deg=0) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 154:sc= 0.125 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.734 K(o=-0.73,f=-0.088!) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 18 MET CE :methyl -148:sc= -0.15 (180deg=-1.3!) USER MOD Single : A 19 ASN : amide:sc=-0.00133 K(o=-0.0013,f=-1.3!) USER MOD Single : A 21 MET CE :methyl 176:sc= 0 (180deg=-0.00612) USER MOD Single : A 25 ASN : amide:sc= -0.902 X(o=-0.9,f=-0.98) USER MOD Single : A 27 LYS NZ :NH3+ -125:sc= -1.09 (180deg=-3.31!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.0185 K(o=-0.018,f=-1.3) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.667 USER MOD Single : A 48 LYS NZ :NH3+ -142:sc= -0.246 (180deg=-0.509) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.152 K(o=-0.15,f=-1.4!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -0.233 K(o=-0.23,f=-5.6!) USER MOD Single : A 62 TYR OH : rot 180:sc= -0.664 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.289 X(o=-0.29,f=-0.0082) USER MOD Single : A 78 SER OG : rot 44:sc= 0.3 USER MOD Single : A 80 TYR OH : rot -171:sc= 0.0045 USER MOD Single : A 87 TYR OH : rot 107:sc= 0.0823 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 107:sc= 1.12 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.434 K(o=-0.43,f=-4.2!) USER MOD Single : A 116 ASN : amide:sc= -5.35! C(o=-5.3!,f=-6.1!) USER MOD Single : A 118 MET CE :methyl -148:sc= -0.242 (180deg=-1.34) USER MOD Single : A 120 ASN : amide:sc= -1.87 K(o=-1.9,f=-0.35) USER MOD Single : A 126 SER OG : rot 180:sc= -0.957 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -0.0911 X(o=-0.091,f=-0.11) USER MOD Single : A 134 SER OG : rot -33:sc= 0.314 USER MOD Single : A 139 THR OG1 : rot 180:sc= -0.0298 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 114.083 -22.191 10.860 1.00 0.00 N ATOM 2 CA ALA A 1 113.180 -21.012 10.973 1.00 0.00 C ATOM 3 C ALA A 1 113.448 -20.291 12.288 1.00 0.00 C ATOM 4 O ALA A 1 112.772 -20.532 13.289 1.00 0.00 O ATOM 5 CB ALA A 1 111.724 -21.480 10.922 1.00 0.00 C ATOM 0 H1 ALA A 1 113.900 -22.683 9.962 1.00 0.00 H new ATOM 0 H2 ALA A 1 115.073 -21.874 10.886 1.00 0.00 H new ATOM 0 H3 ALA A 1 113.907 -22.840 11.653 1.00 0.00 H new ATOM 0 HA ALA A 1 113.366 -20.327 10.146 1.00 0.00 H new ATOM 0 HB1 ALA A 1 111.062 -20.618 11.005 1.00 0.00 H new ATOM 0 HB2 ALA A 1 111.539 -21.991 9.977 1.00 0.00 H new ATOM 0 HB3 ALA A 1 111.533 -22.165 11.748 1.00 0.00 H new ATOM 13 N THR A 2 114.446 -19.411 12.281 1.00 0.00 N ATOM 14 CA THR A 2 114.806 -18.651 13.476 1.00 0.00 C ATOM 15 C THR A 2 114.784 -17.155 13.183 1.00 0.00 C ATOM 16 O THR A 2 114.010 -16.405 13.779 1.00 0.00 O ATOM 17 CB THR A 2 116.203 -19.058 13.951 1.00 0.00 C ATOM 18 OG1 THR A 2 116.252 -20.468 14.118 1.00 0.00 O ATOM 19 CG2 THR A 2 116.513 -18.373 15.282 1.00 0.00 C ATOM 0 H THR A 2 115.019 -19.206 11.463 1.00 0.00 H new ATOM 0 HA THR A 2 114.078 -18.869 14.257 1.00 0.00 H new ATOM 0 HB THR A 2 116.942 -18.753 13.210 1.00 0.00 H new ATOM 0 HG1 THR A 2 117.146 -20.731 14.420 1.00 0.00 H new ATOM 0 HG21 THR A 2 117.508 -18.664 15.618 1.00 0.00 H new ATOM 0 HG22 THR A 2 116.476 -17.291 15.152 1.00 0.00 H new ATOM 0 HG23 THR A 2 115.776 -18.674 16.026 1.00 0.00 H new ATOM 27 N SER A 3 115.644 -16.727 12.262 1.00 0.00 N ATOM 28 CA SER A 3 115.732 -15.316 11.895 1.00 0.00 C ATOM 29 C SER A 3 115.641 -15.159 10.382 1.00 0.00 C ATOM 30 O SER A 3 116.074 -16.034 9.633 1.00 0.00 O ATOM 31 CB SER A 3 117.055 -14.729 12.391 1.00 0.00 C ATOM 32 OG SER A 3 117.134 -14.884 13.801 1.00 0.00 O ATOM 0 H SER A 3 116.288 -17.335 11.757 1.00 0.00 H new ATOM 0 HA SER A 3 114.903 -14.782 12.360 1.00 0.00 H new ATOM 0 HB2 SER A 3 117.893 -15.233 11.910 1.00 0.00 H new ATOM 0 HB3 SER A 3 117.122 -13.674 12.125 1.00 0.00 H new ATOM 0 HG SER A 3 117.981 -14.511 14.124 1.00 0.00 H new ATOM 38 N THR A 4 115.077 -14.041 9.934 1.00 0.00 N ATOM 39 CA THR A 4 114.936 -13.783 8.502 1.00 0.00 C ATOM 40 C THR A 4 115.551 -12.435 8.143 1.00 0.00 C ATOM 41 O THR A 4 115.410 -11.459 8.880 1.00 0.00 O ATOM 42 CB THR A 4 113.454 -13.781 8.118 1.00 0.00 C ATOM 43 OG1 THR A 4 112.829 -14.949 8.632 1.00 0.00 O ATOM 44 CG2 THR A 4 113.324 -13.761 6.593 1.00 0.00 C ATOM 0 H THR A 4 114.712 -13.303 10.536 1.00 0.00 H new ATOM 0 HA THR A 4 115.455 -14.570 7.955 1.00 0.00 H new ATOM 0 HB THR A 4 112.971 -12.898 8.536 1.00 0.00 H new ATOM 0 HG1 THR A 4 111.875 -14.775 8.773 1.00 0.00 H new ATOM 0 HG21 THR A 4 112.269 -13.760 6.318 1.00 0.00 H new ATOM 0 HG22 THR A 4 113.803 -12.865 6.199 1.00 0.00 H new ATOM 0 HG23 THR A 4 113.807 -14.644 6.175 1.00 0.00 H new ATOM 52 N VAL A 5 116.235 -12.391 7.004 1.00 0.00 N ATOM 53 CA VAL A 5 116.844 -11.147 6.527 1.00 0.00 C ATOM 54 C VAL A 5 116.292 -10.803 5.148 1.00 0.00 C ATOM 55 O VAL A 5 116.397 -11.597 4.213 1.00 0.00 O ATOM 56 CB VAL A 5 118.369 -11.298 6.455 1.00 0.00 C ATOM 57 CG1 VAL A 5 119.003 -9.967 6.046 1.00 0.00 C ATOM 58 CG2 VAL A 5 118.916 -11.714 7.823 1.00 0.00 C ATOM 0 H VAL A 5 116.383 -13.196 6.395 1.00 0.00 H new ATOM 0 HA VAL A 5 116.603 -10.344 7.223 1.00 0.00 H new ATOM 0 HB VAL A 5 118.613 -12.062 5.717 1.00 0.00 H new ATOM 0 HG11 VAL A 5 120.086 -10.080 5.996 1.00 0.00 H new ATOM 0 HG12 VAL A 5 118.624 -9.669 5.068 1.00 0.00 H new ATOM 0 HG13 VAL A 5 118.751 -9.203 6.781 1.00 0.00 H new ATOM 0 HG21 VAL A 5 119.999 -11.819 7.765 1.00 0.00 H new ATOM 0 HG22 VAL A 5 118.665 -10.953 8.562 1.00 0.00 H new ATOM 0 HG23 VAL A 5 118.474 -12.666 8.117 1.00 0.00 H new ATOM 68 N THR A 6 115.703 -9.615 5.025 1.00 0.00 N ATOM 69 CA THR A 6 115.111 -9.191 3.759 1.00 0.00 C ATOM 70 C THR A 6 115.627 -7.818 3.346 1.00 0.00 C ATOM 71 O THR A 6 115.848 -6.944 4.184 1.00 0.00 O ATOM 72 CB THR A 6 113.588 -9.145 3.890 1.00 0.00 C ATOM 73 OG1 THR A 6 113.117 -10.393 4.380 1.00 0.00 O ATOM 74 CG2 THR A 6 112.961 -8.865 2.523 1.00 0.00 C ATOM 0 H THR A 6 115.623 -8.934 5.780 1.00 0.00 H new ATOM 0 HA THR A 6 115.394 -9.912 2.992 1.00 0.00 H new ATOM 0 HB THR A 6 113.310 -8.352 4.584 1.00 0.00 H new ATOM 0 HG1 THR A 6 112.141 -10.364 4.466 1.00 0.00 H new ATOM 0 HG21 THR A 6 111.876 -8.833 2.620 1.00 0.00 H new ATOM 0 HG22 THR A 6 113.320 -7.907 2.147 1.00 0.00 H new ATOM 0 HG23 THR A 6 113.240 -9.655 1.826 1.00 0.00 H new ATOM 82 N GLY A 7 115.824 -7.641 2.046 1.00 0.00 N ATOM 83 CA GLY A 7 116.168 -6.333 1.500 1.00 0.00 C ATOM 84 C GLY A 7 115.298 -6.062 0.283 1.00 0.00 C ATOM 85 O GLY A 7 115.025 -6.981 -0.489 1.00 0.00 O ATOM 0 H GLY A 7 115.752 -8.384 1.351 1.00 0.00 H new ATOM 0 HA2 GLY A 7 116.016 -5.559 2.252 1.00 0.00 H new ATOM 0 HA3 GLY A 7 117.222 -6.306 1.223 1.00 0.00 H new ATOM 89 N GLY A 8 114.843 -4.821 0.122 1.00 0.00 N ATOM 90 CA GLY A 8 113.943 -4.507 -0.982 1.00 0.00 C ATOM 91 C GLY A 8 114.015 -3.041 -1.377 1.00 0.00 C ATOM 92 O GLY A 8 114.722 -2.250 -0.750 1.00 0.00 O ATOM 0 H GLY A 8 115.077 -4.034 0.727 1.00 0.00 H new ATOM 0 HA2 GLY A 8 114.195 -5.127 -1.842 1.00 0.00 H new ATOM 0 HA3 GLY A 8 112.921 -4.756 -0.698 1.00 0.00 H new ATOM 96 N TYR A 9 113.230 -2.686 -2.389 1.00 0.00 N ATOM 97 CA TYR A 9 113.224 -1.325 -2.910 1.00 0.00 C ATOM 98 C TYR A 9 111.789 -0.828 -3.032 1.00 0.00 C ATOM 99 O TYR A 9 110.879 -1.605 -3.319 1.00 0.00 O ATOM 100 CB TYR A 9 113.931 -1.277 -4.270 1.00 0.00 C ATOM 101 CG TYR A 9 113.190 -1.988 -5.381 1.00 0.00 C ATOM 102 CD1 TYR A 9 113.349 -3.366 -5.560 1.00 0.00 C ATOM 103 CD2 TYR A 9 112.346 -1.266 -6.233 1.00 0.00 C ATOM 104 CE1 TYR A 9 112.666 -4.024 -6.589 1.00 0.00 C ATOM 105 CE2 TYR A 9 111.660 -1.923 -7.263 1.00 0.00 C ATOM 106 CZ TYR A 9 111.822 -3.301 -7.440 1.00 0.00 C ATOM 107 OH TYR A 9 111.146 -3.948 -8.457 1.00 0.00 O ATOM 0 H TYR A 9 112.590 -3.322 -2.864 1.00 0.00 H new ATOM 0 HA TYR A 9 113.763 -0.674 -2.222 1.00 0.00 H new ATOM 0 HB2 TYR A 9 114.076 -0.235 -4.555 1.00 0.00 H new ATOM 0 HB3 TYR A 9 114.921 -1.720 -4.168 1.00 0.00 H new ATOM 0 HD1 TYR A 9 114.000 -3.923 -4.903 1.00 0.00 H new ATOM 0 HD2 TYR A 9 112.224 -0.202 -6.096 1.00 0.00 H new ATOM 0 HE1 TYR A 9 112.790 -5.088 -6.726 1.00 0.00 H new ATOM 0 HE2 TYR A 9 111.007 -1.366 -7.919 1.00 0.00 H new ATOM 0 HH TYR A 9 110.603 -3.300 -8.953 1.00 0.00 H new ATOM 117 N ALA A 10 111.599 0.466 -2.813 1.00 0.00 N ATOM 118 CA ALA A 10 110.264 1.048 -2.806 1.00 0.00 C ATOM 119 C ALA A 10 110.227 2.338 -3.613 1.00 0.00 C ATOM 120 O ALA A 10 111.218 3.060 -3.687 1.00 0.00 O ATOM 121 CB ALA A 10 109.838 1.349 -1.369 1.00 0.00 C ATOM 0 H ALA A 10 112.352 1.132 -2.638 1.00 0.00 H new ATOM 0 HA ALA A 10 109.580 0.329 -3.257 1.00 0.00 H new ATOM 0 HB1 ALA A 10 108.839 1.784 -1.369 1.00 0.00 H new ATOM 0 HB2 ALA A 10 109.831 0.425 -0.790 1.00 0.00 H new ATOM 0 HB3 ALA A 10 110.540 2.052 -0.921 1.00 0.00 H new ATOM 127 N GLN A 11 109.073 2.616 -4.210 1.00 0.00 N ATOM 128 CA GLN A 11 108.885 3.851 -4.965 1.00 0.00 C ATOM 129 C GLN A 11 107.813 4.694 -4.288 1.00 0.00 C ATOM 130 O GLN A 11 106.788 4.161 -3.860 1.00 0.00 O ATOM 131 CB GLN A 11 108.472 3.534 -6.405 1.00 0.00 C ATOM 132 CG GLN A 11 108.452 4.826 -7.225 1.00 0.00 C ATOM 133 CD GLN A 11 107.917 4.547 -8.626 1.00 0.00 C ATOM 134 OE1 GLN A 11 106.810 4.037 -8.780 1.00 0.00 O ATOM 135 NE2 GLN A 11 108.647 4.855 -9.665 1.00 0.00 N ATOM 0 H GLN A 11 108.256 2.006 -4.186 1.00 0.00 H new ATOM 0 HA GLN A 11 109.823 4.405 -4.989 1.00 0.00 H new ATOM 0 HB2 GLN A 11 109.169 2.821 -6.846 1.00 0.00 H new ATOM 0 HB3 GLN A 11 107.487 3.067 -6.418 1.00 0.00 H new ATOM 0 HG2 GLN A 11 107.828 5.571 -6.730 1.00 0.00 H new ATOM 0 HG3 GLN A 11 109.457 5.243 -7.287 1.00 0.00 H new ATOM 0 HE21 GLN A 11 109.566 5.278 -9.535 1.00 0.00 H new ATOM 0 HE22 GLN A 11 108.298 4.672 -10.606 1.00 0.00 H new ATOM 144 N SER A 12 108.063 5.998 -4.170 1.00 0.00 N ATOM 145 CA SER A 12 107.131 6.894 -3.493 1.00 0.00 C ATOM 146 C SER A 12 106.521 7.865 -4.495 1.00 0.00 C ATOM 147 O SER A 12 107.231 8.409 -5.344 1.00 0.00 O ATOM 148 CB SER A 12 107.858 7.676 -2.401 1.00 0.00 C ATOM 149 OG SER A 12 106.915 8.456 -1.677 1.00 0.00 O ATOM 0 H SER A 12 108.900 6.454 -4.533 1.00 0.00 H new ATOM 0 HA SER A 12 106.338 6.299 -3.041 1.00 0.00 H new ATOM 0 HB2 SER A 12 108.374 6.991 -1.728 1.00 0.00 H new ATOM 0 HB3 SER A 12 108.618 8.320 -2.843 1.00 0.00 H new ATOM 0 HG SER A 12 107.377 8.958 -0.974 1.00 0.00 H new ATOM 155 N ASP A 13 105.223 8.116 -4.342 1.00 0.00 N ATOM 156 CA ASP A 13 104.481 8.926 -5.301 1.00 0.00 C ATOM 157 C ASP A 13 104.741 10.411 -5.079 1.00 0.00 C ATOM 158 O ASP A 13 104.603 10.926 -3.971 1.00 0.00 O ATOM 159 CB ASP A 13 102.983 8.646 -5.169 1.00 0.00 C ATOM 160 CG ASP A 13 102.215 9.388 -6.258 1.00 0.00 C ATOM 161 OD1 ASP A 13 102.125 8.863 -7.356 1.00 0.00 O ATOM 162 OD2 ASP A 13 101.731 10.473 -5.977 1.00 0.00 O ATOM 0 H ASP A 13 104.664 7.769 -3.562 1.00 0.00 H new ATOM 0 HA ASP A 13 104.819 8.660 -6.303 1.00 0.00 H new ATOM 0 HB2 ASP A 13 102.797 7.575 -5.247 1.00 0.00 H new ATOM 0 HB3 ASP A 13 102.631 8.960 -4.186 1.00 0.00 H new ATOM 167 N ALA A 14 105.122 11.084 -6.158 1.00 0.00 N ATOM 168 CA ALA A 14 105.480 12.495 -6.093 1.00 0.00 C ATOM 169 C ALA A 14 104.251 13.391 -6.201 1.00 0.00 C ATOM 170 O ALA A 14 103.308 13.099 -6.936 1.00 0.00 O ATOM 171 CB ALA A 14 106.458 12.832 -7.220 1.00 0.00 C ATOM 0 H ALA A 14 105.191 10.674 -7.090 1.00 0.00 H new ATOM 0 HA ALA A 14 105.948 12.677 -5.126 1.00 0.00 H new ATOM 0 HB1 ALA A 14 106.723 13.888 -7.168 1.00 0.00 H new ATOM 0 HB2 ALA A 14 107.358 12.226 -7.114 1.00 0.00 H new ATOM 0 HB3 ALA A 14 105.991 12.622 -8.182 1.00 0.00 H new ATOM 177 N GLN A 15 104.284 14.488 -5.454 1.00 0.00 N ATOM 178 CA GLN A 15 103.243 15.505 -5.533 1.00 0.00 C ATOM 179 C GLN A 15 103.639 16.521 -6.598 1.00 0.00 C ATOM 180 O GLN A 15 104.825 16.692 -6.875 1.00 0.00 O ATOM 181 CB GLN A 15 103.081 16.197 -4.178 1.00 0.00 C ATOM 182 CG GLN A 15 101.882 17.150 -4.222 1.00 0.00 C ATOM 183 CD GLN A 15 101.651 17.805 -2.861 1.00 0.00 C ATOM 184 OE1 GLN A 15 102.281 17.441 -1.865 1.00 0.00 O ATOM 185 NE2 GLN A 15 100.772 18.765 -2.756 1.00 0.00 N ATOM 0 H GLN A 15 105.024 14.696 -4.784 1.00 0.00 H new ATOM 0 HA GLN A 15 102.291 15.044 -5.797 1.00 0.00 H new ATOM 0 HB2 GLN A 15 102.937 15.453 -3.394 1.00 0.00 H new ATOM 0 HB3 GLN A 15 103.987 16.750 -3.931 1.00 0.00 H new ATOM 0 HG2 GLN A 15 102.052 17.919 -4.975 1.00 0.00 H new ATOM 0 HG3 GLN A 15 100.989 16.602 -4.522 1.00 0.00 H new ATOM 0 HE21 GLN A 15 100.249 19.069 -3.577 1.00 0.00 H new ATOM 0 HE22 GLN A 15 100.609 19.211 -1.853 1.00 0.00 H new ATOM 194 N GLY A 16 102.658 17.183 -7.206 1.00 0.00 N ATOM 195 CA GLY A 16 102.920 18.042 -8.363 1.00 0.00 C ATOM 196 C GLY A 16 104.076 19.012 -8.110 1.00 0.00 C ATOM 197 O GLY A 16 104.297 19.444 -6.979 1.00 0.00 O ATOM 0 H GLY A 16 101.679 17.143 -6.921 1.00 0.00 H new ATOM 0 HA2 GLY A 16 103.151 17.422 -9.229 1.00 0.00 H new ATOM 0 HA3 GLY A 16 102.020 18.607 -8.606 1.00 0.00 H new ATOM 201 N GLN A 17 104.815 19.307 -9.175 1.00 0.00 N ATOM 202 CA GLN A 17 106.040 20.099 -9.081 1.00 0.00 C ATOM 203 C GLN A 17 107.075 19.392 -8.202 1.00 0.00 C ATOM 204 O GLN A 17 107.790 20.031 -7.429 1.00 0.00 O ATOM 205 CB GLN A 17 105.744 21.500 -8.535 1.00 0.00 C ATOM 206 CG GLN A 17 104.790 22.227 -9.487 1.00 0.00 C ATOM 207 CD GLN A 17 104.408 23.595 -8.922 1.00 0.00 C ATOM 208 OE1 GLN A 17 104.567 23.849 -7.728 1.00 0.00 O ATOM 209 NE2 GLN A 17 103.906 24.497 -9.720 1.00 0.00 N ATOM 0 H GLN A 17 104.585 19.007 -10.122 1.00 0.00 H new ATOM 0 HA GLN A 17 106.452 20.203 -10.085 1.00 0.00 H new ATOM 0 HB2 GLN A 17 105.300 21.429 -7.542 1.00 0.00 H new ATOM 0 HB3 GLN A 17 106.671 22.064 -8.430 1.00 0.00 H new ATOM 0 HG2 GLN A 17 105.263 22.349 -10.462 1.00 0.00 H new ATOM 0 HG3 GLN A 17 103.893 21.627 -9.640 1.00 0.00 H new ATOM 0 HE21 GLN A 17 103.774 24.286 -10.709 1.00 0.00 H new ATOM 0 HE22 GLN A 17 103.645 25.413 -9.355 1.00 0.00 H new ATOM 218 N MET A 18 107.154 18.070 -8.332 1.00 0.00 N ATOM 219 CA MET A 18 108.148 17.287 -7.604 1.00 0.00 C ATOM 220 C MET A 18 108.383 15.954 -8.312 1.00 0.00 C ATOM 221 O MET A 18 107.499 15.452 -9.006 1.00 0.00 O ATOM 222 CB MET A 18 107.677 17.037 -6.169 1.00 0.00 C ATOM 223 CG MET A 18 108.872 16.658 -5.291 1.00 0.00 C ATOM 224 SD MET A 18 108.288 16.151 -3.655 1.00 0.00 S ATOM 225 CE MET A 18 107.506 17.717 -3.189 1.00 0.00 C ATOM 0 H MET A 18 106.542 17.519 -8.934 1.00 0.00 H new ATOM 0 HA MET A 18 109.083 17.847 -7.576 1.00 0.00 H new ATOM 0 HB2 MET A 18 107.193 17.930 -5.774 1.00 0.00 H new ATOM 0 HB3 MET A 18 106.935 16.239 -6.154 1.00 0.00 H new ATOM 0 HG2 MET A 18 109.434 15.847 -5.755 1.00 0.00 H new ATOM 0 HG3 MET A 18 109.552 17.505 -5.199 1.00 0.00 H new ATOM 0 HE1 MET A 18 107.583 17.856 -2.111 1.00 0.00 H new ATOM 0 HE2 MET A 18 108.008 18.540 -3.698 1.00 0.00 H new ATOM 0 HE3 MET A 18 106.455 17.699 -3.478 1.00 0.00 H new ATOM 235 N ASN A 19 109.572 15.383 -8.137 1.00 0.00 N ATOM 236 CA ASN A 19 109.905 14.111 -8.774 1.00 0.00 C ATOM 237 C ASN A 19 109.804 12.959 -7.776 1.00 0.00 C ATOM 238 O ASN A 19 110.037 13.139 -6.581 1.00 0.00 O ATOM 239 CB ASN A 19 111.321 14.171 -9.349 1.00 0.00 C ATOM 240 CG ASN A 19 111.393 15.204 -10.473 1.00 0.00 C ATOM 241 OD1 ASN A 19 110.374 15.543 -11.075 1.00 0.00 O ATOM 242 ND2 ASN A 19 112.546 15.727 -10.789 1.00 0.00 N ATOM 0 H ASN A 19 110.317 15.778 -7.563 1.00 0.00 H new ATOM 0 HA ASN A 19 109.192 13.935 -9.579 1.00 0.00 H new ATOM 0 HB2 ASN A 19 112.030 14.429 -8.562 1.00 0.00 H new ATOM 0 HB3 ASN A 19 111.609 13.190 -9.728 1.00 0.00 H new ATOM 0 HD21 ASN A 19 112.605 16.419 -11.536 1.00 0.00 H new ATOM 0 HD22 ASN A 19 113.389 15.444 -10.289 1.00 0.00 H new ATOM 249 N LYS A 20 109.457 11.776 -8.277 1.00 0.00 N ATOM 250 CA LYS A 20 109.293 10.602 -7.422 1.00 0.00 C ATOM 251 C LYS A 20 110.559 10.341 -6.615 1.00 0.00 C ATOM 252 O LYS A 20 111.615 10.902 -6.905 1.00 0.00 O ATOM 253 CB LYS A 20 108.967 9.376 -8.279 1.00 0.00 C ATOM 254 CG LYS A 20 107.679 9.629 -9.066 1.00 0.00 C ATOM 255 CD LYS A 20 107.208 8.330 -9.723 1.00 0.00 C ATOM 256 CE LYS A 20 108.232 7.875 -10.765 1.00 0.00 C ATOM 257 NZ LYS A 20 107.600 6.887 -11.683 1.00 0.00 N ATOM 0 H LYS A 20 109.284 11.605 -9.268 1.00 0.00 H new ATOM 0 HA LYS A 20 108.472 10.792 -6.730 1.00 0.00 H new ATOM 0 HB2 LYS A 20 109.789 9.169 -8.964 1.00 0.00 H new ATOM 0 HB3 LYS A 20 108.851 8.497 -7.645 1.00 0.00 H new ATOM 0 HG2 LYS A 20 106.905 10.012 -8.401 1.00 0.00 H new ATOM 0 HG3 LYS A 20 107.851 10.390 -9.827 1.00 0.00 H new ATOM 0 HD2 LYS A 20 107.077 7.556 -8.967 1.00 0.00 H new ATOM 0 HD3 LYS A 20 106.238 8.482 -10.196 1.00 0.00 H new ATOM 0 HE2 LYS A 20 108.596 8.732 -11.331 1.00 0.00 H new ATOM 0 HE3 LYS A 20 109.095 7.429 -10.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 108.339 6.391 -12.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 107.054 6.197 -11.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 106.965 7.382 -12.342 1.00 0.00 H new ATOM 271 N MET A 21 110.452 9.485 -5.597 1.00 0.00 N ATOM 272 CA MET A 21 111.591 9.212 -4.719 1.00 0.00 C ATOM 273 C MET A 21 111.819 7.712 -4.585 1.00 0.00 C ATOM 274 O MET A 21 110.915 6.921 -4.851 1.00 0.00 O ATOM 275 CB MET A 21 111.334 9.815 -3.337 1.00 0.00 C ATOM 276 CG MET A 21 111.272 11.340 -3.451 1.00 0.00 C ATOM 277 SD MET A 21 111.085 12.063 -1.801 1.00 0.00 S ATOM 278 CE MET A 21 110.917 13.786 -2.328 1.00 0.00 C ATOM 0 H MET A 21 109.600 8.975 -5.362 1.00 0.00 H new ATOM 0 HA MET A 21 112.481 9.664 -5.157 1.00 0.00 H new ATOM 0 HB2 MET A 21 110.399 9.432 -2.929 1.00 0.00 H new ATOM 0 HB3 MET A 21 112.126 9.523 -2.648 1.00 0.00 H new ATOM 0 HG2 MET A 21 112.179 11.717 -3.924 1.00 0.00 H new ATOM 0 HG3 MET A 21 110.436 11.634 -4.085 1.00 0.00 H new ATOM 0 HE1 MET A 21 110.717 14.414 -1.460 1.00 0.00 H new ATOM 0 HE2 MET A 21 111.840 14.112 -2.807 1.00 0.00 H new ATOM 0 HE3 MET A 21 110.092 13.871 -3.035 1.00 0.00 H new ATOM 288 N GLY A 22 113.019 7.323 -4.155 1.00 0.00 N ATOM 289 CA GLY A 22 113.345 5.905 -4.010 1.00 0.00 C ATOM 290 C GLY A 22 113.727 5.595 -2.571 1.00 0.00 C ATOM 291 O GLY A 22 114.278 6.447 -1.879 1.00 0.00 O ATOM 0 H GLY A 22 113.774 7.962 -3.904 1.00 0.00 H new ATOM 0 HA2 GLY A 22 112.490 5.296 -4.306 1.00 0.00 H new ATOM 0 HA3 GLY A 22 114.168 5.644 -4.676 1.00 0.00 H new ATOM 295 N GLY A 23 113.426 4.382 -2.117 1.00 0.00 N ATOM 296 CA GLY A 23 113.742 3.992 -0.746 1.00 0.00 C ATOM 297 C GLY A 23 114.317 2.582 -0.678 1.00 0.00 C ATOM 298 O GLY A 23 113.902 1.697 -1.426 1.00 0.00 O ATOM 0 H GLY A 23 112.968 3.658 -2.671 1.00 0.00 H new ATOM 0 HA2 GLY A 23 114.457 4.697 -0.323 1.00 0.00 H new ATOM 0 HA3 GLY A 23 112.841 4.047 -0.135 1.00 0.00 H new ATOM 302 N PHE A 24 115.276 2.390 0.221 1.00 0.00 N ATOM 303 CA PHE A 24 115.859 1.072 0.463 1.00 0.00 C ATOM 304 C PHE A 24 115.475 0.606 1.862 1.00 0.00 C ATOM 305 O PHE A 24 115.543 1.389 2.807 1.00 0.00 O ATOM 306 CB PHE A 24 117.381 1.148 0.333 1.00 0.00 C ATOM 307 CG PHE A 24 118.069 -0.188 0.477 1.00 0.00 C ATOM 308 CD1 PHE A 24 118.481 -0.631 1.740 1.00 0.00 C ATOM 309 CD2 PHE A 24 118.299 -0.984 -0.651 1.00 0.00 C ATOM 310 CE1 PHE A 24 119.122 -1.867 1.874 1.00 0.00 C ATOM 311 CE2 PHE A 24 118.938 -2.221 -0.518 1.00 0.00 C ATOM 312 CZ PHE A 24 119.352 -2.662 0.745 1.00 0.00 C ATOM 0 H PHE A 24 115.669 3.134 0.798 1.00 0.00 H new ATOM 0 HA PHE A 24 115.480 0.361 -0.272 1.00 0.00 H new ATOM 0 HB2 PHE A 24 117.633 1.574 -0.638 1.00 0.00 H new ATOM 0 HB3 PHE A 24 117.768 1.830 1.090 1.00 0.00 H new ATOM 0 HD1 PHE A 24 118.304 -0.018 2.611 1.00 0.00 H new ATOM 0 HD2 PHE A 24 117.983 -0.643 -1.626 1.00 0.00 H new ATOM 0 HE1 PHE A 24 119.439 -2.208 2.848 1.00 0.00 H new ATOM 0 HE2 PHE A 24 119.112 -2.836 -1.389 1.00 0.00 H new ATOM 0 HZ PHE A 24 119.849 -3.615 0.848 1.00 0.00 H new ATOM 322 N ASN A 25 115.059 -0.655 1.996 1.00 0.00 N ATOM 323 CA ASN A 25 114.553 -1.146 3.278 1.00 0.00 C ATOM 324 C ASN A 25 115.197 -2.469 3.672 1.00 0.00 C ATOM 325 O ASN A 25 115.387 -3.350 2.833 1.00 0.00 O ATOM 326 CB ASN A 25 113.036 -1.334 3.190 1.00 0.00 C ATOM 327 CG ASN A 25 112.452 -1.564 4.578 1.00 0.00 C ATOM 328 OD1 ASN A 25 112.649 -0.749 5.478 1.00 0.00 O ATOM 329 ND2 ASN A 25 111.739 -2.634 4.806 1.00 0.00 N ATOM 0 H ASN A 25 115.062 -1.345 1.245 1.00 0.00 H new ATOM 0 HA ASN A 25 114.803 -0.407 4.039 1.00 0.00 H new ATOM 0 HB2 ASN A 25 112.579 -0.454 2.737 1.00 0.00 H new ATOM 0 HB3 ASN A 25 112.804 -2.182 2.545 1.00 0.00 H new ATOM 0 HD21 ASN A 25 111.344 -2.796 5.732 1.00 0.00 H new ATOM 0 HD22 ASN A 25 111.577 -3.308 4.058 1.00 0.00 H new ATOM 336 N LEU A 26 115.536 -2.588 4.955 1.00 0.00 N ATOM 337 CA LEU A 26 116.045 -3.843 5.506 1.00 0.00 C ATOM 338 C LEU A 26 115.148 -4.289 6.655 1.00 0.00 C ATOM 339 O LEU A 26 114.718 -3.459 7.456 1.00 0.00 O ATOM 340 CB LEU A 26 117.478 -3.653 6.014 1.00 0.00 C ATOM 341 CG LEU A 26 118.375 -3.174 4.870 1.00 0.00 C ATOM 342 CD1 LEU A 26 119.775 -2.878 5.410 1.00 0.00 C ATOM 343 CD2 LEU A 26 118.471 -4.267 3.799 1.00 0.00 C ATOM 0 H LEU A 26 115.467 -1.829 5.633 1.00 0.00 H new ATOM 0 HA LEU A 26 116.046 -4.603 4.725 1.00 0.00 H new ATOM 0 HB2 LEU A 26 117.492 -2.927 6.827 1.00 0.00 H new ATOM 0 HB3 LEU A 26 117.858 -4.592 6.418 1.00 0.00 H new ATOM 0 HG LEU A 26 117.949 -2.270 4.434 1.00 0.00 H new ATOM 0 HD11 LEU A 26 120.414 -2.537 4.596 1.00 0.00 H new ATOM 0 HD12 LEU A 26 119.714 -2.102 6.173 1.00 0.00 H new ATOM 0 HD13 LEU A 26 120.196 -3.784 5.846 1.00 0.00 H new ATOM 0 HD21 LEU A 26 119.110 -3.924 2.985 1.00 0.00 H new ATOM 0 HD22 LEU A 26 118.895 -5.170 4.238 1.00 0.00 H new ATOM 0 HD23 LEU A 26 117.476 -4.485 3.411 1.00 0.00 H new ATOM 355 N LYS A 27 114.872 -5.590 6.742 1.00 0.00 N ATOM 356 CA LYS A 27 113.933 -6.098 7.741 1.00 0.00 C ATOM 357 C LYS A 27 114.520 -7.278 8.508 1.00 0.00 C ATOM 358 O LYS A 27 115.227 -8.113 7.941 1.00 0.00 O ATOM 359 CB LYS A 27 112.646 -6.552 7.051 1.00 0.00 C ATOM 360 CG LYS A 27 112.023 -5.377 6.293 1.00 0.00 C ATOM 361 CD LYS A 27 110.824 -5.868 5.478 1.00 0.00 C ATOM 362 CE LYS A 27 109.688 -6.279 6.419 1.00 0.00 C ATOM 363 NZ LYS A 27 109.861 -7.708 6.811 1.00 0.00 N ATOM 0 H LYS A 27 115.280 -6.305 6.140 1.00 0.00 H new ATOM 0 HA LYS A 27 113.726 -5.292 8.445 1.00 0.00 H new ATOM 0 HB2 LYS A 27 112.860 -7.369 6.362 1.00 0.00 H new ATOM 0 HB3 LYS A 27 111.942 -6.935 7.790 1.00 0.00 H new ATOM 0 HG2 LYS A 27 111.707 -4.605 6.995 1.00 0.00 H new ATOM 0 HG3 LYS A 27 112.763 -4.924 5.633 1.00 0.00 H new ATOM 0 HD2 LYS A 27 110.484 -5.081 4.805 1.00 0.00 H new ATOM 0 HD3 LYS A 27 111.117 -6.714 4.857 1.00 0.00 H new ATOM 0 HE2 LYS A 27 109.688 -5.645 7.306 1.00 0.00 H new ATOM 0 HE3 LYS A 27 108.725 -6.139 5.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 108.995 -8.237 6.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 110.663 -8.117 6.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 110.046 -7.768 7.833 1.00 0.00 H new ATOM 377 N TYR A 28 114.222 -7.337 9.802 1.00 0.00 N ATOM 378 CA TYR A 28 114.596 -8.482 10.628 1.00 0.00 C ATOM 379 C TYR A 28 113.341 -9.076 11.251 1.00 0.00 C ATOM 380 O TYR A 28 112.506 -8.342 11.780 1.00 0.00 O ATOM 381 CB TYR A 28 115.563 -8.042 11.729 1.00 0.00 C ATOM 382 CG TYR A 28 116.847 -7.444 11.199 1.00 0.00 C ATOM 383 CD1 TYR A 28 117.949 -8.268 10.945 1.00 0.00 C ATOM 384 CD2 TYR A 28 116.931 -6.067 10.964 1.00 0.00 C ATOM 385 CE1 TYR A 28 119.137 -7.715 10.455 1.00 0.00 C ATOM 386 CE2 TYR A 28 118.119 -5.513 10.473 1.00 0.00 C ATOM 387 CZ TYR A 28 119.222 -6.337 10.220 1.00 0.00 C ATOM 388 OH TYR A 28 120.394 -5.791 9.736 1.00 0.00 O ATOM 0 H TYR A 28 113.721 -6.603 10.303 1.00 0.00 H new ATOM 0 HA TYR A 28 115.089 -9.231 10.009 1.00 0.00 H new ATOM 0 HB2 TYR A 28 115.067 -7.311 12.367 1.00 0.00 H new ATOM 0 HB3 TYR A 28 115.803 -8.901 12.356 1.00 0.00 H new ATOM 0 HD1 TYR A 28 117.882 -9.330 11.127 1.00 0.00 H new ATOM 0 HD2 TYR A 28 116.080 -5.432 11.161 1.00 0.00 H new ATOM 0 HE1 TYR A 28 119.988 -8.350 10.258 1.00 0.00 H new ATOM 0 HE2 TYR A 28 118.185 -4.451 10.290 1.00 0.00 H new ATOM 0 HH TYR A 28 120.284 -4.823 9.628 1.00 0.00 H new ATOM 398 N ARG A 29 113.205 -10.397 11.184 1.00 0.00 N ATOM 399 CA ARG A 29 112.003 -11.062 11.685 1.00 0.00 C ATOM 400 C ARG A 29 112.359 -12.322 12.468 1.00 0.00 C ATOM 401 O ARG A 29 113.305 -13.031 12.131 1.00 0.00 O ATOM 402 CB ARG A 29 111.084 -11.428 10.515 1.00 0.00 C ATOM 403 CG ARG A 29 109.767 -12.004 11.044 1.00 0.00 C ATOM 404 CD ARG A 29 108.821 -12.276 9.873 1.00 0.00 C ATOM 405 NE ARG A 29 109.327 -13.387 9.063 1.00 0.00 N ATOM 406 CZ ARG A 29 108.537 -14.187 8.328 1.00 0.00 C ATOM 407 NH1 ARG A 29 107.234 -14.032 8.281 1.00 0.00 N ATOM 408 NH2 ARG A 29 109.082 -15.152 7.640 1.00 0.00 N ATOM 0 H ARG A 29 113.906 -11.026 10.791 1.00 0.00 H new ATOM 0 HA ARG A 29 111.488 -10.373 12.355 1.00 0.00 H new ATOM 0 HB2 ARG A 29 110.886 -10.545 9.907 1.00 0.00 H new ATOM 0 HB3 ARG A 29 111.576 -12.156 9.869 1.00 0.00 H new ATOM 0 HG2 ARG A 29 109.956 -12.926 11.594 1.00 0.00 H new ATOM 0 HG3 ARG A 29 109.307 -11.305 11.742 1.00 0.00 H new ATOM 0 HD2 ARG A 29 107.825 -12.513 10.248 1.00 0.00 H new ATOM 0 HD3 ARG A 29 108.725 -11.381 9.258 1.00 0.00 H new ATOM 0 HE ARG A 29 110.332 -13.562 9.057 1.00 0.00 H new ATOM 0 HH11 ARG A 29 106.790 -13.284 8.814 1.00 0.00 H new ATOM 0 HH12 ARG A 29 106.666 -14.659 7.711 1.00 0.00 H new ATOM 0 HH21 ARG A 29 110.092 -15.289 7.666 1.00 0.00 H new ATOM 0 HH22 ARG A 29 108.498 -15.769 7.076 1.00 0.00 H new ATOM 422 N TYR A 30 111.592 -12.591 13.522 1.00 0.00 N ATOM 423 CA TYR A 30 111.770 -13.810 14.301 1.00 0.00 C ATOM 424 C TYR A 30 110.649 -14.789 13.972 1.00 0.00 C ATOM 425 O TYR A 30 109.507 -14.378 13.763 1.00 0.00 O ATOM 426 CB TYR A 30 111.757 -13.487 15.796 1.00 0.00 C ATOM 427 CG TYR A 30 112.875 -12.562 16.218 1.00 0.00 C ATOM 428 CD1 TYR A 30 114.144 -13.082 16.498 1.00 0.00 C ATOM 429 CD2 TYR A 30 112.642 -11.186 16.328 1.00 0.00 C ATOM 430 CE1 TYR A 30 115.180 -12.226 16.889 1.00 0.00 C ATOM 431 CE2 TYR A 30 113.678 -10.330 16.718 1.00 0.00 C ATOM 432 CZ TYR A 30 114.948 -10.849 16.999 1.00 0.00 C ATOM 433 OH TYR A 30 115.969 -10.005 17.385 1.00 0.00 O ATOM 0 H TYR A 30 110.844 -11.982 13.854 1.00 0.00 H new ATOM 0 HA TYR A 30 112.731 -14.259 14.049 1.00 0.00 H new ATOM 0 HB2 TYR A 30 110.801 -13.031 16.054 1.00 0.00 H new ATOM 0 HB3 TYR A 30 111.830 -14.416 16.362 1.00 0.00 H new ATOM 0 HD1 TYR A 30 114.324 -14.143 16.412 1.00 0.00 H new ATOM 0 HD2 TYR A 30 111.663 -10.785 16.112 1.00 0.00 H new ATOM 0 HE1 TYR A 30 116.159 -12.627 17.106 1.00 0.00 H new ATOM 0 HE2 TYR A 30 113.498 -9.268 16.802 1.00 0.00 H new ATOM 0 HH TYR A 30 115.639 -9.083 17.410 1.00 0.00 H new ATOM 443 N GLU A 31 110.974 -16.079 13.931 1.00 0.00 N ATOM 444 CA GLU A 31 109.982 -17.080 13.556 1.00 0.00 C ATOM 445 C GLU A 31 109.291 -17.626 14.798 1.00 0.00 C ATOM 446 O GLU A 31 109.937 -18.096 15.734 1.00 0.00 O ATOM 447 CB GLU A 31 110.654 -18.225 12.795 1.00 0.00 C ATOM 448 CG GLU A 31 111.286 -17.685 11.508 1.00 0.00 C ATOM 449 CD GLU A 31 110.230 -17.088 10.574 1.00 0.00 C ATOM 450 OE1 GLU A 31 109.056 -17.381 10.741 1.00 0.00 O ATOM 451 OE2 GLU A 31 110.618 -16.339 9.692 1.00 0.00 O ATOM 0 H GLU A 31 111.899 -16.450 14.149 1.00 0.00 H new ATOM 0 HA GLU A 31 109.238 -16.610 12.913 1.00 0.00 H new ATOM 0 HB2 GLU A 31 111.417 -18.692 13.419 1.00 0.00 H new ATOM 0 HB3 GLU A 31 109.921 -18.996 12.557 1.00 0.00 H new ATOM 0 HG2 GLU A 31 112.026 -16.924 11.756 1.00 0.00 H new ATOM 0 HG3 GLU A 31 111.814 -18.489 10.995 1.00 0.00 H new ATOM 458 N GLU A 32 107.964 -17.554 14.787 1.00 0.00 N ATOM 459 CA GLU A 32 107.165 -17.901 15.957 1.00 0.00 C ATOM 460 C GLU A 32 105.976 -18.772 15.571 1.00 0.00 C ATOM 461 O GLU A 32 105.485 -18.716 14.443 1.00 0.00 O ATOM 462 CB GLU A 32 106.675 -16.627 16.647 1.00 0.00 C ATOM 463 CG GLU A 32 107.885 -15.810 17.118 1.00 0.00 C ATOM 464 CD GLU A 32 108.716 -16.581 18.146 1.00 0.00 C ATOM 465 OE1 GLU A 32 108.210 -17.533 18.723 1.00 0.00 O ATOM 466 OE2 GLU A 32 109.859 -16.204 18.345 1.00 0.00 O ATOM 0 H GLU A 32 107.418 -17.258 13.978 1.00 0.00 H new ATOM 0 HA GLU A 32 107.793 -18.468 16.644 1.00 0.00 H new ATOM 0 HB2 GLU A 32 106.068 -16.037 15.960 1.00 0.00 H new ATOM 0 HB3 GLU A 32 106.040 -16.880 17.496 1.00 0.00 H new ATOM 0 HG2 GLU A 32 108.509 -15.555 16.261 1.00 0.00 H new ATOM 0 HG3 GLU A 32 107.544 -14.871 17.554 1.00 0.00 H new ATOM 473 N ASP A 33 105.521 -19.576 16.524 1.00 0.00 N ATOM 474 CA ASP A 33 104.413 -20.495 16.290 1.00 0.00 C ATOM 475 C ASP A 33 103.088 -19.741 16.240 1.00 0.00 C ATOM 476 O ASP A 33 103.055 -18.512 16.286 1.00 0.00 O ATOM 477 CB ASP A 33 104.363 -21.544 17.405 1.00 0.00 C ATOM 478 CG ASP A 33 105.635 -22.393 17.399 1.00 0.00 C ATOM 479 OD1 ASP A 33 106.199 -22.585 16.334 1.00 0.00 O ATOM 480 OD2 ASP A 33 106.025 -22.838 18.465 1.00 0.00 O ATOM 0 H ASP A 33 105.903 -19.610 17.469 1.00 0.00 H new ATOM 0 HA ASP A 33 104.572 -20.988 15.331 1.00 0.00 H new ATOM 0 HB2 ASP A 33 104.252 -21.051 18.371 1.00 0.00 H new ATOM 0 HB3 ASP A 33 103.491 -22.184 17.271 1.00 0.00 H new ATOM 485 N ASN A 34 102.004 -20.483 16.060 1.00 0.00 N ATOM 486 CA ASN A 34 100.681 -19.880 15.966 1.00 0.00 C ATOM 487 C ASN A 34 100.344 -19.019 17.185 1.00 0.00 C ATOM 488 O ASN A 34 99.651 -18.010 17.046 1.00 0.00 O ATOM 489 CB ASN A 34 99.625 -20.980 15.818 1.00 0.00 C ATOM 490 CG ASN A 34 99.831 -21.739 14.513 1.00 0.00 C ATOM 491 OD1 ASN A 34 100.431 -21.216 13.571 1.00 0.00 O ATOM 492 ND2 ASN A 34 99.366 -22.954 14.395 1.00 0.00 N ATOM 0 H ASN A 34 102.014 -21.500 15.976 1.00 0.00 H new ATOM 0 HA ASN A 34 100.683 -19.229 15.092 1.00 0.00 H new ATOM 0 HB2 ASN A 34 99.687 -21.669 16.661 1.00 0.00 H new ATOM 0 HB3 ASN A 34 98.628 -20.541 15.838 1.00 0.00 H new ATOM 0 HD21 ASN A 34 99.499 -23.469 13.525 1.00 0.00 H new ATOM 0 HD22 ASN A 34 98.870 -23.388 15.173 1.00 0.00 H new ATOM 499 N SER A 35 100.826 -19.401 18.370 1.00 0.00 N ATOM 500 CA SER A 35 100.373 -18.741 19.597 1.00 0.00 C ATOM 501 C SER A 35 101.255 -17.570 20.054 1.00 0.00 C ATOM 502 O SER A 35 100.753 -16.678 20.740 1.00 0.00 O ATOM 503 CB SER A 35 100.297 -19.769 20.725 1.00 0.00 C ATOM 504 OG SER A 35 99.124 -20.556 20.562 1.00 0.00 O ATOM 0 H SER A 35 101.512 -20.144 18.506 1.00 0.00 H new ATOM 0 HA SER A 35 99.396 -18.318 19.365 1.00 0.00 H new ATOM 0 HB2 SER A 35 101.181 -20.406 20.713 1.00 0.00 H new ATOM 0 HB3 SER A 35 100.280 -19.265 21.692 1.00 0.00 H new ATOM 0 HG SER A 35 99.072 -21.218 21.282 1.00 0.00 H new ATOM 510 N PRO A 36 102.525 -17.526 19.724 1.00 0.00 N ATOM 511 CA PRO A 36 103.325 -16.277 19.852 1.00 0.00 C ATOM 512 C PRO A 36 103.536 -15.594 18.500 1.00 0.00 C ATOM 513 O PRO A 36 103.852 -16.245 17.504 1.00 0.00 O ATOM 514 CB PRO A 36 104.654 -16.763 20.451 1.00 0.00 C ATOM 515 CG PRO A 36 104.659 -18.258 20.335 1.00 0.00 C ATOM 516 CD PRO A 36 103.438 -18.652 19.503 1.00 0.00 C ATOM 0 HA PRO A 36 102.831 -15.525 20.468 1.00 0.00 H new ATOM 0 HB2 PRO A 36 105.500 -16.331 19.917 1.00 0.00 H new ATOM 0 HB3 PRO A 36 104.744 -16.456 21.493 1.00 0.00 H new ATOM 0 HG2 PRO A 36 105.577 -18.604 19.859 1.00 0.00 H new ATOM 0 HG3 PRO A 36 104.618 -18.720 21.321 1.00 0.00 H new ATOM 0 HD2 PRO A 36 103.687 -18.771 18.449 1.00 0.00 H new ATOM 0 HD3 PRO A 36 103.007 -19.596 19.837 1.00 0.00 H new ATOM 524 N LEU A 37 103.354 -14.275 18.477 1.00 0.00 N ATOM 525 CA LEU A 37 103.470 -13.510 17.239 1.00 0.00 C ATOM 526 C LEU A 37 104.932 -13.278 16.867 1.00 0.00 C ATOM 527 O LEU A 37 105.820 -13.362 17.716 1.00 0.00 O ATOM 528 CB LEU A 37 102.747 -12.165 17.386 1.00 0.00 C ATOM 529 CG LEU A 37 103.387 -11.330 18.508 1.00 0.00 C ATOM 530 CD1 LEU A 37 104.505 -10.450 17.935 1.00 0.00 C ATOM 531 CD2 LEU A 37 102.325 -10.435 19.160 1.00 0.00 C ATOM 0 H LEU A 37 103.126 -13.716 19.299 1.00 0.00 H new ATOM 0 HA LEU A 37 103.005 -14.087 16.439 1.00 0.00 H new ATOM 0 HB2 LEU A 37 102.792 -11.616 16.445 1.00 0.00 H new ATOM 0 HB3 LEU A 37 101.693 -12.334 17.606 1.00 0.00 H new ATOM 0 HG LEU A 37 103.805 -12.006 19.254 1.00 0.00 H new ATOM 0 HD11 LEU A 37 104.952 -9.862 18.737 1.00 0.00 H new ATOM 0 HD12 LEU A 37 105.267 -11.081 17.479 1.00 0.00 H new ATOM 0 HD13 LEU A 37 104.091 -9.780 17.182 1.00 0.00 H new ATOM 0 HD21 LEU A 37 102.784 -9.846 19.954 1.00 0.00 H new ATOM 0 HD22 LEU A 37 101.902 -9.767 18.410 1.00 0.00 H new ATOM 0 HD23 LEU A 37 101.534 -11.056 19.580 1.00 0.00 H new ATOM 543 N GLY A 38 105.171 -12.966 15.596 1.00 0.00 N ATOM 544 CA GLY A 38 106.529 -12.735 15.111 1.00 0.00 C ATOM 545 C GLY A 38 106.847 -11.245 15.128 1.00 0.00 C ATOM 546 O GLY A 38 105.996 -10.431 14.779 1.00 0.00 O ATOM 0 H GLY A 38 104.446 -12.868 14.886 1.00 0.00 H new ATOM 0 HA2 GLY A 38 107.242 -13.274 15.735 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.633 -13.125 14.098 1.00 0.00 H new ATOM 550 N VAL A 39 108.068 -10.885 15.516 1.00 0.00 N ATOM 551 CA VAL A 39 108.417 -9.471 15.660 1.00 0.00 C ATOM 552 C VAL A 39 109.219 -9.008 14.450 1.00 0.00 C ATOM 553 O VAL A 39 110.247 -9.596 14.118 1.00 0.00 O ATOM 554 CB VAL A 39 109.234 -9.253 16.941 1.00 0.00 C ATOM 555 CG1 VAL A 39 109.508 -7.758 17.135 1.00 0.00 C ATOM 556 CG2 VAL A 39 108.455 -9.776 18.151 1.00 0.00 C ATOM 0 H VAL A 39 108.821 -11.538 15.733 1.00 0.00 H new ATOM 0 HA VAL A 39 107.498 -8.888 15.725 1.00 0.00 H new ATOM 0 HB VAL A 39 110.177 -9.791 16.851 1.00 0.00 H new ATOM 0 HG11 VAL A 39 110.088 -7.610 18.046 1.00 0.00 H new ATOM 0 HG12 VAL A 39 110.069 -7.377 16.281 1.00 0.00 H new ATOM 0 HG13 VAL A 39 108.562 -7.222 17.216 1.00 0.00 H new ATOM 0 HG21 VAL A 39 109.041 -9.618 19.057 1.00 0.00 H new ATOM 0 HG22 VAL A 39 107.509 -9.242 18.233 1.00 0.00 H new ATOM 0 HG23 VAL A 39 108.260 -10.841 18.026 1.00 0.00 H new ATOM 566 N ILE A 40 108.751 -7.943 13.801 1.00 0.00 N ATOM 567 CA ILE A 40 109.439 -7.405 12.632 1.00 0.00 C ATOM 568 C ILE A 40 109.863 -5.971 12.915 1.00 0.00 C ATOM 569 O ILE A 40 109.090 -5.199 13.476 1.00 0.00 O ATOM 570 CB ILE A 40 108.515 -7.436 11.407 1.00 0.00 C ATOM 571 CG1 ILE A 40 108.036 -8.867 11.157 1.00 0.00 C ATOM 572 CG2 ILE A 40 109.276 -6.946 10.169 1.00 0.00 C ATOM 573 CD1 ILE A 40 106.929 -8.866 10.101 1.00 0.00 C ATOM 0 H ILE A 40 107.904 -7.439 14.064 1.00 0.00 H new ATOM 0 HA ILE A 40 110.317 -8.016 12.423 1.00 0.00 H new ATOM 0 HB ILE A 40 107.660 -6.787 11.595 1.00 0.00 H new ATOM 0 HG12 ILE A 40 108.869 -9.486 10.823 1.00 0.00 H new ATOM 0 HG13 ILE A 40 107.666 -9.304 12.085 1.00 0.00 H new ATOM 0 HG21 ILE A 40 108.615 -6.970 9.303 1.00 0.00 H new ATOM 0 HG22 ILE A 40 109.621 -5.925 10.334 1.00 0.00 H new ATOM 0 HG23 ILE A 40 110.134 -7.594 9.989 1.00 0.00 H new ATOM 0 HD11 ILE A 40 106.591 -9.888 9.927 1.00 0.00 H new ATOM 0 HD12 ILE A 40 106.092 -8.262 10.452 1.00 0.00 H new ATOM 0 HD13 ILE A 40 107.314 -8.447 9.171 1.00 0.00 H new ATOM 585 N GLY A 41 111.091 -5.640 12.538 1.00 0.00 N ATOM 586 CA GLY A 41 111.578 -4.270 12.642 1.00 0.00 C ATOM 587 C GLY A 41 112.297 -3.899 11.354 1.00 0.00 C ATOM 588 O GLY A 41 113.061 -4.706 10.825 1.00 0.00 O ATOM 0 H GLY A 41 111.768 -6.301 12.157 1.00 0.00 H new ATOM 0 HA2 GLY A 41 110.747 -3.588 12.819 1.00 0.00 H new ATOM 0 HA3 GLY A 41 112.255 -4.175 13.491 1.00 0.00 H new ATOM 592 N SER A 42 112.049 -2.697 10.838 1.00 0.00 N ATOM 593 CA SER A 42 112.614 -2.314 9.546 1.00 0.00 C ATOM 594 C SER A 42 113.125 -0.880 9.561 1.00 0.00 C ATOM 595 O SER A 42 112.582 -0.022 10.256 1.00 0.00 O ATOM 596 CB SER A 42 111.554 -2.456 8.455 1.00 0.00 C ATOM 597 OG SER A 42 110.629 -1.383 8.554 1.00 0.00 O ATOM 0 H SER A 42 111.472 -1.984 11.284 1.00 0.00 H new ATOM 0 HA SER A 42 113.455 -2.977 9.343 1.00 0.00 H new ATOM 0 HB2 SER A 42 112.025 -2.455 7.472 1.00 0.00 H new ATOM 0 HB3 SER A 42 111.035 -3.409 8.559 1.00 0.00 H new ATOM 0 HG SER A 42 109.853 -1.668 9.080 1.00 0.00 H new ATOM 603 N PHE A 43 114.163 -0.642 8.764 1.00 0.00 N ATOM 604 CA PHE A 43 114.723 0.696 8.611 1.00 0.00 C ATOM 605 C PHE A 43 114.674 1.088 7.140 1.00 0.00 C ATOM 606 O PHE A 43 115.007 0.276 6.276 1.00 0.00 O ATOM 607 CB PHE A 43 116.172 0.715 9.100 1.00 0.00 C ATOM 608 CG PHE A 43 116.323 0.335 10.556 1.00 0.00 C ATOM 609 CD1 PHE A 43 116.225 1.316 11.550 1.00 0.00 C ATOM 610 CD2 PHE A 43 116.560 -0.998 10.908 1.00 0.00 C ATOM 611 CE1 PHE A 43 116.363 0.964 12.896 1.00 0.00 C ATOM 612 CE2 PHE A 43 116.700 -1.351 12.256 1.00 0.00 C ATOM 613 CZ PHE A 43 116.602 -0.369 13.250 1.00 0.00 C ATOM 0 H PHE A 43 114.634 -1.360 8.213 1.00 0.00 H new ATOM 0 HA PHE A 43 114.142 1.404 9.202 1.00 0.00 H new ATOM 0 HB2 PHE A 43 116.762 0.030 8.491 1.00 0.00 H new ATOM 0 HB3 PHE A 43 116.585 1.712 8.948 1.00 0.00 H new ATOM 0 HD1 PHE A 43 116.043 2.345 11.277 1.00 0.00 H new ATOM 0 HD2 PHE A 43 116.635 -1.754 10.141 1.00 0.00 H new ATOM 0 HE1 PHE A 43 116.285 1.721 13.663 1.00 0.00 H new ATOM 0 HE2 PHE A 43 116.883 -2.380 12.529 1.00 0.00 H new ATOM 0 HZ PHE A 43 116.711 -0.640 14.290 1.00 0.00 H new ATOM 623 N THR A 44 114.254 2.317 6.856 1.00 0.00 N ATOM 624 CA THR A 44 114.165 2.782 5.474 1.00 0.00 C ATOM 625 C THR A 44 114.851 4.134 5.303 1.00 0.00 C ATOM 626 O THR A 44 114.740 5.008 6.164 1.00 0.00 O ATOM 627 CB THR A 44 112.693 2.886 5.057 1.00 0.00 C ATOM 628 OG1 THR A 44 112.616 3.309 3.704 1.00 0.00 O ATOM 629 CG2 THR A 44 111.960 3.889 5.954 1.00 0.00 C ATOM 0 H THR A 44 113.972 3.004 7.556 1.00 0.00 H new ATOM 0 HA THR A 44 114.675 2.060 4.836 1.00 0.00 H new ATOM 0 HB THR A 44 112.221 1.909 5.163 1.00 0.00 H new ATOM 0 HG1 THR A 44 111.676 3.375 3.435 1.00 0.00 H new ATOM 0 HG21 THR A 44 110.916 3.955 5.649 1.00 0.00 H new ATOM 0 HG22 THR A 44 112.015 3.558 6.991 1.00 0.00 H new ATOM 0 HG23 THR A 44 112.427 4.869 5.861 1.00 0.00 H new ATOM 637 N TYR A 45 115.552 4.284 4.183 1.00 0.00 N ATOM 638 CA TYR A 45 116.212 5.542 3.848 1.00 0.00 C ATOM 639 C TYR A 45 115.764 6.002 2.464 1.00 0.00 C ATOM 640 O TYR A 45 115.686 5.189 1.545 1.00 0.00 O ATOM 641 CB TYR A 45 117.730 5.351 3.847 1.00 0.00 C ATOM 642 CG TYR A 45 118.264 4.744 5.124 1.00 0.00 C ATOM 643 CD1 TYR A 45 118.589 5.567 6.207 1.00 0.00 C ATOM 644 CD2 TYR A 45 118.437 3.359 5.219 1.00 0.00 C ATOM 645 CE1 TYR A 45 119.085 5.004 7.390 1.00 0.00 C ATOM 646 CE2 TYR A 45 118.933 2.795 6.400 1.00 0.00 C ATOM 647 CZ TYR A 45 119.258 3.617 7.487 1.00 0.00 C ATOM 648 OH TYR A 45 119.748 3.062 8.650 1.00 0.00 O ATOM 0 H TYR A 45 115.678 3.547 3.489 1.00 0.00 H new ATOM 0 HA TYR A 45 115.942 6.293 4.591 1.00 0.00 H new ATOM 0 HB2 TYR A 45 118.007 4.713 3.008 1.00 0.00 H new ATOM 0 HB3 TYR A 45 118.209 6.317 3.685 1.00 0.00 H new ATOM 0 HD1 TYR A 45 118.458 6.636 6.131 1.00 0.00 H new ATOM 0 HD2 TYR A 45 118.188 2.725 4.381 1.00 0.00 H new ATOM 0 HE1 TYR A 45 119.334 5.639 8.227 1.00 0.00 H new ATOM 0 HE2 TYR A 45 119.065 1.726 6.473 1.00 0.00 H new ATOM 0 HH TYR A 45 119.805 2.089 8.549 1.00 0.00 H new ATOM 658 N THR A 46 115.480 7.293 2.312 1.00 0.00 N ATOM 659 CA THR A 46 115.018 7.818 1.029 1.00 0.00 C ATOM 660 C THR A 46 116.158 8.515 0.290 1.00 0.00 C ATOM 661 O THR A 46 117.020 9.140 0.907 1.00 0.00 O ATOM 662 CB THR A 46 113.869 8.804 1.245 1.00 0.00 C ATOM 663 OG1 THR A 46 112.853 8.179 2.017 1.00 0.00 O ATOM 664 CG2 THR A 46 113.291 9.226 -0.109 1.00 0.00 C ATOM 0 H THR A 46 115.560 7.989 3.053 1.00 0.00 H new ATOM 0 HA THR A 46 114.667 6.981 0.425 1.00 0.00 H new ATOM 0 HB THR A 46 114.240 9.684 1.770 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.116 8.809 2.159 1.00 0.00 H new ATOM 0 HG21 THR A 46 112.472 9.929 0.048 1.00 0.00 H new ATOM 0 HG22 THR A 46 114.070 9.703 -0.704 1.00 0.00 H new ATOM 0 HG23 THR A 46 112.919 8.347 -0.636 1.00 0.00 H new ATOM 672 N GLU A 47 116.152 8.403 -1.036 1.00 0.00 N ATOM 673 CA GLU A 47 117.211 8.982 -1.855 1.00 0.00 C ATOM 674 C GLU A 47 116.613 9.791 -3.000 1.00 0.00 C ATOM 675 O GLU A 47 115.549 9.453 -3.523 1.00 0.00 O ATOM 676 CB GLU A 47 118.093 7.868 -2.426 1.00 0.00 C ATOM 677 CG GLU A 47 118.736 7.085 -1.277 1.00 0.00 C ATOM 678 CD GLU A 47 119.645 7.978 -0.427 1.00 0.00 C ATOM 679 OE1 GLU A 47 120.031 9.042 -0.889 1.00 0.00 O ATOM 680 OE2 GLU A 47 119.946 7.578 0.686 1.00 0.00 O ATOM 0 H GLU A 47 115.427 7.918 -1.564 1.00 0.00 H new ATOM 0 HA GLU A 47 117.813 9.641 -1.230 1.00 0.00 H new ATOM 0 HB2 GLU A 47 117.496 7.199 -3.047 1.00 0.00 H new ATOM 0 HB3 GLU A 47 118.865 8.294 -3.067 1.00 0.00 H new ATOM 0 HG2 GLU A 47 117.957 6.654 -0.648 1.00 0.00 H new ATOM 0 HG3 GLU A 47 119.315 6.254 -1.681 1.00 0.00 H new ATOM 687 N LYS A 48 117.314 10.856 -3.377 1.00 0.00 N ATOM 688 CA LYS A 48 116.881 11.712 -4.476 1.00 0.00 C ATOM 689 C LYS A 48 118.065 12.015 -5.390 1.00 0.00 C ATOM 690 O LYS A 48 119.167 12.296 -4.916 1.00 0.00 O ATOM 691 CB LYS A 48 116.309 13.020 -3.922 1.00 0.00 C ATOM 692 CG LYS A 48 115.729 13.862 -5.061 1.00 0.00 C ATOM 693 CD LYS A 48 114.392 13.269 -5.511 1.00 0.00 C ATOM 694 CE LYS A 48 113.767 14.169 -6.577 1.00 0.00 C ATOM 695 NZ LYS A 48 114.418 13.908 -7.892 1.00 0.00 N ATOM 0 H LYS A 48 118.187 11.147 -2.936 1.00 0.00 H new ATOM 0 HA LYS A 48 116.108 11.197 -5.047 1.00 0.00 H new ATOM 0 HB2 LYS A 48 115.534 12.805 -3.187 1.00 0.00 H new ATOM 0 HB3 LYS A 48 117.090 13.579 -3.407 1.00 0.00 H new ATOM 0 HG2 LYS A 48 115.589 14.891 -4.730 1.00 0.00 H new ATOM 0 HG3 LYS A 48 116.426 13.888 -5.898 1.00 0.00 H new ATOM 0 HD2 LYS A 48 114.543 12.266 -5.910 1.00 0.00 H new ATOM 0 HD3 LYS A 48 113.719 13.175 -4.659 1.00 0.00 H new ATOM 0 HE2 LYS A 48 112.696 13.980 -6.646 1.00 0.00 H new ATOM 0 HE3 LYS A 48 113.888 15.216 -6.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 114.526 14.803 -8.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 115.354 13.482 -7.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 113.829 13.256 -8.448 1.00 0.00 H new ATOM 709 N SER A 49 117.839 11.956 -6.699 1.00 0.00 N ATOM 710 CA SER A 49 118.915 12.181 -7.661 1.00 0.00 C ATOM 711 C SER A 49 118.783 13.551 -8.319 1.00 0.00 C ATOM 712 O SER A 49 117.691 13.962 -8.713 1.00 0.00 O ATOM 713 CB SER A 49 118.878 11.097 -8.740 1.00 0.00 C ATOM 714 OG SER A 49 119.996 11.259 -9.602 1.00 0.00 O ATOM 0 H SER A 49 116.930 11.756 -7.116 1.00 0.00 H new ATOM 0 HA SER A 49 119.864 12.141 -7.126 1.00 0.00 H new ATOM 0 HB2 SER A 49 118.898 10.109 -8.281 1.00 0.00 H new ATOM 0 HB3 SER A 49 117.951 11.165 -9.310 1.00 0.00 H new ATOM 0 HG SER A 49 119.978 10.566 -10.295 1.00 0.00 H new ATOM 720 N ARG A 50 119.908 14.252 -8.430 1.00 0.00 N ATOM 721 CA ARG A 50 119.935 15.560 -9.075 1.00 0.00 C ATOM 722 C ARG A 50 121.117 15.654 -10.035 1.00 0.00 C ATOM 723 O ARG A 50 121.995 14.793 -10.038 1.00 0.00 O ATOM 724 CB ARG A 50 120.043 16.665 -8.024 1.00 0.00 C ATOM 725 CG ARG A 50 118.793 16.665 -7.145 1.00 0.00 C ATOM 726 CD ARG A 50 118.886 17.804 -6.127 1.00 0.00 C ATOM 727 NE ARG A 50 118.775 19.099 -6.805 1.00 0.00 N ATOM 728 CZ ARG A 50 119.210 20.252 -6.274 1.00 0.00 C ATOM 729 NH1 ARG A 50 119.772 20.309 -5.091 1.00 0.00 N ATOM 730 NH2 ARG A 50 119.069 21.355 -6.959 1.00 0.00 N ATOM 0 H ARG A 50 120.813 13.935 -8.081 1.00 0.00 H new ATOM 0 HA ARG A 50 119.009 15.686 -9.636 1.00 0.00 H new ATOM 0 HB2 ARG A 50 120.931 16.511 -7.410 1.00 0.00 H new ATOM 0 HB3 ARG A 50 120.157 17.633 -8.511 1.00 0.00 H new ATOM 0 HG2 ARG A 50 117.902 16.785 -7.761 1.00 0.00 H new ATOM 0 HG3 ARG A 50 118.698 15.709 -6.630 1.00 0.00 H new ATOM 0 HD2 ARG A 50 118.093 17.704 -5.385 1.00 0.00 H new ATOM 0 HD3 ARG A 50 119.833 17.746 -5.591 1.00 0.00 H new ATOM 0 HE ARG A 50 118.344 19.125 -7.729 1.00 0.00 H new ATOM 0 HH11 ARG A 50 119.891 19.458 -4.541 1.00 0.00 H new ATOM 0 HH12 ARG A 50 120.090 21.204 -4.720 1.00 0.00 H new ATOM 0 HH21 ARG A 50 118.634 21.330 -7.881 1.00 0.00 H new ATOM 0 HH22 ARG A 50 119.394 22.241 -6.572 1.00 0.00 H new ATOM 744 N THR A 51 121.130 16.703 -10.850 1.00 0.00 N ATOM 745 CA THR A 51 122.230 16.912 -11.787 1.00 0.00 C ATOM 746 C THR A 51 123.495 17.299 -11.031 1.00 0.00 C ATOM 747 O THR A 51 123.444 17.607 -9.839 1.00 0.00 O ATOM 748 CB THR A 51 121.874 18.018 -12.786 1.00 0.00 C ATOM 749 OG1 THR A 51 121.712 19.246 -12.094 1.00 0.00 O ATOM 750 CG2 THR A 51 120.576 17.663 -13.516 1.00 0.00 C ATOM 0 H THR A 51 120.401 17.415 -10.882 1.00 0.00 H new ATOM 0 HA THR A 51 122.404 15.983 -12.329 1.00 0.00 H new ATOM 0 HB THR A 51 122.678 18.115 -13.516 1.00 0.00 H new ATOM 0 HG1 THR A 51 121.486 19.954 -12.733 1.00 0.00 H new ATOM 0 HG21 THR A 51 120.329 18.454 -14.224 1.00 0.00 H new ATOM 0 HG22 THR A 51 120.705 16.723 -14.052 1.00 0.00 H new ATOM 0 HG23 THR A 51 119.768 17.559 -12.792 1.00 0.00 H new ATOM 758 N ALA A 52 124.631 17.281 -11.722 1.00 0.00 N ATOM 759 CA ALA A 52 125.903 17.592 -11.080 1.00 0.00 C ATOM 760 C ALA A 52 125.861 18.987 -10.461 1.00 0.00 C ATOM 761 O ALA A 52 125.695 19.985 -11.162 1.00 0.00 O ATOM 762 CB ALA A 52 127.036 17.522 -12.106 1.00 0.00 C ATOM 0 H ALA A 52 124.697 17.057 -12.715 1.00 0.00 H new ATOM 0 HA ALA A 52 126.081 16.860 -10.292 1.00 0.00 H new ATOM 0 HB1 ALA A 52 127.983 17.755 -11.619 1.00 0.00 H new ATOM 0 HB2 ALA A 52 127.083 16.518 -12.528 1.00 0.00 H new ATOM 0 HB3 ALA A 52 126.850 18.242 -12.903 1.00 0.00 H new ATOM 768 N SER A 53 126.013 19.041 -9.142 1.00 0.00 N ATOM 769 CA SER A 53 125.962 20.309 -8.426 1.00 0.00 C ATOM 770 C SER A 53 126.642 20.185 -7.068 1.00 0.00 C ATOM 771 O SER A 53 127.132 19.117 -6.702 1.00 0.00 O ATOM 772 CB SER A 53 124.508 20.741 -8.232 1.00 0.00 C ATOM 773 OG SER A 53 123.886 19.879 -7.288 1.00 0.00 O ATOM 0 H SER A 53 126.172 18.226 -8.550 1.00 0.00 H new ATOM 0 HA SER A 53 126.488 21.059 -9.016 1.00 0.00 H new ATOM 0 HB2 SER A 53 124.466 21.773 -7.883 1.00 0.00 H new ATOM 0 HB3 SER A 53 123.975 20.704 -9.182 1.00 0.00 H new ATOM 0 HG SER A 53 122.954 20.153 -7.159 1.00 0.00 H new ATOM 779 N SER A 54 126.678 21.289 -6.328 1.00 0.00 N ATOM 780 CA SER A 54 127.275 21.290 -4.994 1.00 0.00 C ATOM 781 C SER A 54 126.584 20.300 -4.048 1.00 0.00 C ATOM 782 O SER A 54 127.193 19.838 -3.084 1.00 0.00 O ATOM 783 CB SER A 54 127.197 22.695 -4.396 1.00 0.00 C ATOM 784 OG SER A 54 125.837 23.020 -4.143 1.00 0.00 O ATOM 0 H SER A 54 126.304 22.190 -6.626 1.00 0.00 H new ATOM 0 HA SER A 54 128.314 20.979 -5.103 1.00 0.00 H new ATOM 0 HB2 SER A 54 127.773 22.742 -3.472 1.00 0.00 H new ATOM 0 HB3 SER A 54 127.635 23.420 -5.082 1.00 0.00 H new ATOM 0 HG SER A 54 125.782 23.919 -3.758 1.00 0.00 H new ATOM 790 N GLY A 55 125.319 19.975 -4.316 1.00 0.00 N ATOM 791 CA GLY A 55 124.567 19.068 -3.450 1.00 0.00 C ATOM 792 C GLY A 55 125.047 17.614 -3.538 1.00 0.00 C ATOM 793 O GLY A 55 124.679 16.795 -2.695 1.00 0.00 O ATOM 0 H GLY A 55 124.797 20.324 -5.120 1.00 0.00 H new ATOM 0 HA2 GLY A 55 124.649 19.409 -2.418 1.00 0.00 H new ATOM 0 HA3 GLY A 55 123.511 19.112 -3.717 1.00 0.00 H new ATOM 797 N ASP A 56 125.847 17.281 -4.550 1.00 0.00 N ATOM 798 CA ASP A 56 126.367 15.926 -4.695 1.00 0.00 C ATOM 799 C ASP A 56 125.223 14.918 -4.824 1.00 0.00 C ATOM 800 O ASP A 56 125.198 13.884 -4.154 1.00 0.00 O ATOM 801 CB ASP A 56 127.257 15.576 -3.497 1.00 0.00 C ATOM 802 CG ASP A 56 128.461 16.515 -3.435 1.00 0.00 C ATOM 803 OD1 ASP A 56 128.910 16.950 -4.483 1.00 0.00 O ATOM 804 OD2 ASP A 56 128.918 16.783 -2.337 1.00 0.00 O ATOM 0 H ASP A 56 126.147 17.929 -5.278 1.00 0.00 H new ATOM 0 HA ASP A 56 126.965 15.878 -5.605 1.00 0.00 H new ATOM 0 HB2 ASP A 56 126.682 15.651 -2.574 1.00 0.00 H new ATOM 0 HB3 ASP A 56 127.597 14.543 -3.578 1.00 0.00 H new ATOM 809 N TYR A 57 124.275 15.230 -5.702 1.00 0.00 N ATOM 810 CA TYR A 57 123.146 14.338 -5.948 1.00 0.00 C ATOM 811 C TYR A 57 122.336 14.080 -4.675 1.00 0.00 C ATOM 812 O TYR A 57 121.748 13.011 -4.514 1.00 0.00 O ATOM 813 CB TYR A 57 123.657 13.004 -6.498 1.00 0.00 C ATOM 814 CG TYR A 57 124.576 13.151 -7.688 1.00 0.00 C ATOM 815 CD1 TYR A 57 125.956 13.277 -7.492 1.00 0.00 C ATOM 816 CD2 TYR A 57 124.049 13.159 -8.986 1.00 0.00 C ATOM 817 CE1 TYR A 57 126.810 13.413 -8.593 1.00 0.00 C ATOM 818 CE2 TYR A 57 124.904 13.296 -10.087 1.00 0.00 C ATOM 819 CZ TYR A 57 126.285 13.423 -9.890 1.00 0.00 C ATOM 820 OH TYR A 57 127.126 13.557 -10.977 1.00 0.00 O ATOM 0 H TYR A 57 124.265 16.089 -6.253 1.00 0.00 H new ATOM 0 HA TYR A 57 122.492 14.823 -6.673 1.00 0.00 H new ATOM 0 HB2 TYR A 57 124.185 12.473 -5.706 1.00 0.00 H new ATOM 0 HB3 TYR A 57 122.804 12.388 -6.782 1.00 0.00 H new ATOM 0 HD1 TYR A 57 126.362 13.269 -6.491 1.00 0.00 H new ATOM 0 HD2 TYR A 57 122.984 13.060 -9.138 1.00 0.00 H new ATOM 0 HE1 TYR A 57 127.875 13.510 -8.441 1.00 0.00 H new ATOM 0 HE2 TYR A 57 124.498 13.304 -11.088 1.00 0.00 H new ATOM 0 HH TYR A 57 126.598 13.543 -11.803 1.00 0.00 H new ATOM 830 N ASN A 58 122.300 15.058 -3.770 1.00 0.00 N ATOM 831 CA ASN A 58 121.558 14.914 -2.521 1.00 0.00 C ATOM 832 C ASN A 58 120.621 16.100 -2.309 1.00 0.00 C ATOM 833 O ASN A 58 121.067 17.241 -2.187 1.00 0.00 O ATOM 834 CB ASN A 58 122.531 14.818 -1.344 1.00 0.00 C ATOM 835 CG ASN A 58 123.381 13.555 -1.460 1.00 0.00 C ATOM 836 OD1 ASN A 58 122.993 12.598 -2.131 1.00 0.00 O ATOM 837 ND2 ASN A 58 124.527 13.495 -0.839 1.00 0.00 N ATOM 0 H ASN A 58 122.774 15.954 -3.879 1.00 0.00 H new ATOM 0 HA ASN A 58 120.963 14.002 -2.580 1.00 0.00 H new ATOM 0 HB2 ASN A 58 123.175 15.697 -1.323 1.00 0.00 H new ATOM 0 HB3 ASN A 58 121.977 14.807 -0.405 1.00 0.00 H new ATOM 0 HD21 ASN A 58 125.102 12.655 -0.909 1.00 0.00 H new ATOM 0 HD22 ASN A 58 124.848 14.288 -0.283 1.00 0.00 H new ATOM 844 N LYS A 59 119.321 15.823 -2.266 1.00 0.00 N ATOM 845 CA LYS A 59 118.336 16.869 -2.019 1.00 0.00 C ATOM 846 C LYS A 59 117.985 16.921 -0.535 1.00 0.00 C ATOM 847 O LYS A 59 118.321 17.879 0.160 1.00 0.00 O ATOM 848 CB LYS A 59 117.072 16.607 -2.844 1.00 0.00 C ATOM 849 CG LYS A 59 116.115 17.792 -2.701 1.00 0.00 C ATOM 850 CD LYS A 59 114.818 17.497 -3.457 1.00 0.00 C ATOM 851 CE LYS A 59 113.927 18.741 -3.451 1.00 0.00 C ATOM 852 NZ LYS A 59 112.996 18.690 -4.613 1.00 0.00 N ATOM 0 H LYS A 59 118.928 14.891 -2.398 1.00 0.00 H new ATOM 0 HA LYS A 59 118.762 17.828 -2.316 1.00 0.00 H new ATOM 0 HB2 LYS A 59 117.333 16.461 -3.892 1.00 0.00 H new ATOM 0 HB3 LYS A 59 116.587 15.691 -2.505 1.00 0.00 H new ATOM 0 HG2 LYS A 59 115.901 17.975 -1.648 1.00 0.00 H new ATOM 0 HG3 LYS A 59 116.579 18.697 -3.093 1.00 0.00 H new ATOM 0 HD2 LYS A 59 115.042 17.202 -4.482 1.00 0.00 H new ATOM 0 HD3 LYS A 59 114.296 16.661 -2.992 1.00 0.00 H new ATOM 0 HE2 LYS A 59 113.362 18.792 -2.520 1.00 0.00 H new ATOM 0 HE3 LYS A 59 114.540 19.641 -3.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 112.390 19.535 -4.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 113.544 18.661 -5.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 112.403 17.838 -4.545 1.00 0.00 H new ATOM 866 N ASN A 60 117.310 15.880 -0.058 1.00 0.00 N ATOM 867 CA ASN A 60 116.949 15.789 1.353 1.00 0.00 C ATOM 868 C ASN A 60 117.128 14.357 1.850 1.00 0.00 C ATOM 869 O ASN A 60 117.399 13.450 1.063 1.00 0.00 O ATOM 870 CB ASN A 60 115.499 16.243 1.555 1.00 0.00 C ATOM 871 CG ASN A 60 114.533 15.323 0.813 1.00 0.00 C ATOM 872 OD1 ASN A 60 114.936 14.590 -0.092 1.00 0.00 O ATOM 873 ND2 ASN A 60 113.271 15.316 1.145 1.00 0.00 N ATOM 0 H ASN A 60 117.003 15.090 -0.625 1.00 0.00 H new ATOM 0 HA ASN A 60 117.605 16.443 1.928 1.00 0.00 H new ATOM 0 HB2 ASN A 60 115.260 16.247 2.618 1.00 0.00 H new ATOM 0 HB3 ASN A 60 115.381 17.266 1.198 1.00 0.00 H new ATOM 0 HD21 ASN A 60 112.618 14.704 0.655 1.00 0.00 H new ATOM 0 HD22 ASN A 60 112.937 15.923 1.894 1.00 0.00 H new ATOM 880 N GLN A 61 116.977 14.155 3.156 1.00 0.00 N ATOM 881 CA GLN A 61 117.136 12.824 3.740 1.00 0.00 C ATOM 882 C GLN A 61 115.900 12.452 4.549 1.00 0.00 C ATOM 883 O GLN A 61 115.307 13.304 5.208 1.00 0.00 O ATOM 884 CB GLN A 61 118.367 12.799 4.647 1.00 0.00 C ATOM 885 CG GLN A 61 119.625 13.040 3.809 1.00 0.00 C ATOM 886 CD GLN A 61 120.863 13.104 4.701 1.00 0.00 C ATOM 887 OE1 GLN A 61 120.756 13.304 5.911 1.00 0.00 O ATOM 888 NE2 GLN A 61 122.043 12.942 4.170 1.00 0.00 N ATOM 0 H GLN A 61 116.747 14.888 3.826 1.00 0.00 H new ATOM 0 HA GLN A 61 117.264 12.101 2.934 1.00 0.00 H new ATOM 0 HB2 GLN A 61 118.279 13.564 5.418 1.00 0.00 H new ATOM 0 HB3 GLN A 61 118.436 11.838 5.158 1.00 0.00 H new ATOM 0 HG2 GLN A 61 119.739 12.241 3.077 1.00 0.00 H new ATOM 0 HG3 GLN A 61 119.524 13.971 3.251 1.00 0.00 H new ATOM 0 HE21 GLN A 61 122.133 12.776 3.168 1.00 0.00 H new ATOM 0 HE22 GLN A 61 122.876 12.981 4.757 1.00 0.00 H new ATOM 897 N TYR A 62 115.518 11.178 4.501 1.00 0.00 N ATOM 898 CA TYR A 62 114.364 10.710 5.260 1.00 0.00 C ATOM 899 C TYR A 62 114.697 9.393 5.951 1.00 0.00 C ATOM 900 O TYR A 62 115.296 8.502 5.349 1.00 0.00 O ATOM 901 CB TYR A 62 113.176 10.514 4.315 1.00 0.00 C ATOM 902 CG TYR A 62 111.860 10.285 5.020 1.00 0.00 C ATOM 903 CD1 TYR A 62 111.450 8.985 5.341 1.00 0.00 C ATOM 904 CD2 TYR A 62 111.043 11.375 5.342 1.00 0.00 C ATOM 905 CE1 TYR A 62 110.225 8.775 5.981 1.00 0.00 C ATOM 906 CE2 TYR A 62 109.817 11.166 5.986 1.00 0.00 C ATOM 907 CZ TYR A 62 109.408 9.867 6.305 1.00 0.00 C ATOM 908 OH TYR A 62 108.196 9.660 6.934 1.00 0.00 O ATOM 0 H TYR A 62 115.986 10.458 3.950 1.00 0.00 H new ATOM 0 HA TYR A 62 114.106 11.452 6.016 1.00 0.00 H new ATOM 0 HB2 TYR A 62 113.085 11.392 3.675 1.00 0.00 H new ATOM 0 HB3 TYR A 62 113.380 9.664 3.663 1.00 0.00 H new ATOM 0 HD1 TYR A 62 112.081 8.144 5.094 1.00 0.00 H new ATOM 0 HD2 TYR A 62 111.358 12.378 5.094 1.00 0.00 H new ATOM 0 HE1 TYR A 62 109.908 7.772 6.226 1.00 0.00 H new ATOM 0 HE2 TYR A 62 109.188 12.007 6.236 1.00 0.00 H new ATOM 0 HH TYR A 62 107.756 10.522 7.088 1.00 0.00 H new ATOM 918 N TYR A 63 114.306 9.273 7.216 1.00 0.00 N ATOM 919 CA TYR A 63 114.576 8.061 7.981 1.00 0.00 C ATOM 920 C TYR A 63 113.296 7.581 8.648 1.00 0.00 C ATOM 921 O TYR A 63 112.574 8.380 9.240 1.00 0.00 O ATOM 922 CB TYR A 63 115.631 8.346 9.052 1.00 0.00 C ATOM 923 CG TYR A 63 116.927 8.885 8.493 1.00 0.00 C ATOM 924 CD1 TYR A 63 117.106 10.265 8.348 1.00 0.00 C ATOM 925 CD2 TYR A 63 117.950 8.003 8.125 1.00 0.00 C ATOM 926 CE1 TYR A 63 118.309 10.765 7.832 1.00 0.00 C ATOM 927 CE2 TYR A 63 119.151 8.501 7.609 1.00 0.00 C ATOM 928 CZ TYR A 63 119.332 9.881 7.463 1.00 0.00 C ATOM 929 OH TYR A 63 120.517 10.373 6.955 1.00 0.00 O ATOM 0 H TYR A 63 113.804 9.996 7.731 1.00 0.00 H new ATOM 0 HA TYR A 63 114.947 7.290 7.306 1.00 0.00 H new ATOM 0 HB2 TYR A 63 115.227 9.063 9.767 1.00 0.00 H new ATOM 0 HB3 TYR A 63 115.836 7.428 9.602 1.00 0.00 H new ATOM 0 HD1 TYR A 63 116.317 10.945 8.634 1.00 0.00 H new ATOM 0 HD2 TYR A 63 117.812 6.938 8.240 1.00 0.00 H new ATOM 0 HE1 TYR A 63 118.448 11.830 7.719 1.00 0.00 H new ATOM 0 HE2 TYR A 63 119.939 7.820 7.323 1.00 0.00 H new ATOM 0 HH TYR A 63 120.389 11.300 6.665 1.00 0.00 H new ATOM 939 N GLY A 64 113.008 6.287 8.541 1.00 0.00 N ATOM 940 CA GLY A 64 111.809 5.732 9.165 1.00 0.00 C ATOM 941 C GLY A 64 112.113 4.416 9.871 1.00 0.00 C ATOM 942 O GLY A 64 112.820 3.566 9.331 1.00 0.00 O ATOM 0 H GLY A 64 113.579 5.610 8.035 1.00 0.00 H new ATOM 0 HA2 GLY A 64 111.405 6.447 9.882 1.00 0.00 H new ATOM 0 HA3 GLY A 64 111.042 5.572 8.407 1.00 0.00 H new ATOM 946 N ILE A 65 111.586 4.266 11.086 1.00 0.00 N ATOM 947 CA ILE A 65 111.749 3.026 11.843 1.00 0.00 C ATOM 948 C ILE A 65 110.376 2.480 12.220 1.00 0.00 C ATOM 949 O ILE A 65 109.579 3.188 12.838 1.00 0.00 O ATOM 950 CB ILE A 65 112.568 3.285 13.113 1.00 0.00 C ATOM 951 CG1 ILE A 65 113.919 3.908 12.742 1.00 0.00 C ATOM 952 CG2 ILE A 65 112.813 1.964 13.848 1.00 0.00 C ATOM 953 CD1 ILE A 65 114.663 4.316 14.014 1.00 0.00 C ATOM 0 H ILE A 65 111.044 4.985 11.565 1.00 0.00 H new ATOM 0 HA ILE A 65 112.277 2.298 11.227 1.00 0.00 H new ATOM 0 HB ILE A 65 112.014 3.968 13.758 1.00 0.00 H new ATOM 0 HG12 ILE A 65 114.515 3.195 12.173 1.00 0.00 H new ATOM 0 HG13 ILE A 65 113.766 4.778 12.103 1.00 0.00 H new ATOM 0 HG21 ILE A 65 113.395 2.152 14.750 1.00 0.00 H new ATOM 0 HG22 ILE A 65 111.857 1.516 14.120 1.00 0.00 H new ATOM 0 HG23 ILE A 65 113.361 1.282 13.198 1.00 0.00 H new ATOM 0 HD11 ILE A 65 115.623 4.759 13.748 1.00 0.00 H new ATOM 0 HD12 ILE A 65 114.068 5.044 14.566 1.00 0.00 H new ATOM 0 HD13 ILE A 65 114.829 3.437 14.636 1.00 0.00 H new ATOM 965 N THR A 66 110.093 1.237 11.829 1.00 0.00 N ATOM 966 CA THR A 66 108.791 0.631 12.111 1.00 0.00 C ATOM 967 C THR A 66 108.951 -0.670 12.890 1.00 0.00 C ATOM 968 O THR A 66 109.972 -1.348 12.768 1.00 0.00 O ATOM 969 CB THR A 66 108.046 0.336 10.804 1.00 0.00 C ATOM 970 OG1 THR A 66 108.794 -0.596 10.038 1.00 0.00 O ATOM 971 CG2 THR A 66 107.843 1.621 9.995 1.00 0.00 C ATOM 0 H THR A 66 110.741 0.635 11.321 1.00 0.00 H new ATOM 0 HA THR A 66 108.220 1.340 12.711 1.00 0.00 H new ATOM 0 HB THR A 66 107.067 -0.080 11.043 1.00 0.00 H new ATOM 0 HG1 THR A 66 109.404 -0.114 9.441 1.00 0.00 H new ATOM 0 HG21 THR A 66 107.313 1.389 9.071 1.00 0.00 H new ATOM 0 HG22 THR A 66 107.259 2.331 10.581 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.813 2.058 9.757 1.00 0.00 H new ATOM 979 N ALA A 67 107.926 -1.023 13.660 1.00 0.00 N ATOM 980 CA ALA A 67 107.893 -2.307 14.352 1.00 0.00 C ATOM 981 C ALA A 67 106.457 -2.815 14.409 1.00 0.00 C ATOM 982 O ALA A 67 105.532 -2.010 14.520 1.00 0.00 O ATOM 983 CB ALA A 67 108.446 -2.156 15.772 1.00 0.00 C ATOM 0 H ALA A 67 107.107 -0.437 13.820 1.00 0.00 H new ATOM 0 HA ALA A 67 108.511 -3.022 13.809 1.00 0.00 H new ATOM 0 HB1 ALA A 67 108.416 -3.121 16.279 1.00 0.00 H new ATOM 0 HB2 ALA A 67 109.476 -1.802 15.726 1.00 0.00 H new ATOM 0 HB3 ALA A 67 107.840 -1.438 16.324 1.00 0.00 H new ATOM 989 N GLY A 68 106.260 -4.133 14.294 1.00 0.00 N ATOM 990 CA GLY A 68 104.900 -4.672 14.300 1.00 0.00 C ATOM 991 C GLY A 68 104.861 -6.193 14.450 1.00 0.00 C ATOM 992 O GLY A 68 105.900 -6.848 14.370 1.00 0.00 O ATOM 0 H GLY A 68 107.002 -4.827 14.198 1.00 0.00 H new ATOM 0 HA2 GLY A 68 104.339 -4.217 15.116 1.00 0.00 H new ATOM 0 HA3 GLY A 68 104.400 -4.391 13.373 1.00 0.00 H new ATOM 996 N PRO A 69 103.698 -6.770 14.678 1.00 0.00 N ATOM 997 CA PRO A 69 103.544 -8.245 14.772 1.00 0.00 C ATOM 998 C PRO A 69 103.069 -8.879 13.463 1.00 0.00 C ATOM 999 O PRO A 69 102.109 -8.412 12.841 1.00 0.00 O ATOM 1000 CB PRO A 69 102.486 -8.400 15.864 1.00 0.00 C ATOM 1001 CG PRO A 69 101.647 -7.162 15.799 1.00 0.00 C ATOM 1002 CD PRO A 69 102.393 -6.135 14.941 1.00 0.00 C ATOM 0 HA PRO A 69 104.488 -8.746 14.987 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.881 -9.291 15.698 1.00 0.00 H new ATOM 0 HB3 PRO A 69 102.949 -8.507 16.845 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.671 -7.384 15.367 1.00 0.00 H new ATOM 0 HG3 PRO A 69 101.470 -6.767 16.800 1.00 0.00 H new ATOM 0 HD2 PRO A 69 101.858 -5.924 14.015 1.00 0.00 H new ATOM 0 HD3 PRO A 69 102.509 -5.186 15.465 1.00 0.00 H new ATOM 1010 N ALA A 70 103.842 -9.852 12.988 1.00 0.00 N ATOM 1011 CA ALA A 70 103.436 -10.706 11.879 1.00 0.00 C ATOM 1012 C ALA A 70 102.505 -11.818 12.365 1.00 0.00 C ATOM 1013 O ALA A 70 102.680 -12.326 13.474 1.00 0.00 O ATOM 1014 CB ALA A 70 104.674 -11.320 11.217 1.00 0.00 C ATOM 0 H ALA A 70 104.766 -10.069 13.361 1.00 0.00 H new ATOM 0 HA ALA A 70 102.899 -10.097 11.152 1.00 0.00 H new ATOM 0 HB1 ALA A 70 104.365 -11.958 10.389 1.00 0.00 H new ATOM 0 HB2 ALA A 70 105.318 -10.525 10.842 1.00 0.00 H new ATOM 0 HB3 ALA A 70 105.220 -11.915 11.949 1.00 0.00 H new ATOM 1020 N TYR A 71 101.560 -12.224 11.518 1.00 0.00 N ATOM 1021 CA TYR A 71 100.715 -13.377 11.807 1.00 0.00 C ATOM 1022 C TYR A 71 100.890 -14.397 10.688 1.00 0.00 C ATOM 1023 O TYR A 71 100.761 -14.054 9.512 1.00 0.00 O ATOM 1024 CB TYR A 71 99.248 -12.950 11.893 1.00 0.00 C ATOM 1025 CG TYR A 71 98.316 -14.080 12.259 1.00 0.00 C ATOM 1026 CD1 TYR A 71 98.107 -14.412 13.603 1.00 0.00 C ATOM 1027 CD2 TYR A 71 97.659 -14.798 11.252 1.00 0.00 C ATOM 1028 CE1 TYR A 71 97.243 -15.459 13.942 1.00 0.00 C ATOM 1029 CE2 TYR A 71 96.795 -15.847 11.590 1.00 0.00 C ATOM 1030 CZ TYR A 71 96.588 -16.178 12.934 1.00 0.00 C ATOM 1031 OH TYR A 71 95.735 -17.211 13.268 1.00 0.00 O ATOM 0 H TYR A 71 101.362 -11.770 10.626 1.00 0.00 H new ATOM 0 HA TYR A 71 101.004 -13.814 12.763 1.00 0.00 H new ATOM 0 HB2 TYR A 71 99.151 -12.155 12.632 1.00 0.00 H new ATOM 0 HB3 TYR A 71 98.942 -12.532 10.934 1.00 0.00 H new ATOM 0 HD1 TYR A 71 98.614 -13.859 14.380 1.00 0.00 H new ATOM 0 HD2 TYR A 71 97.819 -14.543 10.215 1.00 0.00 H new ATOM 0 HE1 TYR A 71 97.081 -15.712 14.979 1.00 0.00 H new ATOM 0 HE2 TYR A 71 96.288 -16.401 10.813 1.00 0.00 H new ATOM 0 HH TYR A 71 95.362 -17.604 12.452 1.00 0.00 H new ATOM 1041 N ARG A 72 101.161 -15.647 11.052 1.00 0.00 N ATOM 1042 CA ARG A 72 101.544 -16.641 10.057 1.00 0.00 C ATOM 1043 C ARG A 72 100.348 -17.470 9.600 1.00 0.00 C ATOM 1044 O ARG A 72 99.822 -18.300 10.342 1.00 0.00 O ATOM 1045 CB ARG A 72 102.612 -17.569 10.641 1.00 0.00 C ATOM 1046 CG ARG A 72 103.143 -18.498 9.548 1.00 0.00 C ATOM 1047 CD ARG A 72 104.169 -19.462 10.150 1.00 0.00 C ATOM 1048 NE ARG A 72 104.777 -20.279 9.095 1.00 0.00 N ATOM 1049 CZ ARG A 72 105.966 -20.886 9.223 1.00 0.00 C ATOM 1050 NH1 ARG A 72 106.686 -20.794 10.315 1.00 0.00 N ATOM 1051 NH2 ARG A 72 106.424 -21.593 8.225 1.00 0.00 N ATOM 0 H ARG A 72 101.123 -15.991 12.012 1.00 0.00 H new ATOM 0 HA ARG A 72 101.940 -16.111 9.191 1.00 0.00 H new ATOM 0 HB2 ARG A 72 103.429 -16.981 11.060 1.00 0.00 H new ATOM 0 HB3 ARG A 72 102.190 -18.156 11.457 1.00 0.00 H new ATOM 0 HG2 ARG A 72 102.321 -19.058 9.101 1.00 0.00 H new ATOM 0 HG3 ARG A 72 103.602 -17.913 8.751 1.00 0.00 H new ATOM 0 HD2 ARG A 72 104.941 -18.901 10.676 1.00 0.00 H new ATOM 0 HD3 ARG A 72 103.686 -20.105 10.886 1.00 0.00 H new ATOM 0 HE ARG A 72 104.269 -20.392 8.218 1.00 0.00 H new ATOM 0 HH11 ARG A 72 106.346 -20.246 11.105 1.00 0.00 H new ATOM 0 HH12 ARG A 72 107.586 -21.271 10.374 1.00 0.00 H new ATOM 0 HH21 ARG A 72 105.879 -21.676 7.367 1.00 0.00 H new ATOM 0 HH22 ARG A 72 107.326 -22.062 8.304 1.00 0.00 H new ATOM 1065 N ILE A 73 99.932 -17.226 8.362 1.00 0.00 N ATOM 1066 CA ILE A 73 98.911 -18.036 7.711 1.00 0.00 C ATOM 1067 C ILE A 73 99.586 -19.095 6.845 1.00 0.00 C ATOM 1068 O ILE A 73 100.486 -18.780 6.065 1.00 0.00 O ATOM 1069 CB ILE A 73 97.989 -17.153 6.860 1.00 0.00 C ATOM 1070 CG1 ILE A 73 97.361 -16.070 7.746 1.00 0.00 C ATOM 1071 CG2 ILE A 73 96.879 -18.010 6.245 1.00 0.00 C ATOM 1072 CD1 ILE A 73 96.537 -15.104 6.891 1.00 0.00 C ATOM 0 H ILE A 73 100.291 -16.465 7.785 1.00 0.00 H new ATOM 0 HA ILE A 73 98.302 -18.527 8.470 1.00 0.00 H new ATOM 0 HB ILE A 73 98.570 -16.686 6.065 1.00 0.00 H new ATOM 0 HG12 ILE A 73 96.726 -16.531 8.502 1.00 0.00 H new ATOM 0 HG13 ILE A 73 98.142 -15.524 8.275 1.00 0.00 H new ATOM 0 HG21 ILE A 73 96.226 -17.380 5.641 1.00 0.00 H new ATOM 0 HG22 ILE A 73 97.322 -18.782 5.616 1.00 0.00 H new ATOM 0 HG23 ILE A 73 96.298 -18.478 7.040 1.00 0.00 H new ATOM 0 HD11 ILE A 73 96.095 -14.339 7.530 1.00 0.00 H new ATOM 0 HD12 ILE A 73 97.183 -14.631 6.152 1.00 0.00 H new ATOM 0 HD13 ILE A 73 95.745 -15.653 6.382 1.00 0.00 H new ATOM 1084 N ASN A 74 99.154 -20.346 6.974 1.00 0.00 N ATOM 1085 CA ASN A 74 99.807 -21.440 6.258 1.00 0.00 C ATOM 1086 C ASN A 74 99.709 -21.239 4.745 1.00 0.00 C ATOM 1087 O ASN A 74 100.629 -21.595 4.010 1.00 0.00 O ATOM 1088 CB ASN A 74 99.155 -22.772 6.639 1.00 0.00 C ATOM 1089 CG ASN A 74 99.334 -23.030 8.130 1.00 0.00 C ATOM 1090 OD1 ASN A 74 98.379 -23.395 8.816 1.00 0.00 O ATOM 1091 ND2 ASN A 74 100.507 -22.864 8.677 1.00 0.00 N ATOM 0 H ASN A 74 98.366 -20.626 7.558 1.00 0.00 H new ATOM 0 HA ASN A 74 100.860 -21.451 6.540 1.00 0.00 H new ATOM 0 HB2 ASN A 74 98.094 -22.752 6.389 1.00 0.00 H new ATOM 0 HB3 ASN A 74 99.602 -23.583 6.065 1.00 0.00 H new ATOM 0 HD21 ASN A 74 100.634 -23.037 9.674 1.00 0.00 H new ATOM 0 HD22 ASN A 74 101.297 -22.562 8.107 1.00 0.00 H new ATOM 1098 N ASP A 75 98.599 -20.672 4.281 1.00 0.00 N ATOM 1099 CA ASP A 75 98.473 -20.308 2.875 1.00 0.00 C ATOM 1100 C ASP A 75 99.467 -19.202 2.537 1.00 0.00 C ATOM 1101 O ASP A 75 100.228 -18.759 3.399 1.00 0.00 O ATOM 1102 CB ASP A 75 97.050 -19.830 2.579 1.00 0.00 C ATOM 1103 CG ASP A 75 96.045 -20.954 2.821 1.00 0.00 C ATOM 1104 OD1 ASP A 75 96.407 -22.105 2.633 1.00 0.00 O ATOM 1105 OD2 ASP A 75 94.925 -20.646 3.192 1.00 0.00 O ATOM 0 H ASP A 75 97.782 -20.457 4.852 1.00 0.00 H new ATOM 0 HA ASP A 75 98.686 -21.185 2.264 1.00 0.00 H new ATOM 0 HB2 ASP A 75 96.808 -18.976 3.212 1.00 0.00 H new ATOM 0 HB3 ASP A 75 96.982 -19.490 1.546 1.00 0.00 H new ATOM 1110 N TRP A 76 99.459 -18.752 1.286 1.00 0.00 N ATOM 1111 CA TRP A 76 100.360 -17.683 0.860 1.00 0.00 C ATOM 1112 C TRP A 76 99.736 -16.305 1.099 1.00 0.00 C ATOM 1113 O TRP A 76 99.912 -15.382 0.303 1.00 0.00 O ATOM 1114 CB TRP A 76 100.686 -17.852 -0.625 1.00 0.00 C ATOM 1115 CG TRP A 76 99.493 -17.715 -1.518 1.00 0.00 C ATOM 1116 CD1 TRP A 76 99.113 -16.574 -2.136 1.00 0.00 C ATOM 1117 CD2 TRP A 76 98.524 -18.734 -1.905 1.00 0.00 C ATOM 1118 NE1 TRP A 76 97.972 -16.824 -2.875 1.00 0.00 N ATOM 1119 CE2 TRP A 76 97.568 -18.140 -2.766 1.00 0.00 C ATOM 1120 CE3 TRP A 76 98.380 -20.098 -1.596 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 96.509 -18.877 -3.299 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 97.317 -20.840 -2.131 1.00 0.00 C ATOM 1123 CH2 TRP A 76 96.384 -20.233 -2.980 1.00 0.00 C ATOM 0 H TRP A 76 98.844 -19.107 0.553 1.00 0.00 H new ATOM 0 HA TRP A 76 101.274 -17.748 1.450 1.00 0.00 H new ATOM 0 HB2 TRP A 76 101.432 -17.110 -0.912 1.00 0.00 H new ATOM 0 HB3 TRP A 76 101.136 -18.833 -0.781 1.00 0.00 H new ATOM 0 HD1 TRP A 76 99.619 -15.622 -2.064 1.00 0.00 H new ATOM 0 HE1 TRP A 76 97.487 -16.121 -3.433 1.00 0.00 H new ATOM 0 HE3 TRP A 76 99.093 -20.578 -0.942 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 95.792 -18.404 -3.953 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 97.217 -21.887 -1.886 1.00 0.00 H new ATOM 0 HH2 TRP A 76 95.568 -20.811 -3.388 1.00 0.00 H new ATOM 1134 N ALA A 77 99.012 -16.168 2.209 1.00 0.00 N ATOM 1135 CA ALA A 77 98.289 -14.933 2.514 1.00 0.00 C ATOM 1136 C ALA A 77 98.715 -14.324 3.852 1.00 0.00 C ATOM 1137 O ALA A 77 97.958 -13.545 4.433 1.00 0.00 O ATOM 1138 CB ALA A 77 96.786 -15.218 2.547 1.00 0.00 C ATOM 0 H ALA A 77 98.910 -16.898 2.914 1.00 0.00 H new ATOM 0 HA ALA A 77 98.528 -14.213 1.731 1.00 0.00 H new ATOM 0 HB1 ALA A 77 96.246 -14.299 2.774 1.00 0.00 H new ATOM 0 HB2 ALA A 77 96.466 -15.596 1.576 1.00 0.00 H new ATOM 0 HB3 ALA A 77 96.574 -15.962 3.314 1.00 0.00 H new ATOM 1144 N SER A 78 99.915 -14.649 4.340 1.00 0.00 N ATOM 1145 CA SER A 78 100.287 -14.275 5.701 1.00 0.00 C ATOM 1146 C SER A 78 100.448 -12.764 5.762 1.00 0.00 C ATOM 1147 O SER A 78 100.812 -12.150 4.764 1.00 0.00 O ATOM 1148 CB SER A 78 101.590 -14.969 6.104 1.00 0.00 C ATOM 1149 OG SER A 78 101.337 -16.352 6.308 1.00 0.00 O ATOM 0 H SER A 78 100.631 -15.160 3.823 1.00 0.00 H new ATOM 0 HA SER A 78 99.509 -14.589 6.397 1.00 0.00 H new ATOM 0 HB2 SER A 78 102.343 -14.835 5.327 1.00 0.00 H new ATOM 0 HB3 SER A 78 101.988 -14.521 7.015 1.00 0.00 H new ATOM 0 HG SER A 78 100.769 -16.691 5.585 1.00 0.00 H new ATOM 1155 N ILE A 79 100.193 -12.162 6.922 1.00 0.00 N ATOM 1156 CA ILE A 79 100.072 -10.707 6.986 1.00 0.00 C ATOM 1157 C ILE A 79 100.796 -10.142 8.195 1.00 0.00 C ATOM 1158 O ILE A 79 100.821 -10.757 9.256 1.00 0.00 O ATOM 1159 CB ILE A 79 98.588 -10.317 7.036 1.00 0.00 C ATOM 1160 CG1 ILE A 79 97.928 -10.904 8.289 1.00 0.00 C ATOM 1161 CG2 ILE A 79 97.874 -10.849 5.789 1.00 0.00 C ATOM 1162 CD1 ILE A 79 96.499 -10.370 8.412 1.00 0.00 C ATOM 0 H ILE A 79 100.069 -12.646 7.811 1.00 0.00 H new ATOM 0 HA ILE A 79 100.535 -10.287 6.093 1.00 0.00 H new ATOM 0 HB ILE A 79 98.511 -9.230 7.068 1.00 0.00 H new ATOM 0 HG12 ILE A 79 97.917 -11.992 8.231 1.00 0.00 H new ATOM 0 HG13 ILE A 79 98.504 -10.638 9.175 1.00 0.00 H new ATOM 0 HG21 ILE A 79 96.821 -10.571 5.826 1.00 0.00 H new ATOM 0 HG22 ILE A 79 98.331 -10.420 4.897 1.00 0.00 H new ATOM 0 HG23 ILE A 79 97.962 -11.935 5.755 1.00 0.00 H new ATOM 0 HD11 ILE A 79 96.030 -10.788 9.303 1.00 0.00 H new ATOM 0 HD12 ILE A 79 96.522 -9.283 8.490 1.00 0.00 H new ATOM 0 HD13 ILE A 79 95.926 -10.659 7.531 1.00 0.00 H new ATOM 1174 N TYR A 80 101.385 -8.967 8.026 1.00 0.00 N ATOM 1175 CA TYR A 80 101.967 -8.250 9.156 1.00 0.00 C ATOM 1176 C TYR A 80 101.614 -6.770 9.067 1.00 0.00 C ATOM 1177 O TYR A 80 101.494 -6.225 7.970 1.00 0.00 O ATOM 1178 CB TYR A 80 103.490 -8.454 9.195 1.00 0.00 C ATOM 1179 CG TYR A 80 104.265 -7.700 8.136 1.00 0.00 C ATOM 1180 CD1 TYR A 80 104.731 -6.407 8.404 1.00 0.00 C ATOM 1181 CD2 TYR A 80 104.522 -8.292 6.894 1.00 0.00 C ATOM 1182 CE1 TYR A 80 105.451 -5.705 7.431 1.00 0.00 C ATOM 1183 CE2 TYR A 80 105.244 -7.591 5.923 1.00 0.00 C ATOM 1184 CZ TYR A 80 105.708 -6.296 6.190 1.00 0.00 C ATOM 1185 OH TYR A 80 106.420 -5.607 5.230 1.00 0.00 O ATOM 0 H TYR A 80 101.473 -8.492 7.128 1.00 0.00 H new ATOM 0 HA TYR A 80 101.553 -8.648 10.083 1.00 0.00 H new ATOM 0 HB2 TYR A 80 103.857 -8.152 10.176 1.00 0.00 H new ATOM 0 HB3 TYR A 80 103.701 -9.518 9.090 1.00 0.00 H new ATOM 0 HD1 TYR A 80 104.534 -5.951 9.363 1.00 0.00 H new ATOM 0 HD2 TYR A 80 104.163 -9.289 6.686 1.00 0.00 H new ATOM 0 HE1 TYR A 80 105.808 -4.707 7.638 1.00 0.00 H new ATOM 0 HE2 TYR A 80 105.444 -8.049 4.965 1.00 0.00 H new ATOM 0 HH TYR A 80 106.381 -6.095 4.381 1.00 0.00 H new ATOM 1195 N GLY A 81 101.454 -6.136 10.226 1.00 0.00 N ATOM 1196 CA GLY A 81 101.175 -4.701 10.267 1.00 0.00 C ATOM 1197 C GLY A 81 102.135 -4.007 11.222 1.00 0.00 C ATOM 1198 O GLY A 81 102.390 -4.507 12.315 1.00 0.00 O ATOM 0 H GLY A 81 101.512 -6.586 11.140 1.00 0.00 H new ATOM 0 HA2 GLY A 81 101.273 -4.275 9.268 1.00 0.00 H new ATOM 0 HA3 GLY A 81 100.147 -4.532 10.587 1.00 0.00 H new ATOM 1202 N VAL A 82 102.641 -2.844 10.821 1.00 0.00 N ATOM 1203 CA VAL A 82 103.655 -2.148 11.609 1.00 0.00 C ATOM 1204 C VAL A 82 103.331 -0.664 11.728 1.00 0.00 C ATOM 1205 O VAL A 82 102.633 -0.103 10.885 1.00 0.00 O ATOM 1206 CB VAL A 82 105.034 -2.306 10.955 1.00 0.00 C ATOM 1207 CG1 VAL A 82 105.444 -3.780 10.929 1.00 0.00 C ATOM 1208 CG2 VAL A 82 104.987 -1.775 9.518 1.00 0.00 C ATOM 0 H VAL A 82 102.369 -2.366 9.962 1.00 0.00 H new ATOM 0 HA VAL A 82 103.664 -2.591 12.605 1.00 0.00 H new ATOM 0 HB VAL A 82 105.762 -1.740 11.537 1.00 0.00 H new ATOM 0 HG11 VAL A 82 106.424 -3.877 10.462 1.00 0.00 H new ATOM 0 HG12 VAL A 82 105.488 -4.163 11.948 1.00 0.00 H new ATOM 0 HG13 VAL A 82 104.712 -4.351 10.358 1.00 0.00 H new ATOM 0 HG21 VAL A 82 105.968 -1.888 9.056 1.00 0.00 H new ATOM 0 HG22 VAL A 82 104.249 -2.338 8.946 1.00 0.00 H new ATOM 0 HG23 VAL A 82 104.711 -0.721 9.529 1.00 0.00 H new ATOM 1218 N VAL A 83 103.866 -0.036 12.772 1.00 0.00 N ATOM 1219 CA VAL A 83 103.760 1.410 12.935 1.00 0.00 C ATOM 1220 C VAL A 83 105.155 1.971 13.181 1.00 0.00 C ATOM 1221 O VAL A 83 105.959 1.332 13.861 1.00 0.00 O ATOM 1222 CB VAL A 83 102.837 1.741 14.112 1.00 0.00 C ATOM 1223 CG1 VAL A 83 101.431 1.208 13.824 1.00 0.00 C ATOM 1224 CG2 VAL A 83 103.371 1.087 15.391 1.00 0.00 C ATOM 0 H VAL A 83 104.378 -0.507 13.518 1.00 0.00 H new ATOM 0 HA VAL A 83 103.336 1.857 12.036 1.00 0.00 H new ATOM 0 HB VAL A 83 102.801 2.822 14.245 1.00 0.00 H new ATOM 0 HG11 VAL A 83 100.774 1.443 14.661 1.00 0.00 H new ATOM 0 HG12 VAL A 83 101.044 1.673 12.917 1.00 0.00 H new ATOM 0 HG13 VAL A 83 101.472 0.127 13.688 1.00 0.00 H new ATOM 0 HG21 VAL A 83 102.711 1.326 16.225 1.00 0.00 H new ATOM 0 HG22 VAL A 83 103.411 0.006 15.258 1.00 0.00 H new ATOM 0 HG23 VAL A 83 104.372 1.464 15.602 1.00 0.00 H new ATOM 1234 N GLY A 84 105.457 3.133 12.604 1.00 0.00 N ATOM 1235 CA GLY A 84 106.795 3.692 12.731 1.00 0.00 C ATOM 1236 C GLY A 84 106.769 5.212 12.757 1.00 0.00 C ATOM 1237 O GLY A 84 105.729 5.832 12.552 1.00 0.00 O ATOM 0 H GLY A 84 104.805 3.694 12.055 1.00 0.00 H new ATOM 0 HA2 GLY A 84 107.260 3.320 13.644 1.00 0.00 H new ATOM 0 HA3 GLY A 84 107.412 3.353 11.899 1.00 0.00 H new ATOM 1241 N VAL A 85 107.939 5.797 12.973 1.00 0.00 N ATOM 1242 CA VAL A 85 108.079 7.248 12.952 1.00 0.00 C ATOM 1243 C VAL A 85 109.013 7.628 11.813 1.00 0.00 C ATOM 1244 O VAL A 85 110.082 7.038 11.668 1.00 0.00 O ATOM 1245 CB VAL A 85 108.653 7.748 14.283 1.00 0.00 C ATOM 1246 CG1 VAL A 85 108.716 9.279 14.273 1.00 0.00 C ATOM 1247 CG2 VAL A 85 107.755 7.291 15.437 1.00 0.00 C ATOM 0 H VAL A 85 108.804 5.291 13.164 1.00 0.00 H new ATOM 0 HA VAL A 85 107.101 7.707 12.806 1.00 0.00 H new ATOM 0 HB VAL A 85 109.655 7.340 14.415 1.00 0.00 H new ATOM 0 HG11 VAL A 85 109.124 9.633 15.220 1.00 0.00 H new ATOM 0 HG12 VAL A 85 109.356 9.612 13.455 1.00 0.00 H new ATOM 0 HG13 VAL A 85 107.713 9.684 14.137 1.00 0.00 H new ATOM 0 HG21 VAL A 85 108.166 7.648 16.381 1.00 0.00 H new ATOM 0 HG22 VAL A 85 106.753 7.697 15.301 1.00 0.00 H new ATOM 0 HG23 VAL A 85 107.707 6.202 15.451 1.00 0.00 H new ATOM 1257 N GLY A 86 108.586 8.572 10.978 1.00 0.00 N ATOM 1258 CA GLY A 86 109.421 9.019 9.864 1.00 0.00 C ATOM 1259 C GLY A 86 109.668 10.520 9.946 1.00 0.00 C ATOM 1260 O GLY A 86 108.755 11.278 10.249 1.00 0.00 O ATOM 0 H GLY A 86 107.681 9.037 11.048 1.00 0.00 H new ATOM 0 HA2 GLY A 86 110.372 8.487 9.880 1.00 0.00 H new ATOM 0 HA3 GLY A 86 108.936 8.776 8.919 1.00 0.00 H new ATOM 1264 N TYR A 87 110.903 10.944 9.680 1.00 0.00 N ATOM 1265 CA TYR A 87 111.229 12.368 9.718 1.00 0.00 C ATOM 1266 C TYR A 87 112.147 12.738 8.559 1.00 0.00 C ATOM 1267 O TYR A 87 112.912 11.906 8.073 1.00 0.00 O ATOM 1268 CB TYR A 87 111.882 12.726 11.058 1.00 0.00 C ATOM 1269 CG TYR A 87 113.269 12.155 11.250 1.00 0.00 C ATOM 1270 CD1 TYR A 87 113.429 10.875 11.791 1.00 0.00 C ATOM 1271 CD2 TYR A 87 114.392 12.910 10.891 1.00 0.00 C ATOM 1272 CE1 TYR A 87 114.714 10.348 11.973 1.00 0.00 C ATOM 1273 CE2 TYR A 87 115.676 12.383 11.072 1.00 0.00 C ATOM 1274 CZ TYR A 87 115.838 11.102 11.613 1.00 0.00 C ATOM 1275 OH TYR A 87 117.104 10.583 11.793 1.00 0.00 O ATOM 0 H TYR A 87 111.683 10.332 9.439 1.00 0.00 H new ATOM 0 HA TYR A 87 110.306 12.939 9.618 1.00 0.00 H new ATOM 0 HB2 TYR A 87 111.934 13.811 11.144 1.00 0.00 H new ATOM 0 HB3 TYR A 87 111.242 12.372 11.866 1.00 0.00 H new ATOM 0 HD1 TYR A 87 112.562 10.293 12.068 1.00 0.00 H new ATOM 0 HD2 TYR A 87 114.268 13.899 10.475 1.00 0.00 H new ATOM 0 HE1 TYR A 87 114.838 9.360 12.391 1.00 0.00 H new ATOM 0 HE2 TYR A 87 116.542 12.965 10.794 1.00 0.00 H new ATOM 0 HH TYR A 87 117.485 10.341 10.923 1.00 0.00 H new ATOM 1285 N GLY A 88 112.061 13.992 8.123 1.00 0.00 N ATOM 1286 CA GLY A 88 112.854 14.465 6.988 1.00 0.00 C ATOM 1287 C GLY A 88 113.658 15.710 7.343 1.00 0.00 C ATOM 1288 O GLY A 88 113.249 16.510 8.183 1.00 0.00 O ATOM 0 H GLY A 88 111.452 14.699 8.536 1.00 0.00 H new ATOM 0 HA2 GLY A 88 113.531 13.675 6.662 1.00 0.00 H new ATOM 0 HA3 GLY A 88 112.194 14.685 6.149 1.00 0.00 H new ATOM 1292 N LYS A 89 114.807 15.865 6.689 1.00 0.00 N ATOM 1293 CA LYS A 89 115.633 17.057 6.857 1.00 0.00 C ATOM 1294 C LYS A 89 115.909 17.671 5.490 1.00 0.00 C ATOM 1295 O LYS A 89 116.272 16.957 4.553 1.00 0.00 O ATOM 1296 CB LYS A 89 116.955 16.690 7.535 1.00 0.00 C ATOM 1297 CG LYS A 89 116.672 16.050 8.896 1.00 0.00 C ATOM 1298 CD LYS A 89 117.977 15.910 9.685 1.00 0.00 C ATOM 1299 CE LYS A 89 118.916 14.936 8.969 1.00 0.00 C ATOM 1300 NZ LYS A 89 120.109 14.674 9.823 1.00 0.00 N ATOM 0 H LYS A 89 115.187 15.179 6.037 1.00 0.00 H new ATOM 0 HA LYS A 89 115.106 17.776 7.484 1.00 0.00 H new ATOM 0 HB2 LYS A 89 117.518 16.000 6.907 1.00 0.00 H new ATOM 0 HB3 LYS A 89 117.570 17.581 7.661 1.00 0.00 H new ATOM 0 HG2 LYS A 89 115.962 16.660 9.455 1.00 0.00 H new ATOM 0 HG3 LYS A 89 116.212 15.071 8.759 1.00 0.00 H new ATOM 0 HD2 LYS A 89 118.457 16.883 9.787 1.00 0.00 H new ATOM 0 HD3 LYS A 89 117.766 15.552 10.693 1.00 0.00 H new ATOM 0 HE2 LYS A 89 118.395 14.002 8.757 1.00 0.00 H new ATOM 0 HE3 LYS A 89 119.226 15.352 8.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 120.746 14.012 9.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 120.610 15.567 10.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 119.805 14.259 10.727 1.00 0.00 H new ATOM 1314 N PHE A 90 115.737 18.986 5.378 1.00 0.00 N ATOM 1315 CA PHE A 90 115.879 19.661 4.091 1.00 0.00 C ATOM 1316 C PHE A 90 117.169 20.472 4.031 1.00 0.00 C ATOM 1317 O PHE A 90 117.482 21.231 4.950 1.00 0.00 O ATOM 1318 CB PHE A 90 114.683 20.589 3.862 1.00 0.00 C ATOM 1319 CG PHE A 90 114.632 21.171 2.470 1.00 0.00 C ATOM 1320 CD1 PHE A 90 114.055 20.433 1.427 1.00 0.00 C ATOM 1321 CD2 PHE A 90 115.157 22.443 2.221 1.00 0.00 C ATOM 1322 CE1 PHE A 90 114.003 20.970 0.136 1.00 0.00 C ATOM 1323 CE2 PHE A 90 115.103 22.980 0.928 1.00 0.00 C ATOM 1324 CZ PHE A 90 114.528 22.243 -0.115 1.00 0.00 C ATOM 0 H PHE A 90 115.501 19.601 6.157 1.00 0.00 H new ATOM 0 HA PHE A 90 115.916 18.900 3.311 1.00 0.00 H new ATOM 0 HB2 PHE A 90 113.763 20.036 4.050 1.00 0.00 H new ATOM 0 HB3 PHE A 90 114.720 21.402 4.587 1.00 0.00 H new ATOM 0 HD1 PHE A 90 113.651 19.450 1.620 1.00 0.00 H new ATOM 0 HD2 PHE A 90 115.603 23.011 3.024 1.00 0.00 H new ATOM 0 HE1 PHE A 90 113.558 20.402 -0.667 1.00 0.00 H new ATOM 0 HE2 PHE A 90 115.505 23.964 0.735 1.00 0.00 H new ATOM 0 HZ PHE A 90 114.490 22.657 -1.112 1.00 0.00 H new ATOM 1334 N GLN A 91 117.914 20.302 2.942 1.00 0.00 N ATOM 1335 CA GLN A 91 119.145 21.059 2.729 1.00 0.00 C ATOM 1336 C GLN A 91 118.952 22.066 1.600 1.00 0.00 C ATOM 1337 O GLN A 91 118.329 21.756 0.584 1.00 0.00 O ATOM 1338 CB GLN A 91 120.288 20.105 2.379 1.00 0.00 C ATOM 1339 CG GLN A 91 121.601 20.889 2.290 1.00 0.00 C ATOM 1340 CD GLN A 91 122.776 19.955 1.991 1.00 0.00 C ATOM 1341 OE1 GLN A 91 122.634 18.731 1.999 1.00 0.00 O ATOM 1342 NE2 GLN A 91 123.945 20.471 1.723 1.00 0.00 N ATOM 0 H GLN A 91 117.687 19.647 2.194 1.00 0.00 H new ATOM 0 HA GLN A 91 119.392 21.595 3.645 1.00 0.00 H new ATOM 0 HB2 GLN A 91 120.369 19.325 3.136 1.00 0.00 H new ATOM 0 HB3 GLN A 91 120.084 19.609 1.430 1.00 0.00 H new ATOM 0 HG2 GLN A 91 121.525 21.646 1.509 1.00 0.00 H new ATOM 0 HG3 GLN A 91 121.779 21.415 3.228 1.00 0.00 H new ATOM 0 HE21 GLN A 91 124.066 21.484 1.716 1.00 0.00 H new ATOM 0 HE22 GLN A 91 124.737 19.861 1.521 1.00 0.00 H new ATOM 1351 N THR A 92 119.486 23.271 1.778 1.00 0.00 N ATOM 1352 CA THR A 92 119.338 24.321 0.774 1.00 0.00 C ATOM 1353 C THR A 92 120.659 24.569 0.051 1.00 0.00 C ATOM 1354 O THR A 92 121.735 24.353 0.610 1.00 0.00 O ATOM 1355 CB THR A 92 118.878 25.623 1.439 1.00 0.00 C ATOM 1356 OG1 THR A 92 119.876 26.062 2.349 1.00 0.00 O ATOM 1357 CG2 THR A 92 117.565 25.390 2.189 1.00 0.00 C ATOM 0 H THR A 92 120.022 23.544 2.602 1.00 0.00 H new ATOM 0 HA THR A 92 118.592 23.993 0.050 1.00 0.00 H new ATOM 0 HB THR A 92 118.719 26.383 0.674 1.00 0.00 H new ATOM 0 HG1 THR A 92 120.342 26.838 1.974 1.00 0.00 H new ATOM 0 HG21 THR A 92 117.244 26.320 2.659 1.00 0.00 H new ATOM 0 HG22 THR A 92 116.800 25.055 1.488 1.00 0.00 H new ATOM 0 HG23 THR A 92 117.714 24.629 2.955 1.00 0.00 H new ATOM 1365 N THR A 93 120.568 25.022 -1.195 1.00 0.00 N ATOM 1366 CA THR A 93 121.759 25.331 -1.979 1.00 0.00 C ATOM 1367 C THR A 93 122.431 26.616 -1.490 1.00 0.00 C ATOM 1368 O THR A 93 123.656 26.729 -1.515 1.00 0.00 O ATOM 1369 CB THR A 93 121.390 25.482 -3.455 1.00 0.00 C ATOM 1370 OG1 THR A 93 120.488 26.570 -3.606 1.00 0.00 O ATOM 1371 CG2 THR A 93 120.730 24.196 -3.958 1.00 0.00 C ATOM 0 H THR A 93 119.686 25.183 -1.682 1.00 0.00 H new ATOM 0 HA THR A 93 122.461 24.506 -1.856 1.00 0.00 H new ATOM 0 HB THR A 93 122.293 25.672 -4.036 1.00 0.00 H new ATOM 0 HG1 THR A 93 120.251 26.670 -4.552 1.00 0.00 H new ATOM 0 HG21 THR A 93 120.469 24.309 -5.010 1.00 0.00 H new ATOM 0 HG22 THR A 93 121.423 23.362 -3.843 1.00 0.00 H new ATOM 0 HG23 THR A 93 119.827 24.000 -3.379 1.00 0.00 H new ATOM 1379 N GLU A 94 121.627 27.579 -1.047 1.00 0.00 N ATOM 1380 CA GLU A 94 122.162 28.847 -0.566 1.00 0.00 C ATOM 1381 C GLU A 94 122.243 28.847 0.957 1.00 0.00 C ATOM 1382 O GLU A 94 121.380 28.289 1.634 1.00 0.00 O ATOM 1383 CB GLU A 94 121.265 29.998 -1.031 1.00 0.00 C ATOM 1384 CG GLU A 94 121.931 31.338 -0.686 1.00 0.00 C ATOM 1385 CD GLU A 94 121.038 32.531 -1.045 1.00 0.00 C ATOM 1386 OE1 GLU A 94 119.928 32.328 -1.519 1.00 0.00 O ATOM 1387 OE2 GLU A 94 121.484 33.646 -0.837 1.00 0.00 O ATOM 0 H GLU A 94 120.610 27.506 -1.012 1.00 0.00 H new ATOM 0 HA GLU A 94 123.165 28.979 -0.973 1.00 0.00 H new ATOM 0 HB2 GLU A 94 121.096 29.930 -2.106 1.00 0.00 H new ATOM 0 HB3 GLU A 94 120.289 29.930 -0.550 1.00 0.00 H new ATOM 0 HG2 GLU A 94 122.161 31.365 0.379 1.00 0.00 H new ATOM 0 HG3 GLU A 94 122.878 31.420 -1.219 1.00 0.00 H new ATOM 1394 N TYR A 95 123.287 29.477 1.490 1.00 0.00 N ATOM 1395 CA TYR A 95 123.491 29.531 2.935 1.00 0.00 C ATOM 1396 C TYR A 95 123.548 30.986 3.416 1.00 0.00 C ATOM 1397 O TYR A 95 124.637 31.528 3.620 1.00 0.00 O ATOM 1398 CB TYR A 95 124.788 28.804 3.301 1.00 0.00 C ATOM 1399 CG TYR A 95 124.616 27.311 3.457 1.00 0.00 C ATOM 1400 CD1 TYR A 95 124.412 26.509 2.329 1.00 0.00 C ATOM 1401 CD2 TYR A 95 124.662 26.732 4.730 1.00 0.00 C ATOM 1402 CE1 TYR A 95 124.254 25.126 2.474 1.00 0.00 C ATOM 1403 CE2 TYR A 95 124.503 25.349 4.875 1.00 0.00 C ATOM 1404 CZ TYR A 95 124.299 24.545 3.747 1.00 0.00 C ATOM 1405 OH TYR A 95 124.143 23.181 3.889 1.00 0.00 O ATOM 0 H TYR A 95 124.003 29.956 0.944 1.00 0.00 H new ATOM 0 HA TYR A 95 122.652 29.039 3.427 1.00 0.00 H new ATOM 0 HB2 TYR A 95 125.534 28.998 2.530 1.00 0.00 H new ATOM 0 HB3 TYR A 95 125.177 29.217 4.232 1.00 0.00 H new ATOM 0 HD1 TYR A 95 124.376 26.957 1.347 1.00 0.00 H new ATOM 0 HD2 TYR A 95 124.820 27.352 5.600 1.00 0.00 H new ATOM 0 HE1 TYR A 95 124.097 24.507 1.603 1.00 0.00 H new ATOM 0 HE2 TYR A 95 124.538 24.902 5.857 1.00 0.00 H new ATOM 0 HH TYR A 95 124.202 22.942 4.838 1.00 0.00 H new ATOM 1415 N PRO A 96 122.415 31.639 3.590 1.00 0.00 N ATOM 1416 CA PRO A 96 122.396 33.043 4.107 1.00 0.00 C ATOM 1417 C PRO A 96 122.664 33.108 5.608 1.00 0.00 C ATOM 1418 O PRO A 96 123.239 34.076 6.105 1.00 0.00 O ATOM 1419 CB PRO A 96 120.987 33.538 3.782 1.00 0.00 C ATOM 1420 CG PRO A 96 120.136 32.313 3.768 1.00 0.00 C ATOM 1421 CD PRO A 96 121.040 31.160 3.332 1.00 0.00 C ATOM 0 HA PRO A 96 123.178 33.652 3.654 1.00 0.00 H new ATOM 0 HB2 PRO A 96 120.638 34.251 4.529 1.00 0.00 H new ATOM 0 HB3 PRO A 96 120.961 34.047 2.818 1.00 0.00 H new ATOM 0 HG2 PRO A 96 119.714 32.123 4.755 1.00 0.00 H new ATOM 0 HG3 PRO A 96 119.299 32.431 3.080 1.00 0.00 H new ATOM 0 HD2 PRO A 96 120.825 30.253 3.897 1.00 0.00 H new ATOM 0 HD3 PRO A 96 120.896 30.921 2.278 1.00 0.00 H new ATOM 1429 N THR A 97 122.242 32.070 6.327 1.00 0.00 N ATOM 1430 CA THR A 97 122.453 31.999 7.769 1.00 0.00 C ATOM 1431 C THR A 97 123.433 30.876 8.099 1.00 0.00 C ATOM 1432 O THR A 97 123.455 29.845 7.427 1.00 0.00 O ATOM 1433 CB THR A 97 121.121 31.743 8.478 1.00 0.00 C ATOM 1434 OG1 THR A 97 120.161 32.688 8.027 1.00 0.00 O ATOM 1435 CG2 THR A 97 121.304 31.885 9.989 1.00 0.00 C ATOM 0 H THR A 97 121.752 31.267 5.933 1.00 0.00 H new ATOM 0 HA THR A 97 122.867 32.947 8.112 1.00 0.00 H new ATOM 0 HB THR A 97 120.778 30.733 8.251 1.00 0.00 H new ATOM 0 HG1 THR A 97 119.306 32.526 8.478 1.00 0.00 H new ATOM 0 HG21 THR A 97 120.353 31.702 10.489 1.00 0.00 H new ATOM 0 HG22 THR A 97 122.042 31.161 10.336 1.00 0.00 H new ATOM 0 HG23 THR A 97 121.648 32.893 10.221 1.00 0.00 H new ATOM 1443 N TYR A 98 124.241 31.080 9.133 1.00 0.00 N ATOM 1444 CA TYR A 98 125.254 30.096 9.502 1.00 0.00 C ATOM 1445 C TYR A 98 124.618 28.734 9.764 1.00 0.00 C ATOM 1446 O TYR A 98 125.181 27.698 9.405 1.00 0.00 O ATOM 1447 CB TYR A 98 126.001 30.564 10.751 1.00 0.00 C ATOM 1448 CG TYR A 98 126.742 31.865 10.556 1.00 0.00 C ATOM 1449 CD1 TYR A 98 126.101 33.081 10.823 1.00 0.00 C ATOM 1450 CD2 TYR A 98 128.067 31.854 10.106 1.00 0.00 C ATOM 1451 CE1 TYR A 98 126.789 34.287 10.641 1.00 0.00 C ATOM 1452 CE2 TYR A 98 128.753 33.060 9.923 1.00 0.00 C ATOM 1453 CZ TYR A 98 128.115 34.277 10.191 1.00 0.00 C ATOM 1454 OH TYR A 98 128.791 35.466 10.010 1.00 0.00 O ATOM 0 H TYR A 98 124.216 31.909 9.726 1.00 0.00 H new ATOM 0 HA TYR A 98 125.955 29.997 8.673 1.00 0.00 H new ATOM 0 HB2 TYR A 98 125.290 30.679 11.569 1.00 0.00 H new ATOM 0 HB3 TYR A 98 126.710 29.792 11.051 1.00 0.00 H new ATOM 0 HD1 TYR A 98 125.078 33.089 11.169 1.00 0.00 H new ATOM 0 HD2 TYR A 98 128.560 30.915 9.900 1.00 0.00 H new ATOM 0 HE1 TYR A 98 126.297 35.226 10.848 1.00 0.00 H new ATOM 0 HE2 TYR A 98 129.775 33.052 9.575 1.00 0.00 H new ATOM 0 HH TYR A 98 129.700 35.281 9.695 1.00 0.00 H new ATOM 1464 N LYS A 99 123.445 28.733 10.393 1.00 0.00 N ATOM 1465 CA LYS A 99 122.725 27.492 10.663 1.00 0.00 C ATOM 1466 C LYS A 99 121.283 27.597 10.181 1.00 0.00 C ATOM 1467 O LYS A 99 120.533 28.467 10.626 1.00 0.00 O ATOM 1468 CB LYS A 99 122.744 27.198 12.164 1.00 0.00 C ATOM 1469 CG LYS A 99 124.183 26.949 12.617 1.00 0.00 C ATOM 1470 CD LYS A 99 124.220 26.792 14.141 1.00 0.00 C ATOM 1471 CE LYS A 99 123.523 25.489 14.537 1.00 0.00 C ATOM 1472 NZ LYS A 99 124.037 25.034 15.860 1.00 0.00 N ATOM 0 H LYS A 99 122.974 29.575 10.724 1.00 0.00 H new ATOM 0 HA LYS A 99 123.217 26.680 10.127 1.00 0.00 H new ATOM 0 HB2 LYS A 99 122.318 28.037 12.715 1.00 0.00 H new ATOM 0 HB3 LYS A 99 122.127 26.327 12.382 1.00 0.00 H new ATOM 0 HG2 LYS A 99 124.576 26.052 12.139 1.00 0.00 H new ATOM 0 HG3 LYS A 99 124.820 27.778 12.311 1.00 0.00 H new ATOM 0 HD2 LYS A 99 125.252 26.786 14.492 1.00 0.00 H new ATOM 0 HD3 LYS A 99 123.727 27.640 14.617 1.00 0.00 H new ATOM 0 HE2 LYS A 99 122.445 25.641 14.586 1.00 0.00 H new ATOM 0 HE3 LYS A 99 123.703 24.724 13.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 123.564 24.148 16.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 125.063 24.874 15.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 123.844 25.762 16.577 1.00 0.00 H new ATOM 1486 N HIS A 100 120.899 26.709 9.269 1.00 0.00 N ATOM 1487 CA HIS A 100 119.538 26.709 8.743 1.00 0.00 C ATOM 1488 C HIS A 100 119.117 25.301 8.335 1.00 0.00 C ATOM 1489 O HIS A 100 119.806 24.638 7.561 1.00 0.00 O ATOM 1490 CB HIS A 100 119.449 27.641 7.532 1.00 0.00 C ATOM 1491 CG HIS A 100 118.057 27.764 6.974 1.00 0.00 C ATOM 1492 ND1 HIS A 100 117.028 28.363 7.683 1.00 0.00 N ATOM 1493 CD2 HIS A 100 117.509 27.372 5.777 1.00 0.00 C ATOM 1494 CE1 HIS A 100 115.924 28.313 6.917 1.00 0.00 C ATOM 1495 NE2 HIS A 100 116.161 27.721 5.743 1.00 0.00 N ATOM 0 H HIS A 100 121.505 25.986 8.881 1.00 0.00 H new ATOM 0 HA HIS A 100 118.867 27.062 9.526 1.00 0.00 H new ATOM 0 HB2 HIS A 100 119.807 28.630 7.817 1.00 0.00 H new ATOM 0 HB3 HIS A 100 120.115 27.274 6.751 1.00 0.00 H new ATOM 0 HD2 HIS A 100 118.042 26.870 4.983 1.00 0.00 H new ATOM 0 HE1 HIS A 100 114.962 28.704 7.215 1.00 0.00 H new ATOM 0 HE2 HIS A 100 115.498 27.559 4.985 1.00 0.00 H new ATOM 1503 N ASP A 101 117.983 24.850 8.862 1.00 0.00 N ATOM 1504 CA ASP A 101 117.468 23.530 8.520 1.00 0.00 C ATOM 1505 C ASP A 101 116.008 23.394 8.944 1.00 0.00 C ATOM 1506 O ASP A 101 115.536 24.124 9.816 1.00 0.00 O ATOM 1507 CB ASP A 101 118.305 22.450 9.207 1.00 0.00 C ATOM 1508 CG ASP A 101 118.252 22.630 10.720 1.00 0.00 C ATOM 1509 OD1 ASP A 101 117.309 22.143 11.323 1.00 0.00 O ATOM 1510 OD2 ASP A 101 119.156 23.250 11.256 1.00 0.00 O ATOM 0 H ASP A 101 117.408 25.374 9.522 1.00 0.00 H new ATOM 0 HA ASP A 101 117.531 23.406 7.439 1.00 0.00 H new ATOM 0 HB2 ASP A 101 117.931 21.462 8.937 1.00 0.00 H new ATOM 0 HB3 ASP A 101 119.338 22.505 8.862 1.00 0.00 H new ATOM 1515 N THR A 102 115.300 22.454 8.323 1.00 0.00 N ATOM 1516 CA THR A 102 113.902 22.203 8.662 1.00 0.00 C ATOM 1517 C THR A 102 113.686 20.717 8.930 1.00 0.00 C ATOM 1518 O THR A 102 114.206 19.868 8.207 1.00 0.00 O ATOM 1519 CB THR A 102 112.998 22.655 7.513 1.00 0.00 C ATOM 1520 OG1 THR A 102 113.278 24.011 7.198 1.00 0.00 O ATOM 1521 CG2 THR A 102 111.531 22.519 7.930 1.00 0.00 C ATOM 0 H THR A 102 115.670 21.855 7.585 1.00 0.00 H new ATOM 0 HA THR A 102 113.652 22.767 9.560 1.00 0.00 H new ATOM 0 HB THR A 102 113.184 22.032 6.638 1.00 0.00 H new ATOM 0 HG1 THR A 102 112.701 24.302 6.461 1.00 0.00 H new ATOM 0 HG21 THR A 102 110.888 22.841 7.111 1.00 0.00 H new ATOM 0 HG22 THR A 102 111.316 21.478 8.172 1.00 0.00 H new ATOM 0 HG23 THR A 102 111.342 23.141 8.805 1.00 0.00 H new ATOM 1529 N SER A 103 112.920 20.405 9.971 1.00 0.00 N ATOM 1530 CA SER A 103 112.659 19.013 10.321 1.00 0.00 C ATOM 1531 C SER A 103 111.205 18.815 10.741 1.00 0.00 C ATOM 1532 O SER A 103 110.671 19.574 11.550 1.00 0.00 O ATOM 1533 CB SER A 103 113.581 18.585 11.462 1.00 0.00 C ATOM 1534 OG SER A 103 113.400 17.197 11.713 1.00 0.00 O ATOM 0 H SER A 103 112.473 21.089 10.581 1.00 0.00 H new ATOM 0 HA SER A 103 112.851 18.400 9.440 1.00 0.00 H new ATOM 0 HB2 SER A 103 114.620 18.787 11.202 1.00 0.00 H new ATOM 0 HB3 SER A 103 113.360 19.161 12.360 1.00 0.00 H new ATOM 0 HG SER A 103 113.991 16.917 12.443 1.00 0.00 H new ATOM 1540 N ASP A 104 110.581 17.777 10.194 1.00 0.00 N ATOM 1541 CA ASP A 104 109.210 17.431 10.551 1.00 0.00 C ATOM 1542 C ASP A 104 109.077 15.914 10.651 1.00 0.00 C ATOM 1543 O ASP A 104 109.843 15.185 10.023 1.00 0.00 O ATOM 1544 CB ASP A 104 108.237 17.959 9.494 1.00 0.00 C ATOM 1545 CG ASP A 104 108.259 19.484 9.464 1.00 0.00 C ATOM 1546 OD1 ASP A 104 108.439 20.076 10.515 1.00 0.00 O ATOM 1547 OD2 ASP A 104 108.098 20.038 8.390 1.00 0.00 O ATOM 0 H ASP A 104 111.004 17.160 9.501 1.00 0.00 H new ATOM 0 HA ASP A 104 108.970 17.886 11.512 1.00 0.00 H new ATOM 0 HB2 ASP A 104 108.507 17.566 8.514 1.00 0.00 H new ATOM 0 HB3 ASP A 104 107.228 17.608 9.712 1.00 0.00 H new ATOM 1552 N TYR A 105 108.103 15.447 11.430 1.00 0.00 N ATOM 1553 CA TYR A 105 107.901 14.010 11.614 1.00 0.00 C ATOM 1554 C TYR A 105 106.434 13.631 11.435 1.00 0.00 C ATOM 1555 O TYR A 105 105.538 14.447 11.657 1.00 0.00 O ATOM 1556 CB TYR A 105 108.393 13.596 13.006 1.00 0.00 C ATOM 1557 CG TYR A 105 107.549 14.125 14.144 1.00 0.00 C ATOM 1558 CD1 TYR A 105 107.781 15.408 14.651 1.00 0.00 C ATOM 1559 CD2 TYR A 105 106.534 13.330 14.690 1.00 0.00 C ATOM 1560 CE1 TYR A 105 107.000 15.898 15.703 1.00 0.00 C ATOM 1561 CE2 TYR A 105 105.752 13.820 15.743 1.00 0.00 C ATOM 1562 CZ TYR A 105 105.985 15.105 16.250 1.00 0.00 C ATOM 1563 OH TYR A 105 105.215 15.585 17.290 1.00 0.00 O ATOM 0 H TYR A 105 107.446 16.037 11.940 1.00 0.00 H new ATOM 0 HA TYR A 105 108.475 13.480 10.854 1.00 0.00 H new ATOM 0 HB2 TYR A 105 108.417 12.508 13.062 1.00 0.00 H new ATOM 0 HB3 TYR A 105 109.418 13.945 13.136 1.00 0.00 H new ATOM 0 HD1 TYR A 105 108.564 16.021 14.230 1.00 0.00 H new ATOM 0 HD2 TYR A 105 106.354 12.339 14.299 1.00 0.00 H new ATOM 0 HE1 TYR A 105 107.180 16.889 16.093 1.00 0.00 H new ATOM 0 HE2 TYR A 105 104.969 13.207 16.164 1.00 0.00 H new ATOM 0 HH TYR A 105 104.556 14.907 17.549 1.00 0.00 H new ATOM 1573 N GLY A 106 106.196 12.385 11.032 1.00 0.00 N ATOM 1574 CA GLY A 106 104.838 11.898 10.832 1.00 0.00 C ATOM 1575 C GLY A 106 104.730 10.449 11.287 1.00 0.00 C ATOM 1576 O GLY A 106 105.745 9.786 11.499 1.00 0.00 O ATOM 0 H GLY A 106 106.925 11.698 10.839 1.00 0.00 H new ATOM 0 HA2 GLY A 106 104.136 12.516 11.391 1.00 0.00 H new ATOM 0 HA3 GLY A 106 104.566 11.978 9.780 1.00 0.00 H new ATOM 1580 N PHE A 107 103.502 9.953 11.414 1.00 0.00 N ATOM 1581 CA PHE A 107 103.293 8.567 11.818 1.00 0.00 C ATOM 1582 C PHE A 107 102.970 7.723 10.592 1.00 0.00 C ATOM 1583 O PHE A 107 102.050 8.043 9.840 1.00 0.00 O ATOM 1584 CB PHE A 107 102.143 8.481 12.822 1.00 0.00 C ATOM 1585 CG PHE A 107 102.418 9.212 14.114 1.00 0.00 C ATOM 1586 CD1 PHE A 107 103.130 8.578 15.140 1.00 0.00 C ATOM 1587 CD2 PHE A 107 101.961 10.525 14.288 1.00 0.00 C ATOM 1588 CE1 PHE A 107 103.385 9.255 16.338 1.00 0.00 C ATOM 1589 CE2 PHE A 107 102.216 11.202 15.486 1.00 0.00 C ATOM 1590 CZ PHE A 107 102.927 10.568 16.511 1.00 0.00 C ATOM 0 H PHE A 107 102.647 10.483 11.245 1.00 0.00 H new ATOM 0 HA PHE A 107 104.201 8.191 12.289 1.00 0.00 H new ATOM 0 HB2 PHE A 107 101.242 8.891 12.366 1.00 0.00 H new ATOM 0 HB3 PHE A 107 101.941 7.433 13.042 1.00 0.00 H new ATOM 0 HD1 PHE A 107 103.483 7.566 15.007 1.00 0.00 H new ATOM 0 HD2 PHE A 107 101.412 11.015 13.497 1.00 0.00 H new ATOM 0 HE1 PHE A 107 103.934 8.766 17.129 1.00 0.00 H new ATOM 0 HE2 PHE A 107 101.864 12.214 15.619 1.00 0.00 H new ATOM 0 HZ PHE A 107 103.123 11.091 17.436 1.00 0.00 H new ATOM 1600 N SER A 108 103.727 6.647 10.388 1.00 0.00 N ATOM 1601 CA SER A 108 103.527 5.804 9.214 1.00 0.00 C ATOM 1602 C SER A 108 102.945 4.450 9.602 1.00 0.00 C ATOM 1603 O SER A 108 103.303 3.883 10.631 1.00 0.00 O ATOM 1604 CB SER A 108 104.860 5.589 8.497 1.00 0.00 C ATOM 1605 OG SER A 108 105.393 6.850 8.114 1.00 0.00 O ATOM 0 H SER A 108 104.474 6.342 11.012 1.00 0.00 H new ATOM 0 HA SER A 108 102.824 6.310 8.552 1.00 0.00 H new ATOM 0 HB2 SER A 108 105.559 5.069 9.152 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.717 4.959 7.619 1.00 0.00 H new ATOM 0 HG SER A 108 106.249 6.718 7.655 1.00 0.00 H new ATOM 1611 N TYR A 109 102.047 3.945 8.762 1.00 0.00 N ATOM 1612 CA TYR A 109 101.455 2.628 8.965 1.00 0.00 C ATOM 1613 C TYR A 109 101.676 1.790 7.713 1.00 0.00 C ATOM 1614 O TYR A 109 101.518 2.296 6.605 1.00 0.00 O ATOM 1615 CB TYR A 109 99.955 2.768 9.233 1.00 0.00 C ATOM 1616 CG TYR A 109 99.642 3.602 10.453 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.477 4.987 10.330 1.00 0.00 C ATOM 1618 CD2 TYR A 109 99.525 2.992 11.707 1.00 0.00 C ATOM 1619 CE1 TYR A 109 99.194 5.761 11.461 1.00 0.00 C ATOM 1620 CE2 TYR A 109 99.240 3.766 12.839 1.00 0.00 C ATOM 1621 CZ TYR A 109 99.076 5.150 12.717 1.00 0.00 C ATOM 1622 OH TYR A 109 98.795 5.912 13.831 1.00 0.00 O ATOM 0 H TYR A 109 101.712 4.431 7.930 1.00 0.00 H new ATOM 0 HA TYR A 109 101.923 2.144 9.822 1.00 0.00 H new ATOM 0 HB2 TYR A 109 99.478 3.217 8.362 1.00 0.00 H new ATOM 0 HB3 TYR A 109 99.521 1.776 9.358 1.00 0.00 H new ATOM 0 HD1 TYR A 109 99.568 5.458 9.362 1.00 0.00 H new ATOM 0 HD2 TYR A 109 99.655 1.924 11.802 1.00 0.00 H new ATOM 0 HE1 TYR A 109 99.066 6.829 11.366 1.00 0.00 H new ATOM 0 HE2 TYR A 109 99.147 3.294 13.806 1.00 0.00 H new ATOM 0 HH TYR A 109 98.746 5.333 14.620 1.00 0.00 H new ATOM 1632 N GLY A 110 102.048 0.522 7.880 1.00 0.00 N ATOM 1633 CA GLY A 110 102.340 -0.323 6.726 1.00 0.00 C ATOM 1634 C GLY A 110 101.813 -1.736 6.917 1.00 0.00 C ATOM 1635 O GLY A 110 101.679 -2.212 8.043 1.00 0.00 O ATOM 0 H GLY A 110 102.153 0.065 8.786 1.00 0.00 H new ATOM 0 HA2 GLY A 110 101.894 0.114 5.833 1.00 0.00 H new ATOM 0 HA3 GLY A 110 103.417 -0.355 6.562 1.00 0.00 H new ATOM 1639 N ALA A 111 101.525 -2.402 5.805 1.00 0.00 N ATOM 1640 CA ALA A 111 101.082 -3.790 5.850 1.00 0.00 C ATOM 1641 C ALA A 111 101.577 -4.530 4.616 1.00 0.00 C ATOM 1642 O ALA A 111 101.709 -3.935 3.547 1.00 0.00 O ATOM 1643 CB ALA A 111 99.555 -3.853 5.913 1.00 0.00 C ATOM 0 H ALA A 111 101.590 -2.007 4.867 1.00 0.00 H new ATOM 0 HA ALA A 111 101.493 -4.263 6.742 1.00 0.00 H new ATOM 0 HB1 ALA A 111 99.235 -4.894 5.946 1.00 0.00 H new ATOM 0 HB2 ALA A 111 99.206 -3.337 6.808 1.00 0.00 H new ATOM 0 HB3 ALA A 111 99.134 -3.372 5.030 1.00 0.00 H new ATOM 1649 N GLY A 112 101.838 -5.825 4.760 1.00 0.00 N ATOM 1650 CA GLY A 112 102.354 -6.608 3.640 1.00 0.00 C ATOM 1651 C GLY A 112 101.878 -8.056 3.676 1.00 0.00 C ATOM 1652 O GLY A 112 101.488 -8.566 4.729 1.00 0.00 O ATOM 0 H GLY A 112 101.704 -6.349 5.625 1.00 0.00 H new ATOM 0 HA2 GLY A 112 102.040 -6.148 2.703 1.00 0.00 H new ATOM 0 HA3 GLY A 112 103.444 -6.586 3.656 1.00 0.00 H new ATOM 1656 N LEU A 113 101.950 -8.705 2.515 1.00 0.00 N ATOM 1657 CA LEU A 113 101.573 -10.108 2.380 1.00 0.00 C ATOM 1658 C LEU A 113 102.836 -10.938 2.168 1.00 0.00 C ATOM 1659 O LEU A 113 103.766 -10.463 1.514 1.00 0.00 O ATOM 1660 CB LEU A 113 100.633 -10.300 1.184 1.00 0.00 C ATOM 1661 CG LEU A 113 99.415 -9.381 1.312 1.00 0.00 C ATOM 1662 CD1 LEU A 113 98.535 -9.527 0.069 1.00 0.00 C ATOM 1663 CD2 LEU A 113 98.602 -9.766 2.551 1.00 0.00 C ATOM 0 H LEU A 113 102.270 -8.275 1.647 1.00 0.00 H new ATOM 0 HA LEU A 113 101.056 -10.428 3.284 1.00 0.00 H new ATOM 0 HB2 LEU A 113 101.164 -10.084 0.257 1.00 0.00 H new ATOM 0 HB3 LEU A 113 100.309 -11.339 1.131 1.00 0.00 H new ATOM 0 HG LEU A 113 99.753 -8.349 1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 113 97.667 -8.873 0.159 1.00 0.00 H new ATOM 0 HD12 LEU A 113 99.107 -9.251 -0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 113 98.202 -10.561 -0.022 1.00 0.00 H new ATOM 0 HD21 LEU A 113 97.737 -9.109 2.637 1.00 0.00 H new ATOM 0 HD22 LEU A 113 98.266 -10.799 2.459 1.00 0.00 H new ATOM 0 HD23 LEU A 113 99.224 -9.665 3.440 1.00 0.00 H new ATOM 1675 N GLN A 114 102.873 -12.172 2.683 1.00 0.00 N ATOM 1676 CA GLN A 114 104.112 -12.953 2.647 1.00 0.00 C ATOM 1677 C GLN A 114 103.904 -14.315 1.995 1.00 0.00 C ATOM 1678 O GLN A 114 102.883 -14.972 2.199 1.00 0.00 O ATOM 1679 CB GLN A 114 104.638 -13.165 4.068 1.00 0.00 C ATOM 1680 CG GLN A 114 105.041 -11.824 4.683 1.00 0.00 C ATOM 1681 CD GLN A 114 105.475 -12.006 6.135 1.00 0.00 C ATOM 1682 OE1 GLN A 114 105.167 -13.022 6.761 1.00 0.00 O ATOM 1683 NE2 GLN A 114 106.178 -11.073 6.715 1.00 0.00 N ATOM 0 H GLN A 114 102.080 -12.642 3.119 1.00 0.00 H new ATOM 0 HA GLN A 114 104.832 -12.390 2.054 1.00 0.00 H new ATOM 0 HB2 GLN A 114 103.872 -13.640 4.681 1.00 0.00 H new ATOM 0 HB3 GLN A 114 105.495 -13.838 4.051 1.00 0.00 H new ATOM 0 HG2 GLN A 114 105.855 -11.384 4.107 1.00 0.00 H new ATOM 0 HG3 GLN A 114 104.203 -11.129 4.633 1.00 0.00 H new ATOM 0 HE21 GLN A 114 106.434 -10.232 6.198 1.00 0.00 H new ATOM 0 HE22 GLN A 114 106.472 -11.185 7.685 1.00 0.00 H new ATOM 1692 N PHE A 115 104.892 -14.725 1.205 1.00 0.00 N ATOM 1693 CA PHE A 115 104.947 -16.087 0.698 1.00 0.00 C ATOM 1694 C PHE A 115 106.397 -16.532 0.753 1.00 0.00 C ATOM 1695 O PHE A 115 107.230 -16.006 0.015 1.00 0.00 O ATOM 1696 CB PHE A 115 104.431 -16.151 -0.741 1.00 0.00 C ATOM 1697 CG PHE A 115 104.543 -17.526 -1.357 1.00 0.00 C ATOM 1698 CD1 PHE A 115 103.735 -18.571 -0.893 1.00 0.00 C ATOM 1699 CD2 PHE A 115 105.453 -17.756 -2.396 1.00 0.00 C ATOM 1700 CE1 PHE A 115 103.838 -19.845 -1.465 1.00 0.00 C ATOM 1701 CE2 PHE A 115 105.557 -19.029 -2.968 1.00 0.00 C ATOM 1702 CZ PHE A 115 104.749 -20.073 -2.504 1.00 0.00 C ATOM 0 H PHE A 115 105.665 -14.131 0.903 1.00 0.00 H new ATOM 0 HA PHE A 115 104.317 -16.740 1.301 1.00 0.00 H new ATOM 0 HB2 PHE A 115 103.388 -15.836 -0.759 1.00 0.00 H new ATOM 0 HB3 PHE A 115 104.989 -15.441 -1.351 1.00 0.00 H new ATOM 0 HD1 PHE A 115 103.031 -18.394 -0.093 1.00 0.00 H new ATOM 0 HD2 PHE A 115 106.075 -16.950 -2.756 1.00 0.00 H new ATOM 0 HE1 PHE A 115 103.216 -20.651 -1.105 1.00 0.00 H new ATOM 0 HE2 PHE A 115 106.261 -19.206 -3.768 1.00 0.00 H new ATOM 0 HZ PHE A 115 104.828 -21.055 -2.947 1.00 0.00 H new ATOM 1712 N ASN A 116 106.716 -17.462 1.654 1.00 0.00 N ATOM 1713 CA ASN A 116 108.118 -17.783 1.912 1.00 0.00 C ATOM 1714 C ASN A 116 108.379 -19.289 1.929 1.00 0.00 C ATOM 1715 O ASN A 116 107.743 -20.023 2.686 1.00 0.00 O ATOM 1716 CB ASN A 116 108.503 -17.218 3.284 1.00 0.00 C ATOM 1717 CG ASN A 116 108.232 -15.716 3.344 1.00 0.00 C ATOM 1718 OD1 ASN A 116 108.141 -15.056 2.310 1.00 0.00 O ATOM 1719 ND2 ASN A 116 108.092 -15.135 4.503 1.00 0.00 N ATOM 0 H ASN A 116 106.041 -17.994 2.204 1.00 0.00 H new ATOM 0 HA ASN A 116 108.710 -17.346 1.108 1.00 0.00 H new ATOM 0 HB2 ASN A 116 107.937 -17.726 4.064 1.00 0.00 H new ATOM 0 HB3 ASN A 116 109.558 -17.410 3.479 1.00 0.00 H new ATOM 0 HD21 ASN A 116 107.907 -14.133 4.552 1.00 0.00 H new ATOM 0 HD22 ASN A 116 108.167 -15.682 5.360 1.00 0.00 H new ATOM 1726 N PRO A 117 109.292 -19.762 1.118 1.00 0.00 N ATOM 1727 CA PRO A 117 109.997 -21.044 1.356 1.00 0.00 C ATOM 1728 C PRO A 117 111.391 -20.757 1.908 1.00 0.00 C ATOM 1729 O PRO A 117 111.782 -19.594 2.017 1.00 0.00 O ATOM 1730 CB PRO A 117 110.062 -21.682 -0.041 1.00 0.00 C ATOM 1731 CG PRO A 117 109.702 -20.601 -1.015 1.00 0.00 C ATOM 1732 CD PRO A 117 109.637 -19.292 -0.228 1.00 0.00 C ATOM 0 HA PRO A 117 109.507 -21.696 2.079 1.00 0.00 H new ATOM 0 HB2 PRO A 117 111.059 -22.072 -0.244 1.00 0.00 H new ATOM 0 HB3 PRO A 117 109.370 -22.521 -0.118 1.00 0.00 H new ATOM 0 HG2 PRO A 117 110.444 -20.536 -1.810 1.00 0.00 H new ATOM 0 HG3 PRO A 117 108.744 -20.813 -1.490 1.00 0.00 H new ATOM 0 HD2 PRO A 117 110.588 -18.759 -0.243 1.00 0.00 H new ATOM 0 HD3 PRO A 117 108.885 -18.612 -0.628 1.00 0.00 H new ATOM 1740 N MET A 118 112.138 -21.801 2.253 1.00 0.00 N ATOM 1741 CA MET A 118 113.486 -21.610 2.782 1.00 0.00 C ATOM 1742 C MET A 118 114.348 -20.834 1.785 1.00 0.00 C ATOM 1743 O MET A 118 113.959 -20.656 0.633 1.00 0.00 O ATOM 1744 CB MET A 118 114.131 -22.967 3.068 1.00 0.00 C ATOM 1745 CG MET A 118 113.345 -23.683 4.169 1.00 0.00 C ATOM 1746 SD MET A 118 114.221 -25.186 4.670 1.00 0.00 S ATOM 1747 CE MET A 118 114.200 -26.022 3.065 1.00 0.00 C ATOM 0 H MET A 118 111.840 -22.774 2.178 1.00 0.00 H new ATOM 0 HA MET A 118 113.416 -21.039 3.708 1.00 0.00 H new ATOM 0 HB2 MET A 118 114.144 -23.574 2.162 1.00 0.00 H new ATOM 0 HB3 MET A 118 115.168 -22.831 3.376 1.00 0.00 H new ATOM 0 HG2 MET A 118 113.218 -23.022 5.026 1.00 0.00 H new ATOM 0 HG3 MET A 118 112.347 -23.935 3.811 1.00 0.00 H new ATOM 0 HE1 MET A 118 114.148 -27.100 3.217 1.00 0.00 H new ATOM 0 HE2 MET A 118 113.331 -25.693 2.495 1.00 0.00 H new ATOM 0 HE3 MET A 118 115.109 -25.777 2.515 1.00 0.00 H new ATOM 1757 N GLU A 119 115.498 -20.353 2.253 1.00 0.00 N ATOM 1758 CA GLU A 119 116.467 -19.676 1.391 1.00 0.00 C ATOM 1759 C GLU A 119 115.921 -18.359 0.831 1.00 0.00 C ATOM 1760 O GLU A 119 114.815 -17.936 1.167 1.00 0.00 O ATOM 1761 CB GLU A 119 116.887 -20.611 0.250 1.00 0.00 C ATOM 1762 CG GLU A 119 117.511 -21.881 0.840 1.00 0.00 C ATOM 1763 CD GLU A 119 118.036 -22.818 -0.253 1.00 0.00 C ATOM 1764 OE1 GLU A 119 117.748 -22.595 -1.422 1.00 0.00 O ATOM 1765 OE2 GLU A 119 118.725 -23.761 0.098 1.00 0.00 O ATOM 0 H GLU A 119 115.783 -20.420 3.230 1.00 0.00 H new ATOM 0 HA GLU A 119 117.337 -19.428 1.999 1.00 0.00 H new ATOM 0 HB2 GLU A 119 116.023 -20.867 -0.362 1.00 0.00 H new ATOM 0 HB3 GLU A 119 117.602 -20.110 -0.402 1.00 0.00 H new ATOM 0 HG2 GLU A 119 118.328 -21.608 1.508 1.00 0.00 H new ATOM 0 HG3 GLU A 119 116.769 -22.405 1.442 1.00 0.00 H new ATOM 1772 N ASN A 120 116.703 -17.741 -0.055 1.00 0.00 N ATOM 1773 CA ASN A 120 116.412 -16.416 -0.608 1.00 0.00 C ATOM 1774 C ASN A 120 115.069 -16.328 -1.340 1.00 0.00 C ATOM 1775 O ASN A 120 114.607 -15.233 -1.649 1.00 0.00 O ATOM 1776 CB ASN A 120 117.527 -16.016 -1.576 1.00 0.00 C ATOM 1777 CG ASN A 120 118.863 -15.969 -0.842 1.00 0.00 C ATOM 1778 OD1 ASN A 120 119.852 -16.531 -1.314 1.00 0.00 O ATOM 1779 ND2 ASN A 120 118.953 -15.327 0.290 1.00 0.00 N ATOM 0 H ASN A 120 117.566 -18.150 -0.413 1.00 0.00 H new ATOM 0 HA ASN A 120 116.353 -15.737 0.242 1.00 0.00 H new ATOM 0 HB2 ASN A 120 117.579 -16.730 -2.398 1.00 0.00 H new ATOM 0 HB3 ASN A 120 117.308 -15.042 -2.013 1.00 0.00 H new ATOM 0 HD21 ASN A 120 119.844 -15.290 0.786 1.00 0.00 H new ATOM 0 HD22 ASN A 120 118.133 -14.862 0.679 1.00 0.00 H new ATOM 1786 N VAL A 121 114.435 -17.459 -1.608 1.00 0.00 N ATOM 1787 CA VAL A 121 113.261 -17.491 -2.477 1.00 0.00 C ATOM 1788 C VAL A 121 111.974 -17.027 -1.782 1.00 0.00 C ATOM 1789 O VAL A 121 110.882 -17.309 -2.278 1.00 0.00 O ATOM 1790 CB VAL A 121 113.060 -18.897 -3.053 1.00 0.00 C ATOM 1791 CG1 VAL A 121 114.233 -19.238 -3.975 1.00 0.00 C ATOM 1792 CG2 VAL A 121 112.994 -19.931 -1.924 1.00 0.00 C ATOM 0 H VAL A 121 114.711 -18.369 -1.238 1.00 0.00 H new ATOM 0 HA VAL A 121 113.460 -16.782 -3.280 1.00 0.00 H new ATOM 0 HB VAL A 121 112.124 -18.919 -3.612 1.00 0.00 H new ATOM 0 HG11 VAL A 121 114.094 -20.238 -4.387 1.00 0.00 H new ATOM 0 HG12 VAL A 121 114.279 -18.514 -4.788 1.00 0.00 H new ATOM 0 HG13 VAL A 121 115.163 -19.206 -3.408 1.00 0.00 H new ATOM 0 HG21 VAL A 121 112.851 -20.925 -2.349 1.00 0.00 H new ATOM 0 HG22 VAL A 121 113.924 -19.909 -1.356 1.00 0.00 H new ATOM 0 HG23 VAL A 121 112.160 -19.695 -1.263 1.00 0.00 H new ATOM 1802 N ALA A 122 112.081 -16.327 -0.648 1.00 0.00 N ATOM 1803 CA ALA A 122 110.889 -15.840 0.047 1.00 0.00 C ATOM 1804 C ALA A 122 110.741 -14.338 -0.188 1.00 0.00 C ATOM 1805 O ALA A 122 111.745 -13.630 -0.227 1.00 0.00 O ATOM 1806 CB ALA A 122 111.038 -16.105 1.545 1.00 0.00 C ATOM 0 H ALA A 122 112.965 -16.089 -0.199 1.00 0.00 H new ATOM 0 HA ALA A 122 110.007 -16.356 -0.333 1.00 0.00 H new ATOM 0 HB1 ALA A 122 110.152 -15.744 2.068 1.00 0.00 H new ATOM 0 HB2 ALA A 122 111.149 -17.176 1.716 1.00 0.00 H new ATOM 0 HB3 ALA A 122 111.919 -15.584 1.921 1.00 0.00 H new ATOM 1812 N LEU A 123 109.505 -13.844 -0.337 1.00 0.00 N ATOM 1813 CA LEU A 123 109.313 -12.435 -0.687 1.00 0.00 C ATOM 1814 C LEU A 123 108.052 -11.848 -0.061 1.00 0.00 C ATOM 1815 O LEU A 123 107.111 -12.568 0.276 1.00 0.00 O ATOM 1816 CB LEU A 123 109.284 -12.214 -2.217 1.00 0.00 C ATOM 1817 CG LEU A 123 108.503 -13.281 -3.016 1.00 0.00 C ATOM 1818 CD1 LEU A 123 109.339 -14.551 -3.189 1.00 0.00 C ATOM 1819 CD2 LEU A 123 107.160 -13.632 -2.361 1.00 0.00 C ATOM 0 H LEU A 123 108.646 -14.383 -0.224 1.00 0.00 H new ATOM 0 HA LEU A 123 110.176 -11.910 -0.276 1.00 0.00 H new ATOM 0 HB2 LEU A 123 108.845 -11.237 -2.420 1.00 0.00 H new ATOM 0 HB3 LEU A 123 110.310 -12.185 -2.584 1.00 0.00 H new ATOM 0 HG LEU A 123 108.295 -12.848 -3.994 1.00 0.00 H new ATOM 0 HD11 LEU A 123 108.769 -15.288 -3.754 1.00 0.00 H new ATOM 0 HD12 LEU A 123 110.257 -14.312 -3.727 1.00 0.00 H new ATOM 0 HD13 LEU A 123 109.588 -14.959 -2.209 1.00 0.00 H new ATOM 0 HD21 LEU A 123 106.649 -14.386 -2.960 1.00 0.00 H new ATOM 0 HD22 LEU A 123 107.335 -14.023 -1.359 1.00 0.00 H new ATOM 0 HD23 LEU A 123 106.541 -12.737 -2.299 1.00 0.00 H new ATOM 1831 N ASP A 124 108.063 -10.527 0.099 1.00 0.00 N ATOM 1832 CA ASP A 124 106.930 -9.806 0.673 1.00 0.00 C ATOM 1833 C ASP A 124 106.652 -8.526 -0.115 1.00 0.00 C ATOM 1834 O ASP A 124 107.573 -7.911 -0.653 1.00 0.00 O ATOM 1835 CB ASP A 124 107.222 -9.462 2.139 1.00 0.00 C ATOM 1836 CG ASP A 124 106.045 -8.716 2.765 1.00 0.00 C ATOM 1837 OD1 ASP A 124 106.036 -7.499 2.691 1.00 0.00 O ATOM 1838 OD2 ASP A 124 105.164 -9.370 3.293 1.00 0.00 O ATOM 0 H ASP A 124 108.849 -9.931 -0.162 1.00 0.00 H new ATOM 0 HA ASP A 124 106.048 -10.445 0.620 1.00 0.00 H new ATOM 0 HB2 ASP A 124 107.419 -10.376 2.700 1.00 0.00 H new ATOM 0 HB3 ASP A 124 108.121 -8.850 2.202 1.00 0.00 H new ATOM 1843 N PHE A 125 105.379 -8.141 -0.170 1.00 0.00 N ATOM 1844 CA PHE A 125 104.989 -6.874 -0.791 1.00 0.00 C ATOM 1845 C PHE A 125 104.159 -6.062 0.199 1.00 0.00 C ATOM 1846 O PHE A 125 103.186 -6.578 0.748 1.00 0.00 O ATOM 1847 CB PHE A 125 104.167 -7.138 -2.053 1.00 0.00 C ATOM 1848 CG PHE A 125 104.924 -7.895 -3.120 1.00 0.00 C ATOM 1849 CD1 PHE A 125 104.889 -9.294 -3.142 1.00 0.00 C ATOM 1850 CD2 PHE A 125 105.661 -7.198 -4.085 1.00 0.00 C ATOM 1851 CE1 PHE A 125 105.589 -9.997 -4.130 1.00 0.00 C ATOM 1852 CE2 PHE A 125 106.361 -7.902 -5.071 1.00 0.00 C ATOM 1853 CZ PHE A 125 106.325 -9.300 -5.094 1.00 0.00 C ATOM 0 H PHE A 125 104.602 -8.684 0.206 1.00 0.00 H new ATOM 0 HA PHE A 125 105.886 -6.317 -1.063 1.00 0.00 H new ATOM 0 HB2 PHE A 125 103.274 -7.702 -1.784 1.00 0.00 H new ATOM 0 HB3 PHE A 125 103.831 -6.186 -2.464 1.00 0.00 H new ATOM 0 HD1 PHE A 125 104.322 -9.832 -2.397 1.00 0.00 H new ATOM 0 HD2 PHE A 125 105.689 -6.118 -4.068 1.00 0.00 H new ATOM 0 HE1 PHE A 125 105.561 -11.076 -4.148 1.00 0.00 H new ATOM 0 HE2 PHE A 125 106.930 -7.365 -5.815 1.00 0.00 H new ATOM 0 HZ PHE A 125 106.866 -9.842 -5.856 1.00 0.00 H new ATOM 1863 N SER A 126 104.540 -4.807 0.438 1.00 0.00 N ATOM 1864 CA SER A 126 103.855 -3.999 1.450 1.00 0.00 C ATOM 1865 C SER A 126 103.677 -2.559 0.986 1.00 0.00 C ATOM 1866 O SER A 126 104.441 -2.070 0.155 1.00 0.00 O ATOM 1867 CB SER A 126 104.629 -4.031 2.767 1.00 0.00 C ATOM 1868 OG SER A 126 105.826 -3.281 2.629 1.00 0.00 O ATOM 0 H SER A 126 105.304 -4.334 -0.044 1.00 0.00 H new ATOM 0 HA SER A 126 102.865 -4.429 1.604 1.00 0.00 H new ATOM 0 HB2 SER A 126 104.019 -3.618 3.570 1.00 0.00 H new ATOM 0 HB3 SER A 126 104.861 -5.060 3.040 1.00 0.00 H new ATOM 0 HG SER A 126 106.323 -3.299 3.474 1.00 0.00 H new ATOM 1874 N TYR A 127 102.660 -1.887 1.521 1.00 0.00 N ATOM 1875 CA TYR A 127 102.419 -0.480 1.209 1.00 0.00 C ATOM 1876 C TYR A 127 102.464 0.349 2.489 1.00 0.00 C ATOM 1877 O TYR A 127 102.140 -0.153 3.567 1.00 0.00 O ATOM 1878 CB TYR A 127 101.062 -0.324 0.513 1.00 0.00 C ATOM 1879 CG TYR A 127 99.870 -0.605 1.400 1.00 0.00 C ATOM 1880 CD1 TYR A 127 99.417 -1.918 1.569 1.00 0.00 C ATOM 1881 CD2 TYR A 127 99.221 0.451 2.051 1.00 0.00 C ATOM 1882 CE1 TYR A 127 98.312 -2.176 2.390 1.00 0.00 C ATOM 1883 CE2 TYR A 127 98.118 0.192 2.873 1.00 0.00 C ATOM 1884 CZ TYR A 127 97.662 -1.121 3.043 1.00 0.00 C ATOM 1885 OH TYR A 127 96.574 -1.374 3.851 1.00 0.00 O ATOM 0 H TYR A 127 101.989 -2.294 2.173 1.00 0.00 H new ATOM 0 HA TYR A 127 103.197 -0.122 0.535 1.00 0.00 H new ATOM 0 HB2 TYR A 127 100.980 0.692 0.126 1.00 0.00 H new ATOM 0 HB3 TYR A 127 101.028 -0.996 -0.345 1.00 0.00 H new ATOM 0 HD1 TYR A 127 99.919 -2.732 1.067 1.00 0.00 H new ATOM 0 HD2 TYR A 127 99.571 1.464 1.919 1.00 0.00 H new ATOM 0 HE1 TYR A 127 97.961 -3.189 2.520 1.00 0.00 H new ATOM 0 HE2 TYR A 127 97.618 1.006 3.377 1.00 0.00 H new ATOM 0 HH TYR A 127 96.243 -0.532 4.228 1.00 0.00 H new ATOM 1895 N GLU A 128 102.873 1.609 2.359 1.00 0.00 N ATOM 1896 CA GLU A 128 103.025 2.493 3.510 1.00 0.00 C ATOM 1897 C GLU A 128 102.209 3.765 3.318 1.00 0.00 C ATOM 1898 O GLU A 128 102.184 4.337 2.229 1.00 0.00 O ATOM 1899 CB GLU A 128 104.503 2.850 3.680 1.00 0.00 C ATOM 1900 CG GLU A 128 104.715 3.623 4.987 1.00 0.00 C ATOM 1901 CD GLU A 128 106.170 4.080 5.148 1.00 0.00 C ATOM 1902 OE1 GLU A 128 106.981 3.834 4.266 1.00 0.00 O ATOM 1903 OE2 GLU A 128 106.460 4.682 6.170 1.00 0.00 O ATOM 0 H GLU A 128 103.106 2.041 1.465 1.00 0.00 H new ATOM 0 HA GLU A 128 102.663 1.980 4.401 1.00 0.00 H new ATOM 0 HB2 GLU A 128 105.106 1.942 3.685 1.00 0.00 H new ATOM 0 HB3 GLU A 128 104.839 3.451 2.835 1.00 0.00 H new ATOM 0 HG2 GLU A 128 104.057 4.492 5.007 1.00 0.00 H new ATOM 0 HG3 GLU A 128 104.436 2.993 5.832 1.00 0.00 H new ATOM 1910 N GLN A 129 101.541 4.207 4.381 1.00 0.00 N ATOM 1911 CA GLN A 129 100.718 5.409 4.321 1.00 0.00 C ATOM 1912 C GLN A 129 101.187 6.424 5.359 1.00 0.00 C ATOM 1913 O GLN A 129 101.362 6.086 6.529 1.00 0.00 O ATOM 1914 CB GLN A 129 99.254 5.050 4.583 1.00 0.00 C ATOM 1915 CG GLN A 129 98.371 6.280 4.349 1.00 0.00 C ATOM 1916 CD GLN A 129 98.231 6.543 2.853 1.00 0.00 C ATOM 1917 OE1 GLN A 129 97.667 5.723 2.129 1.00 0.00 O ATOM 1918 NE2 GLN A 129 98.711 7.644 2.346 1.00 0.00 N ATOM 0 H GLN A 129 101.554 3.750 5.293 1.00 0.00 H new ATOM 0 HA GLN A 129 100.813 5.847 3.327 1.00 0.00 H new ATOM 0 HB2 GLN A 129 98.945 4.238 3.925 1.00 0.00 H new ATOM 0 HB3 GLN A 129 99.134 4.694 5.606 1.00 0.00 H new ATOM 0 HG2 GLN A 129 97.388 6.122 4.793 1.00 0.00 H new ATOM 0 HG3 GLN A 129 98.807 7.150 4.841 1.00 0.00 H new ATOM 0 HE21 GLN A 129 99.178 8.322 2.949 1.00 0.00 H new ATOM 0 HE22 GLN A 129 98.620 7.828 1.347 1.00 0.00 H new ATOM 1927 N SER A 130 101.405 7.654 4.909 1.00 0.00 N ATOM 1928 CA SER A 130 101.758 8.754 5.798 1.00 0.00 C ATOM 1929 C SER A 130 100.701 9.841 5.678 1.00 0.00 C ATOM 1930 O SER A 130 100.302 10.181 4.560 1.00 0.00 O ATOM 1931 CB SER A 130 103.127 9.334 5.444 1.00 0.00 C ATOM 1932 OG SER A 130 104.067 8.275 5.324 1.00 0.00 O ATOM 0 H SER A 130 101.343 7.916 3.925 1.00 0.00 H new ATOM 0 HA SER A 130 101.804 8.377 6.820 1.00 0.00 H new ATOM 0 HB2 SER A 130 103.068 9.892 4.509 1.00 0.00 H new ATOM 0 HB3 SER A 130 103.448 10.036 6.214 1.00 0.00 H new ATOM 0 HG SER A 130 104.971 8.646 5.254 1.00 0.00 H new ATOM 1938 N ARG A 131 100.410 10.503 6.795 1.00 0.00 N ATOM 1939 CA ARG A 131 99.201 11.309 6.937 1.00 0.00 C ATOM 1940 C ARG A 131 99.480 12.731 6.481 1.00 0.00 C ATOM 1941 O ARG A 131 100.585 13.244 6.652 1.00 0.00 O ATOM 1942 CB ARG A 131 98.725 11.321 8.392 1.00 0.00 C ATOM 1943 CG ARG A 131 98.274 9.919 8.804 1.00 0.00 C ATOM 1944 CD ARG A 131 97.686 9.971 10.214 1.00 0.00 C ATOM 1945 NE ARG A 131 97.397 8.618 10.700 1.00 0.00 N ATOM 1946 CZ ARG A 131 96.386 7.866 10.237 1.00 0.00 C ATOM 1947 NH1 ARG A 131 95.584 8.283 9.286 1.00 0.00 N ATOM 1948 NH2 ARG A 131 96.195 6.681 10.748 1.00 0.00 N ATOM 0 H ARG A 131 101.004 10.496 7.624 1.00 0.00 H new ATOM 0 HA ARG A 131 98.417 10.871 6.319 1.00 0.00 H new ATOM 0 HB2 ARG A 131 99.530 11.660 9.044 1.00 0.00 H new ATOM 0 HB3 ARG A 131 97.902 12.026 8.509 1.00 0.00 H new ATOM 0 HG2 ARG A 131 97.531 9.543 8.101 1.00 0.00 H new ATOM 0 HG3 ARG A 131 99.118 9.230 8.775 1.00 0.00 H new ATOM 0 HD2 ARG A 131 98.386 10.464 10.888 1.00 0.00 H new ATOM 0 HD3 ARG A 131 96.773 10.566 10.212 1.00 0.00 H new ATOM 0 HE ARG A 131 97.996 8.228 11.428 1.00 0.00 H new ATOM 0 HH11 ARG A 131 95.719 9.206 8.874 1.00 0.00 H new ATOM 0 HH12 ARG A 131 94.826 7.684 8.959 1.00 0.00 H new ATOM 0 HH21 ARG A 131 96.809 6.339 11.487 1.00 0.00 H new ATOM 0 HH22 ARG A 131 95.432 6.096 10.408 1.00 0.00 H new ATOM 1962 N ILE A 132 98.468 13.363 5.895 1.00 0.00 N ATOM 1963 CA ILE A 132 98.713 14.342 4.850 1.00 0.00 C ATOM 1964 C ILE A 132 98.944 15.759 5.385 1.00 0.00 C ATOM 1965 O ILE A 132 98.035 16.533 5.683 1.00 0.00 O ATOM 1966 CB ILE A 132 97.546 14.317 3.846 1.00 0.00 C ATOM 1967 CG1 ILE A 132 97.839 15.264 2.675 1.00 0.00 C ATOM 1968 CG2 ILE A 132 96.225 14.723 4.516 1.00 0.00 C ATOM 1969 CD1 ILE A 132 97.072 14.806 1.433 1.00 0.00 C ATOM 0 H ILE A 132 97.485 13.216 6.124 1.00 0.00 H new ATOM 0 HA ILE A 132 99.641 14.061 4.352 1.00 0.00 H new ATOM 0 HB ILE A 132 97.445 13.297 3.476 1.00 0.00 H new ATOM 0 HG12 ILE A 132 97.550 16.282 2.937 1.00 0.00 H new ATOM 0 HG13 ILE A 132 98.909 15.280 2.467 1.00 0.00 H new ATOM 0 HG21 ILE A 132 95.421 14.695 3.781 1.00 0.00 H new ATOM 0 HG22 ILE A 132 96.000 14.030 5.326 1.00 0.00 H new ATOM 0 HG23 ILE A 132 96.316 15.733 4.917 1.00 0.00 H new ATOM 0 HD11 ILE A 132 97.284 15.482 0.605 1.00 0.00 H new ATOM 0 HD12 ILE A 132 97.383 13.796 1.166 1.00 0.00 H new ATOM 0 HD13 ILE A 132 96.002 14.813 1.643 1.00 0.00 H new ATOM 1981 N ARG A 133 100.234 16.036 5.512 1.00 0.00 N ATOM 1982 CA ARG A 133 100.780 17.386 5.527 1.00 0.00 C ATOM 1983 C ARG A 133 101.097 17.769 4.078 1.00 0.00 C ATOM 1984 O ARG A 133 100.806 17.003 3.151 1.00 0.00 O ATOM 1985 CB ARG A 133 102.054 17.437 6.374 1.00 0.00 C ATOM 1986 CG ARG A 133 101.718 17.082 7.824 1.00 0.00 C ATOM 1987 CD ARG A 133 102.988 17.153 8.676 1.00 0.00 C ATOM 1988 NE ARG A 133 103.433 18.543 8.811 1.00 0.00 N ATOM 1989 CZ ARG A 133 102.884 19.416 9.669 1.00 0.00 C ATOM 1990 NH1 ARG A 133 101.892 19.088 10.462 1.00 0.00 N ATOM 1991 NH2 ARG A 133 103.354 20.633 9.716 1.00 0.00 N ATOM 0 H ARG A 133 100.946 15.312 5.610 1.00 0.00 H new ATOM 0 HA ARG A 133 100.062 18.081 5.962 1.00 0.00 H new ATOM 0 HB2 ARG A 133 102.793 16.740 5.980 1.00 0.00 H new ATOM 0 HB3 ARG A 133 102.496 18.432 6.325 1.00 0.00 H new ATOM 0 HG2 ARG A 133 100.968 17.770 8.213 1.00 0.00 H new ATOM 0 HG3 ARG A 133 101.289 16.081 7.874 1.00 0.00 H new ATOM 0 HD2 ARG A 133 102.797 16.728 9.661 1.00 0.00 H new ATOM 0 HD3 ARG A 133 103.775 16.555 8.218 1.00 0.00 H new ATOM 0 HE ARG A 133 104.201 18.864 8.221 1.00 0.00 H new ATOM 0 HH11 ARG A 133 101.512 18.142 10.439 1.00 0.00 H new ATOM 0 HH12 ARG A 133 101.500 19.779 11.101 1.00 0.00 H new ATOM 0 HH21 ARG A 133 104.125 20.906 9.107 1.00 0.00 H new ATOM 0 HH22 ARG A 133 102.950 21.311 10.362 1.00 0.00 H new ATOM 2005 N SER A 134 101.671 18.950 3.859 1.00 0.00 N ATOM 2006 CA SER A 134 101.897 19.424 2.488 1.00 0.00 C ATOM 2007 C SER A 134 102.638 18.382 1.628 1.00 0.00 C ATOM 2008 O SER A 134 102.641 18.492 0.403 1.00 0.00 O ATOM 2009 CB SER A 134 102.705 20.721 2.518 1.00 0.00 C ATOM 2010 OG SER A 134 102.821 21.229 1.196 1.00 0.00 O ATOM 0 H SER A 134 101.983 19.587 4.592 1.00 0.00 H new ATOM 0 HA SER A 134 100.920 19.596 2.036 1.00 0.00 H new ATOM 0 HB2 SER A 134 102.216 21.453 3.160 1.00 0.00 H new ATOM 0 HB3 SER A 134 103.694 20.538 2.938 1.00 0.00 H new ATOM 0 HG SER A 134 102.862 20.483 0.561 1.00 0.00 H new ATOM 2016 N VAL A 135 103.264 17.379 2.254 1.00 0.00 N ATOM 2017 CA VAL A 135 103.759 16.210 1.525 1.00 0.00 C ATOM 2018 C VAL A 135 103.036 14.950 2.015 1.00 0.00 C ATOM 2019 O VAL A 135 102.993 14.681 3.215 1.00 0.00 O ATOM 2020 CB VAL A 135 105.270 16.055 1.732 1.00 0.00 C ATOM 2021 CG1 VAL A 135 105.792 14.886 0.893 1.00 0.00 C ATOM 2022 CG2 VAL A 135 105.987 17.338 1.299 1.00 0.00 C ATOM 0 H VAL A 135 103.438 17.355 3.259 1.00 0.00 H new ATOM 0 HA VAL A 135 103.563 16.349 0.462 1.00 0.00 H new ATOM 0 HB VAL A 135 105.463 15.864 2.788 1.00 0.00 H new ATOM 0 HG11 VAL A 135 106.866 14.781 1.044 1.00 0.00 H new ATOM 0 HG12 VAL A 135 105.291 13.967 1.198 1.00 0.00 H new ATOM 0 HG13 VAL A 135 105.591 15.076 -0.161 1.00 0.00 H new ATOM 0 HG21 VAL A 135 107.061 17.223 1.448 1.00 0.00 H new ATOM 0 HG22 VAL A 135 105.785 17.529 0.245 1.00 0.00 H new ATOM 0 HG23 VAL A 135 105.626 18.176 1.895 1.00 0.00 H new ATOM 2032 N ASP A 136 102.471 14.186 1.081 1.00 0.00 N ATOM 2033 CA ASP A 136 101.756 12.952 1.419 1.00 0.00 C ATOM 2034 C ASP A 136 102.488 11.748 0.831 1.00 0.00 C ATOM 2035 O ASP A 136 102.963 11.815 -0.303 1.00 0.00 O ATOM 2036 CB ASP A 136 100.332 13.002 0.857 1.00 0.00 C ATOM 2037 CG ASP A 136 99.532 11.806 1.360 1.00 0.00 C ATOM 2038 OD1 ASP A 136 99.006 11.890 2.457 1.00 0.00 O ATOM 2039 OD2 ASP A 136 99.456 10.823 0.641 1.00 0.00 O ATOM 0 H ASP A 136 102.494 14.398 0.084 1.00 0.00 H new ATOM 0 HA ASP A 136 101.715 12.857 2.504 1.00 0.00 H new ATOM 0 HB2 ASP A 136 99.845 13.929 1.159 1.00 0.00 H new ATOM 0 HB3 ASP A 136 100.362 12.998 -0.233 1.00 0.00 H new ATOM 2044 N VAL A 137 102.583 10.647 1.585 1.00 0.00 N ATOM 2045 CA VAL A 137 103.426 9.522 1.146 1.00 0.00 C ATOM 2046 C VAL A 137 102.592 8.326 0.692 1.00 0.00 C ATOM 2047 O VAL A 137 101.731 7.839 1.424 1.00 0.00 O ATOM 2048 CB VAL A 137 104.366 9.058 2.267 1.00 0.00 C ATOM 2049 CG1 VAL A 137 105.381 8.063 1.699 1.00 0.00 C ATOM 2050 CG2 VAL A 137 105.126 10.248 2.867 1.00 0.00 C ATOM 0 H VAL A 137 102.104 10.509 2.475 1.00 0.00 H new ATOM 0 HA VAL A 137 104.009 9.893 0.303 1.00 0.00 H new ATOM 0 HB VAL A 137 103.767 8.588 3.047 1.00 0.00 H new ATOM 0 HG11 VAL A 137 106.050 7.732 2.493 1.00 0.00 H new ATOM 0 HG12 VAL A 137 104.855 7.203 1.286 1.00 0.00 H new ATOM 0 HG13 VAL A 137 105.962 8.545 0.913 1.00 0.00 H new ATOM 0 HG21 VAL A 137 105.786 9.896 3.660 1.00 0.00 H new ATOM 0 HG22 VAL A 137 105.718 10.731 2.090 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.415 10.964 3.279 1.00 0.00 H new ATOM 2060 N GLY A 138 102.859 7.864 -0.527 1.00 0.00 N ATOM 2061 CA GLY A 138 102.347 6.578 -0.991 1.00 0.00 C ATOM 2062 C GLY A 138 103.514 5.722 -1.468 1.00 0.00 C ATOM 2063 O GLY A 138 104.115 6.030 -2.495 1.00 0.00 O ATOM 0 H GLY A 138 103.428 8.362 -1.212 1.00 0.00 H new ATOM 0 HA2 GLY A 138 101.814 6.072 -0.186 1.00 0.00 H new ATOM 0 HA3 GLY A 138 101.634 6.727 -1.801 1.00 0.00 H new ATOM 2067 N THR A 139 103.860 4.677 -0.719 1.00 0.00 N ATOM 2068 CA THR A 139 105.048 3.882 -1.036 1.00 0.00 C ATOM 2069 C THR A 139 104.708 2.403 -1.162 1.00 0.00 C ATOM 2070 O THR A 139 103.990 1.856 -0.329 1.00 0.00 O ATOM 2071 CB THR A 139 106.102 4.070 0.058 1.00 0.00 C ATOM 2072 OG1 THR A 139 106.337 5.458 0.250 1.00 0.00 O ATOM 2073 CG2 THR A 139 107.405 3.385 -0.361 1.00 0.00 C ATOM 0 H THR A 139 103.343 4.362 0.102 1.00 0.00 H new ATOM 0 HA THR A 139 105.439 4.227 -1.993 1.00 0.00 H new ATOM 0 HB THR A 139 105.745 3.627 0.988 1.00 0.00 H new ATOM 0 HG1 THR A 139 107.010 5.582 0.951 1.00 0.00 H new ATOM 0 HG21 THR A 139 108.154 3.520 0.419 1.00 0.00 H new ATOM 0 HG22 THR A 139 107.225 2.320 -0.511 1.00 0.00 H new ATOM 0 HG23 THR A 139 107.765 3.826 -1.290 1.00 0.00 H new ATOM 2081 N TRP A 140 105.221 1.762 -2.211 1.00 0.00 N ATOM 2082 CA TRP A 140 105.072 0.313 -2.365 1.00 0.00 C ATOM 2083 C TRP A 140 106.450 -0.323 -2.488 1.00 0.00 C ATOM 2084 O TRP A 140 107.280 0.160 -3.256 1.00 0.00 O ATOM 2085 CB TRP A 140 104.222 -0.027 -3.595 1.00 0.00 C ATOM 2086 CG TRP A 140 104.577 0.741 -4.828 1.00 0.00 C ATOM 2087 CD1 TRP A 140 105.552 0.407 -5.705 1.00 0.00 C ATOM 2088 CD2 TRP A 140 103.969 1.964 -5.338 1.00 0.00 C ATOM 2089 NE1 TRP A 140 105.583 1.345 -6.719 1.00 0.00 N ATOM 2090 CE2 TRP A 140 104.627 2.325 -6.539 1.00 0.00 C ATOM 2091 CE3 TRP A 140 102.925 2.784 -4.880 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 104.256 3.463 -7.260 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 102.551 3.929 -5.602 1.00 0.00 C ATOM 2094 CH2 TRP A 140 103.213 4.267 -6.788 1.00 0.00 C ATOM 0 H TRP A 140 105.740 2.217 -2.962 1.00 0.00 H new ATOM 0 HA TRP A 140 104.561 -0.082 -1.487 1.00 0.00 H new ATOM 0 HB2 TRP A 140 104.320 -1.092 -3.805 1.00 0.00 H new ATOM 0 HB3 TRP A 140 103.174 0.156 -3.358 1.00 0.00 H new ATOM 0 HD1 TRP A 140 106.200 -0.453 -5.625 1.00 0.00 H new ATOM 0 HE1 TRP A 140 106.233 1.317 -7.505 1.00 0.00 H new ATOM 0 HE3 TRP A 140 102.406 2.532 -3.967 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 104.770 3.720 -8.174 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 101.747 4.553 -5.240 1.00 0.00 H new ATOM 0 HH2 TRP A 140 102.919 5.148 -7.339 1.00 0.00 H new ATOM 2105 N ILE A 141 106.693 -1.393 -1.729 1.00 0.00 N ATOM 2106 CA ILE A 141 108.032 -1.970 -1.636 1.00 0.00 C ATOM 2107 C ILE A 141 107.997 -3.479 -1.867 1.00 0.00 C ATOM 2108 O ILE A 141 107.060 -4.155 -1.443 1.00 0.00 O ATOM 2109 CB ILE A 141 108.618 -1.656 -0.252 1.00 0.00 C ATOM 2110 CG1 ILE A 141 110.053 -2.185 -0.152 1.00 0.00 C ATOM 2111 CG2 ILE A 141 107.768 -2.299 0.847 1.00 0.00 C ATOM 2112 CD1 ILE A 141 110.768 -1.513 1.022 1.00 0.00 C ATOM 0 H ILE A 141 105.985 -1.874 -1.174 1.00 0.00 H new ATOM 0 HA ILE A 141 108.661 -1.531 -2.410 1.00 0.00 H new ATOM 0 HB ILE A 141 108.619 -0.574 -0.120 1.00 0.00 H new ATOM 0 HG12 ILE A 141 110.044 -3.266 -0.014 1.00 0.00 H new ATOM 0 HG13 ILE A 141 110.590 -1.986 -1.080 1.00 0.00 H new ATOM 0 HG21 ILE A 141 108.197 -2.067 1.822 1.00 0.00 H new ATOM 0 HG22 ILE A 141 106.751 -1.909 0.796 1.00 0.00 H new ATOM 0 HG23 ILE A 141 107.749 -3.380 0.707 1.00 0.00 H new ATOM 0 HD11 ILE A 141 111.788 -1.891 1.091 1.00 0.00 H new ATOM 0 HD12 ILE A 141 110.790 -0.435 0.865 1.00 0.00 H new ATOM 0 HD13 ILE A 141 110.236 -1.734 1.947 1.00 0.00 H new ATOM 2124 N ALA A 142 109.033 -3.991 -2.526 1.00 0.00 N ATOM 2125 CA ALA A 142 109.177 -5.431 -2.726 1.00 0.00 C ATOM 2126 C ALA A 142 110.526 -5.874 -2.171 1.00 0.00 C ATOM 2127 O ALA A 142 111.548 -5.252 -2.459 1.00 0.00 O ATOM 2128 CB ALA A 142 109.095 -5.769 -4.216 1.00 0.00 C ATOM 0 H ALA A 142 109.784 -3.432 -2.930 1.00 0.00 H new ATOM 0 HA ALA A 142 108.372 -5.952 -2.207 1.00 0.00 H new ATOM 0 HB1 ALA A 142 109.204 -6.845 -4.352 1.00 0.00 H new ATOM 0 HB2 ALA A 142 108.130 -5.449 -4.609 1.00 0.00 H new ATOM 0 HB3 ALA A 142 109.893 -5.254 -4.750 1.00 0.00 H new ATOM 2134 N GLY A 143 110.523 -6.935 -1.366 1.00 0.00 N ATOM 2135 CA GLY A 143 111.754 -7.396 -0.729 1.00 0.00 C ATOM 2136 C GLY A 143 111.907 -8.910 -0.827 1.00 0.00 C ATOM 2137 O GLY A 143 110.921 -9.642 -0.888 1.00 0.00 O ATOM 0 H GLY A 143 109.694 -7.485 -1.142 1.00 0.00 H new ATOM 0 HA2 GLY A 143 112.610 -6.913 -1.199 1.00 0.00 H new ATOM 0 HA3 GLY A 143 111.755 -7.097 0.319 1.00 0.00 H new ATOM 2141 N VAL A 144 113.160 -9.358 -0.804 1.00 0.00 N ATOM 2142 CA VAL A 144 113.482 -10.776 -0.906 1.00 0.00 C ATOM 2143 C VAL A 144 114.411 -11.170 0.243 1.00 0.00 C ATOM 2144 O VAL A 144 115.279 -10.383 0.624 1.00 0.00 O ATOM 2145 CB VAL A 144 114.145 -11.036 -2.264 1.00 0.00 C ATOM 2146 CG1 VAL A 144 115.434 -10.220 -2.383 1.00 0.00 C ATOM 2147 CG2 VAL A 144 114.472 -12.522 -2.409 1.00 0.00 C ATOM 0 H VAL A 144 113.975 -8.751 -0.715 1.00 0.00 H new ATOM 0 HA VAL A 144 112.577 -11.379 -0.835 1.00 0.00 H new ATOM 0 HB VAL A 144 113.455 -10.738 -3.053 1.00 0.00 H new ATOM 0 HG11 VAL A 144 115.898 -10.411 -3.351 1.00 0.00 H new ATOM 0 HG12 VAL A 144 115.202 -9.159 -2.295 1.00 0.00 H new ATOM 0 HG13 VAL A 144 116.122 -10.508 -1.588 1.00 0.00 H new ATOM 0 HG21 VAL A 144 114.943 -12.698 -3.376 1.00 0.00 H new ATOM 0 HG22 VAL A 144 115.153 -12.824 -1.614 1.00 0.00 H new ATOM 0 HG23 VAL A 144 113.554 -13.105 -2.341 1.00 0.00 H new ATOM 2157 N GLY A 145 114.214 -12.359 0.812 1.00 0.00 N ATOM 2158 CA GLY A 145 114.981 -12.753 1.988 1.00 0.00 C ATOM 2159 C GLY A 145 115.089 -14.268 2.143 1.00 0.00 C ATOM 2160 O GLY A 145 114.524 -15.035 1.358 1.00 0.00 O ATOM 0 H GLY A 145 113.542 -13.053 0.484 1.00 0.00 H new ATOM 0 HA2 GLY A 145 115.982 -12.327 1.923 1.00 0.00 H new ATOM 0 HA3 GLY A 145 114.513 -12.334 2.879 1.00 0.00 H new ATOM 2164 N TYR A 146 115.818 -14.671 3.185 1.00 0.00 N ATOM 2165 CA TYR A 146 116.016 -16.082 3.502 1.00 0.00 C ATOM 2166 C TYR A 146 115.946 -16.300 5.011 1.00 0.00 C ATOM 2167 O TYR A 146 115.928 -15.340 5.782 1.00 0.00 O ATOM 2168 CB TYR A 146 117.371 -16.562 2.963 1.00 0.00 C ATOM 2169 CG TYR A 146 118.568 -15.957 3.661 1.00 0.00 C ATOM 2170 CD1 TYR A 146 119.064 -14.714 3.250 1.00 0.00 C ATOM 2171 CD2 TYR A 146 119.179 -16.639 4.720 1.00 0.00 C ATOM 2172 CE1 TYR A 146 120.173 -14.154 3.897 1.00 0.00 C ATOM 2173 CE2 TYR A 146 120.287 -16.080 5.367 1.00 0.00 C ATOM 2174 CZ TYR A 146 120.783 -14.837 4.956 1.00 0.00 C ATOM 2175 OH TYR A 146 121.877 -14.285 5.594 1.00 0.00 O ATOM 0 H TYR A 146 116.284 -14.031 3.828 1.00 0.00 H new ATOM 0 HA TYR A 146 115.223 -16.660 3.027 1.00 0.00 H new ATOM 0 HB2 TYR A 146 117.422 -17.647 3.055 1.00 0.00 H new ATOM 0 HB3 TYR A 146 117.429 -16.329 1.900 1.00 0.00 H new ATOM 0 HD1 TYR A 146 118.592 -14.187 2.434 1.00 0.00 H new ATOM 0 HD2 TYR A 146 118.795 -17.597 5.038 1.00 0.00 H new ATOM 0 HE1 TYR A 146 120.557 -13.196 3.579 1.00 0.00 H new ATOM 0 HE2 TYR A 146 120.759 -16.607 6.183 1.00 0.00 H new ATOM 0 HH TYR A 146 122.178 -14.887 6.306 1.00 0.00 H new ATOM 2185 N ARG A 147 115.942 -17.567 5.424 1.00 0.00 N ATOM 2186 CA ARG A 147 115.856 -17.917 6.839 1.00 0.00 C ATOM 2187 C ARG A 147 117.107 -18.671 7.280 1.00 0.00 C ATOM 2188 O ARG A 147 117.718 -19.391 6.491 1.00 0.00 O ATOM 2189 CB ARG A 147 114.630 -18.796 7.089 1.00 0.00 C ATOM 2190 CG ARG A 147 113.356 -18.025 6.741 1.00 0.00 C ATOM 2191 CD ARG A 147 112.137 -18.879 7.097 1.00 0.00 C ATOM 2192 NE ARG A 147 110.911 -18.253 6.594 1.00 0.00 N ATOM 2193 CZ ARG A 147 109.682 -18.738 6.831 1.00 0.00 C ATOM 2194 NH1 ARG A 147 109.483 -19.826 7.536 1.00 0.00 N ATOM 2195 NH2 ARG A 147 108.651 -18.106 6.343 1.00 0.00 N ATOM 0 H ARG A 147 115.998 -18.369 4.796 1.00 0.00 H new ATOM 0 HA ARG A 147 115.770 -16.995 7.413 1.00 0.00 H new ATOM 0 HB2 ARG A 147 114.693 -19.702 6.487 1.00 0.00 H new ATOM 0 HB3 ARG A 147 114.603 -19.108 8.133 1.00 0.00 H new ATOM 0 HG2 ARG A 147 113.327 -17.082 7.288 1.00 0.00 H new ATOM 0 HG3 ARG A 147 113.345 -17.778 5.679 1.00 0.00 H new ATOM 0 HD2 ARG A 147 112.246 -19.876 6.670 1.00 0.00 H new ATOM 0 HD3 ARG A 147 112.074 -19.001 8.178 1.00 0.00 H new ATOM 0 HE ARG A 147 110.996 -17.404 6.035 1.00 0.00 H new ATOM 0 HH11 ARG A 147 110.277 -20.334 7.925 1.00 0.00 H new ATOM 0 HH12 ARG A 147 108.534 -20.164 7.695 1.00 0.00 H new ATOM 0 HH21 ARG A 147 108.786 -17.258 5.792 1.00 0.00 H new ATOM 0 HH22 ARG A 147 107.709 -18.459 6.512 1.00 0.00 H new ATOM 2209 N PHE A 148 117.483 -18.503 8.545 1.00 0.00 N ATOM 2210 CA PHE A 148 118.672 -19.164 9.073 1.00 0.00 C ATOM 2211 C PHE A 148 118.394 -20.640 9.335 1.00 0.00 C ATOM 2212 O PHE A 148 119.313 -21.429 9.192 1.00 0.00 O ATOM 2213 CB PHE A 148 119.111 -18.487 10.372 1.00 0.00 C ATOM 2214 CG PHE A 148 120.402 -19.035 10.929 1.00 0.00 C ATOM 2215 CD1 PHE A 148 121.626 -18.470 10.550 1.00 0.00 C ATOM 2216 CD2 PHE A 148 120.376 -20.109 11.827 1.00 0.00 C ATOM 2217 CE1 PHE A 148 122.822 -18.978 11.069 1.00 0.00 C ATOM 2218 CE2 PHE A 148 121.574 -20.618 12.344 1.00 0.00 C ATOM 2219 CZ PHE A 148 122.797 -20.053 11.965 1.00 0.00 C ATOM 2220 OXT PHE A 148 117.267 -20.959 9.673 1.00 0.00 O ATOM 0 H PHE A 148 116.986 -17.920 9.218 1.00 0.00 H new ATOM 0 HA PHE A 148 119.468 -19.083 8.333 1.00 0.00 H new ATOM 0 HB2 PHE A 148 119.226 -17.418 10.194 1.00 0.00 H new ATOM 0 HB3 PHE A 148 118.324 -18.604 11.117 1.00 0.00 H new ATOM 0 HD1 PHE A 148 121.647 -17.642 9.857 1.00 0.00 H new ATOM 0 HD2 PHE A 148 119.433 -20.545 12.121 1.00 0.00 H new ATOM 0 HE1 PHE A 148 123.765 -18.540 10.778 1.00 0.00 H new ATOM 0 HE2 PHE A 148 121.554 -21.447 13.036 1.00 0.00 H new ATOM 0 HZ PHE A 148 123.721 -20.446 12.364 1.00 0.00 H new TER 2230 PHE A 148