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 169:sc= 1.26 USER MOD Set 1.2: A 130 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 89 LYS NZ :NH3+ -169:sc= 1.17 (180deg=0) USER MOD Set 2.2: A 103 SER OG : rot -40:sc= 1.05 USER MOD Set 3.1: A 59 LYS NZ :NH3+ -155:sc= -1.32 (180deg=-2.2) USER MOD Set 3.2: A 61 GLN : amide:sc= -0.472 K(o=-1.8,f=-2.7) USER MOD Set 3.3: A 63 TYR OH : rot 173:sc=-1.5e-05 USER MOD Set 4.1: A 12 SER OG : rot 180:sc= 1.05 USER MOD Set 4.2: A 139 THR OG1 : rot -120:sc= 1.28 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 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 16:sc= -0.225 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 17 GLN : amide:sc= -0.0706 X(o=-0.071,f=-0.072) USER MOD Single : A 18 MET CE :methyl -147:sc= -0.179 (180deg=-1.34) USER MOD Single : A 19 ASN : amide:sc= -1.23 K(o=-1.2,f=-0.37) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -149:sc= -0.213 (180deg=-1.29) USER MOD Single : A 25 ASN : amide:sc= -2.8 K(o=-2.8,f=-7.8!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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=-0.000589 K(o=-0.00059,f=-1.3) USER MOD Single : A 35 SER OG : rot 97:sc= -1.01! USER MOD Single : A 42 SER OG : rot 180:sc= -0.0335 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot -76:sc= 1.37 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.101 K(o=-0.1,f=-5.4!) USER MOD Single : A 60 ASN : amide:sc= -1.28 K(o=-1.3,f=-3) USER MOD Single : A 62 TYR OH : rot 180:sc= -0.331 USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.716 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.357 X(o=-0.36,f=-0.049) USER MOD Single : A 78 SER OG : rot -133:sc= 0.49 USER MOD Single : A 80 TYR OH : rot 180:sc= -0.134 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -1.13 K(o=-1.1,f=-3.1) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.182 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : 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+ 155:sc= -0.221 (180deg=-1.1) 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 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= -1.05 K(o=-1,f=-2.3) USER MOD Single : A 116 ASN : amide:sc= -0.265 X(o=-0.26,f=-0.082) USER MOD Single : A 118 MET CE :methyl 129:sc= -0.133 (180deg=-0.998) USER MOD Single : A 120 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 126 SER OG : rot 25:sc= 0.686 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 SER OG : rot -43:sc= 1.08 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 115.545 -22.197 9.370 1.00 0.00 N ATOM 2 CA ALA A 1 116.390 -23.237 8.720 1.00 0.00 C ATOM 3 C ALA A 1 117.211 -22.600 7.604 1.00 0.00 C ATOM 4 O ALA A 1 118.438 -22.691 7.592 1.00 0.00 O ATOM 5 CB ALA A 1 115.492 -24.335 8.145 1.00 0.00 C ATOM 0 H1 ALA A 1 114.985 -22.631 10.131 1.00 0.00 H new ATOM 0 H2 ALA A 1 116.154 -21.454 9.769 1.00 0.00 H new ATOM 0 H3 ALA A 1 114.905 -21.779 8.665 1.00 0.00 H new ATOM 0 HA ALA A 1 117.065 -23.674 9.456 1.00 0.00 H new ATOM 0 HB1 ALA A 1 116.109 -25.097 7.669 1.00 0.00 H new ATOM 0 HB2 ALA A 1 114.911 -24.788 8.949 1.00 0.00 H new ATOM 0 HB3 ALA A 1 114.816 -23.903 7.408 1.00 0.00 H new ATOM 13 N THR A 2 116.523 -21.953 6.667 1.00 0.00 N ATOM 14 CA THR A 2 117.188 -21.297 5.544 1.00 0.00 C ATOM 15 C THR A 2 116.830 -19.815 5.504 1.00 0.00 C ATOM 16 O THR A 2 115.689 -19.436 5.764 1.00 0.00 O ATOM 17 CB THR A 2 116.766 -21.960 4.231 1.00 0.00 C ATOM 18 OG1 THR A 2 117.003 -23.359 4.312 1.00 0.00 O ATOM 19 CG2 THR A 2 117.575 -21.370 3.074 1.00 0.00 C ATOM 0 H THR A 2 115.506 -21.869 6.663 1.00 0.00 H new ATOM 0 HA THR A 2 118.266 -21.397 5.673 1.00 0.00 H new ATOM 0 HB THR A 2 115.705 -21.779 4.057 1.00 0.00 H new ATOM 0 HG1 THR A 2 116.732 -23.786 3.473 1.00 0.00 H new ATOM 0 HG21 THR A 2 117.273 -21.844 2.140 1.00 0.00 H new ATOM 0 HG22 THR A 2 117.393 -20.297 3.012 1.00 0.00 H new ATOM 0 HG23 THR A 2 118.637 -21.548 3.244 1.00 0.00 H new ATOM 27 N SER A 3 117.814 -18.981 5.178 1.00 0.00 N ATOM 28 CA SER A 3 117.599 -17.539 5.107 1.00 0.00 C ATOM 29 C SER A 3 118.117 -16.988 3.783 1.00 0.00 C ATOM 30 O SER A 3 119.038 -17.546 3.187 1.00 0.00 O ATOM 31 CB SER A 3 118.321 -16.848 6.264 1.00 0.00 C ATOM 32 OG SER A 3 119.723 -17.017 6.105 1.00 0.00 O ATOM 0 H SER A 3 118.765 -19.278 4.959 1.00 0.00 H new ATOM 0 HA SER A 3 116.529 -17.344 5.177 1.00 0.00 H new ATOM 0 HB2 SER A 3 118.070 -15.787 6.284 1.00 0.00 H new ATOM 0 HB3 SER A 3 117.997 -17.270 7.215 1.00 0.00 H new ATOM 0 HG SER A 3 120.192 -16.574 6.843 1.00 0.00 H new ATOM 38 N THR A 4 117.509 -15.894 3.328 1.00 0.00 N ATOM 39 CA THR A 4 117.913 -15.255 2.079 1.00 0.00 C ATOM 40 C THR A 4 118.098 -13.754 2.286 1.00 0.00 C ATOM 41 O THR A 4 117.250 -13.096 2.889 1.00 0.00 O ATOM 42 CB THR A 4 116.854 -15.499 1.001 1.00 0.00 C ATOM 43 OG1 THR A 4 116.614 -16.894 0.886 1.00 0.00 O ATOM 44 CG2 THR A 4 117.350 -14.953 -0.338 1.00 0.00 C ATOM 0 H THR A 4 116.735 -15.432 3.806 1.00 0.00 H new ATOM 0 HA THR A 4 118.861 -15.687 1.758 1.00 0.00 H new ATOM 0 HB THR A 4 115.930 -14.991 1.277 1.00 0.00 H new ATOM 0 HG1 THR A 4 115.935 -17.053 0.198 1.00 0.00 H new ATOM 0 HG21 THR A 4 116.595 -15.128 -1.104 1.00 0.00 H new ATOM 0 HG22 THR A 4 117.535 -13.883 -0.248 1.00 0.00 H new ATOM 0 HG23 THR A 4 118.274 -15.459 -0.617 1.00 0.00 H new ATOM 52 N VAL A 5 119.207 -13.216 1.786 1.00 0.00 N ATOM 53 CA VAL A 5 119.494 -11.789 1.934 1.00 0.00 C ATOM 54 C VAL A 5 119.679 -11.165 0.557 1.00 0.00 C ATOM 55 O VAL A 5 120.385 -11.716 -0.284 1.00 0.00 O ATOM 56 CB VAL A 5 120.764 -11.586 2.771 1.00 0.00 C ATOM 57 CG1 VAL A 5 121.000 -10.091 2.998 1.00 0.00 C ATOM 58 CG2 VAL A 5 120.606 -12.277 4.128 1.00 0.00 C ATOM 0 H VAL A 5 119.919 -13.741 1.278 1.00 0.00 H new ATOM 0 HA VAL A 5 118.659 -11.308 2.444 1.00 0.00 H new ATOM 0 HB VAL A 5 121.612 -12.015 2.237 1.00 0.00 H new ATOM 0 HG11 VAL A 5 121.903 -9.951 3.593 1.00 0.00 H new ATOM 0 HG12 VAL A 5 121.118 -9.591 2.037 1.00 0.00 H new ATOM 0 HG13 VAL A 5 120.148 -9.664 3.527 1.00 0.00 H new ATOM 0 HG21 VAL A 5 121.510 -12.130 4.719 1.00 0.00 H new ATOM 0 HG22 VAL A 5 119.754 -11.850 4.657 1.00 0.00 H new ATOM 0 HG23 VAL A 5 120.441 -13.344 3.976 1.00 0.00 H new ATOM 68 N THR A 6 119.029 -10.028 0.322 1.00 0.00 N ATOM 69 CA THR A 6 119.122 -9.365 -0.974 1.00 0.00 C ATOM 70 C THR A 6 119.193 -7.847 -0.818 1.00 0.00 C ATOM 71 O THR A 6 118.799 -7.298 0.210 1.00 0.00 O ATOM 72 CB THR A 6 117.926 -9.764 -1.849 1.00 0.00 C ATOM 73 OG1 THR A 6 118.101 -9.239 -3.157 1.00 0.00 O ATOM 74 CG2 THR A 6 116.614 -9.241 -1.257 1.00 0.00 C ATOM 0 H THR A 6 118.439 -9.552 1.004 1.00 0.00 H new ATOM 0 HA THR A 6 120.043 -9.688 -1.460 1.00 0.00 H new ATOM 0 HB THR A 6 117.875 -10.852 -1.889 1.00 0.00 H new ATOM 0 HG1 THR A 6 119.036 -8.973 -3.280 1.00 0.00 H new ATOM 0 HG21 THR A 6 115.783 -9.538 -1.896 1.00 0.00 H new ATOM 0 HG22 THR A 6 116.472 -9.659 -0.260 1.00 0.00 H new ATOM 0 HG23 THR A 6 116.652 -8.154 -1.192 1.00 0.00 H new ATOM 82 N GLY A 7 119.699 -7.182 -1.850 1.00 0.00 N ATOM 83 CA GLY A 7 119.730 -5.724 -1.867 1.00 0.00 C ATOM 84 C GLY A 7 119.480 -5.225 -3.282 1.00 0.00 C ATOM 85 O GLY A 7 119.811 -5.916 -4.246 1.00 0.00 O ATOM 0 H GLY A 7 120.091 -7.625 -2.681 1.00 0.00 H new ATOM 0 HA2 GLY A 7 118.973 -5.326 -1.191 1.00 0.00 H new ATOM 0 HA3 GLY A 7 120.696 -5.366 -1.510 1.00 0.00 H new ATOM 89 N GLY A 8 118.900 -4.035 -3.406 1.00 0.00 N ATOM 90 CA GLY A 8 118.589 -3.500 -4.728 1.00 0.00 C ATOM 91 C GLY A 8 118.543 -1.978 -4.728 1.00 0.00 C ATOM 92 O GLY A 8 118.550 -1.343 -3.675 1.00 0.00 O ATOM 0 H GLY A 8 118.640 -3.433 -2.625 1.00 0.00 H new ATOM 0 HA2 GLY A 8 119.338 -3.841 -5.443 1.00 0.00 H new ATOM 0 HA3 GLY A 8 117.628 -3.892 -5.062 1.00 0.00 H new ATOM 96 N TYR A 9 118.471 -1.413 -5.929 1.00 0.00 N ATOM 97 CA TYR A 9 118.402 0.034 -6.103 1.00 0.00 C ATOM 98 C TYR A 9 117.177 0.397 -6.939 1.00 0.00 C ATOM 99 O TYR A 9 116.777 -0.363 -7.823 1.00 0.00 O ATOM 100 CB TYR A 9 119.680 0.539 -6.779 1.00 0.00 C ATOM 101 CG TYR A 9 119.844 0.083 -8.212 1.00 0.00 C ATOM 102 CD1 TYR A 9 120.511 -1.116 -8.493 1.00 0.00 C ATOM 103 CD2 TYR A 9 119.329 0.859 -9.257 1.00 0.00 C ATOM 104 CE1 TYR A 9 120.661 -1.538 -9.819 1.00 0.00 C ATOM 105 CE2 TYR A 9 119.478 0.435 -10.583 1.00 0.00 C ATOM 106 CZ TYR A 9 120.146 -0.764 -10.864 1.00 0.00 C ATOM 107 OH TYR A 9 120.294 -1.180 -12.171 1.00 0.00 O ATOM 0 H TYR A 9 118.459 -1.940 -6.802 1.00 0.00 H new ATOM 0 HA TYR A 9 118.313 0.510 -5.127 1.00 0.00 H new ATOM 0 HB2 TYR A 9 119.685 1.629 -6.753 1.00 0.00 H new ATOM 0 HB3 TYR A 9 120.541 0.202 -6.201 1.00 0.00 H new ATOM 0 HD1 TYR A 9 120.909 -1.715 -7.687 1.00 0.00 H new ATOM 0 HD2 TYR A 9 118.817 1.785 -9.040 1.00 0.00 H new ATOM 0 HE1 TYR A 9 121.175 -2.463 -10.036 1.00 0.00 H new ATOM 0 HE2 TYR A 9 119.078 1.032 -11.389 1.00 0.00 H new ATOM 0 HH TYR A 9 119.877 -0.527 -12.771 1.00 0.00 H new ATOM 117 N ALA A 10 116.551 1.526 -6.613 1.00 0.00 N ATOM 118 CA ALA A 10 115.375 1.973 -7.351 1.00 0.00 C ATOM 119 C ALA A 10 115.409 3.483 -7.581 1.00 0.00 C ATOM 120 O ALA A 10 115.905 4.236 -6.742 1.00 0.00 O ATOM 121 CB ALA A 10 114.108 1.598 -6.579 1.00 0.00 C ATOM 0 H ALA A 10 116.836 2.141 -5.851 1.00 0.00 H new ATOM 0 HA ALA A 10 115.374 1.479 -8.323 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.231 1.934 -7.133 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.065 0.516 -6.453 1.00 0.00 H new ATOM 0 HB3 ALA A 10 114.123 2.077 -5.600 1.00 0.00 H new ATOM 127 N GLN A 11 114.871 3.908 -8.721 1.00 0.00 N ATOM 128 CA GLN A 11 114.738 5.328 -9.034 1.00 0.00 C ATOM 129 C GLN A 11 113.259 5.696 -9.095 1.00 0.00 C ATOM 130 O GLN A 11 112.451 4.924 -9.611 1.00 0.00 O ATOM 131 CB GLN A 11 115.403 5.635 -10.378 1.00 0.00 C ATOM 132 CG GLN A 11 115.367 7.144 -10.635 1.00 0.00 C ATOM 133 CD GLN A 11 116.071 7.492 -11.947 1.00 0.00 C ATOM 134 OE1 GLN A 11 116.703 6.641 -12.574 1.00 0.00 O ATOM 135 NE2 GLN A 11 115.996 8.713 -12.405 1.00 0.00 N ATOM 0 H GLN A 11 114.518 3.285 -9.447 1.00 0.00 H new ATOM 0 HA GLN A 11 115.228 5.914 -8.257 1.00 0.00 H new ATOM 0 HB2 GLN A 11 116.434 5.281 -10.375 1.00 0.00 H new ATOM 0 HB3 GLN A 11 114.887 5.107 -11.180 1.00 0.00 H new ATOM 0 HG2 GLN A 11 114.333 7.486 -10.671 1.00 0.00 H new ATOM 0 HG3 GLN A 11 115.848 7.669 -9.810 1.00 0.00 H new ATOM 0 HE21 GLN A 11 115.473 9.420 -11.888 1.00 0.00 H new ATOM 0 HE22 GLN A 11 116.460 8.959 -13.279 1.00 0.00 H new ATOM 144 N SER A 12 112.897 6.867 -8.572 1.00 0.00 N ATOM 145 CA SER A 12 111.487 7.242 -8.474 1.00 0.00 C ATOM 146 C SER A 12 111.201 8.501 -9.281 1.00 0.00 C ATOM 147 O SER A 12 111.996 9.443 -9.282 1.00 0.00 O ATOM 148 CB SER A 12 111.120 7.488 -7.011 1.00 0.00 C ATOM 149 OG SER A 12 111.415 6.322 -6.252 1.00 0.00 O ATOM 0 H SER A 12 113.550 7.564 -8.214 1.00 0.00 H new ATOM 0 HA SER A 12 110.888 6.425 -8.876 1.00 0.00 H new ATOM 0 HB2 SER A 12 111.678 8.340 -6.622 1.00 0.00 H new ATOM 0 HB3 SER A 12 110.062 7.734 -6.926 1.00 0.00 H new ATOM 0 HG SER A 12 111.182 6.476 -5.313 1.00 0.00 H new ATOM 155 N ASP A 13 110.049 8.504 -9.944 1.00 0.00 N ATOM 156 CA ASP A 13 109.605 9.654 -10.722 1.00 0.00 C ATOM 157 C ASP A 13 108.370 10.256 -10.067 1.00 0.00 C ATOM 158 O ASP A 13 107.487 9.525 -9.616 1.00 0.00 O ATOM 159 CB ASP A 13 109.273 9.225 -12.153 1.00 0.00 C ATOM 160 CG ASP A 13 108.912 10.443 -12.994 1.00 0.00 C ATOM 161 OD1 ASP A 13 109.821 11.078 -13.503 1.00 0.00 O ATOM 162 OD2 ASP A 13 107.731 10.725 -13.118 1.00 0.00 O ATOM 0 H ASP A 13 109.402 7.716 -9.957 1.00 0.00 H new ATOM 0 HA ASP A 13 110.402 10.396 -10.754 1.00 0.00 H new ATOM 0 HB2 ASP A 13 110.126 8.709 -12.594 1.00 0.00 H new ATOM 0 HB3 ASP A 13 108.443 8.519 -12.146 1.00 0.00 H new ATOM 167 N ALA A 14 108.313 11.582 -10.015 1.00 0.00 N ATOM 168 CA ALA A 14 107.226 12.270 -9.336 1.00 0.00 C ATOM 169 C ALA A 14 106.296 12.917 -10.353 1.00 0.00 C ATOM 170 O ALA A 14 106.645 13.905 -10.998 1.00 0.00 O ATOM 171 CB ALA A 14 107.796 13.339 -8.402 1.00 0.00 C ATOM 0 H ALA A 14 109.007 12.200 -10.435 1.00 0.00 H new ATOM 0 HA ALA A 14 106.659 11.545 -8.752 1.00 0.00 H new ATOM 0 HB1 ALA A 14 106.979 13.852 -7.895 1.00 0.00 H new ATOM 0 HB2 ALA A 14 108.443 12.868 -7.662 1.00 0.00 H new ATOM 0 HB3 ALA A 14 108.373 14.059 -8.982 1.00 0.00 H new ATOM 177 N GLN A 15 105.116 12.336 -10.493 1.00 0.00 N ATOM 178 CA GLN A 15 104.093 12.900 -11.364 1.00 0.00 C ATOM 179 C GLN A 15 103.331 13.997 -10.628 1.00 0.00 C ATOM 180 O GLN A 15 102.723 13.754 -9.581 1.00 0.00 O ATOM 181 CB GLN A 15 103.121 11.809 -11.815 1.00 0.00 C ATOM 182 CG GLN A 15 103.858 10.795 -12.693 1.00 0.00 C ATOM 183 CD GLN A 15 102.928 9.647 -13.083 1.00 0.00 C ATOM 184 OE1 GLN A 15 101.892 9.434 -12.452 1.00 0.00 O ATOM 185 NE2 GLN A 15 103.242 8.886 -14.096 1.00 0.00 N ATOM 0 H GLN A 15 104.841 11.477 -10.017 1.00 0.00 H new ATOM 0 HA GLN A 15 104.578 13.326 -12.242 1.00 0.00 H new ATOM 0 HB2 GLN A 15 102.692 11.309 -10.947 1.00 0.00 H new ATOM 0 HB3 GLN A 15 102.294 12.252 -12.370 1.00 0.00 H new ATOM 0 HG2 GLN A 15 104.233 11.287 -13.590 1.00 0.00 H new ATOM 0 HG3 GLN A 15 104.724 10.404 -12.158 1.00 0.00 H new ATOM 0 HE21 GLN A 15 104.100 9.062 -14.619 1.00 0.00 H new ATOM 0 HE22 GLN A 15 102.630 8.116 -14.364 1.00 0.00 H new ATOM 194 N GLY A 16 103.364 15.189 -11.213 1.00 0.00 N ATOM 195 CA GLY A 16 102.782 16.386 -10.607 1.00 0.00 C ATOM 196 C GLY A 16 103.778 17.144 -9.714 1.00 0.00 C ATOM 197 O GLY A 16 103.532 18.295 -9.354 1.00 0.00 O ATOM 0 H GLY A 16 103.795 15.355 -12.122 1.00 0.00 H new ATOM 0 HA2 GLY A 16 102.428 17.051 -11.394 1.00 0.00 H new ATOM 0 HA3 GLY A 16 101.912 16.102 -10.014 1.00 0.00 H new ATOM 201 N GLN A 17 104.896 16.508 -9.356 1.00 0.00 N ATOM 202 CA GLN A 17 105.999 17.194 -8.689 1.00 0.00 C ATOM 203 C GLN A 17 107.236 17.154 -9.582 1.00 0.00 C ATOM 204 O GLN A 17 107.493 16.141 -10.233 1.00 0.00 O ATOM 205 CB GLN A 17 106.301 16.528 -7.344 1.00 0.00 C ATOM 206 CG GLN A 17 107.360 17.337 -6.594 1.00 0.00 C ATOM 207 CD GLN A 17 106.743 18.617 -6.037 1.00 0.00 C ATOM 208 OE1 GLN A 17 105.855 18.559 -5.185 1.00 0.00 O ATOM 209 NE2 GLN A 17 107.159 19.774 -6.472 1.00 0.00 N ATOM 0 H GLN A 17 105.059 15.514 -9.519 1.00 0.00 H new ATOM 0 HA GLN A 17 105.718 18.231 -8.507 1.00 0.00 H new ATOM 0 HB2 GLN A 17 105.391 16.461 -6.748 1.00 0.00 H new ATOM 0 HB3 GLN A 17 106.653 15.509 -7.503 1.00 0.00 H new ATOM 0 HG2 GLN A 17 107.777 16.741 -5.782 1.00 0.00 H new ATOM 0 HG3 GLN A 17 108.184 17.583 -7.264 1.00 0.00 H new ATOM 0 HE21 GLN A 17 107.894 19.819 -7.177 1.00 0.00 H new ATOM 0 HE22 GLN A 17 106.749 20.634 -6.107 1.00 0.00 H new ATOM 218 N MET A 18 108.000 18.243 -9.615 1.00 0.00 N ATOM 219 CA MET A 18 109.228 18.264 -10.405 1.00 0.00 C ATOM 220 C MET A 18 110.415 17.828 -9.552 1.00 0.00 C ATOM 221 O MET A 18 110.999 18.640 -8.835 1.00 0.00 O ATOM 222 CB MET A 18 109.478 19.675 -10.945 1.00 0.00 C ATOM 223 CG MET A 18 108.353 20.060 -11.908 1.00 0.00 C ATOM 224 SD MET A 18 108.753 21.629 -12.722 1.00 0.00 S ATOM 225 CE MET A 18 108.855 22.651 -11.232 1.00 0.00 C ATOM 0 H MET A 18 107.796 19.108 -9.114 1.00 0.00 H new ATOM 0 HA MET A 18 109.116 17.571 -11.239 1.00 0.00 H new ATOM 0 HB2 MET A 18 109.526 20.388 -10.122 1.00 0.00 H new ATOM 0 HB3 MET A 18 110.439 19.715 -11.457 1.00 0.00 H new ATOM 0 HG2 MET A 18 108.216 19.277 -12.654 1.00 0.00 H new ATOM 0 HG3 MET A 18 107.412 20.151 -11.365 1.00 0.00 H new ATOM 0 HE1 MET A 18 108.515 23.661 -11.460 1.00 0.00 H new ATOM 0 HE2 MET A 18 108.224 22.223 -10.453 1.00 0.00 H new ATOM 0 HE3 MET A 18 109.887 22.685 -10.884 1.00 0.00 H new ATOM 235 N ASN A 19 110.790 16.554 -9.665 1.00 0.00 N ATOM 236 CA ASN A 19 111.899 16.018 -8.881 1.00 0.00 C ATOM 237 C ASN A 19 112.172 14.556 -9.230 1.00 0.00 C ATOM 238 O ASN A 19 111.276 13.827 -9.654 1.00 0.00 O ATOM 239 CB ASN A 19 111.588 16.111 -7.385 1.00 0.00 C ATOM 240 CG ASN A 19 112.863 15.897 -6.577 1.00 0.00 C ATOM 241 OD1 ASN A 19 113.777 16.720 -6.627 1.00 0.00 O ATOM 242 ND2 ASN A 19 112.981 14.833 -5.831 1.00 0.00 N ATOM 0 H ASN A 19 110.345 15.879 -10.287 1.00 0.00 H new ATOM 0 HA ASN A 19 112.781 16.613 -9.119 1.00 0.00 H new ATOM 0 HB2 ASN A 19 111.159 17.086 -7.153 1.00 0.00 H new ATOM 0 HB3 ASN A 19 110.844 15.363 -7.112 1.00 0.00 H new ATOM 0 HD21 ASN A 19 113.831 14.682 -5.288 1.00 0.00 H new ATOM 0 HD22 ASN A 19 112.223 14.152 -5.791 1.00 0.00 H new ATOM 249 N LYS A 20 113.420 14.140 -9.038 1.00 0.00 N ATOM 250 CA LYS A 20 113.803 12.740 -9.194 1.00 0.00 C ATOM 251 C LYS A 20 114.470 12.263 -7.907 1.00 0.00 C ATOM 252 O LYS A 20 115.192 13.032 -7.270 1.00 0.00 O ATOM 253 CB LYS A 20 114.783 12.581 -10.362 1.00 0.00 C ATOM 254 CG LYS A 20 114.176 13.157 -11.645 1.00 0.00 C ATOM 255 CD LYS A 20 112.942 12.346 -12.045 1.00 0.00 C ATOM 256 CE LYS A 20 112.437 12.818 -13.409 1.00 0.00 C ATOM 257 NZ LYS A 20 111.537 13.992 -13.226 1.00 0.00 N ATOM 0 H LYS A 20 114.188 14.757 -8.772 1.00 0.00 H new ATOM 0 HA LYS A 20 112.912 12.146 -9.400 1.00 0.00 H new ATOM 0 HB2 LYS A 20 115.719 13.091 -10.133 1.00 0.00 H new ATOM 0 HB3 LYS A 20 115.021 11.527 -10.505 1.00 0.00 H new ATOM 0 HG2 LYS A 20 113.902 14.201 -11.492 1.00 0.00 H new ATOM 0 HG3 LYS A 20 114.913 13.135 -12.448 1.00 0.00 H new ATOM 0 HD2 LYS A 20 113.189 11.285 -12.085 1.00 0.00 H new ATOM 0 HD3 LYS A 20 112.159 12.463 -11.296 1.00 0.00 H new ATOM 0 HE2 LYS A 20 113.279 13.087 -14.047 1.00 0.00 H new ATOM 0 HE3 LYS A 20 111.902 12.011 -13.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 111.193 14.314 -14.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 110.728 13.720 -12.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 112.061 14.763 -12.765 1.00 0.00 H new ATOM 271 N MET A 21 114.239 11.008 -7.518 1.00 0.00 N ATOM 272 CA MET A 21 114.770 10.513 -6.247 1.00 0.00 C ATOM 273 C MET A 21 115.447 9.159 -6.422 1.00 0.00 C ATOM 274 O MET A 21 115.164 8.437 -7.375 1.00 0.00 O ATOM 275 CB MET A 21 113.634 10.391 -5.230 1.00 0.00 C ATOM 276 CG MET A 21 113.041 11.776 -4.963 1.00 0.00 C ATOM 277 SD MET A 21 111.853 11.681 -3.599 1.00 0.00 S ATOM 278 CE MET A 21 110.709 10.504 -4.362 1.00 0.00 C ATOM 0 H MET A 21 113.699 10.328 -8.052 1.00 0.00 H new ATOM 0 HA MET A 21 115.515 11.223 -5.888 1.00 0.00 H new ATOM 0 HB2 MET A 21 112.863 9.720 -5.608 1.00 0.00 H new ATOM 0 HB3 MET A 21 114.007 9.958 -4.302 1.00 0.00 H new ATOM 0 HG2 MET A 21 113.835 12.481 -4.717 1.00 0.00 H new ATOM 0 HG3 MET A 21 112.549 12.150 -5.861 1.00 0.00 H new ATOM 0 HE1 MET A 21 109.697 10.698 -4.007 1.00 0.00 H new ATOM 0 HE2 MET A 21 110.741 10.616 -5.446 1.00 0.00 H new ATOM 0 HE3 MET A 21 110.999 9.488 -4.093 1.00 0.00 H new ATOM 288 N GLY A 22 116.327 8.814 -5.486 1.00 0.00 N ATOM 289 CA GLY A 22 117.031 7.538 -5.551 1.00 0.00 C ATOM 290 C GLY A 22 117.164 6.935 -4.159 1.00 0.00 C ATOM 291 O GLY A 22 117.467 7.646 -3.203 1.00 0.00 O ATOM 0 H GLY A 22 116.568 9.394 -4.682 1.00 0.00 H new ATOM 0 HA2 GLY A 22 116.492 6.850 -6.202 1.00 0.00 H new ATOM 0 HA3 GLY A 22 118.019 7.682 -5.988 1.00 0.00 H new ATOM 295 N GLY A 23 116.917 5.633 -4.044 1.00 0.00 N ATOM 296 CA GLY A 23 116.978 4.976 -2.743 1.00 0.00 C ATOM 297 C GLY A 23 117.423 3.525 -2.868 1.00 0.00 C ATOM 298 O GLY A 23 117.456 2.965 -3.964 1.00 0.00 O ATOM 0 H GLY A 23 116.676 5.020 -4.823 1.00 0.00 H new ATOM 0 HA2 GLY A 23 117.669 5.515 -2.095 1.00 0.00 H new ATOM 0 HA3 GLY A 23 115.998 5.017 -2.268 1.00 0.00 H new ATOM 302 N PHE A 24 117.746 2.919 -1.729 1.00 0.00 N ATOM 303 CA PHE A 24 118.183 1.525 -1.697 1.00 0.00 C ATOM 304 C PHE A 24 117.284 0.720 -0.764 1.00 0.00 C ATOM 305 O PHE A 24 116.699 1.274 0.168 1.00 0.00 O ATOM 306 CB PHE A 24 119.634 1.439 -1.221 1.00 0.00 C ATOM 307 CG PHE A 24 120.607 2.149 -2.133 1.00 0.00 C ATOM 308 CD1 PHE A 24 121.205 1.458 -3.192 1.00 0.00 C ATOM 309 CD2 PHE A 24 120.910 3.499 -1.918 1.00 0.00 C ATOM 310 CE1 PHE A 24 122.107 2.115 -4.038 1.00 0.00 C ATOM 311 CE2 PHE A 24 121.811 4.157 -2.764 1.00 0.00 C ATOM 312 CZ PHE A 24 122.409 3.465 -3.823 1.00 0.00 C ATOM 0 H PHE A 24 117.714 3.371 -0.815 1.00 0.00 H new ATOM 0 HA PHE A 24 118.116 1.112 -2.703 1.00 0.00 H new ATOM 0 HB2 PHE A 24 119.707 1.866 -0.221 1.00 0.00 H new ATOM 0 HB3 PHE A 24 119.921 0.391 -1.141 1.00 0.00 H new ATOM 0 HD1 PHE A 24 120.971 0.417 -3.357 1.00 0.00 H new ATOM 0 HD2 PHE A 24 120.449 4.033 -1.100 1.00 0.00 H new ATOM 0 HE1 PHE A 24 122.569 1.581 -4.855 1.00 0.00 H new ATOM 0 HE2 PHE A 24 122.044 5.199 -2.599 1.00 0.00 H new ATOM 0 HZ PHE A 24 123.104 3.973 -4.475 1.00 0.00 H new ATOM 322 N ASN A 25 117.180 -0.581 -1.022 1.00 0.00 N ATOM 323 CA ASN A 25 116.282 -1.442 -0.257 1.00 0.00 C ATOM 324 C ASN A 25 116.994 -2.707 0.207 1.00 0.00 C ATOM 325 O ASN A 25 117.747 -3.311 -0.556 1.00 0.00 O ATOM 326 CB ASN A 25 115.088 -1.831 -1.131 1.00 0.00 C ATOM 327 CG ASN A 25 114.039 -2.566 -0.304 1.00 0.00 C ATOM 328 OD1 ASN A 25 113.984 -2.410 0.917 1.00 0.00 O ATOM 329 ND2 ASN A 25 113.198 -3.364 -0.902 1.00 0.00 N ATOM 0 H ASN A 25 117.705 -1.061 -1.753 1.00 0.00 H new ATOM 0 HA ASN A 25 115.947 -0.892 0.622 1.00 0.00 H new ATOM 0 HB2 ASN A 25 114.649 -0.938 -1.576 1.00 0.00 H new ATOM 0 HB3 ASN A 25 115.422 -2.465 -1.952 1.00 0.00 H new ATOM 0 HD21 ASN A 25 112.492 -3.861 -0.359 1.00 0.00 H new ATOM 0 HD22 ASN A 25 113.246 -3.491 -1.913 1.00 0.00 H new ATOM 336 N LEU A 26 116.730 -3.108 1.450 1.00 0.00 N ATOM 337 CA LEU A 26 117.267 -4.355 1.988 1.00 0.00 C ATOM 338 C LEU A 26 116.101 -5.222 2.448 1.00 0.00 C ATOM 339 O LEU A 26 115.185 -4.726 3.099 1.00 0.00 O ATOM 340 CB LEU A 26 118.188 -4.078 3.187 1.00 0.00 C ATOM 341 CG LEU A 26 119.615 -3.703 2.754 1.00 0.00 C ATOM 342 CD1 LEU A 26 120.285 -4.890 2.056 1.00 0.00 C ATOM 343 CD2 LEU A 26 119.599 -2.485 1.822 1.00 0.00 C ATOM 0 H LEU A 26 116.146 -2.586 2.103 1.00 0.00 H new ATOM 0 HA LEU A 26 117.846 -4.860 1.214 1.00 0.00 H new ATOM 0 HB2 LEU A 26 117.768 -3.269 3.785 1.00 0.00 H new ATOM 0 HB3 LEU A 26 118.225 -4.961 3.825 1.00 0.00 H new ATOM 0 HG LEU A 26 120.187 -3.446 3.646 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.295 -4.612 1.754 1.00 0.00 H new ATOM 0 HD12 LEU A 26 120.331 -5.736 2.741 1.00 0.00 H new ATOM 0 HD13 LEU A 26 119.707 -5.168 1.175 1.00 0.00 H new ATOM 0 HD21 LEU A 26 120.619 -2.238 1.529 1.00 0.00 H new ATOM 0 HD22 LEU A 26 119.011 -2.715 0.933 1.00 0.00 H new ATOM 0 HD23 LEU A 26 119.155 -1.636 2.341 1.00 0.00 H new ATOM 355 N LYS A 27 116.137 -6.514 2.128 1.00 0.00 N ATOM 356 CA LYS A 27 114.995 -7.387 2.402 1.00 0.00 C ATOM 357 C LYS A 27 115.437 -8.703 3.035 1.00 0.00 C ATOM 358 O LYS A 27 116.444 -9.290 2.641 1.00 0.00 O ATOM 359 CB LYS A 27 114.253 -7.668 1.094 1.00 0.00 C ATOM 360 CG LYS A 27 112.974 -8.459 1.374 1.00 0.00 C ATOM 361 CD LYS A 27 112.201 -8.646 0.066 1.00 0.00 C ATOM 362 CE LYS A 27 112.983 -9.576 -0.863 1.00 0.00 C ATOM 363 NZ LYS A 27 112.046 -10.218 -1.827 1.00 0.00 N ATOM 0 H LYS A 27 116.932 -6.975 1.685 1.00 0.00 H new ATOM 0 HA LYS A 27 114.337 -6.881 3.108 1.00 0.00 H new ATOM 0 HB2 LYS A 27 114.008 -6.729 0.597 1.00 0.00 H new ATOM 0 HB3 LYS A 27 114.896 -8.229 0.416 1.00 0.00 H new ATOM 0 HG2 LYS A 27 113.219 -9.429 1.807 1.00 0.00 H new ATOM 0 HG3 LYS A 27 112.358 -7.931 2.102 1.00 0.00 H new ATOM 0 HD2 LYS A 27 111.216 -9.064 0.271 1.00 0.00 H new ATOM 0 HD3 LYS A 27 112.044 -7.681 -0.417 1.00 0.00 H new ATOM 0 HE2 LYS A 27 113.746 -9.013 -1.401 1.00 0.00 H new ATOM 0 HE3 LYS A 27 113.501 -10.338 -0.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 112.577 -10.850 -2.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 111.334 -10.768 -1.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 111.571 -9.484 -2.391 1.00 0.00 H new ATOM 377 N TYR A 28 114.667 -9.156 4.022 1.00 0.00 N ATOM 378 CA TYR A 28 114.940 -10.429 4.687 1.00 0.00 C ATOM 379 C TYR A 28 113.732 -11.352 4.561 1.00 0.00 C ATOM 380 O TYR A 28 112.593 -10.910 4.722 1.00 0.00 O ATOM 381 CB TYR A 28 115.249 -10.189 6.166 1.00 0.00 C ATOM 382 CG TYR A 28 115.633 -11.445 6.912 1.00 0.00 C ATOM 383 CD1 TYR A 28 116.960 -11.891 6.897 1.00 0.00 C ATOM 384 CD2 TYR A 28 114.662 -12.162 7.622 1.00 0.00 C ATOM 385 CE1 TYR A 28 117.317 -13.054 7.591 1.00 0.00 C ATOM 386 CE2 TYR A 28 115.019 -13.325 8.315 1.00 0.00 C ATOM 387 CZ TYR A 28 116.346 -13.771 8.299 1.00 0.00 C ATOM 388 OH TYR A 28 116.697 -14.916 8.983 1.00 0.00 O ATOM 0 H TYR A 28 113.850 -8.661 4.379 1.00 0.00 H new ATOM 0 HA TYR A 28 115.801 -10.898 4.211 1.00 0.00 H new ATOM 0 HB2 TYR A 28 116.060 -9.465 6.247 1.00 0.00 H new ATOM 0 HB3 TYR A 28 114.376 -9.744 6.644 1.00 0.00 H new ATOM 0 HD1 TYR A 28 117.709 -11.338 6.350 1.00 0.00 H new ATOM 0 HD2 TYR A 28 113.638 -11.818 7.635 1.00 0.00 H new ATOM 0 HE1 TYR A 28 118.341 -13.397 7.580 1.00 0.00 H new ATOM 0 HE2 TYR A 28 114.270 -13.878 8.862 1.00 0.00 H new ATOM 0 HH TYR A 28 115.905 -15.291 9.421 1.00 0.00 H new ATOM 398 N ARG A 29 113.989 -12.622 4.253 1.00 0.00 N ATOM 399 CA ARG A 29 112.916 -13.594 4.055 1.00 0.00 C ATOM 400 C ARG A 29 113.259 -14.931 4.708 1.00 0.00 C ATOM 401 O ARG A 29 114.404 -15.380 4.652 1.00 0.00 O ATOM 402 CB ARG A 29 112.680 -13.798 2.556 1.00 0.00 C ATOM 403 CG ARG A 29 111.468 -14.707 2.340 1.00 0.00 C ATOM 404 CD ARG A 29 111.282 -14.959 0.842 1.00 0.00 C ATOM 405 NE ARG A 29 110.063 -15.737 0.604 1.00 0.00 N ATOM 406 CZ ARG A 29 109.818 -16.396 -0.539 1.00 0.00 C ATOM 407 NH1 ARG A 29 110.660 -16.389 -1.546 1.00 0.00 N ATOM 408 NH2 ARG A 29 108.704 -17.067 -0.655 1.00 0.00 N ATOM 0 H ARG A 29 114.929 -13.001 4.135 1.00 0.00 H new ATOM 0 HA ARG A 29 112.011 -13.207 4.523 1.00 0.00 H new ATOM 0 HB2 ARG A 29 112.516 -12.836 2.070 1.00 0.00 H new ATOM 0 HB3 ARG A 29 113.564 -14.240 2.096 1.00 0.00 H new ATOM 0 HG2 ARG A 29 111.610 -15.652 2.864 1.00 0.00 H new ATOM 0 HG3 ARG A 29 110.573 -14.244 2.756 1.00 0.00 H new ATOM 0 HD2 ARG A 29 111.224 -14.009 0.311 1.00 0.00 H new ATOM 0 HD3 ARG A 29 112.146 -15.494 0.446 1.00 0.00 H new ATOM 0 HE ARG A 29 109.364 -15.780 1.346 1.00 0.00 H new ATOM 0 HH11 ARG A 29 111.535 -15.870 -1.475 1.00 0.00 H new ATOM 0 HH12 ARG A 29 110.439 -16.902 -2.399 1.00 0.00 H new ATOM 0 HH21 ARG A 29 108.036 -17.084 0.116 1.00 0.00 H new ATOM 0 HH22 ARG A 29 108.501 -17.574 -1.517 1.00 0.00 H new ATOM 422 N TYR A 30 112.265 -15.568 5.328 1.00 0.00 N ATOM 423 CA TYR A 30 112.471 -16.872 5.960 1.00 0.00 C ATOM 424 C TYR A 30 111.384 -17.859 5.536 1.00 0.00 C ATOM 425 O TYR A 30 110.219 -17.490 5.391 1.00 0.00 O ATOM 426 CB TYR A 30 112.494 -16.726 7.485 1.00 0.00 C ATOM 427 CG TYR A 30 111.161 -16.362 8.098 1.00 0.00 C ATOM 428 CD1 TYR A 30 110.274 -17.371 8.495 1.00 0.00 C ATOM 429 CD2 TYR A 30 110.818 -15.018 8.281 1.00 0.00 C ATOM 430 CE1 TYR A 30 109.045 -17.034 9.074 1.00 0.00 C ATOM 431 CE2 TYR A 30 109.588 -14.681 8.859 1.00 0.00 C ATOM 432 CZ TYR A 30 108.701 -15.690 9.255 1.00 0.00 C ATOM 433 OH TYR A 30 107.490 -15.357 9.826 1.00 0.00 O ATOM 0 H TYR A 30 111.315 -15.205 5.406 1.00 0.00 H new ATOM 0 HA TYR A 30 113.434 -17.263 5.631 1.00 0.00 H new ATOM 0 HB2 TYR A 30 112.837 -17.664 7.922 1.00 0.00 H new ATOM 0 HB3 TYR A 30 113.224 -15.963 7.754 1.00 0.00 H new ATOM 0 HD1 TYR A 30 110.538 -18.409 8.354 1.00 0.00 H new ATOM 0 HD2 TYR A 30 111.502 -14.240 7.976 1.00 0.00 H new ATOM 0 HE1 TYR A 30 108.362 -17.812 9.381 1.00 0.00 H new ATOM 0 HE2 TYR A 30 109.323 -13.643 8.999 1.00 0.00 H new ATOM 0 HH TYR A 30 107.411 -14.382 9.879 1.00 0.00 H new ATOM 443 N GLU A 31 111.778 -19.115 5.338 1.00 0.00 N ATOM 444 CA GLU A 31 110.857 -20.140 4.850 1.00 0.00 C ATOM 445 C GLU A 31 110.934 -21.404 5.706 1.00 0.00 C ATOM 446 O GLU A 31 111.993 -21.741 6.234 1.00 0.00 O ATOM 447 CB GLU A 31 111.206 -20.476 3.397 1.00 0.00 C ATOM 448 CG GLU A 31 110.148 -21.416 2.806 1.00 0.00 C ATOM 449 CD GLU A 31 110.498 -21.842 1.375 1.00 0.00 C ATOM 450 OE1 GLU A 31 111.540 -21.450 0.869 1.00 0.00 O ATOM 451 OE2 GLU A 31 109.705 -22.567 0.797 1.00 0.00 O ATOM 0 H GLU A 31 112.727 -19.448 5.508 1.00 0.00 H new ATOM 0 HA GLU A 31 109.840 -19.753 4.911 1.00 0.00 H new ATOM 0 HB2 GLU A 31 111.261 -19.561 2.807 1.00 0.00 H new ATOM 0 HB3 GLU A 31 112.188 -20.946 3.350 1.00 0.00 H new ATOM 0 HG2 GLU A 31 110.056 -22.301 3.436 1.00 0.00 H new ATOM 0 HG3 GLU A 31 109.178 -20.919 2.810 1.00 0.00 H new ATOM 458 N GLU A 32 109.806 -22.099 5.838 1.00 0.00 N ATOM 459 CA GLU A 32 109.764 -23.342 6.605 1.00 0.00 C ATOM 460 C GLU A 32 109.986 -24.544 5.690 1.00 0.00 C ATOM 461 O GLU A 32 109.499 -24.575 4.560 1.00 0.00 O ATOM 462 CB GLU A 32 108.417 -23.475 7.318 1.00 0.00 C ATOM 463 CG GLU A 32 108.464 -24.671 8.277 1.00 0.00 C ATOM 464 CD GLU A 32 107.113 -24.910 8.962 1.00 0.00 C ATOM 465 OE1 GLU A 32 106.163 -24.192 8.683 1.00 0.00 O ATOM 466 OE2 GLU A 32 107.050 -25.821 9.770 1.00 0.00 O ATOM 0 H GLU A 32 108.914 -21.825 5.426 1.00 0.00 H new ATOM 0 HA GLU A 32 110.561 -23.315 7.348 1.00 0.00 H new ATOM 0 HB2 GLU A 32 108.193 -22.562 7.869 1.00 0.00 H new ATOM 0 HB3 GLU A 32 107.619 -23.611 6.588 1.00 0.00 H new ATOM 0 HG2 GLU A 32 108.755 -25.566 7.727 1.00 0.00 H new ATOM 0 HG3 GLU A 32 109.229 -24.499 9.034 1.00 0.00 H new ATOM 473 N ASP A 33 110.726 -25.531 6.186 1.00 0.00 N ATOM 474 CA ASP A 33 111.141 -26.662 5.360 1.00 0.00 C ATOM 475 C ASP A 33 109.972 -27.548 4.929 1.00 0.00 C ATOM 476 O ASP A 33 109.887 -27.931 3.762 1.00 0.00 O ATOM 477 CB ASP A 33 112.156 -27.512 6.128 1.00 0.00 C ATOM 478 CG ASP A 33 113.428 -26.711 6.404 1.00 0.00 C ATOM 479 OD1 ASP A 33 113.754 -25.847 5.606 1.00 0.00 O ATOM 480 OD2 ASP A 33 114.058 -26.975 7.414 1.00 0.00 O ATOM 0 H ASP A 33 111.050 -25.572 7.152 1.00 0.00 H new ATOM 0 HA ASP A 33 111.585 -26.247 4.455 1.00 0.00 H new ATOM 0 HB2 ASP A 33 111.720 -27.848 7.069 1.00 0.00 H new ATOM 0 HB3 ASP A 33 112.400 -28.405 5.553 1.00 0.00 H new ATOM 485 N ASN A 34 109.070 -27.877 5.856 1.00 0.00 N ATOM 486 CA ASN A 34 107.993 -28.827 5.550 1.00 0.00 C ATOM 487 C ASN A 34 106.632 -28.159 5.329 1.00 0.00 C ATOM 488 O ASN A 34 105.706 -28.800 4.831 1.00 0.00 O ATOM 489 CB ASN A 34 107.870 -29.834 6.696 1.00 0.00 C ATOM 490 CG ASN A 34 109.158 -30.642 6.831 1.00 0.00 C ATOM 491 OD1 ASN A 34 109.920 -30.768 5.872 1.00 0.00 O ATOM 492 ND2 ASN A 34 109.448 -31.200 7.974 1.00 0.00 N ATOM 0 H ASN A 34 109.060 -27.509 6.807 1.00 0.00 H new ATOM 0 HA ASN A 34 108.264 -29.316 4.614 1.00 0.00 H new ATOM 0 HB2 ASN A 34 107.662 -29.310 7.629 1.00 0.00 H new ATOM 0 HB3 ASN A 34 107.030 -30.504 6.512 1.00 0.00 H new ATOM 0 HD21 ASN A 34 110.307 -31.741 8.074 1.00 0.00 H new ATOM 0 HD22 ASN A 34 108.816 -31.095 8.768 1.00 0.00 H new ATOM 499 N SER A 35 106.499 -26.887 5.692 1.00 0.00 N ATOM 500 CA SER A 35 105.270 -26.146 5.434 1.00 0.00 C ATOM 501 C SER A 35 105.615 -24.679 5.170 1.00 0.00 C ATOM 502 O SER A 35 105.406 -23.827 6.039 1.00 0.00 O ATOM 503 CB SER A 35 104.310 -26.275 6.622 1.00 0.00 C ATOM 504 OG SER A 35 105.057 -26.297 7.831 1.00 0.00 O ATOM 0 H SER A 35 107.226 -26.349 6.165 1.00 0.00 H new ATOM 0 HA SER A 35 104.772 -26.559 4.556 1.00 0.00 H new ATOM 0 HB2 SER A 35 103.609 -25.440 6.630 1.00 0.00 H new ATOM 0 HB3 SER A 35 103.720 -27.187 6.530 1.00 0.00 H new ATOM 0 HG SER A 35 105.075 -25.398 8.221 1.00 0.00 H new ATOM 510 N PRO A 36 106.134 -24.357 4.004 1.00 0.00 N ATOM 511 CA PRO A 36 106.728 -23.008 3.777 1.00 0.00 C ATOM 512 C PRO A 36 105.686 -21.902 3.639 1.00 0.00 C ATOM 513 O PRO A 36 104.687 -22.043 2.934 1.00 0.00 O ATOM 514 CB PRO A 36 107.510 -23.174 2.474 1.00 0.00 C ATOM 515 CG PRO A 36 106.795 -24.246 1.726 1.00 0.00 C ATOM 516 CD PRO A 36 106.197 -25.180 2.776 1.00 0.00 C ATOM 0 HA PRO A 36 107.339 -22.699 4.625 1.00 0.00 H new ATOM 0 HB2 PRO A 36 107.531 -22.244 1.906 1.00 0.00 H new ATOM 0 HB3 PRO A 36 108.546 -23.453 2.669 1.00 0.00 H new ATOM 0 HG2 PRO A 36 106.015 -23.823 1.093 1.00 0.00 H new ATOM 0 HG3 PRO A 36 107.480 -24.785 1.071 1.00 0.00 H new ATOM 0 HD2 PRO A 36 105.208 -25.530 2.480 1.00 0.00 H new ATOM 0 HD3 PRO A 36 106.817 -26.064 2.921 1.00 0.00 H new ATOM 524 N LEU A 37 105.949 -20.801 4.333 1.00 0.00 N ATOM 525 CA LEU A 37 105.206 -19.562 4.150 1.00 0.00 C ATOM 526 C LEU A 37 106.207 -18.449 3.871 1.00 0.00 C ATOM 527 O LEU A 37 107.225 -18.367 4.563 1.00 0.00 O ATOM 528 CB LEU A 37 104.396 -19.235 5.407 1.00 0.00 C ATOM 529 CG LEU A 37 103.526 -18.004 5.148 1.00 0.00 C ATOM 530 CD1 LEU A 37 102.381 -18.376 4.205 1.00 0.00 C ATOM 531 CD2 LEU A 37 102.949 -17.500 6.473 1.00 0.00 C ATOM 0 H LEU A 37 106.684 -20.743 5.038 1.00 0.00 H new ATOM 0 HA LEU A 37 104.510 -19.664 3.317 1.00 0.00 H new ATOM 0 HB2 LEU A 37 103.770 -20.085 5.680 1.00 0.00 H new ATOM 0 HB3 LEU A 37 105.066 -19.050 6.246 1.00 0.00 H new ATOM 0 HG LEU A 37 104.132 -17.221 4.692 1.00 0.00 H new ATOM 0 HD11 LEU A 37 101.761 -17.498 4.021 1.00 0.00 H new ATOM 0 HD12 LEU A 37 102.790 -18.736 3.261 1.00 0.00 H new ATOM 0 HD13 LEU A 37 101.775 -19.159 4.660 1.00 0.00 H new ATOM 0 HD21 LEU A 37 102.329 -16.623 6.289 1.00 0.00 H new ATOM 0 HD22 LEU A 37 102.343 -18.284 6.928 1.00 0.00 H new ATOM 0 HD23 LEU A 37 103.763 -17.234 7.147 1.00 0.00 H new ATOM 543 N GLY A 38 105.936 -17.599 2.882 1.00 0.00 N ATOM 544 CA GLY A 38 106.903 -16.573 2.519 1.00 0.00 C ATOM 545 C GLY A 38 106.601 -15.289 3.272 1.00 0.00 C ATOM 546 O GLY A 38 105.536 -14.707 3.104 1.00 0.00 O ATOM 0 H GLY A 38 105.077 -17.600 2.332 1.00 0.00 H new ATOM 0 HA2 GLY A 38 107.912 -16.913 2.752 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.868 -16.392 1.445 1.00 0.00 H new ATOM 550 N VAL A 39 107.528 -14.859 4.121 1.00 0.00 N ATOM 551 CA VAL A 39 107.372 -13.583 4.814 1.00 0.00 C ATOM 552 C VAL A 39 108.573 -12.712 4.498 1.00 0.00 C ATOM 553 O VAL A 39 109.715 -13.155 4.613 1.00 0.00 O ATOM 554 CB VAL A 39 107.274 -13.808 6.326 1.00 0.00 C ATOM 555 CG1 VAL A 39 107.031 -12.472 7.033 1.00 0.00 C ATOM 556 CG2 VAL A 39 106.110 -14.755 6.633 1.00 0.00 C ATOM 0 H VAL A 39 108.384 -15.366 4.345 1.00 0.00 H new ATOM 0 HA VAL A 39 106.457 -13.094 4.480 1.00 0.00 H new ATOM 0 HB VAL A 39 108.207 -14.246 6.681 1.00 0.00 H new ATOM 0 HG11 VAL A 39 106.962 -12.637 8.108 1.00 0.00 H new ATOM 0 HG12 VAL A 39 107.857 -11.793 6.822 1.00 0.00 H new ATOM 0 HG13 VAL A 39 106.100 -12.034 6.673 1.00 0.00 H new ATOM 0 HG21 VAL A 39 106.043 -14.913 7.709 1.00 0.00 H new ATOM 0 HG22 VAL A 39 105.179 -14.317 6.272 1.00 0.00 H new ATOM 0 HG23 VAL A 39 106.278 -15.711 6.136 1.00 0.00 H new ATOM 566 N ILE A 40 108.315 -11.472 4.101 1.00 0.00 N ATOM 567 CA ILE A 40 109.397 -10.548 3.784 1.00 0.00 C ATOM 568 C ILE A 40 109.199 -9.221 4.495 1.00 0.00 C ATOM 569 O ILE A 40 108.067 -8.772 4.682 1.00 0.00 O ATOM 570 CB ILE A 40 109.458 -10.326 2.270 1.00 0.00 C ATOM 571 CG1 ILE A 40 108.121 -9.770 1.771 1.00 0.00 C ATOM 572 CG2 ILE A 40 109.746 -11.661 1.580 1.00 0.00 C ATOM 573 CD1 ILE A 40 108.268 -9.278 0.330 1.00 0.00 C ATOM 0 H ILE A 40 107.377 -11.086 3.992 1.00 0.00 H new ATOM 0 HA ILE A 40 110.336 -10.982 4.126 1.00 0.00 H new ATOM 0 HB ILE A 40 110.249 -9.612 2.039 1.00 0.00 H new ATOM 0 HG12 ILE A 40 107.353 -10.542 1.825 1.00 0.00 H new ATOM 0 HG13 ILE A 40 107.795 -8.951 2.413 1.00 0.00 H new ATOM 0 HG21 ILE A 40 109.791 -11.511 0.501 1.00 0.00 H new ATOM 0 HG22 ILE A 40 110.700 -12.054 1.932 1.00 0.00 H new ATOM 0 HG23 ILE A 40 108.953 -12.371 1.815 1.00 0.00 H new ATOM 0 HD11 ILE A 40 107.314 -8.884 -0.019 1.00 0.00 H new ATOM 0 HD12 ILE A 40 109.022 -8.492 0.289 1.00 0.00 H new ATOM 0 HD13 ILE A 40 108.573 -10.107 -0.308 1.00 0.00 H new ATOM 585 N GLY A 41 110.314 -8.626 4.902 1.00 0.00 N ATOM 586 CA GLY A 41 110.310 -7.279 5.455 1.00 0.00 C ATOM 587 C GLY A 41 111.391 -6.456 4.767 1.00 0.00 C ATOM 588 O GLY A 41 112.531 -6.906 4.651 1.00 0.00 O ATOM 0 H GLY A 41 111.237 -9.059 4.859 1.00 0.00 H new ATOM 0 HA2 GLY A 41 109.334 -6.815 5.309 1.00 0.00 H new ATOM 0 HA3 GLY A 41 110.490 -7.313 6.530 1.00 0.00 H new ATOM 592 N SER A 42 111.028 -5.268 4.288 1.00 0.00 N ATOM 593 CA SER A 42 111.961 -4.440 3.524 1.00 0.00 C ATOM 594 C SER A 42 112.063 -3.037 4.107 1.00 0.00 C ATOM 595 O SER A 42 111.058 -2.429 4.475 1.00 0.00 O ATOM 596 CB SER A 42 111.501 -4.351 2.070 1.00 0.00 C ATOM 597 OG SER A 42 111.503 -5.652 1.498 1.00 0.00 O ATOM 0 H SER A 42 110.102 -4.859 4.413 1.00 0.00 H new ATOM 0 HA SER A 42 112.945 -4.907 3.577 1.00 0.00 H new ATOM 0 HB2 SER A 42 110.501 -3.920 2.018 1.00 0.00 H new ATOM 0 HB3 SER A 42 112.162 -3.692 1.507 1.00 0.00 H new ATOM 0 HG SER A 42 111.207 -5.600 0.565 1.00 0.00 H new ATOM 603 N PHE A 43 113.290 -2.526 4.187 1.00 0.00 N ATOM 604 CA PHE A 43 113.523 -1.162 4.649 1.00 0.00 C ATOM 605 C PHE A 43 114.153 -0.350 3.526 1.00 0.00 C ATOM 606 O PHE A 43 115.170 -0.755 2.961 1.00 0.00 O ATOM 607 CB PHE A 43 114.453 -1.171 5.863 1.00 0.00 C ATOM 608 CG PHE A 43 114.658 0.196 6.472 1.00 0.00 C ATOM 609 CD1 PHE A 43 113.740 0.692 7.406 1.00 0.00 C ATOM 610 CD2 PHE A 43 115.765 0.969 6.102 1.00 0.00 C ATOM 611 CE1 PHE A 43 113.929 1.960 7.968 1.00 0.00 C ATOM 612 CE2 PHE A 43 115.955 2.236 6.665 1.00 0.00 C ATOM 613 CZ PHE A 43 115.037 2.732 7.599 1.00 0.00 C ATOM 0 H PHE A 43 114.137 -3.037 3.938 1.00 0.00 H new ATOM 0 HA PHE A 43 112.572 -0.713 4.936 1.00 0.00 H new ATOM 0 HB2 PHE A 43 114.044 -1.840 6.620 1.00 0.00 H new ATOM 0 HB3 PHE A 43 115.420 -1.578 5.567 1.00 0.00 H new ATOM 0 HD1 PHE A 43 112.886 0.096 7.693 1.00 0.00 H new ATOM 0 HD2 PHE A 43 116.473 0.587 5.381 1.00 0.00 H new ATOM 0 HE1 PHE A 43 113.220 2.343 8.687 1.00 0.00 H new ATOM 0 HE2 PHE A 43 116.810 2.831 6.379 1.00 0.00 H new ATOM 0 HZ PHE A 43 115.184 3.709 8.034 1.00 0.00 H new ATOM 623 N THR A 44 113.556 0.794 3.197 1.00 0.00 N ATOM 624 CA THR A 44 114.057 1.611 2.094 1.00 0.00 C ATOM 625 C THR A 44 114.392 3.014 2.577 1.00 0.00 C ATOM 626 O THR A 44 113.692 3.570 3.422 1.00 0.00 O ATOM 627 CB THR A 44 112.999 1.707 0.991 1.00 0.00 C ATOM 628 OG1 THR A 44 111.852 2.375 1.496 1.00 0.00 O ATOM 629 CG2 THR A 44 112.607 0.307 0.515 1.00 0.00 C ATOM 0 H THR A 44 112.736 1.172 3.671 1.00 0.00 H new ATOM 0 HA THR A 44 114.959 1.139 1.704 1.00 0.00 H new ATOM 0 HB THR A 44 113.409 2.265 0.150 1.00 0.00 H new ATOM 0 HG1 THR A 44 111.174 2.439 0.791 1.00 0.00 H new ATOM 0 HG21 THR A 44 111.854 0.387 -0.269 1.00 0.00 H new ATOM 0 HG22 THR A 44 113.487 -0.204 0.123 1.00 0.00 H new ATOM 0 HG23 THR A 44 112.200 -0.261 1.352 1.00 0.00 H new ATOM 637 N TYR A 45 115.458 3.581 2.020 1.00 0.00 N ATOM 638 CA TYR A 45 115.813 4.969 2.291 1.00 0.00 C ATOM 639 C TYR A 45 116.091 5.688 0.977 1.00 0.00 C ATOM 640 O TYR A 45 116.863 5.206 0.149 1.00 0.00 O ATOM 641 CB TYR A 45 117.029 5.049 3.219 1.00 0.00 C ATOM 642 CG TYR A 45 118.319 4.560 2.601 1.00 0.00 C ATOM 643 CD1 TYR A 45 119.125 5.443 1.873 1.00 0.00 C ATOM 644 CD2 TYR A 45 118.714 3.228 2.771 1.00 0.00 C ATOM 645 CE1 TYR A 45 120.327 4.991 1.314 1.00 0.00 C ATOM 646 CE2 TYR A 45 119.914 2.777 2.211 1.00 0.00 C ATOM 647 CZ TYR A 45 120.721 3.659 1.482 1.00 0.00 C ATOM 648 OH TYR A 45 121.905 3.214 0.931 1.00 0.00 O ATOM 0 H TYR A 45 116.090 3.101 1.379 1.00 0.00 H new ATOM 0 HA TYR A 45 114.978 5.456 2.795 1.00 0.00 H new ATOM 0 HB2 TYR A 45 117.161 6.083 3.536 1.00 0.00 H new ATOM 0 HB3 TYR A 45 116.825 4.464 4.116 1.00 0.00 H new ATOM 0 HD1 TYR A 45 118.821 6.471 1.743 1.00 0.00 H new ATOM 0 HD2 TYR A 45 118.092 2.548 3.335 1.00 0.00 H new ATOM 0 HE1 TYR A 45 120.950 5.671 0.753 1.00 0.00 H new ATOM 0 HE2 TYR A 45 120.218 1.749 2.341 1.00 0.00 H new ATOM 0 HH TYR A 45 121.791 3.092 -0.035 1.00 0.00 H new ATOM 658 N THR A 46 115.437 6.831 0.796 1.00 0.00 N ATOM 659 CA THR A 46 115.514 7.573 -0.456 1.00 0.00 C ATOM 660 C THR A 46 115.864 9.033 -0.187 1.00 0.00 C ATOM 661 O THR A 46 115.456 9.597 0.830 1.00 0.00 O ATOM 662 CB THR A 46 114.164 7.486 -1.173 1.00 0.00 C ATOM 663 OG1 THR A 46 113.745 6.130 -1.217 1.00 0.00 O ATOM 664 CG2 THR A 46 114.293 8.022 -2.598 1.00 0.00 C ATOM 0 H THR A 46 114.845 7.265 1.505 1.00 0.00 H new ATOM 0 HA THR A 46 116.294 7.140 -1.083 1.00 0.00 H new ATOM 0 HB THR A 46 113.431 8.084 -0.632 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.880 6.070 -1.674 1.00 0.00 H new ATOM 0 HG21 THR A 46 113.328 7.956 -3.100 1.00 0.00 H new ATOM 0 HG22 THR A 46 114.616 9.063 -2.567 1.00 0.00 H new ATOM 0 HG23 THR A 46 115.027 7.430 -3.144 1.00 0.00 H new ATOM 672 N GLU A 47 116.621 9.635 -1.101 1.00 0.00 N ATOM 673 CA GLU A 47 117.023 11.031 -0.962 1.00 0.00 C ATOM 674 C GLU A 47 116.702 11.798 -2.238 1.00 0.00 C ATOM 675 O GLU A 47 116.625 11.211 -3.319 1.00 0.00 O ATOM 676 CB GLU A 47 118.525 11.116 -0.677 1.00 0.00 C ATOM 677 CG GLU A 47 118.836 10.407 0.647 1.00 0.00 C ATOM 678 CD GLU A 47 120.314 10.536 1.027 1.00 0.00 C ATOM 679 OE1 GLU A 47 121.105 10.983 0.208 1.00 0.00 O ATOM 680 OE2 GLU A 47 120.638 10.180 2.148 1.00 0.00 O ATOM 0 H GLU A 47 116.968 9.178 -1.945 1.00 0.00 H new ATOM 0 HA GLU A 47 116.473 11.473 -0.131 1.00 0.00 H new ATOM 0 HB2 GLU A 47 119.087 10.655 -1.489 1.00 0.00 H new ATOM 0 HB3 GLU A 47 118.838 12.159 -0.625 1.00 0.00 H new ATOM 0 HG2 GLU A 47 118.219 10.830 1.440 1.00 0.00 H new ATOM 0 HG3 GLU A 47 118.572 9.353 0.566 1.00 0.00 H new ATOM 687 N LYS A 48 116.510 13.107 -2.102 1.00 0.00 N ATOM 688 CA LYS A 48 116.207 13.954 -3.249 1.00 0.00 C ATOM 689 C LYS A 48 117.484 14.590 -3.789 1.00 0.00 C ATOM 690 O LYS A 48 118.335 15.037 -3.022 1.00 0.00 O ATOM 691 CB LYS A 48 115.224 15.053 -2.842 1.00 0.00 C ATOM 692 CG LYS A 48 113.894 14.423 -2.423 1.00 0.00 C ATOM 693 CD LYS A 48 112.964 15.507 -1.874 1.00 0.00 C ATOM 694 CE LYS A 48 112.529 16.435 -3.011 1.00 0.00 C ATOM 695 NZ LYS A 48 111.536 17.418 -2.496 1.00 0.00 N ATOM 0 H LYS A 48 116.559 13.602 -1.212 1.00 0.00 H new ATOM 0 HA LYS A 48 115.759 13.337 -4.027 1.00 0.00 H new ATOM 0 HB2 LYS A 48 115.636 15.637 -2.019 1.00 0.00 H new ATOM 0 HB3 LYS A 48 115.067 15.740 -3.673 1.00 0.00 H new ATOM 0 HG2 LYS A 48 113.429 13.929 -3.276 1.00 0.00 H new ATOM 0 HG3 LYS A 48 114.065 13.658 -1.665 1.00 0.00 H new ATOM 0 HD2 LYS A 48 112.090 15.050 -1.410 1.00 0.00 H new ATOM 0 HD3 LYS A 48 113.474 16.079 -1.099 1.00 0.00 H new ATOM 0 HE2 LYS A 48 113.394 16.956 -3.421 1.00 0.00 H new ATOM 0 HE3 LYS A 48 112.093 15.853 -3.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 111.240 18.049 -3.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 110.707 16.912 -2.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 111.967 17.981 -1.735 1.00 0.00 H new ATOM 709 N SER A 49 117.612 14.628 -5.112 1.00 0.00 N ATOM 710 CA SER A 49 118.790 15.221 -5.738 1.00 0.00 C ATOM 711 C SER A 49 118.463 16.609 -6.277 1.00 0.00 C ATOM 712 O SER A 49 117.481 16.792 -6.996 1.00 0.00 O ATOM 713 CB SER A 49 119.275 14.331 -6.882 1.00 0.00 C ATOM 714 OG SER A 49 120.477 14.869 -7.415 1.00 0.00 O ATOM 0 H SER A 49 116.922 14.259 -5.766 1.00 0.00 H new ATOM 0 HA SER A 49 119.575 15.308 -4.987 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.445 13.316 -6.522 1.00 0.00 H new ATOM 0 HB3 SER A 49 118.513 14.270 -7.659 1.00 0.00 H new ATOM 0 HG SER A 49 120.793 14.301 -8.148 1.00 0.00 H new ATOM 720 N ARG A 50 119.297 17.583 -5.924 1.00 0.00 N ATOM 721 CA ARG A 50 119.097 18.954 -6.380 1.00 0.00 C ATOM 722 C ARG A 50 120.432 19.597 -6.737 1.00 0.00 C ATOM 723 O ARG A 50 121.483 19.173 -6.255 1.00 0.00 O ATOM 724 CB ARG A 50 118.381 19.768 -5.294 1.00 0.00 C ATOM 725 CG ARG A 50 119.191 19.782 -3.987 1.00 0.00 C ATOM 726 CD ARG A 50 120.066 21.039 -3.901 1.00 0.00 C ATOM 727 NE ARG A 50 120.780 21.077 -2.622 1.00 0.00 N ATOM 728 CZ ARG A 50 121.791 20.251 -2.315 1.00 0.00 C ATOM 729 NH1 ARG A 50 122.205 19.315 -3.135 1.00 0.00 N ATOM 730 NH2 ARG A 50 122.384 20.383 -1.159 1.00 0.00 N ATOM 0 H ARG A 50 120.113 17.449 -5.327 1.00 0.00 H new ATOM 0 HA ARG A 50 118.475 18.940 -7.275 1.00 0.00 H new ATOM 0 HB2 ARG A 50 118.229 20.790 -5.642 1.00 0.00 H new ATOM 0 HB3 ARG A 50 117.394 19.344 -5.109 1.00 0.00 H new ATOM 0 HG2 ARG A 50 118.514 19.746 -3.134 1.00 0.00 H new ATOM 0 HG3 ARG A 50 119.819 18.892 -3.933 1.00 0.00 H new ATOM 0 HD2 ARG A 50 120.780 21.050 -4.724 1.00 0.00 H new ATOM 0 HD3 ARG A 50 119.446 21.929 -4.005 1.00 0.00 H new ATOM 0 HE ARG A 50 120.493 21.768 -1.929 1.00 0.00 H new ATOM 0 HH11 ARG A 50 121.754 19.196 -4.042 1.00 0.00 H new ATOM 0 HH12 ARG A 50 122.978 18.706 -2.865 1.00 0.00 H new ATOM 0 HH21 ARG A 50 122.076 21.105 -0.507 1.00 0.00 H new ATOM 0 HH22 ARG A 50 123.155 19.764 -0.908 1.00 0.00 H new ATOM 744 N THR A 51 120.385 20.622 -7.581 1.00 0.00 N ATOM 745 CA THR A 51 121.601 21.321 -7.979 1.00 0.00 C ATOM 746 C THR A 51 122.170 22.103 -6.799 1.00 0.00 C ATOM 747 O THR A 51 121.435 22.773 -6.074 1.00 0.00 O ATOM 748 CB THR A 51 121.299 22.278 -9.134 1.00 0.00 C ATOM 749 OG1 THR A 51 120.670 21.560 -10.187 1.00 0.00 O ATOM 750 CG2 THR A 51 122.603 22.894 -9.642 1.00 0.00 C ATOM 0 H THR A 51 119.528 20.984 -7.999 1.00 0.00 H new ATOM 0 HA THR A 51 122.336 20.585 -8.305 1.00 0.00 H new ATOM 0 HB THR A 51 120.637 23.071 -8.787 1.00 0.00 H new ATOM 0 HG1 THR A 51 120.474 22.171 -10.928 1.00 0.00 H new ATOM 0 HG21 THR A 51 122.387 23.576 -10.465 1.00 0.00 H new ATOM 0 HG22 THR A 51 123.085 23.443 -8.833 1.00 0.00 H new ATOM 0 HG23 THR A 51 123.267 22.103 -9.991 1.00 0.00 H new ATOM 758 N ALA A 52 123.485 22.021 -6.620 1.00 0.00 N ATOM 759 CA ALA A 52 124.132 22.685 -5.494 1.00 0.00 C ATOM 760 C ALA A 52 124.196 24.192 -5.718 1.00 0.00 C ATOM 761 O ALA A 52 124.540 24.655 -6.805 1.00 0.00 O ATOM 762 CB ALA A 52 125.549 22.136 -5.312 1.00 0.00 C ATOM 0 H ALA A 52 124.118 21.507 -7.233 1.00 0.00 H new ATOM 0 HA ALA A 52 123.544 22.490 -4.597 1.00 0.00 H new ATOM 0 HB1 ALA A 52 126.027 22.636 -4.470 1.00 0.00 H new ATOM 0 HB2 ALA A 52 125.502 21.064 -5.119 1.00 0.00 H new ATOM 0 HB3 ALA A 52 126.128 22.317 -6.217 1.00 0.00 H new ATOM 768 N SER A 53 123.856 24.949 -4.680 1.00 0.00 N ATOM 769 CA SER A 53 123.899 26.405 -4.757 1.00 0.00 C ATOM 770 C SER A 53 124.485 26.987 -3.475 1.00 0.00 C ATOM 771 O SER A 53 124.213 26.495 -2.379 1.00 0.00 O ATOM 772 CB SER A 53 122.489 26.959 -4.972 1.00 0.00 C ATOM 773 OG SER A 53 122.565 28.364 -5.169 1.00 0.00 O ATOM 0 H SER A 53 123.549 24.581 -3.780 1.00 0.00 H new ATOM 0 HA SER A 53 124.532 26.689 -5.598 1.00 0.00 H new ATOM 0 HB2 SER A 53 122.026 26.483 -5.836 1.00 0.00 H new ATOM 0 HB3 SER A 53 121.861 26.734 -4.110 1.00 0.00 H new ATOM 0 HG SER A 53 121.664 28.724 -5.309 1.00 0.00 H new ATOM 779 N SER A 54 125.292 28.034 -3.617 1.00 0.00 N ATOM 780 CA SER A 54 125.912 28.665 -2.458 1.00 0.00 C ATOM 781 C SER A 54 124.863 29.361 -1.598 1.00 0.00 C ATOM 782 O SER A 54 123.882 29.901 -2.109 1.00 0.00 O ATOM 783 CB SER A 54 126.954 29.686 -2.916 1.00 0.00 C ATOM 784 OG SER A 54 127.936 29.030 -3.705 1.00 0.00 O ATOM 0 H SER A 54 125.530 28.459 -4.513 1.00 0.00 H new ATOM 0 HA SER A 54 126.396 27.890 -1.864 1.00 0.00 H new ATOM 0 HB2 SER A 54 126.476 30.477 -3.493 1.00 0.00 H new ATOM 0 HB3 SER A 54 127.421 30.159 -2.052 1.00 0.00 H new ATOM 0 HG SER A 54 128.605 29.681 -4.002 1.00 0.00 H new ATOM 790 N GLY A 55 125.079 29.343 -0.286 1.00 0.00 N ATOM 791 CA GLY A 55 124.166 30.009 0.643 1.00 0.00 C ATOM 792 C GLY A 55 122.844 29.256 0.845 1.00 0.00 C ATOM 793 O GLY A 55 122.045 29.641 1.698 1.00 0.00 O ATOM 0 H GLY A 55 125.872 28.879 0.157 1.00 0.00 H new ATOM 0 HA2 GLY A 55 124.661 30.124 1.607 1.00 0.00 H new ATOM 0 HA3 GLY A 55 123.951 31.012 0.273 1.00 0.00 H new ATOM 797 N ASP A 56 122.602 28.192 0.076 1.00 0.00 N ATOM 798 CA ASP A 56 121.363 27.428 0.200 1.00 0.00 C ATOM 799 C ASP A 56 121.662 25.962 0.494 1.00 0.00 C ATOM 800 O ASP A 56 122.188 25.244 -0.356 1.00 0.00 O ATOM 801 CB ASP A 56 120.557 27.533 -1.098 1.00 0.00 C ATOM 802 CG ASP A 56 120.146 28.980 -1.358 1.00 0.00 C ATOM 803 OD1 ASP A 56 119.952 29.711 -0.399 1.00 0.00 O ATOM 804 OD2 ASP A 56 120.030 29.339 -2.518 1.00 0.00 O ATOM 0 H ASP A 56 123.245 27.843 -0.635 1.00 0.00 H new ATOM 0 HA ASP A 56 120.784 27.841 1.026 1.00 0.00 H new ATOM 0 HB2 ASP A 56 121.152 27.162 -1.933 1.00 0.00 H new ATOM 0 HB3 ASP A 56 119.670 26.903 -1.034 1.00 0.00 H new ATOM 809 N TYR A 57 121.326 25.523 1.704 1.00 0.00 N ATOM 810 CA TYR A 57 121.538 24.132 2.093 1.00 0.00 C ATOM 811 C TYR A 57 120.294 23.568 2.772 1.00 0.00 C ATOM 812 O TYR A 57 119.762 24.165 3.709 1.00 0.00 O ATOM 813 CB TYR A 57 122.730 24.033 3.047 1.00 0.00 C ATOM 814 CG TYR A 57 123.079 22.613 3.426 1.00 0.00 C ATOM 815 CD1 TYR A 57 123.994 21.888 2.653 1.00 0.00 C ATOM 816 CD2 TYR A 57 122.488 22.023 4.550 1.00 0.00 C ATOM 817 CE1 TYR A 57 124.318 20.572 3.005 1.00 0.00 C ATOM 818 CE2 TYR A 57 122.812 20.707 4.901 1.00 0.00 C ATOM 819 CZ TYR A 57 123.726 19.982 4.129 1.00 0.00 C ATOM 820 OH TYR A 57 124.045 18.684 4.475 1.00 0.00 O ATOM 0 H TYR A 57 120.908 26.107 2.429 1.00 0.00 H new ATOM 0 HA TYR A 57 121.742 23.551 1.194 1.00 0.00 H new ATOM 0 HB2 TYR A 57 123.598 24.501 2.582 1.00 0.00 H new ATOM 0 HB3 TYR A 57 122.509 24.599 3.952 1.00 0.00 H new ATOM 0 HD1 TYR A 57 124.449 22.343 1.786 1.00 0.00 H new ATOM 0 HD2 TYR A 57 121.782 22.583 5.146 1.00 0.00 H new ATOM 0 HE1 TYR A 57 125.024 20.012 2.410 1.00 0.00 H new ATOM 0 HE2 TYR A 57 122.356 20.252 5.768 1.00 0.00 H new ATOM 0 HH TYR A 57 123.548 18.428 5.280 1.00 0.00 H new ATOM 830 N ASN A 58 119.834 22.417 2.292 1.00 0.00 N ATOM 831 CA ASN A 58 118.676 21.759 2.886 1.00 0.00 C ATOM 832 C ASN A 58 118.797 20.243 2.751 1.00 0.00 C ATOM 833 O ASN A 58 119.474 19.746 1.851 1.00 0.00 O ATOM 834 CB ASN A 58 117.392 22.251 2.211 1.00 0.00 C ATOM 835 CG ASN A 58 117.371 21.864 0.733 1.00 0.00 C ATOM 836 OD1 ASN A 58 118.413 21.552 0.154 1.00 0.00 O ATOM 837 ND2 ASN A 58 116.239 21.868 0.085 1.00 0.00 N ATOM 0 H ASN A 58 120.242 21.923 1.498 1.00 0.00 H new ATOM 0 HA ASN A 58 118.636 22.009 3.946 1.00 0.00 H new ATOM 0 HB2 ASN A 58 116.525 21.825 2.715 1.00 0.00 H new ATOM 0 HB3 ASN A 58 117.317 23.334 2.309 1.00 0.00 H new ATOM 0 HD21 ASN A 58 116.216 21.613 -0.902 1.00 0.00 H new ATOM 0 HD22 ASN A 58 115.377 22.126 0.566 1.00 0.00 H new ATOM 844 N LYS A 59 118.139 19.512 3.647 1.00 0.00 N ATOM 845 CA LYS A 59 118.184 18.051 3.614 1.00 0.00 C ATOM 846 C LYS A 59 116.780 17.464 3.711 1.00 0.00 C ATOM 847 O LYS A 59 116.029 17.770 4.638 1.00 0.00 O ATOM 848 CB LYS A 59 119.039 17.536 4.775 1.00 0.00 C ATOM 849 CG LYS A 59 119.228 16.020 4.658 1.00 0.00 C ATOM 850 CD LYS A 59 120.241 15.710 3.552 1.00 0.00 C ATOM 851 CE LYS A 59 120.513 14.205 3.513 1.00 0.00 C ATOM 852 NZ LYS A 59 119.310 13.495 2.994 1.00 0.00 N ATOM 0 H LYS A 59 117.572 19.903 4.400 1.00 0.00 H new ATOM 0 HA LYS A 59 118.625 17.739 2.667 1.00 0.00 H new ATOM 0 HB2 LYS A 59 120.009 18.033 4.770 1.00 0.00 H new ATOM 0 HB3 LYS A 59 118.561 17.779 5.724 1.00 0.00 H new ATOM 0 HG2 LYS A 59 119.576 15.613 5.607 1.00 0.00 H new ATOM 0 HG3 LYS A 59 118.274 15.541 4.436 1.00 0.00 H new ATOM 0 HD2 LYS A 59 119.857 16.046 2.589 1.00 0.00 H new ATOM 0 HD3 LYS A 59 121.169 16.253 3.732 1.00 0.00 H new ATOM 0 HE2 LYS A 59 121.374 13.997 2.877 1.00 0.00 H new ATOM 0 HE3 LYS A 59 120.759 13.843 4.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 119.306 12.516 3.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 118.451 13.983 3.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 119.332 13.490 1.954 1.00 0.00 H new ATOM 866 N ASN A 60 116.431 16.620 2.744 1.00 0.00 N ATOM 867 CA ASN A 60 115.139 15.939 2.747 1.00 0.00 C ATOM 868 C ASN A 60 115.350 14.429 2.758 1.00 0.00 C ATOM 869 O ASN A 60 116.088 13.895 1.930 1.00 0.00 O ATOM 870 CB ASN A 60 114.337 16.335 1.505 1.00 0.00 C ATOM 871 CG ASN A 60 112.945 15.716 1.563 1.00 0.00 C ATOM 872 OD1 ASN A 60 112.664 14.750 0.854 1.00 0.00 O ATOM 873 ND2 ASN A 60 112.051 16.216 2.373 1.00 0.00 N ATOM 0 H ASN A 60 117.025 16.391 1.947 1.00 0.00 H new ATOM 0 HA ASN A 60 114.587 16.233 3.640 1.00 0.00 H new ATOM 0 HB2 ASN A 60 114.259 17.420 1.443 1.00 0.00 H new ATOM 0 HB3 ASN A 60 114.855 16.001 0.606 1.00 0.00 H new ATOM 0 HD21 ASN A 60 111.118 15.806 2.419 1.00 0.00 H new ATOM 0 HD22 ASN A 60 112.286 17.017 2.960 1.00 0.00 H new ATOM 880 N GLN A 61 114.702 13.738 3.695 1.00 0.00 N ATOM 881 CA GLN A 61 114.882 12.292 3.822 1.00 0.00 C ATOM 882 C GLN A 61 113.535 11.582 3.865 1.00 0.00 C ATOM 883 O GLN A 61 112.577 12.103 4.431 1.00 0.00 O ATOM 884 CB GLN A 61 115.656 11.976 5.104 1.00 0.00 C ATOM 885 CG GLN A 61 117.066 12.565 5.014 1.00 0.00 C ATOM 886 CD GLN A 61 117.823 12.339 6.322 1.00 0.00 C ATOM 887 OE1 GLN A 61 117.216 12.087 7.364 1.00 0.00 O ATOM 888 NE2 GLN A 61 119.125 12.413 6.328 1.00 0.00 N ATOM 0 H GLN A 61 114.056 14.149 4.369 1.00 0.00 H new ATOM 0 HA GLN A 61 115.441 11.940 2.955 1.00 0.00 H new ATOM 0 HB2 GLN A 61 115.133 12.389 5.967 1.00 0.00 H new ATOM 0 HB3 GLN A 61 115.711 10.897 5.251 1.00 0.00 H new ATOM 0 HG2 GLN A 61 117.608 12.103 4.189 1.00 0.00 H new ATOM 0 HG3 GLN A 61 117.008 13.632 4.800 1.00 0.00 H new ATOM 0 HE21 GLN A 61 119.628 12.622 5.465 1.00 0.00 H new ATOM 0 HE22 GLN A 61 119.640 12.262 7.195 1.00 0.00 H new ATOM 897 N TYR A 62 113.472 10.398 3.260 1.00 0.00 N ATOM 898 CA TYR A 62 112.261 9.583 3.308 1.00 0.00 C ATOM 899 C TYR A 62 112.609 8.130 3.623 1.00 0.00 C ATOM 900 O TYR A 62 113.504 7.557 3.004 1.00 0.00 O ATOM 901 CB TYR A 62 111.541 9.660 1.960 1.00 0.00 C ATOM 902 CG TYR A 62 110.213 8.943 1.937 1.00 0.00 C ATOM 903 CD1 TYR A 62 109.056 9.597 2.376 1.00 0.00 C ATOM 904 CD2 TYR A 62 110.137 7.625 1.469 1.00 0.00 C ATOM 905 CE1 TYR A 62 107.823 8.935 2.348 1.00 0.00 C ATOM 906 CE2 TYR A 62 108.904 6.962 1.442 1.00 0.00 C ATOM 907 CZ TYR A 62 107.747 7.618 1.881 1.00 0.00 C ATOM 908 OH TYR A 62 106.532 6.964 1.852 1.00 0.00 O ATOM 0 H TYR A 62 114.241 9.983 2.734 1.00 0.00 H new ATOM 0 HA TYR A 62 111.609 9.964 4.094 1.00 0.00 H new ATOM 0 HB2 TYR A 62 111.382 10.707 1.703 1.00 0.00 H new ATOM 0 HB3 TYR A 62 112.185 9.236 1.190 1.00 0.00 H new ATOM 0 HD1 TYR A 62 109.115 10.613 2.737 1.00 0.00 H new ATOM 0 HD2 TYR A 62 111.029 7.120 1.129 1.00 0.00 H new ATOM 0 HE1 TYR A 62 106.931 9.440 2.687 1.00 0.00 H new ATOM 0 HE2 TYR A 62 108.845 5.945 1.083 1.00 0.00 H new ATOM 0 HH TYR A 62 106.656 6.058 1.499 1.00 0.00 H new ATOM 918 N TYR A 63 111.902 7.540 4.584 1.00 0.00 N ATOM 919 CA TYR A 63 112.134 6.143 4.952 1.00 0.00 C ATOM 920 C TYR A 63 110.810 5.387 4.951 1.00 0.00 C ATOM 921 O TYR A 63 109.791 5.946 5.340 1.00 0.00 O ATOM 922 CB TYR A 63 112.769 6.066 6.341 1.00 0.00 C ATOM 923 CG TYR A 63 114.086 6.798 6.441 1.00 0.00 C ATOM 924 CD1 TYR A 63 115.263 6.187 5.993 1.00 0.00 C ATOM 925 CD2 TYR A 63 114.130 8.090 6.981 1.00 0.00 C ATOM 926 CE1 TYR A 63 116.484 6.866 6.085 1.00 0.00 C ATOM 927 CE2 TYR A 63 115.351 8.769 7.073 1.00 0.00 C ATOM 928 CZ TYR A 63 116.528 8.156 6.624 1.00 0.00 C ATOM 929 OH TYR A 63 117.731 8.826 6.715 1.00 0.00 O ATOM 0 H TYR A 63 111.168 8.003 5.120 1.00 0.00 H new ATOM 0 HA TYR A 63 112.810 5.691 4.226 1.00 0.00 H new ATOM 0 HB2 TYR A 63 112.075 6.480 7.073 1.00 0.00 H new ATOM 0 HB3 TYR A 63 112.923 5.020 6.604 1.00 0.00 H new ATOM 0 HD1 TYR A 63 115.229 5.191 5.576 1.00 0.00 H new ATOM 0 HD2 TYR A 63 113.222 8.562 7.326 1.00 0.00 H new ATOM 0 HE1 TYR A 63 117.392 6.394 5.740 1.00 0.00 H new ATOM 0 HE2 TYR A 63 115.385 9.765 7.490 1.00 0.00 H new ATOM 0 HH TYR A 63 117.571 9.748 7.006 1.00 0.00 H new ATOM 939 N GLY A 64 110.826 4.124 4.527 1.00 0.00 N ATOM 940 CA GLY A 64 109.584 3.358 4.413 1.00 0.00 C ATOM 941 C GLY A 64 109.766 1.917 4.880 1.00 0.00 C ATOM 942 O GLY A 64 110.776 1.285 4.570 1.00 0.00 O ATOM 0 H GLY A 64 111.669 3.616 4.261 1.00 0.00 H new ATOM 0 HA2 GLY A 64 108.805 3.837 5.006 1.00 0.00 H new ATOM 0 HA3 GLY A 64 109.246 3.365 3.377 1.00 0.00 H new ATOM 946 N ILE A 65 108.792 1.409 5.636 1.00 0.00 N ATOM 947 CA ILE A 65 108.843 0.032 6.124 1.00 0.00 C ATOM 948 C ILE A 65 107.686 -0.758 5.520 1.00 0.00 C ATOM 949 O ILE A 65 106.536 -0.325 5.601 1.00 0.00 O ATOM 950 CB ILE A 65 108.747 0.006 7.654 1.00 0.00 C ATOM 951 CG1 ILE A 65 109.867 0.859 8.257 1.00 0.00 C ATOM 952 CG2 ILE A 65 108.889 -1.433 8.156 1.00 0.00 C ATOM 953 CD1 ILE A 65 109.668 0.971 9.770 1.00 0.00 C ATOM 0 H ILE A 65 107.962 1.928 5.922 1.00 0.00 H new ATOM 0 HA ILE A 65 109.790 -0.419 5.827 1.00 0.00 H new ATOM 0 HB ILE A 65 107.779 0.406 7.956 1.00 0.00 H new ATOM 0 HG12 ILE A 65 110.837 0.411 8.040 1.00 0.00 H new ATOM 0 HG13 ILE A 65 109.866 1.851 7.805 1.00 0.00 H new ATOM 0 HG21 ILE A 65 108.820 -1.447 9.244 1.00 0.00 H new ATOM 0 HG22 ILE A 65 108.093 -2.046 7.734 1.00 0.00 H new ATOM 0 HG23 ILE A 65 109.856 -1.832 7.848 1.00 0.00 H new ATOM 0 HD11 ILE A 65 110.466 1.578 10.198 1.00 0.00 H new ATOM 0 HD12 ILE A 65 108.705 1.439 9.977 1.00 0.00 H new ATOM 0 HD13 ILE A 65 109.691 -0.024 10.215 1.00 0.00 H new ATOM 965 N THR A 66 107.994 -1.899 4.908 1.00 0.00 N ATOM 966 CA THR A 66 106.969 -2.721 4.265 1.00 0.00 C ATOM 967 C THR A 66 107.086 -4.180 4.697 1.00 0.00 C ATOM 968 O THR A 66 108.126 -4.613 5.192 1.00 0.00 O ATOM 969 CB THR A 66 107.107 -2.640 2.742 1.00 0.00 C ATOM 970 OG1 THR A 66 108.385 -3.129 2.360 1.00 0.00 O ATOM 971 CG2 THR A 66 106.951 -1.193 2.265 1.00 0.00 C ATOM 0 H THR A 66 108.940 -2.275 4.843 1.00 0.00 H new ATOM 0 HA THR A 66 105.995 -2.338 4.570 1.00 0.00 H new ATOM 0 HB THR A 66 106.325 -3.245 2.284 1.00 0.00 H new ATOM 0 HG1 THR A 66 108.476 -3.080 1.385 1.00 0.00 H new ATOM 0 HG21 THR A 66 107.052 -1.155 1.180 1.00 0.00 H new ATOM 0 HG22 THR A 66 105.968 -0.819 2.551 1.00 0.00 H new ATOM 0 HG23 THR A 66 107.722 -0.574 2.723 1.00 0.00 H new ATOM 979 N ALA A 67 106.003 -4.930 4.512 1.00 0.00 N ATOM 980 CA ALA A 67 106.008 -6.363 4.789 1.00 0.00 C ATOM 981 C ALA A 67 104.863 -7.033 4.036 1.00 0.00 C ATOM 982 O ALA A 67 103.911 -6.351 3.649 1.00 0.00 O ATOM 983 CB ALA A 67 105.856 -6.612 6.291 1.00 0.00 C ATOM 0 H ALA A 67 105.112 -4.569 4.172 1.00 0.00 H new ATOM 0 HA ALA A 67 106.957 -6.785 4.457 1.00 0.00 H new ATOM 0 HB1 ALA A 67 105.861 -7.685 6.484 1.00 0.00 H new ATOM 0 HB2 ALA A 67 106.684 -6.143 6.823 1.00 0.00 H new ATOM 0 HB3 ALA A 67 104.914 -6.186 6.637 1.00 0.00 H new ATOM 989 N GLY A 68 104.967 -8.343 3.794 1.00 0.00 N ATOM 990 CA GLY A 68 103.881 -9.040 3.104 1.00 0.00 C ATOM 991 C GLY A 68 104.114 -10.546 2.909 1.00 0.00 C ATOM 992 O GLY A 68 105.241 -11.021 3.063 1.00 0.00 O ATOM 0 H GLY A 68 105.763 -8.925 4.055 1.00 0.00 H new ATOM 0 HA2 GLY A 68 102.959 -8.898 3.668 1.00 0.00 H new ATOM 0 HA3 GLY A 68 103.732 -8.579 2.128 1.00 0.00 H new ATOM 996 N PRO A 69 103.067 -11.305 2.615 1.00 0.00 N ATOM 997 CA PRO A 69 103.183 -12.774 2.332 1.00 0.00 C ATOM 998 C PRO A 69 103.757 -13.089 0.947 1.00 0.00 C ATOM 999 O PRO A 69 103.778 -12.224 0.065 1.00 0.00 O ATOM 1000 CB PRO A 69 101.750 -13.293 2.447 1.00 0.00 C ATOM 1001 CG PRO A 69 100.891 -12.137 2.074 1.00 0.00 C ATOM 1002 CD PRO A 69 101.647 -10.884 2.513 1.00 0.00 C ATOM 0 HA PRO A 69 103.878 -13.245 3.027 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.582 -14.140 1.782 1.00 0.00 H new ATOM 0 HB3 PRO A 69 101.534 -13.635 3.459 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.703 -12.122 1.000 1.00 0.00 H new ATOM 0 HG3 PRO A 69 99.921 -12.198 2.566 1.00 0.00 H new ATOM 0 HD2 PRO A 69 101.526 -10.077 1.790 1.00 0.00 H new ATOM 0 HD3 PRO A 69 101.276 -10.514 3.469 1.00 0.00 H new ATOM 1010 N ALA A 70 104.208 -14.334 0.753 1.00 0.00 N ATOM 1011 CA ALA A 70 104.720 -14.765 -0.547 1.00 0.00 C ATOM 1012 C ALA A 70 104.165 -16.149 -0.891 1.00 0.00 C ATOM 1013 O ALA A 70 103.862 -16.940 0.003 1.00 0.00 O ATOM 1014 CB ALA A 70 106.256 -14.777 -0.534 1.00 0.00 C ATOM 0 H ALA A 70 104.228 -15.054 1.476 1.00 0.00 H new ATOM 0 HA ALA A 70 104.393 -14.062 -1.313 1.00 0.00 H new ATOM 0 HB1 ALA A 70 106.626 -15.100 -1.507 1.00 0.00 H new ATOM 0 HB2 ALA A 70 106.626 -13.774 -0.319 1.00 0.00 H new ATOM 0 HB3 ALA A 70 106.608 -15.466 0.234 1.00 0.00 H new ATOM 1020 N TYR A 71 104.033 -16.438 -2.185 1.00 0.00 N ATOM 1021 CA TYR A 71 103.421 -17.687 -2.630 1.00 0.00 C ATOM 1022 C TYR A 71 104.386 -18.474 -3.508 1.00 0.00 C ATOM 1023 O TYR A 71 104.973 -17.921 -4.437 1.00 0.00 O ATOM 1024 CB TYR A 71 102.145 -17.387 -3.417 1.00 0.00 C ATOM 1025 CG TYR A 71 101.104 -16.642 -2.614 1.00 0.00 C ATOM 1026 CD1 TYR A 71 101.096 -15.243 -2.606 1.00 0.00 C ATOM 1027 CD2 TYR A 71 100.150 -17.353 -1.875 1.00 0.00 C ATOM 1028 CE1 TYR A 71 100.133 -14.552 -1.860 1.00 0.00 C ATOM 1029 CE2 TYR A 71 99.187 -16.663 -1.129 1.00 0.00 C ATOM 1030 CZ TYR A 71 99.179 -15.263 -1.122 1.00 0.00 C ATOM 1031 OH TYR A 71 98.230 -14.582 -0.387 1.00 0.00 O ATOM 0 H TYR A 71 104.341 -15.826 -2.941 1.00 0.00 H new ATOM 0 HA TYR A 71 103.178 -18.285 -1.752 1.00 0.00 H new ATOM 0 HB2 TYR A 71 102.401 -16.800 -4.299 1.00 0.00 H new ATOM 0 HB3 TYR A 71 101.717 -18.325 -3.771 1.00 0.00 H new ATOM 0 HD1 TYR A 71 101.833 -14.696 -3.175 1.00 0.00 H new ATOM 0 HD2 TYR A 71 100.157 -18.433 -1.881 1.00 0.00 H new ATOM 0 HE1 TYR A 71 100.126 -13.472 -1.854 1.00 0.00 H new ATOM 0 HE2 TYR A 71 98.451 -17.210 -0.559 1.00 0.00 H new ATOM 0 HH TYR A 71 97.644 -15.224 0.065 1.00 0.00 H new ATOM 1041 N ARG A 72 104.561 -19.755 -3.200 1.00 0.00 N ATOM 1042 CA ARG A 72 105.395 -20.617 -4.030 1.00 0.00 C ATOM 1043 C ARG A 72 104.525 -21.354 -5.043 1.00 0.00 C ATOM 1044 O ARG A 72 103.708 -22.199 -4.675 1.00 0.00 O ATOM 1045 CB ARG A 72 106.139 -21.625 -3.148 1.00 0.00 C ATOM 1046 CG ARG A 72 107.095 -22.474 -3.994 1.00 0.00 C ATOM 1047 CD ARG A 72 108.334 -21.657 -4.366 1.00 0.00 C ATOM 1048 NE ARG A 72 109.221 -22.448 -5.224 1.00 0.00 N ATOM 1049 CZ ARG A 72 110.357 -21.971 -5.754 1.00 0.00 C ATOM 1050 NH1 ARG A 72 110.768 -20.744 -5.541 1.00 0.00 N ATOM 1051 NH2 ARG A 72 111.078 -22.756 -6.508 1.00 0.00 N ATOM 0 H ARG A 72 104.142 -20.215 -2.392 1.00 0.00 H new ATOM 0 HA ARG A 72 106.124 -20.006 -4.563 1.00 0.00 H new ATOM 0 HB2 ARG A 72 106.698 -21.098 -2.375 1.00 0.00 H new ATOM 0 HB3 ARG A 72 105.423 -22.270 -2.639 1.00 0.00 H new ATOM 0 HG2 ARG A 72 107.390 -23.365 -3.440 1.00 0.00 H new ATOM 0 HG3 ARG A 72 106.589 -22.814 -4.898 1.00 0.00 H new ATOM 0 HD2 ARG A 72 108.036 -20.744 -4.882 1.00 0.00 H new ATOM 0 HD3 ARG A 72 108.864 -21.354 -3.463 1.00 0.00 H new ATOM 0 HE ARG A 72 108.960 -23.413 -5.429 1.00 0.00 H new ATOM 0 HH11 ARG A 72 110.218 -20.116 -4.955 1.00 0.00 H new ATOM 0 HH12 ARG A 72 111.638 -20.417 -5.962 1.00 0.00 H new ATOM 0 HH21 ARG A 72 110.774 -23.713 -6.685 1.00 0.00 H new ATOM 0 HH22 ARG A 72 111.945 -22.412 -6.920 1.00 0.00 H new ATOM 1065 N ILE A 73 104.705 -21.028 -6.320 1.00 0.00 N ATOM 1066 CA ILE A 73 103.912 -21.638 -7.385 1.00 0.00 C ATOM 1067 C ILE A 73 104.823 -22.182 -8.484 1.00 0.00 C ATOM 1068 O ILE A 73 105.820 -21.554 -8.843 1.00 0.00 O ATOM 1069 CB ILE A 73 102.933 -20.601 -7.950 1.00 0.00 C ATOM 1070 CG1 ILE A 73 102.049 -21.246 -9.022 1.00 0.00 C ATOM 1071 CG2 ILE A 73 103.703 -19.427 -8.562 1.00 0.00 C ATOM 1072 CD1 ILE A 73 100.738 -20.466 -9.143 1.00 0.00 C ATOM 0 H ILE A 73 105.392 -20.346 -6.643 1.00 0.00 H new ATOM 0 HA ILE A 73 103.344 -22.474 -6.978 1.00 0.00 H new ATOM 0 HB ILE A 73 102.306 -20.234 -7.137 1.00 0.00 H new ATOM 0 HG12 ILE A 73 102.569 -21.254 -9.980 1.00 0.00 H new ATOM 0 HG13 ILE A 73 101.844 -22.284 -8.762 1.00 0.00 H new ATOM 0 HG21 ILE A 73 102.998 -18.697 -8.960 1.00 0.00 H new ATOM 0 HG22 ILE A 73 104.318 -18.956 -7.795 1.00 0.00 H new ATOM 0 HG23 ILE A 73 104.342 -19.791 -9.367 1.00 0.00 H new ATOM 0 HD11 ILE A 73 100.110 -20.926 -9.906 1.00 0.00 H new ATOM 0 HD12 ILE A 73 100.216 -20.481 -8.186 1.00 0.00 H new ATOM 0 HD13 ILE A 73 100.953 -19.435 -9.423 1.00 0.00 H new ATOM 1084 N ASN A 74 104.476 -23.352 -9.012 1.00 0.00 N ATOM 1085 CA ASN A 74 105.296 -23.996 -10.034 1.00 0.00 C ATOM 1086 C ASN A 74 105.531 -23.065 -11.222 1.00 0.00 C ATOM 1087 O ASN A 74 106.620 -23.044 -11.795 1.00 0.00 O ATOM 1088 CB ASN A 74 104.614 -25.276 -10.517 1.00 0.00 C ATOM 1089 CG ASN A 74 104.446 -26.250 -9.355 1.00 0.00 C ATOM 1090 OD1 ASN A 74 103.371 -26.821 -9.172 1.00 0.00 O ATOM 1091 ND2 ASN A 74 105.452 -26.475 -8.554 1.00 0.00 N ATOM 0 H ASN A 74 103.638 -23.871 -8.751 1.00 0.00 H new ATOM 0 HA ASN A 74 106.261 -24.237 -9.589 1.00 0.00 H new ATOM 0 HB2 ASN A 74 103.641 -25.039 -10.947 1.00 0.00 H new ATOM 0 HB3 ASN A 74 105.207 -25.738 -11.306 1.00 0.00 H new ATOM 0 HD21 ASN A 74 105.348 -27.125 -7.775 1.00 0.00 H new ATOM 0 HD22 ASN A 74 106.342 -26.001 -8.707 1.00 0.00 H new ATOM 1098 N ASP A 75 104.508 -22.300 -11.587 1.00 0.00 N ATOM 1099 CA ASP A 75 104.626 -21.370 -12.705 1.00 0.00 C ATOM 1100 C ASP A 75 105.591 -20.240 -12.363 1.00 0.00 C ATOM 1101 O ASP A 75 105.543 -19.688 -11.264 1.00 0.00 O ATOM 1102 CB ASP A 75 103.254 -20.786 -13.047 1.00 0.00 C ATOM 1103 CG ASP A 75 102.300 -21.903 -13.460 1.00 0.00 C ATOM 1104 OD1 ASP A 75 101.635 -22.440 -12.589 1.00 0.00 O ATOM 1105 OD2 ASP A 75 102.247 -22.203 -14.641 1.00 0.00 O ATOM 0 H ASP A 75 103.596 -22.304 -11.130 1.00 0.00 H new ATOM 0 HA ASP A 75 105.013 -21.915 -13.566 1.00 0.00 H new ATOM 0 HB2 ASP A 75 102.852 -20.253 -12.186 1.00 0.00 H new ATOM 0 HB3 ASP A 75 103.349 -20.061 -13.855 1.00 0.00 H new ATOM 1110 N TRP A 76 106.451 -19.897 -13.318 1.00 0.00 N ATOM 1111 CA TRP A 76 107.451 -18.852 -13.117 1.00 0.00 C ATOM 1112 C TRP A 76 108.402 -19.226 -11.972 1.00 0.00 C ATOM 1113 O TRP A 76 109.478 -19.769 -12.220 1.00 0.00 O ATOM 1114 CB TRP A 76 106.759 -17.506 -12.865 1.00 0.00 C ATOM 1115 CG TRP A 76 105.880 -17.070 -13.994 1.00 0.00 C ATOM 1116 CD1 TRP A 76 104.531 -17.169 -14.008 1.00 0.00 C ATOM 1117 CD2 TRP A 76 106.259 -16.466 -15.266 1.00 0.00 C ATOM 1118 NE1 TRP A 76 104.057 -16.670 -15.207 1.00 0.00 N ATOM 1119 CE2 TRP A 76 105.083 -16.224 -16.017 1.00 0.00 C ATOM 1120 CE3 TRP A 76 107.493 -16.112 -15.837 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 105.132 -15.648 -17.288 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 107.547 -15.534 -17.114 1.00 0.00 C ATOM 1123 CH2 TRP A 76 106.370 -15.302 -17.839 1.00 0.00 C ATOM 0 H TRP A 76 106.475 -20.329 -14.242 1.00 0.00 H new ATOM 0 HA TRP A 76 108.054 -18.756 -14.020 1.00 0.00 H new ATOM 0 HB2 TRP A 76 106.162 -17.577 -11.956 1.00 0.00 H new ATOM 0 HB3 TRP A 76 107.517 -16.743 -12.689 1.00 0.00 H new ATOM 0 HD1 TRP A 76 103.923 -17.572 -13.212 1.00 0.00 H new ATOM 0 HE1 TRP A 76 103.070 -16.635 -15.462 1.00 0.00 H new ATOM 0 HE3 TRP A 76 108.407 -16.286 -15.289 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 104.221 -15.471 -17.841 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 108.502 -15.266 -17.541 1.00 0.00 H new ATOM 0 HH2 TRP A 76 106.419 -14.857 -18.822 1.00 0.00 H new ATOM 1134 N ALA A 77 108.019 -18.944 -10.724 1.00 0.00 N ATOM 1135 CA ALA A 77 108.821 -19.335 -9.568 1.00 0.00 C ATOM 1136 C ALA A 77 108.111 -18.906 -8.272 1.00 0.00 C ATOM 1137 O ALA A 77 107.214 -19.613 -7.813 1.00 0.00 O ATOM 1138 CB ALA A 77 110.245 -18.765 -9.687 1.00 0.00 C ATOM 0 H ALA A 77 107.159 -18.447 -10.491 1.00 0.00 H new ATOM 0 HA ALA A 77 108.922 -20.420 -9.536 1.00 0.00 H new ATOM 0 HB1 ALA A 77 110.831 -19.065 -8.818 1.00 0.00 H new ATOM 0 HB2 ALA A 77 110.716 -19.149 -10.592 1.00 0.00 H new ATOM 0 HB3 ALA A 77 110.199 -17.677 -9.735 1.00 0.00 H new ATOM 1144 N SER A 78 108.488 -17.772 -7.671 1.00 0.00 N ATOM 1145 CA SER A 78 107.817 -17.287 -6.466 1.00 0.00 C ATOM 1146 C SER A 78 107.310 -15.868 -6.694 1.00 0.00 C ATOM 1147 O SER A 78 107.891 -15.118 -7.479 1.00 0.00 O ATOM 1148 CB SER A 78 108.787 -17.299 -5.285 1.00 0.00 C ATOM 1149 OG SER A 78 109.267 -18.623 -5.088 1.00 0.00 O ATOM 0 H SER A 78 109.250 -17.178 -7.999 1.00 0.00 H new ATOM 0 HA SER A 78 106.975 -17.942 -6.243 1.00 0.00 H new ATOM 0 HB2 SER A 78 109.620 -16.622 -5.476 1.00 0.00 H new ATOM 0 HB3 SER A 78 108.287 -16.943 -4.384 1.00 0.00 H new ATOM 0 HG SER A 78 109.215 -18.852 -4.137 1.00 0.00 H new ATOM 1155 N ILE A 79 106.226 -15.497 -6.014 1.00 0.00 N ATOM 1156 CA ILE A 79 105.700 -14.141 -6.128 1.00 0.00 C ATOM 1157 C ILE A 79 105.427 -13.586 -4.735 1.00 0.00 C ATOM 1158 O ILE A 79 105.147 -14.345 -3.812 1.00 0.00 O ATOM 1159 CB ILE A 79 104.418 -14.150 -6.972 1.00 0.00 C ATOM 1160 CG1 ILE A 79 103.890 -12.721 -7.131 1.00 0.00 C ATOM 1161 CG2 ILE A 79 103.348 -15.019 -6.303 1.00 0.00 C ATOM 1162 CD1 ILE A 79 102.887 -12.672 -8.286 1.00 0.00 C ATOM 0 H ILE A 79 105.702 -16.108 -5.387 1.00 0.00 H new ATOM 0 HA ILE A 79 106.431 -13.502 -6.623 1.00 0.00 H new ATOM 0 HB ILE A 79 104.649 -14.563 -7.954 1.00 0.00 H new ATOM 0 HG12 ILE A 79 103.413 -12.393 -6.207 1.00 0.00 H new ATOM 0 HG13 ILE A 79 104.716 -12.036 -7.323 1.00 0.00 H new ATOM 0 HG21 ILE A 79 102.444 -15.016 -6.912 1.00 0.00 H new ATOM 0 HG22 ILE A 79 103.717 -16.040 -6.206 1.00 0.00 H new ATOM 0 HG23 ILE A 79 103.121 -14.620 -5.315 1.00 0.00 H new ATOM 0 HD11 ILE A 79 102.511 -11.655 -8.399 1.00 0.00 H new ATOM 0 HD12 ILE A 79 103.379 -12.982 -9.208 1.00 0.00 H new ATOM 0 HD13 ILE A 79 102.056 -13.344 -8.075 1.00 0.00 H new ATOM 1174 N TYR A 80 105.510 -12.269 -4.591 1.00 0.00 N ATOM 1175 CA TYR A 80 105.238 -11.646 -3.302 1.00 0.00 C ATOM 1176 C TYR A 80 104.581 -10.286 -3.480 1.00 0.00 C ATOM 1177 O TYR A 80 104.786 -9.618 -4.492 1.00 0.00 O ATOM 1178 CB TYR A 80 106.545 -11.499 -2.517 1.00 0.00 C ATOM 1179 CG TYR A 80 107.527 -10.535 -3.145 1.00 0.00 C ATOM 1180 CD1 TYR A 80 108.430 -10.990 -4.112 1.00 0.00 C ATOM 1181 CD2 TYR A 80 107.532 -9.189 -2.760 1.00 0.00 C ATOM 1182 CE1 TYR A 80 109.339 -10.099 -4.695 1.00 0.00 C ATOM 1183 CE2 TYR A 80 108.441 -8.298 -3.343 1.00 0.00 C ATOM 1184 CZ TYR A 80 109.345 -8.753 -4.310 1.00 0.00 C ATOM 1185 OH TYR A 80 110.240 -7.875 -4.885 1.00 0.00 O ATOM 0 H TYR A 80 105.759 -11.621 -5.338 1.00 0.00 H new ATOM 0 HA TYR A 80 104.549 -12.284 -2.748 1.00 0.00 H new ATOM 0 HB2 TYR A 80 106.315 -11.162 -1.506 1.00 0.00 H new ATOM 0 HB3 TYR A 80 107.017 -12.478 -2.428 1.00 0.00 H new ATOM 0 HD1 TYR A 80 108.426 -12.028 -4.409 1.00 0.00 H new ATOM 0 HD2 TYR A 80 106.835 -8.838 -2.013 1.00 0.00 H new ATOM 0 HE1 TYR A 80 110.036 -10.450 -5.442 1.00 0.00 H new ATOM 0 HE2 TYR A 80 108.445 -7.259 -3.047 1.00 0.00 H new ATOM 0 HH TYR A 80 110.110 -6.980 -4.506 1.00 0.00 H new ATOM 1195 N GLY A 81 103.810 -9.878 -2.480 1.00 0.00 N ATOM 1196 CA GLY A 81 103.215 -8.547 -2.482 1.00 0.00 C ATOM 1197 C GLY A 81 103.341 -7.937 -1.096 1.00 0.00 C ATOM 1198 O GLY A 81 103.254 -8.650 -0.099 1.00 0.00 O ATOM 0 H GLY A 81 103.583 -10.444 -1.663 1.00 0.00 H new ATOM 0 HA2 GLY A 81 103.714 -7.915 -3.217 1.00 0.00 H new ATOM 0 HA3 GLY A 81 102.166 -8.606 -2.772 1.00 0.00 H new ATOM 1202 N VAL A 82 103.529 -6.621 -1.030 1.00 0.00 N ATOM 1203 CA VAL A 82 103.769 -5.965 0.250 1.00 0.00 C ATOM 1204 C VAL A 82 103.060 -4.621 0.335 1.00 0.00 C ATOM 1205 O VAL A 82 102.745 -4.003 -0.683 1.00 0.00 O ATOM 1206 CB VAL A 82 105.272 -5.763 0.455 1.00 0.00 C ATOM 1207 CG1 VAL A 82 105.970 -7.123 0.480 1.00 0.00 C ATOM 1208 CG2 VAL A 82 105.840 -4.922 -0.690 1.00 0.00 C ATOM 0 H VAL A 82 103.520 -5.996 -1.836 1.00 0.00 H new ATOM 0 HA VAL A 82 103.369 -6.609 1.033 1.00 0.00 H new ATOM 0 HB VAL A 82 105.441 -5.248 1.401 1.00 0.00 H new ATOM 0 HG11 VAL A 82 107.041 -6.980 0.626 1.00 0.00 H new ATOM 0 HG12 VAL A 82 105.569 -7.723 1.297 1.00 0.00 H new ATOM 0 HG13 VAL A 82 105.798 -7.637 -0.465 1.00 0.00 H new ATOM 0 HG21 VAL A 82 106.910 -4.780 -0.541 1.00 0.00 H new ATOM 0 HG22 VAL A 82 105.670 -5.435 -1.637 1.00 0.00 H new ATOM 0 HG23 VAL A 82 105.344 -3.951 -0.709 1.00 0.00 H new ATOM 1218 N VAL A 83 102.833 -4.185 1.569 1.00 0.00 N ATOM 1219 CA VAL A 83 102.306 -2.855 1.837 1.00 0.00 C ATOM 1220 C VAL A 83 103.126 -2.242 2.968 1.00 0.00 C ATOM 1221 O VAL A 83 103.706 -2.983 3.764 1.00 0.00 O ATOM 1222 CB VAL A 83 100.822 -2.939 2.217 1.00 0.00 C ATOM 1223 CG1 VAL A 83 100.642 -3.791 3.476 1.00 0.00 C ATOM 1224 CG2 VAL A 83 100.277 -1.532 2.474 1.00 0.00 C ATOM 0 H VAL A 83 103.008 -4.741 2.406 1.00 0.00 H new ATOM 0 HA VAL A 83 102.381 -2.229 0.948 1.00 0.00 H new ATOM 0 HB VAL A 83 100.276 -3.401 1.395 1.00 0.00 H new ATOM 0 HG11 VAL A 83 99.584 -3.841 3.733 1.00 0.00 H new ATOM 0 HG12 VAL A 83 101.019 -4.797 3.291 1.00 0.00 H new ATOM 0 HG13 VAL A 83 101.195 -3.342 4.301 1.00 0.00 H new ATOM 0 HG21 VAL A 83 99.223 -1.594 2.744 1.00 0.00 H new ATOM 0 HG22 VAL A 83 100.834 -1.069 3.289 1.00 0.00 H new ATOM 0 HG23 VAL A 83 100.386 -0.929 1.572 1.00 0.00 H new ATOM 1234 N GLY A 84 103.201 -0.915 3.025 1.00 0.00 N ATOM 1235 CA GLY A 84 103.980 -0.271 4.076 1.00 0.00 C ATOM 1236 C GLY A 84 103.676 1.215 4.179 1.00 0.00 C ATOM 1237 O GLY A 84 102.835 1.744 3.452 1.00 0.00 O ATOM 0 H GLY A 84 102.744 -0.278 2.372 1.00 0.00 H new ATOM 0 HA2 GLY A 84 103.768 -0.752 5.031 1.00 0.00 H new ATOM 0 HA3 GLY A 84 105.043 -0.411 3.878 1.00 0.00 H new ATOM 1241 N VAL A 85 104.410 1.884 5.062 1.00 0.00 N ATOM 1242 CA VAL A 85 104.186 3.300 5.320 1.00 0.00 C ATOM 1243 C VAL A 85 105.530 4.012 5.402 1.00 0.00 C ATOM 1244 O VAL A 85 106.502 3.447 5.901 1.00 0.00 O ATOM 1245 CB VAL A 85 103.391 3.474 6.620 1.00 0.00 C ATOM 1246 CG1 VAL A 85 104.177 2.901 7.804 1.00 0.00 C ATOM 1247 CG2 VAL A 85 103.117 4.961 6.865 1.00 0.00 C ATOM 0 H VAL A 85 105.164 1.468 5.610 1.00 0.00 H new ATOM 0 HA VAL A 85 103.606 3.738 4.508 1.00 0.00 H new ATOM 0 HB VAL A 85 102.446 2.938 6.526 1.00 0.00 H new ATOM 0 HG11 VAL A 85 103.601 3.031 8.720 1.00 0.00 H new ATOM 0 HG12 VAL A 85 104.361 1.839 7.639 1.00 0.00 H new ATOM 0 HG13 VAL A 85 105.129 3.424 7.896 1.00 0.00 H new ATOM 0 HG21 VAL A 85 102.552 5.079 7.790 1.00 0.00 H new ATOM 0 HG22 VAL A 85 104.063 5.497 6.947 1.00 0.00 H new ATOM 0 HG23 VAL A 85 102.541 5.367 6.033 1.00 0.00 H new ATOM 1257 N GLY A 86 105.589 5.238 4.892 1.00 0.00 N ATOM 1258 CA GLY A 86 106.840 5.990 4.898 1.00 0.00 C ATOM 1259 C GLY A 86 106.627 7.414 5.392 1.00 0.00 C ATOM 1260 O GLY A 86 105.533 7.965 5.269 1.00 0.00 O ATOM 0 H GLY A 86 104.797 5.727 4.475 1.00 0.00 H new ATOM 0 HA2 GLY A 86 107.566 5.486 5.536 1.00 0.00 H new ATOM 0 HA3 GLY A 86 107.259 6.011 3.892 1.00 0.00 H new ATOM 1264 N TYR A 87 107.691 8.001 5.929 1.00 0.00 N ATOM 1265 CA TYR A 87 107.637 9.357 6.462 1.00 0.00 C ATOM 1266 C TYR A 87 108.723 10.209 5.818 1.00 0.00 C ATOM 1267 O TYR A 87 109.807 9.712 5.512 1.00 0.00 O ATOM 1268 CB TYR A 87 107.837 9.332 7.978 1.00 0.00 C ATOM 1269 CG TYR A 87 106.812 8.495 8.706 1.00 0.00 C ATOM 1270 CD1 TYR A 87 105.550 9.028 8.996 1.00 0.00 C ATOM 1271 CD2 TYR A 87 107.123 7.185 9.091 1.00 0.00 C ATOM 1272 CE1 TYR A 87 104.601 8.252 9.673 1.00 0.00 C ATOM 1273 CE2 TYR A 87 106.174 6.409 9.767 1.00 0.00 C ATOM 1274 CZ TYR A 87 104.913 6.943 10.057 1.00 0.00 C ATOM 1275 OH TYR A 87 103.977 6.178 10.724 1.00 0.00 O ATOM 0 H TYR A 87 108.606 7.556 6.007 1.00 0.00 H new ATOM 0 HA TYR A 87 106.661 9.786 6.237 1.00 0.00 H new ATOM 0 HB2 TYR A 87 108.832 8.947 8.199 1.00 0.00 H new ATOM 0 HB3 TYR A 87 107.798 10.353 8.359 1.00 0.00 H new ATOM 0 HD1 TYR A 87 105.309 10.037 8.698 1.00 0.00 H new ATOM 0 HD2 TYR A 87 108.096 6.773 8.866 1.00 0.00 H new ATOM 0 HE1 TYR A 87 103.628 8.664 9.899 1.00 0.00 H new ATOM 0 HE2 TYR A 87 106.415 5.399 10.065 1.00 0.00 H new ATOM 0 HH TYR A 87 104.354 5.294 10.916 1.00 0.00 H new ATOM 1285 N GLY A 88 108.421 11.487 5.610 1.00 0.00 N ATOM 1286 CA GLY A 88 109.370 12.406 4.992 1.00 0.00 C ATOM 1287 C GLY A 88 109.535 13.668 5.831 1.00 0.00 C ATOM 1288 O GLY A 88 108.560 14.194 6.378 1.00 0.00 O ATOM 0 H GLY A 88 107.527 11.909 5.860 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.335 11.914 4.876 1.00 0.00 H new ATOM 0 HA3 GLY A 88 109.026 12.672 3.993 1.00 0.00 H new ATOM 1292 N LYS A 89 110.776 14.143 5.922 1.00 0.00 N ATOM 1293 CA LYS A 89 111.084 15.350 6.682 1.00 0.00 C ATOM 1294 C LYS A 89 111.884 16.318 5.817 1.00 0.00 C ATOM 1295 O LYS A 89 112.842 15.916 5.156 1.00 0.00 O ATOM 1296 CB LYS A 89 111.904 14.991 7.923 1.00 0.00 C ATOM 1297 CG LYS A 89 111.077 14.107 8.858 1.00 0.00 C ATOM 1298 CD LYS A 89 111.875 13.836 10.137 1.00 0.00 C ATOM 1299 CE LYS A 89 111.121 12.853 11.039 1.00 0.00 C ATOM 1300 NZ LYS A 89 110.281 13.615 12.007 1.00 0.00 N ATOM 0 H LYS A 89 111.585 13.709 5.478 1.00 0.00 H new ATOM 0 HA LYS A 89 110.149 15.820 6.987 1.00 0.00 H new ATOM 0 HB2 LYS A 89 112.816 14.471 7.629 1.00 0.00 H new ATOM 0 HB3 LYS A 89 112.209 15.899 8.443 1.00 0.00 H new ATOM 0 HG2 LYS A 89 110.134 14.597 9.101 1.00 0.00 H new ATOM 0 HG3 LYS A 89 110.830 13.167 8.364 1.00 0.00 H new ATOM 0 HD2 LYS A 89 112.854 13.429 9.883 1.00 0.00 H new ATOM 0 HD3 LYS A 89 112.047 14.771 10.671 1.00 0.00 H new ATOM 0 HE2 LYS A 89 110.495 12.196 10.436 1.00 0.00 H new ATOM 0 HE3 LYS A 89 111.827 12.218 11.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 109.916 12.968 12.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 110.856 14.355 12.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 109.484 14.055 11.504 1.00 0.00 H new ATOM 1314 N PHE A 90 111.478 17.586 5.820 1.00 0.00 N ATOM 1315 CA PHE A 90 112.174 18.619 5.058 1.00 0.00 C ATOM 1316 C PHE A 90 112.710 19.697 5.996 1.00 0.00 C ATOM 1317 O PHE A 90 112.032 20.092 6.944 1.00 0.00 O ATOM 1318 CB PHE A 90 111.217 19.251 4.046 1.00 0.00 C ATOM 1319 CG PHE A 90 111.880 20.252 3.129 1.00 0.00 C ATOM 1320 CD1 PHE A 90 112.536 19.814 1.973 1.00 0.00 C ATOM 1321 CD2 PHE A 90 111.837 21.618 3.435 1.00 0.00 C ATOM 1322 CE1 PHE A 90 113.148 20.741 1.122 1.00 0.00 C ATOM 1323 CE2 PHE A 90 112.449 22.545 2.583 1.00 0.00 C ATOM 1324 CZ PHE A 90 113.105 22.106 1.427 1.00 0.00 C ATOM 0 H PHE A 90 110.669 17.923 6.343 1.00 0.00 H new ATOM 0 HA PHE A 90 113.010 18.160 4.530 1.00 0.00 H new ATOM 0 HB2 PHE A 90 110.766 18.462 3.444 1.00 0.00 H new ATOM 0 HB3 PHE A 90 110.407 19.744 4.584 1.00 0.00 H new ATOM 0 HD1 PHE A 90 112.570 18.760 1.738 1.00 0.00 H new ATOM 0 HD2 PHE A 90 111.332 21.956 4.328 1.00 0.00 H new ATOM 0 HE1 PHE A 90 113.654 20.403 0.230 1.00 0.00 H new ATOM 0 HE2 PHE A 90 112.415 23.599 2.818 1.00 0.00 H new ATOM 0 HZ PHE A 90 113.578 22.821 0.770 1.00 0.00 H new ATOM 1334 N GLN A 91 113.925 20.170 5.731 1.00 0.00 N ATOM 1335 CA GLN A 91 114.525 21.202 6.570 1.00 0.00 C ATOM 1336 C GLN A 91 114.339 22.583 5.947 1.00 0.00 C ATOM 1337 O GLN A 91 114.799 22.842 4.834 1.00 0.00 O ATOM 1338 CB GLN A 91 116.018 20.923 6.750 1.00 0.00 C ATOM 1339 CG GLN A 91 116.205 19.611 7.520 1.00 0.00 C ATOM 1340 CD GLN A 91 117.687 19.263 7.636 1.00 0.00 C ATOM 1341 OE1 GLN A 91 118.517 19.784 6.888 1.00 0.00 O ATOM 1342 NE2 GLN A 91 118.072 18.402 8.537 1.00 0.00 N ATOM 0 H GLN A 91 114.507 19.860 4.952 1.00 0.00 H new ATOM 0 HA GLN A 91 114.028 21.185 7.540 1.00 0.00 H new ATOM 0 HB2 GLN A 91 116.506 20.859 5.778 1.00 0.00 H new ATOM 0 HB3 GLN A 91 116.490 21.744 7.290 1.00 0.00 H new ATOM 0 HG2 GLN A 91 115.768 19.701 8.515 1.00 0.00 H new ATOM 0 HG3 GLN A 91 115.675 18.806 7.011 1.00 0.00 H new ATOM 0 HE21 GLN A 91 117.386 17.971 9.156 1.00 0.00 H new ATOM 0 HE22 GLN A 91 119.059 18.160 8.622 1.00 0.00 H new ATOM 1351 N THR A 92 113.661 23.463 6.675 1.00 0.00 N ATOM 1352 CA THR A 92 113.441 24.829 6.213 1.00 0.00 C ATOM 1353 C THR A 92 113.458 25.803 7.388 1.00 0.00 C ATOM 1354 O THR A 92 113.407 25.387 8.546 1.00 0.00 O ATOM 1355 CB THR A 92 112.105 24.918 5.466 1.00 0.00 C ATOM 1356 OG1 THR A 92 111.929 26.237 4.970 1.00 0.00 O ATOM 1357 CG2 THR A 92 110.945 24.556 6.400 1.00 0.00 C ATOM 0 H THR A 92 113.254 23.255 7.587 1.00 0.00 H new ATOM 0 HA THR A 92 114.247 25.102 5.532 1.00 0.00 H new ATOM 0 HB THR A 92 112.115 24.213 4.635 1.00 0.00 H new ATOM 0 HG1 THR A 92 111.076 26.295 4.491 1.00 0.00 H new ATOM 0 HG21 THR A 92 110.004 24.624 5.854 1.00 0.00 H new ATOM 0 HG22 THR A 92 111.078 23.539 6.768 1.00 0.00 H new ATOM 0 HG23 THR A 92 110.927 25.247 7.242 1.00 0.00 H new ATOM 1365 N THR A 93 113.532 27.099 7.091 1.00 0.00 N ATOM 1366 CA THR A 93 113.436 28.113 8.139 1.00 0.00 C ATOM 1367 C THR A 93 112.016 28.669 8.182 1.00 0.00 C ATOM 1368 O THR A 93 111.483 29.121 7.169 1.00 0.00 O ATOM 1369 CB THR A 93 114.447 29.241 7.892 1.00 0.00 C ATOM 1370 OG1 THR A 93 114.369 30.177 8.958 1.00 0.00 O ATOM 1371 CG2 THR A 93 114.157 29.956 6.568 1.00 0.00 C ATOM 0 H THR A 93 113.656 27.468 6.148 1.00 0.00 H new ATOM 0 HA THR A 93 113.669 27.654 9.100 1.00 0.00 H new ATOM 0 HB THR A 93 115.446 28.809 7.840 1.00 0.00 H new ATOM 0 HG1 THR A 93 115.014 30.899 8.807 1.00 0.00 H new ATOM 0 HG21 THR A 93 114.887 30.751 6.416 1.00 0.00 H new ATOM 0 HG22 THR A 93 114.222 29.242 5.747 1.00 0.00 H new ATOM 0 HG23 THR A 93 113.155 30.384 6.598 1.00 0.00 H new ATOM 1379 N GLU A 94 111.404 28.623 9.362 1.00 0.00 N ATOM 1380 CA GLU A 94 110.004 29.010 9.507 1.00 0.00 C ATOM 1381 C GLU A 94 109.709 29.462 10.933 1.00 0.00 C ATOM 1382 O GLU A 94 110.329 28.987 11.885 1.00 0.00 O ATOM 1383 CB GLU A 94 109.069 27.843 9.168 1.00 0.00 C ATOM 1384 CG GLU A 94 109.209 27.437 7.695 1.00 0.00 C ATOM 1385 CD GLU A 94 108.194 26.355 7.308 1.00 0.00 C ATOM 1386 OE1 GLU A 94 107.544 25.802 8.184 1.00 0.00 O ATOM 1387 OE2 GLU A 94 108.080 26.093 6.122 1.00 0.00 O ATOM 0 H GLU A 94 111.853 28.323 10.228 1.00 0.00 H new ATOM 0 HA GLU A 94 109.828 29.833 8.814 1.00 0.00 H new ATOM 0 HB2 GLU A 94 109.299 26.991 9.807 1.00 0.00 H new ATOM 0 HB3 GLU A 94 108.037 28.127 9.374 1.00 0.00 H new ATOM 0 HG2 GLU A 94 109.068 28.312 7.061 1.00 0.00 H new ATOM 0 HG3 GLU A 94 110.219 27.071 7.513 1.00 0.00 H new ATOM 1394 N TYR A 95 108.761 30.382 11.074 1.00 0.00 N ATOM 1395 CA TYR A 95 108.269 30.749 12.396 1.00 0.00 C ATOM 1396 C TYR A 95 107.261 29.683 12.819 1.00 0.00 C ATOM 1397 O TYR A 95 106.431 29.287 11.998 1.00 0.00 O ATOM 1398 CB TYR A 95 107.597 32.123 12.331 1.00 0.00 C ATOM 1399 CG TYR A 95 107.319 32.738 13.683 1.00 0.00 C ATOM 1400 CD1 TYR A 95 106.100 32.491 14.327 1.00 0.00 C ATOM 1401 CD2 TYR A 95 108.279 33.555 14.289 1.00 0.00 C ATOM 1402 CE1 TYR A 95 105.843 33.063 15.579 1.00 0.00 C ATOM 1403 CE2 TYR A 95 108.022 34.127 15.540 1.00 0.00 C ATOM 1404 CZ TYR A 95 106.804 33.881 16.185 1.00 0.00 C ATOM 1405 OH TYR A 95 106.550 34.446 17.419 1.00 0.00 O ATOM 0 H TYR A 95 108.323 30.881 10.300 1.00 0.00 H new ATOM 0 HA TYR A 95 109.085 30.805 13.116 1.00 0.00 H new ATOM 0 HB2 TYR A 95 108.232 32.800 11.760 1.00 0.00 H new ATOM 0 HB3 TYR A 95 106.658 32.031 11.786 1.00 0.00 H new ATOM 0 HD1 TYR A 95 105.359 31.860 13.858 1.00 0.00 H new ATOM 0 HD2 TYR A 95 109.219 33.744 13.791 1.00 0.00 H new ATOM 0 HE1 TYR A 95 104.904 32.873 16.077 1.00 0.00 H new ATOM 0 HE2 TYR A 95 108.763 34.758 16.008 1.00 0.00 H new ATOM 0 HH TYR A 95 107.320 34.984 17.697 1.00 0.00 H new ATOM 1415 N PRO A 96 107.282 29.216 14.049 1.00 0.00 N ATOM 1416 CA PRO A 96 106.559 27.953 14.389 1.00 0.00 C ATOM 1417 C PRO A 96 105.078 27.998 14.019 1.00 0.00 C ATOM 1418 O PRO A 96 104.375 28.973 14.285 1.00 0.00 O ATOM 1419 CB PRO A 96 106.727 27.811 15.907 1.00 0.00 C ATOM 1420 CG PRO A 96 107.895 28.661 16.271 1.00 0.00 C ATOM 1421 CD PRO A 96 107.981 29.771 15.225 1.00 0.00 C ATOM 0 HA PRO A 96 106.965 27.110 13.829 1.00 0.00 H new ATOM 0 HB2 PRO A 96 105.829 28.137 16.431 1.00 0.00 H new ATOM 0 HB3 PRO A 96 106.899 26.771 16.185 1.00 0.00 H new ATOM 0 HG2 PRO A 96 107.771 29.080 17.269 1.00 0.00 H new ATOM 0 HG3 PRO A 96 108.812 28.072 16.285 1.00 0.00 H new ATOM 0 HD2 PRO A 96 107.505 30.687 15.576 1.00 0.00 H new ATOM 0 HD3 PRO A 96 109.016 30.019 14.992 1.00 0.00 H new ATOM 1429 N THR A 97 104.631 26.912 13.398 1.00 0.00 N ATOM 1430 CA THR A 97 103.228 26.719 13.053 1.00 0.00 C ATOM 1431 C THR A 97 102.690 25.486 13.770 1.00 0.00 C ATOM 1432 O THR A 97 103.468 24.610 14.152 1.00 0.00 O ATOM 1433 CB THR A 97 103.077 26.546 11.541 1.00 0.00 C ATOM 1434 OG1 THR A 97 103.674 27.649 10.877 1.00 0.00 O ATOM 1435 CG2 THR A 97 101.592 26.473 11.179 1.00 0.00 C ATOM 0 H THR A 97 105.234 26.138 13.119 1.00 0.00 H new ATOM 0 HA THR A 97 102.661 27.596 13.366 1.00 0.00 H new ATOM 0 HB THR A 97 103.570 25.625 11.230 1.00 0.00 H new ATOM 0 HG1 THR A 97 103.579 27.538 9.908 1.00 0.00 H new ATOM 0 HG21 THR A 97 101.486 26.350 10.101 1.00 0.00 H new ATOM 0 HG22 THR A 97 101.135 25.625 11.688 1.00 0.00 H new ATOM 0 HG23 THR A 97 101.096 27.393 11.490 1.00 0.00 H new ATOM 1443 N TYR A 98 101.374 25.415 13.957 1.00 0.00 N ATOM 1444 CA TYR A 98 100.775 24.210 14.522 1.00 0.00 C ATOM 1445 C TYR A 98 100.257 23.325 13.393 1.00 0.00 C ATOM 1446 O TYR A 98 99.420 23.744 12.593 1.00 0.00 O ATOM 1447 CB TYR A 98 99.621 24.583 15.455 1.00 0.00 C ATOM 1448 CG TYR A 98 99.004 23.394 16.153 1.00 0.00 C ATOM 1449 CD1 TYR A 98 99.564 22.910 17.341 1.00 0.00 C ATOM 1450 CD2 TYR A 98 97.870 22.777 15.611 1.00 0.00 C ATOM 1451 CE1 TYR A 98 98.991 21.809 17.988 1.00 0.00 C ATOM 1452 CE2 TYR A 98 97.298 21.674 16.258 1.00 0.00 C ATOM 1453 CZ TYR A 98 97.858 21.191 17.446 1.00 0.00 C ATOM 1454 OH TYR A 98 97.293 20.105 18.083 1.00 0.00 O ATOM 0 H TYR A 98 100.715 26.160 13.731 1.00 0.00 H new ATOM 0 HA TYR A 98 101.530 23.670 15.094 1.00 0.00 H new ATOM 0 HB2 TYR A 98 99.983 25.287 16.204 1.00 0.00 H new ATOM 0 HB3 TYR A 98 98.851 25.097 14.880 1.00 0.00 H new ATOM 0 HD1 TYR A 98 100.439 23.386 17.759 1.00 0.00 H new ATOM 0 HD2 TYR A 98 97.437 23.151 14.695 1.00 0.00 H new ATOM 0 HE1 TYR A 98 99.423 21.436 18.905 1.00 0.00 H new ATOM 0 HE2 TYR A 98 96.424 21.196 15.840 1.00 0.00 H new ATOM 0 HH TYR A 98 96.513 19.797 17.575 1.00 0.00 H new ATOM 1464 N LYS A 99 100.765 22.097 13.341 1.00 0.00 N ATOM 1465 CA LYS A 99 100.421 21.166 12.269 1.00 0.00 C ATOM 1466 C LYS A 99 99.647 19.969 12.807 1.00 0.00 C ATOM 1467 O LYS A 99 99.749 19.630 13.986 1.00 0.00 O ATOM 1468 CB LYS A 99 101.697 20.677 11.581 1.00 0.00 C ATOM 1469 CG LYS A 99 102.404 21.861 10.917 1.00 0.00 C ATOM 1470 CD LYS A 99 103.754 21.407 10.357 1.00 0.00 C ATOM 1471 CE LYS A 99 103.534 20.478 9.161 1.00 0.00 C ATOM 1472 NZ LYS A 99 102.724 21.180 8.126 1.00 0.00 N ATOM 0 H LYS A 99 101.417 21.722 14.030 1.00 0.00 H new ATOM 0 HA LYS A 99 99.790 21.692 11.553 1.00 0.00 H new ATOM 0 HB2 LYS A 99 102.358 20.207 12.309 1.00 0.00 H new ATOM 0 HB3 LYS A 99 101.454 19.920 10.835 1.00 0.00 H new ATOM 0 HG2 LYS A 99 101.784 22.265 10.116 1.00 0.00 H new ATOM 0 HG3 LYS A 99 102.551 22.662 11.641 1.00 0.00 H new ATOM 0 HD2 LYS A 99 104.342 22.273 10.053 1.00 0.00 H new ATOM 0 HD3 LYS A 99 104.324 20.891 11.130 1.00 0.00 H new ATOM 0 HE2 LYS A 99 104.493 20.174 8.742 1.00 0.00 H new ATOM 0 HE3 LYS A 99 103.024 19.570 9.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 102.919 20.765 7.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 101.713 21.076 8.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 102.974 22.189 8.115 1.00 0.00 H new ATOM 1486 N HIS A 100 98.872 19.331 11.935 1.00 0.00 N ATOM 1487 CA HIS A 100 98.190 18.093 12.299 1.00 0.00 C ATOM 1488 C HIS A 100 99.206 17.042 12.743 1.00 0.00 C ATOM 1489 O HIS A 100 98.976 16.313 13.709 1.00 0.00 O ATOM 1490 CB HIS A 100 97.392 17.564 11.106 1.00 0.00 C ATOM 1491 CG HIS A 100 96.586 16.334 11.423 1.00 0.00 C ATOM 1492 ND1 HIS A 100 95.507 16.361 12.292 1.00 0.00 N ATOM 1493 CD2 HIS A 100 96.690 15.034 10.994 1.00 0.00 C ATOM 1494 CE1 HIS A 100 95.009 15.114 12.359 1.00 0.00 C ATOM 1495 NE2 HIS A 100 95.692 14.264 11.587 1.00 0.00 N ATOM 0 H HIS A 100 98.701 19.647 10.980 1.00 0.00 H new ATOM 0 HA HIS A 100 97.508 18.300 13.124 1.00 0.00 H new ATOM 0 HB2 HIS A 100 96.722 18.347 10.751 1.00 0.00 H new ATOM 0 HB3 HIS A 100 98.079 17.339 10.290 1.00 0.00 H new ATOM 0 HD2 HIS A 100 97.432 14.665 10.302 1.00 0.00 H new ATOM 0 HE1 HIS A 100 94.159 14.833 12.964 1.00 0.00 H new ATOM 0 HE2 HIS A 100 95.520 13.267 11.459 1.00 0.00 H new ATOM 1503 N ASP A 101 100.328 16.970 12.031 1.00 0.00 N ATOM 1504 CA ASP A 101 101.399 16.049 12.393 1.00 0.00 C ATOM 1505 C ASP A 101 102.763 16.683 12.131 1.00 0.00 C ATOM 1506 O ASP A 101 102.894 17.578 11.296 1.00 0.00 O ATOM 1507 CB ASP A 101 101.263 14.743 11.601 1.00 0.00 C ATOM 1508 CG ASP A 101 101.298 14.991 10.090 1.00 0.00 C ATOM 1509 OD1 ASP A 101 101.741 16.049 9.672 1.00 0.00 O ATOM 1510 OD2 ASP A 101 100.874 14.106 9.364 1.00 0.00 O ATOM 0 H ASP A 101 100.518 17.536 11.204 1.00 0.00 H new ATOM 0 HA ASP A 101 101.319 15.827 13.457 1.00 0.00 H new ATOM 0 HB2 ASP A 101 102.070 14.064 11.877 1.00 0.00 H new ATOM 0 HB3 ASP A 101 100.327 14.251 11.868 1.00 0.00 H new ATOM 1515 N THR A 102 103.773 16.225 12.864 1.00 0.00 N ATOM 1516 CA THR A 102 105.118 16.775 12.727 1.00 0.00 C ATOM 1517 C THR A 102 105.708 16.459 11.354 1.00 0.00 C ATOM 1518 O THR A 102 106.370 17.300 10.746 1.00 0.00 O ATOM 1519 CB THR A 102 106.026 16.200 13.817 1.00 0.00 C ATOM 1520 OG1 THR A 102 105.424 16.406 15.088 1.00 0.00 O ATOM 1521 CG2 THR A 102 107.386 16.899 13.777 1.00 0.00 C ATOM 0 H THR A 102 103.687 15.479 13.555 1.00 0.00 H new ATOM 0 HA THR A 102 105.053 17.858 12.832 1.00 0.00 H new ATOM 0 HB THR A 102 106.165 15.132 13.647 1.00 0.00 H new ATOM 0 HG1 THR A 102 106.003 16.037 15.788 1.00 0.00 H new ATOM 0 HG21 THR A 102 108.030 16.487 14.554 1.00 0.00 H new ATOM 0 HG22 THR A 102 107.848 16.741 12.802 1.00 0.00 H new ATOM 0 HG23 THR A 102 107.251 17.967 13.946 1.00 0.00 H new ATOM 1529 N SER A 103 105.462 15.244 10.872 1.00 0.00 N ATOM 1530 CA SER A 103 106.031 14.793 9.603 1.00 0.00 C ATOM 1531 C SER A 103 104.930 14.362 8.639 1.00 0.00 C ATOM 1532 O SER A 103 103.800 14.104 9.052 1.00 0.00 O ATOM 1533 CB SER A 103 106.979 13.620 9.849 1.00 0.00 C ATOM 1534 OG SER A 103 108.011 14.034 10.732 1.00 0.00 O ATOM 0 H SER A 103 104.874 14.554 11.339 1.00 0.00 H new ATOM 0 HA SER A 103 106.580 15.623 9.159 1.00 0.00 H new ATOM 0 HB2 SER A 103 106.433 12.779 10.276 1.00 0.00 H new ATOM 0 HB3 SER A 103 107.406 13.277 8.906 1.00 0.00 H new ATOM 0 HG SER A 103 108.293 14.944 10.502 1.00 0.00 H new ATOM 1540 N ASP A 104 105.267 14.286 7.355 1.00 0.00 N ATOM 1541 CA ASP A 104 104.292 13.880 6.348 1.00 0.00 C ATOM 1542 C ASP A 104 104.435 12.389 6.071 1.00 0.00 C ATOM 1543 O ASP A 104 105.540 11.856 6.121 1.00 0.00 O ATOM 1544 CB ASP A 104 104.508 14.670 5.056 1.00 0.00 C ATOM 1545 CG ASP A 104 104.362 16.163 5.327 1.00 0.00 C ATOM 1546 OD1 ASP A 104 103.254 16.660 5.214 1.00 0.00 O ATOM 1547 OD2 ASP A 104 105.361 16.788 5.644 1.00 0.00 O ATOM 0 H ASP A 104 106.196 14.497 6.990 1.00 0.00 H new ATOM 0 HA ASP A 104 103.289 14.085 6.722 1.00 0.00 H new ATOM 0 HB2 ASP A 104 105.499 14.460 4.653 1.00 0.00 H new ATOM 0 HB3 ASP A 104 103.785 14.356 4.303 1.00 0.00 H new ATOM 1552 N TYR A 105 103.324 11.715 5.775 1.00 0.00 N ATOM 1553 CA TYR A 105 103.359 10.269 5.556 1.00 0.00 C ATOM 1554 C TYR A 105 102.571 9.869 4.311 1.00 0.00 C ATOM 1555 O TYR A 105 101.675 10.587 3.866 1.00 0.00 O ATOM 1556 CB TYR A 105 102.800 9.549 6.788 1.00 0.00 C ATOM 1557 CG TYR A 105 101.317 9.750 7.004 1.00 0.00 C ATOM 1558 CD1 TYR A 105 100.399 8.865 6.428 1.00 0.00 C ATOM 1559 CD2 TYR A 105 100.863 10.822 7.784 1.00 0.00 C ATOM 1560 CE1 TYR A 105 99.025 9.051 6.630 1.00 0.00 C ATOM 1561 CE2 TYR A 105 99.490 11.008 7.984 1.00 0.00 C ATOM 1562 CZ TYR A 105 98.572 10.122 7.408 1.00 0.00 C ATOM 1563 OH TYR A 105 97.218 10.306 7.606 1.00 0.00 O ATOM 0 H TYR A 105 102.401 12.139 5.682 1.00 0.00 H new ATOM 0 HA TYR A 105 104.397 9.975 5.398 1.00 0.00 H new ATOM 0 HB2 TYR A 105 103.001 8.482 6.693 1.00 0.00 H new ATOM 0 HB3 TYR A 105 103.335 9.897 7.672 1.00 0.00 H new ATOM 0 HD1 TYR A 105 100.749 8.038 5.828 1.00 0.00 H new ATOM 0 HD2 TYR A 105 101.572 11.504 8.230 1.00 0.00 H new ATOM 0 HE1 TYR A 105 98.316 8.368 6.185 1.00 0.00 H new ATOM 0 HE2 TYR A 105 99.139 11.835 8.583 1.00 0.00 H new ATOM 0 HH TYR A 105 97.074 11.094 8.170 1.00 0.00 H new ATOM 1573 N GLY A 106 102.920 8.710 3.763 1.00 0.00 N ATOM 1574 CA GLY A 106 102.235 8.180 2.589 1.00 0.00 C ATOM 1575 C GLY A 106 102.199 6.656 2.627 1.00 0.00 C ATOM 1576 O GLY A 106 102.897 6.036 3.429 1.00 0.00 O ATOM 0 H GLY A 106 103.674 8.119 4.113 1.00 0.00 H new ATOM 0 HA2 GLY A 106 101.219 8.572 2.547 1.00 0.00 H new ATOM 0 HA3 GLY A 106 102.743 8.514 1.684 1.00 0.00 H new ATOM 1580 N PHE A 107 101.407 6.060 1.739 1.00 0.00 N ATOM 1581 CA PHE A 107 101.242 4.604 1.716 1.00 0.00 C ATOM 1582 C PHE A 107 101.838 4.015 0.441 1.00 0.00 C ATOM 1583 O PHE A 107 101.774 4.637 -0.617 1.00 0.00 O ATOM 1584 CB PHE A 107 99.755 4.251 1.795 1.00 0.00 C ATOM 1585 CG PHE A 107 99.096 4.715 3.072 1.00 0.00 C ATOM 1586 CD1 PHE A 107 99.163 3.920 4.222 1.00 0.00 C ATOM 1587 CD2 PHE A 107 98.418 5.939 3.106 1.00 0.00 C ATOM 1588 CE1 PHE A 107 98.553 4.350 5.407 1.00 0.00 C ATOM 1589 CE2 PHE A 107 97.809 6.369 4.291 1.00 0.00 C ATOM 1590 CZ PHE A 107 97.876 5.574 5.441 1.00 0.00 C ATOM 0 H PHE A 107 100.871 6.557 1.028 1.00 0.00 H new ATOM 0 HA PHE A 107 101.765 4.183 2.574 1.00 0.00 H new ATOM 0 HB2 PHE A 107 99.238 4.696 0.945 1.00 0.00 H new ATOM 0 HB3 PHE A 107 99.640 3.171 1.707 1.00 0.00 H new ATOM 0 HD1 PHE A 107 99.685 2.975 4.196 1.00 0.00 H new ATOM 0 HD2 PHE A 107 98.365 6.552 2.218 1.00 0.00 H new ATOM 0 HE1 PHE A 107 98.605 3.737 6.295 1.00 0.00 H new ATOM 0 HE2 PHE A 107 97.287 7.314 4.318 1.00 0.00 H new ATOM 0 HZ PHE A 107 97.405 5.905 6.355 1.00 0.00 H new ATOM 1600 N SER A 108 102.405 2.811 0.538 1.00 0.00 N ATOM 1601 CA SER A 108 103.035 2.180 -0.621 1.00 0.00 C ATOM 1602 C SER A 108 102.618 0.718 -0.750 1.00 0.00 C ATOM 1603 O SER A 108 102.436 0.030 0.253 1.00 0.00 O ATOM 1604 CB SER A 108 104.557 2.262 -0.494 1.00 0.00 C ATOM 1605 OG SER A 108 105.152 1.688 -1.649 1.00 0.00 O ATOM 0 H SER A 108 102.441 2.260 1.396 1.00 0.00 H new ATOM 0 HA SER A 108 102.707 2.713 -1.513 1.00 0.00 H new ATOM 0 HB2 SER A 108 104.870 3.301 -0.387 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.888 1.735 0.401 1.00 0.00 H new ATOM 0 HG SER A 108 106.110 1.895 -1.661 1.00 0.00 H new ATOM 1611 N TYR A 109 102.466 0.261 -1.990 1.00 0.00 N ATOM 1612 CA TYR A 109 102.132 -1.135 -2.260 1.00 0.00 C ATOM 1613 C TYR A 109 102.791 -1.588 -3.559 1.00 0.00 C ATOM 1614 O TYR A 109 103.035 -0.770 -4.446 1.00 0.00 O ATOM 1615 CB TYR A 109 100.616 -1.297 -2.373 1.00 0.00 C ATOM 1616 CG TYR A 109 100.181 -2.723 -2.619 1.00 0.00 C ATOM 1617 CD1 TYR A 109 100.007 -3.598 -1.541 1.00 0.00 C ATOM 1618 CD2 TYR A 109 99.951 -3.169 -3.926 1.00 0.00 C ATOM 1619 CE1 TYR A 109 99.603 -4.919 -1.769 1.00 0.00 C ATOM 1620 CE2 TYR A 109 99.548 -4.490 -4.155 1.00 0.00 C ATOM 1621 CZ TYR A 109 99.374 -5.365 -3.077 1.00 0.00 C ATOM 1622 OH TYR A 109 98.976 -6.667 -3.302 1.00 0.00 O ATOM 0 H TYR A 109 102.569 0.838 -2.825 1.00 0.00 H new ATOM 0 HA TYR A 109 102.499 -1.749 -1.438 1.00 0.00 H new ATOM 0 HB2 TYR A 109 100.150 -0.936 -1.456 1.00 0.00 H new ATOM 0 HB3 TYR A 109 100.250 -0.668 -3.185 1.00 0.00 H new ATOM 0 HD1 TYR A 109 100.184 -3.254 -0.533 1.00 0.00 H new ATOM 0 HD2 TYR A 109 100.085 -2.494 -4.758 1.00 0.00 H new ATOM 0 HE1 TYR A 109 99.468 -5.594 -0.937 1.00 0.00 H new ATOM 0 HE2 TYR A 109 99.371 -4.834 -5.164 1.00 0.00 H new ATOM 0 HH TYR A 109 98.860 -6.812 -4.264 1.00 0.00 H new ATOM 1632 N GLY A 110 103.096 -2.882 -3.665 1.00 0.00 N ATOM 1633 CA GLY A 110 103.672 -3.407 -4.901 1.00 0.00 C ATOM 1634 C GLY A 110 103.864 -4.918 -4.844 1.00 0.00 C ATOM 1635 O GLY A 110 103.588 -5.549 -3.827 1.00 0.00 O ATOM 0 H GLY A 110 102.957 -3.572 -2.927 1.00 0.00 H new ATOM 0 HA2 GLY A 110 103.022 -3.155 -5.739 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.632 -2.926 -5.086 1.00 0.00 H new ATOM 1639 N ALA A 111 104.349 -5.486 -5.945 1.00 0.00 N ATOM 1640 CA ALA A 111 104.595 -6.923 -6.021 1.00 0.00 C ATOM 1641 C ALA A 111 105.821 -7.201 -6.888 1.00 0.00 C ATOM 1642 O ALA A 111 106.160 -6.407 -7.765 1.00 0.00 O ATOM 1643 CB ALA A 111 103.377 -7.633 -6.612 1.00 0.00 C ATOM 0 H ALA A 111 104.579 -4.973 -6.796 1.00 0.00 H new ATOM 0 HA ALA A 111 104.776 -7.300 -5.014 1.00 0.00 H new ATOM 0 HB1 ALA A 111 103.570 -8.704 -6.665 1.00 0.00 H new ATOM 0 HB2 ALA A 111 102.508 -7.452 -5.980 1.00 0.00 H new ATOM 0 HB3 ALA A 111 103.183 -7.250 -7.614 1.00 0.00 H new ATOM 1649 N GLY A 112 106.473 -8.336 -6.649 1.00 0.00 N ATOM 1650 CA GLY A 112 107.696 -8.661 -7.375 1.00 0.00 C ATOM 1651 C GLY A 112 107.829 -10.162 -7.616 1.00 0.00 C ATOM 1652 O GLY A 112 107.119 -10.963 -7.008 1.00 0.00 O ATOM 0 H GLY A 112 106.180 -9.037 -5.968 1.00 0.00 H new ATOM 0 HA2 GLY A 112 107.701 -8.137 -8.331 1.00 0.00 H new ATOM 0 HA3 GLY A 112 108.559 -8.305 -6.812 1.00 0.00 H new ATOM 1656 N LEU A 113 108.758 -10.520 -8.500 1.00 0.00 N ATOM 1657 CA LEU A 113 109.003 -11.916 -8.849 1.00 0.00 C ATOM 1658 C LEU A 113 110.495 -12.218 -8.759 1.00 0.00 C ATOM 1659 O LEU A 113 111.319 -11.311 -8.885 1.00 0.00 O ATOM 1660 CB LEU A 113 108.518 -12.195 -10.275 1.00 0.00 C ATOM 1661 CG LEU A 113 107.035 -11.842 -10.404 1.00 0.00 C ATOM 1662 CD1 LEU A 113 106.601 -11.998 -11.863 1.00 0.00 C ATOM 1663 CD2 LEU A 113 106.208 -12.789 -9.531 1.00 0.00 C ATOM 0 H LEU A 113 109.357 -9.856 -8.991 1.00 0.00 H new ATOM 0 HA LEU A 113 108.458 -12.552 -8.151 1.00 0.00 H new ATOM 0 HB2 LEU A 113 109.102 -11.612 -10.987 1.00 0.00 H new ATOM 0 HB3 LEU A 113 108.673 -13.246 -10.521 1.00 0.00 H new ATOM 0 HG LEU A 113 106.878 -10.813 -10.081 1.00 0.00 H new ATOM 0 HD11 LEU A 113 105.544 -11.747 -11.957 1.00 0.00 H new ATOM 0 HD12 LEU A 113 107.190 -11.330 -12.491 1.00 0.00 H new ATOM 0 HD13 LEU A 113 106.759 -13.028 -12.181 1.00 0.00 H new ATOM 0 HD21 LEU A 113 105.151 -12.538 -9.622 1.00 0.00 H new ATOM 0 HD22 LEU A 113 106.367 -13.817 -9.858 1.00 0.00 H new ATOM 0 HD23 LEU A 113 106.516 -12.687 -8.491 1.00 0.00 H new ATOM 1675 N GLN A 114 110.841 -13.488 -8.539 1.00 0.00 N ATOM 1676 CA GLN A 114 112.244 -13.896 -8.469 1.00 0.00 C ATOM 1677 C GLN A 114 112.539 -15.001 -9.482 1.00 0.00 C ATOM 1678 O GLN A 114 111.718 -15.894 -9.696 1.00 0.00 O ATOM 1679 CB GLN A 114 112.579 -14.371 -7.049 1.00 0.00 C ATOM 1680 CG GLN A 114 111.746 -15.604 -6.684 1.00 0.00 C ATOM 1681 CD GLN A 114 112.069 -16.046 -5.261 1.00 0.00 C ATOM 1682 OE1 GLN A 114 111.535 -15.491 -4.301 1.00 0.00 O ATOM 1683 NE2 GLN A 114 112.917 -17.019 -5.066 1.00 0.00 N ATOM 0 H GLN A 114 110.173 -14.247 -8.407 1.00 0.00 H new ATOM 0 HA GLN A 114 112.868 -13.037 -8.714 1.00 0.00 H new ATOM 0 HB2 GLN A 114 113.641 -14.609 -6.980 1.00 0.00 H new ATOM 0 HB3 GLN A 114 112.385 -13.570 -6.336 1.00 0.00 H new ATOM 0 HG2 GLN A 114 110.684 -15.375 -6.771 1.00 0.00 H new ATOM 0 HG3 GLN A 114 111.955 -16.415 -7.382 1.00 0.00 H new ATOM 0 HE21 GLN A 114 113.359 -17.478 -5.863 1.00 0.00 H new ATOM 0 HE22 GLN A 114 113.138 -17.320 -4.117 1.00 0.00 H new ATOM 1692 N PHE A 115 113.716 -14.937 -10.102 1.00 0.00 N ATOM 1693 CA PHE A 115 114.102 -15.920 -11.111 1.00 0.00 C ATOM 1694 C PHE A 115 115.511 -16.446 -10.855 1.00 0.00 C ATOM 1695 O PHE A 115 116.316 -15.790 -10.195 1.00 0.00 O ATOM 1696 CB PHE A 115 114.030 -15.298 -12.505 1.00 0.00 C ATOM 1697 CG PHE A 115 112.618 -15.026 -12.965 1.00 0.00 C ATOM 1698 CD1 PHE A 115 112.012 -13.794 -12.689 1.00 0.00 C ATOM 1699 CD2 PHE A 115 111.913 -16.010 -13.667 1.00 0.00 C ATOM 1700 CE1 PHE A 115 110.700 -13.548 -13.114 1.00 0.00 C ATOM 1701 CE2 PHE A 115 110.602 -15.765 -14.093 1.00 0.00 C ATOM 1702 CZ PHE A 115 109.995 -14.534 -13.817 1.00 0.00 C ATOM 0 H PHE A 115 114.416 -14.217 -9.924 1.00 0.00 H new ATOM 0 HA PHE A 115 113.406 -16.756 -11.050 1.00 0.00 H new ATOM 0 HB2 PHE A 115 114.592 -14.364 -12.508 1.00 0.00 H new ATOM 0 HB3 PHE A 115 114.515 -15.964 -13.218 1.00 0.00 H new ATOM 0 HD1 PHE A 115 112.556 -13.034 -12.149 1.00 0.00 H new ATOM 0 HD2 PHE A 115 112.381 -16.960 -13.880 1.00 0.00 H new ATOM 0 HE1 PHE A 115 110.232 -12.599 -12.900 1.00 0.00 H new ATOM 0 HE2 PHE A 115 110.059 -16.526 -14.634 1.00 0.00 H new ATOM 0 HZ PHE A 115 108.984 -14.344 -14.146 1.00 0.00 H new ATOM 1712 N ASN A 116 115.803 -17.620 -11.415 1.00 0.00 N ATOM 1713 CA ASN A 116 117.103 -18.271 -11.241 1.00 0.00 C ATOM 1714 C ASN A 116 117.265 -18.782 -9.803 1.00 0.00 C ATOM 1715 O ASN A 116 118.107 -18.286 -9.051 1.00 0.00 O ATOM 1716 CB ASN A 116 118.246 -17.313 -11.610 1.00 0.00 C ATOM 1717 CG ASN A 116 119.448 -18.103 -12.119 1.00 0.00 C ATOM 1718 OD1 ASN A 116 119.496 -18.477 -13.290 1.00 0.00 O ATOM 1719 ND2 ASN A 116 120.428 -18.380 -11.302 1.00 0.00 N ATOM 0 H ASN A 116 115.151 -18.144 -11.998 1.00 0.00 H new ATOM 0 HA ASN A 116 117.148 -19.127 -11.914 1.00 0.00 H new ATOM 0 HB2 ASN A 116 117.911 -16.612 -12.375 1.00 0.00 H new ATOM 0 HB3 ASN A 116 118.531 -16.722 -10.739 1.00 0.00 H new ATOM 0 HD21 ASN A 116 121.235 -18.907 -11.634 1.00 0.00 H new ATOM 0 HD22 ASN A 116 120.386 -18.069 -10.331 1.00 0.00 H new ATOM 1726 N PRO A 117 116.475 -19.756 -9.394 1.00 0.00 N ATOM 1727 CA PRO A 117 116.596 -20.346 -8.029 1.00 0.00 C ATOM 1728 C PRO A 117 117.558 -21.534 -7.973 1.00 0.00 C ATOM 1729 O PRO A 117 118.111 -21.840 -6.917 1.00 0.00 O ATOM 1730 CB PRO A 117 115.167 -20.790 -7.724 1.00 0.00 C ATOM 1731 CG PRO A 117 114.581 -21.163 -9.046 1.00 0.00 C ATOM 1732 CD PRO A 117 115.361 -20.402 -10.123 1.00 0.00 C ATOM 0 HA PRO A 117 117.006 -19.635 -7.311 1.00 0.00 H new ATOM 0 HB2 PRO A 117 115.156 -21.635 -7.036 1.00 0.00 H new ATOM 0 HB3 PRO A 117 114.598 -19.988 -7.253 1.00 0.00 H new ATOM 0 HG2 PRO A 117 114.652 -22.239 -9.208 1.00 0.00 H new ATOM 0 HG3 PRO A 117 113.523 -20.905 -9.084 1.00 0.00 H new ATOM 0 HD2 PRO A 117 115.731 -21.077 -10.895 1.00 0.00 H new ATOM 0 HD3 PRO A 117 114.732 -19.664 -10.620 1.00 0.00 H new ATOM 1740 N MET A 118 117.755 -22.202 -9.108 1.00 0.00 N ATOM 1741 CA MET A 118 118.621 -23.377 -9.154 1.00 0.00 C ATOM 1742 C MET A 118 120.026 -23.052 -8.649 1.00 0.00 C ATOM 1743 O MET A 118 120.667 -23.882 -8.004 1.00 0.00 O ATOM 1744 CB MET A 118 118.706 -23.902 -10.589 1.00 0.00 C ATOM 1745 CG MET A 118 117.324 -24.370 -11.045 1.00 0.00 C ATOM 1746 SD MET A 118 117.465 -25.194 -12.650 1.00 0.00 S ATOM 1747 CE MET A 118 118.264 -26.707 -12.059 1.00 0.00 C ATOM 0 H MET A 118 117.330 -21.952 -10.001 1.00 0.00 H new ATOM 0 HA MET A 118 118.190 -24.138 -8.504 1.00 0.00 H new ATOM 0 HB2 MET A 118 119.073 -23.119 -11.252 1.00 0.00 H new ATOM 0 HB3 MET A 118 119.417 -24.726 -10.644 1.00 0.00 H new ATOM 0 HG2 MET A 118 116.899 -25.053 -10.310 1.00 0.00 H new ATOM 0 HG3 MET A 118 116.646 -23.519 -11.119 1.00 0.00 H new ATOM 0 HE1 MET A 118 117.723 -27.575 -12.436 1.00 0.00 H new ATOM 0 HE2 MET A 118 119.293 -26.738 -12.416 1.00 0.00 H new ATOM 0 HE3 MET A 118 118.257 -26.720 -10.969 1.00 0.00 H new ATOM 1757 N GLU A 119 120.501 -21.845 -8.941 1.00 0.00 N ATOM 1758 CA GLU A 119 121.829 -21.432 -8.505 1.00 0.00 C ATOM 1759 C GLU A 119 121.742 -20.687 -7.178 1.00 0.00 C ATOM 1760 O GLU A 119 120.649 -20.412 -6.683 1.00 0.00 O ATOM 1761 CB GLU A 119 122.469 -20.527 -9.561 1.00 0.00 C ATOM 1762 CG GLU A 119 122.616 -21.299 -10.877 1.00 0.00 C ATOM 1763 CD GLU A 119 123.539 -22.511 -10.716 1.00 0.00 C ATOM 1764 OE1 GLU A 119 124.290 -22.561 -9.753 1.00 0.00 O ATOM 1765 OE2 GLU A 119 123.479 -23.381 -11.569 1.00 0.00 O ATOM 0 H GLU A 119 119.990 -21.141 -9.474 1.00 0.00 H new ATOM 0 HA GLU A 119 122.444 -22.322 -8.373 1.00 0.00 H new ATOM 0 HB2 GLU A 119 121.855 -19.640 -9.715 1.00 0.00 H new ATOM 0 HB3 GLU A 119 123.445 -20.184 -9.218 1.00 0.00 H new ATOM 0 HG2 GLU A 119 121.635 -21.630 -11.218 1.00 0.00 H new ATOM 0 HG3 GLU A 119 123.014 -20.637 -11.646 1.00 0.00 H new ATOM 1772 N ASN A 120 122.896 -20.360 -6.606 1.00 0.00 N ATOM 1773 CA ASN A 120 122.924 -19.645 -5.328 1.00 0.00 C ATOM 1774 C ASN A 120 122.706 -18.132 -5.482 1.00 0.00 C ATOM 1775 O ASN A 120 122.762 -17.401 -4.494 1.00 0.00 O ATOM 1776 CB ASN A 120 124.266 -19.890 -4.636 1.00 0.00 C ATOM 1777 CG ASN A 120 124.466 -21.384 -4.399 1.00 0.00 C ATOM 1778 OD1 ASN A 120 123.518 -22.090 -4.056 1.00 0.00 O ATOM 1779 ND2 ASN A 120 125.650 -21.908 -4.563 1.00 0.00 N ATOM 0 H ASN A 120 123.814 -20.573 -6.997 1.00 0.00 H new ATOM 0 HA ASN A 120 122.100 -20.032 -4.729 1.00 0.00 H new ATOM 0 HB2 ASN A 120 125.078 -19.499 -5.250 1.00 0.00 H new ATOM 0 HB3 ASN A 120 124.298 -19.355 -3.687 1.00 0.00 H new ATOM 0 HD21 ASN A 120 125.792 -22.906 -4.407 1.00 0.00 H new ATOM 0 HD22 ASN A 120 126.433 -21.320 -4.847 1.00 0.00 H new ATOM 1786 N VAL A 121 122.459 -17.654 -6.704 1.00 0.00 N ATOM 1787 CA VAL A 121 122.174 -16.241 -6.932 1.00 0.00 C ATOM 1788 C VAL A 121 120.845 -16.099 -7.669 1.00 0.00 C ATOM 1789 O VAL A 121 120.591 -16.804 -8.646 1.00 0.00 O ATOM 1790 CB VAL A 121 123.297 -15.597 -7.756 1.00 0.00 C ATOM 1791 CG1 VAL A 121 123.033 -14.097 -7.908 1.00 0.00 C ATOM 1792 CG2 VAL A 121 124.640 -15.797 -7.049 1.00 0.00 C ATOM 0 H VAL A 121 122.451 -18.227 -7.548 1.00 0.00 H new ATOM 0 HA VAL A 121 122.111 -15.733 -5.969 1.00 0.00 H new ATOM 0 HB VAL A 121 123.327 -16.067 -8.739 1.00 0.00 H new ATOM 0 HG11 VAL A 121 123.833 -13.644 -8.494 1.00 0.00 H new ATOM 0 HG12 VAL A 121 122.081 -13.945 -8.416 1.00 0.00 H new ATOM 0 HG13 VAL A 121 122.997 -13.632 -6.923 1.00 0.00 H new ATOM 0 HG21 VAL A 121 125.433 -15.338 -7.639 1.00 0.00 H new ATOM 0 HG22 VAL A 121 124.605 -15.333 -6.063 1.00 0.00 H new ATOM 0 HG23 VAL A 121 124.839 -16.863 -6.941 1.00 0.00 H new ATOM 1802 N ALA A 122 120.001 -15.188 -7.197 1.00 0.00 N ATOM 1803 CA ALA A 122 118.697 -14.969 -7.815 1.00 0.00 C ATOM 1804 C ALA A 122 118.452 -13.480 -8.027 1.00 0.00 C ATOM 1805 O ALA A 122 118.999 -12.649 -7.303 1.00 0.00 O ATOM 1806 CB ALA A 122 117.594 -15.545 -6.924 1.00 0.00 C ATOM 0 H ALA A 122 120.194 -14.592 -6.392 1.00 0.00 H new ATOM 0 HA ALA A 122 118.684 -15.472 -8.782 1.00 0.00 H new ATOM 0 HB1 ALA A 122 116.624 -15.378 -7.392 1.00 0.00 H new ATOM 0 HB2 ALA A 122 117.754 -16.615 -6.793 1.00 0.00 H new ATOM 0 HB3 ALA A 122 117.618 -15.053 -5.952 1.00 0.00 H new ATOM 1812 N LEU A 123 117.621 -13.154 -9.012 1.00 0.00 N ATOM 1813 CA LEU A 123 117.333 -11.759 -9.339 1.00 0.00 C ATOM 1814 C LEU A 123 115.882 -11.442 -8.998 1.00 0.00 C ATOM 1815 O LEU A 123 115.005 -12.281 -9.195 1.00 0.00 O ATOM 1816 CB LEU A 123 117.576 -11.503 -10.829 1.00 0.00 C ATOM 1817 CG LEU A 123 119.058 -11.711 -11.156 1.00 0.00 C ATOM 1818 CD1 LEU A 123 119.322 -13.192 -11.436 1.00 0.00 C ATOM 1819 CD2 LEU A 123 119.430 -10.887 -12.392 1.00 0.00 C ATOM 0 H LEU A 123 117.136 -13.834 -9.597 1.00 0.00 H new ATOM 0 HA LEU A 123 117.994 -11.117 -8.757 1.00 0.00 H new ATOM 0 HB2 LEU A 123 116.964 -12.177 -11.428 1.00 0.00 H new ATOM 0 HB3 LEU A 123 117.276 -10.487 -11.086 1.00 0.00 H new ATOM 0 HG LEU A 123 119.661 -11.390 -10.307 1.00 0.00 H new ATOM 0 HD11 LEU A 123 120.377 -13.336 -11.668 1.00 0.00 H new ATOM 0 HD12 LEU A 123 119.060 -13.781 -10.557 1.00 0.00 H new ATOM 0 HD13 LEU A 123 118.717 -13.516 -12.283 1.00 0.00 H new ATOM 0 HD21 LEU A 123 120.485 -11.035 -12.624 1.00 0.00 H new ATOM 0 HD22 LEU A 123 118.823 -11.207 -13.239 1.00 0.00 H new ATOM 0 HD23 LEU A 123 119.247 -9.831 -12.194 1.00 0.00 H new ATOM 1831 N ASP A 124 115.631 -10.239 -8.488 1.00 0.00 N ATOM 1832 CA ASP A 124 114.279 -9.860 -8.089 1.00 0.00 C ATOM 1833 C ASP A 124 113.916 -8.498 -8.666 1.00 0.00 C ATOM 1834 O ASP A 124 114.747 -7.592 -8.697 1.00 0.00 O ATOM 1835 CB ASP A 124 114.187 -9.802 -6.561 1.00 0.00 C ATOM 1836 CG ASP A 124 114.524 -11.161 -5.949 1.00 0.00 C ATOM 1837 OD1 ASP A 124 114.292 -12.167 -6.599 1.00 0.00 O ATOM 1838 OD2 ASP A 124 115.013 -11.173 -4.831 1.00 0.00 O ATOM 0 H ASP A 124 116.337 -9.517 -8.343 1.00 0.00 H new ATOM 0 HA ASP A 124 113.583 -10.606 -8.472 1.00 0.00 H new ATOM 0 HB2 ASP A 124 114.872 -9.045 -6.179 1.00 0.00 H new ATOM 0 HB3 ASP A 124 113.182 -9.502 -6.263 1.00 0.00 H new ATOM 1843 N PHE A 125 112.675 -8.368 -9.125 1.00 0.00 N ATOM 1844 CA PHE A 125 112.188 -7.085 -9.619 1.00 0.00 C ATOM 1845 C PHE A 125 110.740 -6.882 -9.195 1.00 0.00 C ATOM 1846 O PHE A 125 109.968 -7.838 -9.140 1.00 0.00 O ATOM 1847 CB PHE A 125 112.296 -7.030 -11.145 1.00 0.00 C ATOM 1848 CG PHE A 125 111.493 -8.097 -11.846 1.00 0.00 C ATOM 1849 CD1 PHE A 125 112.053 -9.360 -12.071 1.00 0.00 C ATOM 1850 CD2 PHE A 125 110.187 -7.825 -12.274 1.00 0.00 C ATOM 1851 CE1 PHE A 125 111.310 -10.350 -12.723 1.00 0.00 C ATOM 1852 CE2 PHE A 125 109.443 -8.817 -12.926 1.00 0.00 C ATOM 1853 CZ PHE A 125 110.005 -10.079 -13.150 1.00 0.00 C ATOM 0 H PHE A 125 111.995 -9.127 -9.165 1.00 0.00 H new ATOM 0 HA PHE A 125 112.800 -6.290 -9.194 1.00 0.00 H new ATOM 0 HB2 PHE A 125 111.963 -6.051 -11.489 1.00 0.00 H new ATOM 0 HB3 PHE A 125 113.343 -7.129 -11.431 1.00 0.00 H new ATOM 0 HD1 PHE A 125 113.060 -9.570 -11.741 1.00 0.00 H new ATOM 0 HD2 PHE A 125 109.754 -6.851 -12.101 1.00 0.00 H new ATOM 0 HE1 PHE A 125 111.744 -11.324 -12.897 1.00 0.00 H new ATOM 0 HE2 PHE A 125 108.436 -8.608 -13.256 1.00 0.00 H new ATOM 0 HZ PHE A 125 109.432 -10.844 -13.652 1.00 0.00 H new ATOM 1863 N SER A 126 110.379 -5.640 -8.897 1.00 0.00 N ATOM 1864 CA SER A 126 109.034 -5.345 -8.422 1.00 0.00 C ATOM 1865 C SER A 126 108.539 -4.011 -8.972 1.00 0.00 C ATOM 1866 O SER A 126 109.331 -3.119 -9.271 1.00 0.00 O ATOM 1867 CB SER A 126 109.025 -5.298 -6.894 1.00 0.00 C ATOM 1868 OG SER A 126 107.719 -4.968 -6.440 1.00 0.00 O ATOM 0 H SER A 126 110.992 -4.829 -8.975 1.00 0.00 H new ATOM 0 HA SER A 126 108.368 -6.134 -8.773 1.00 0.00 H new ATOM 0 HB2 SER A 126 109.331 -6.262 -6.488 1.00 0.00 H new ATOM 0 HB3 SER A 126 109.743 -4.560 -6.538 1.00 0.00 H new ATOM 0 HG SER A 126 107.062 -5.226 -7.119 1.00 0.00 H new ATOM 1874 N TYR A 127 107.222 -3.886 -9.102 1.00 0.00 N ATOM 1875 CA TYR A 127 106.616 -2.621 -9.504 1.00 0.00 C ATOM 1876 C TYR A 127 105.956 -1.972 -8.292 1.00 0.00 C ATOM 1877 O TYR A 127 104.991 -2.502 -7.741 1.00 0.00 O ATOM 1878 CB TYR A 127 105.570 -2.861 -10.594 1.00 0.00 C ATOM 1879 CG TYR A 127 106.131 -3.513 -11.835 1.00 0.00 C ATOM 1880 CD1 TYR A 127 106.789 -2.738 -12.798 1.00 0.00 C ATOM 1881 CD2 TYR A 127 105.992 -4.894 -12.025 1.00 0.00 C ATOM 1882 CE1 TYR A 127 107.307 -3.343 -13.949 1.00 0.00 C ATOM 1883 CE2 TYR A 127 106.510 -5.498 -13.175 1.00 0.00 C ATOM 1884 CZ TYR A 127 107.168 -4.724 -14.138 1.00 0.00 C ATOM 1885 OH TYR A 127 107.679 -5.319 -15.272 1.00 0.00 O ATOM 0 H TYR A 127 106.557 -4.641 -8.936 1.00 0.00 H new ATOM 0 HA TYR A 127 107.389 -1.961 -9.898 1.00 0.00 H new ATOM 0 HB2 TYR A 127 104.775 -3.489 -10.191 1.00 0.00 H new ATOM 0 HB3 TYR A 127 105.117 -1.908 -10.867 1.00 0.00 H new ATOM 0 HD1 TYR A 127 106.897 -1.673 -12.653 1.00 0.00 H new ATOM 0 HD2 TYR A 127 105.485 -5.493 -11.283 1.00 0.00 H new ATOM 0 HE1 TYR A 127 107.814 -2.745 -14.692 1.00 0.00 H new ATOM 0 HE2 TYR A 127 106.402 -6.563 -13.320 1.00 0.00 H new ATOM 0 HH TYR A 127 107.498 -6.282 -15.246 1.00 0.00 H new ATOM 1895 N GLU A 128 106.481 -0.820 -7.884 1.00 0.00 N ATOM 1896 CA GLU A 128 106.010 -0.155 -6.673 1.00 0.00 C ATOM 1897 C GLU A 128 105.337 1.173 -7.001 1.00 0.00 C ATOM 1898 O GLU A 128 105.812 1.932 -7.845 1.00 0.00 O ATOM 1899 CB GLU A 128 107.194 0.096 -5.735 1.00 0.00 C ATOM 1900 CG GLU A 128 106.685 0.623 -4.388 1.00 0.00 C ATOM 1901 CD GLU A 128 107.836 0.978 -3.440 1.00 0.00 C ATOM 1902 OE1 GLU A 128 108.991 0.849 -3.824 1.00 0.00 O ATOM 1903 OE2 GLU A 128 107.542 1.380 -2.327 1.00 0.00 O ATOM 0 H GLU A 128 107.230 -0.329 -8.372 1.00 0.00 H new ATOM 0 HA GLU A 128 105.278 -0.803 -6.190 1.00 0.00 H new ATOM 0 HB2 GLU A 128 107.755 -0.827 -5.587 1.00 0.00 H new ATOM 0 HB3 GLU A 128 107.879 0.816 -6.183 1.00 0.00 H new ATOM 0 HG2 GLU A 128 106.066 1.505 -4.554 1.00 0.00 H new ATOM 0 HG3 GLU A 128 106.049 -0.129 -3.921 1.00 0.00 H new ATOM 1910 N GLN A 129 104.222 1.440 -6.329 1.00 0.00 N ATOM 1911 CA GLN A 129 103.522 2.711 -6.482 1.00 0.00 C ATOM 1912 C GLN A 129 103.164 3.271 -5.109 1.00 0.00 C ATOM 1913 O GLN A 129 102.798 2.519 -4.206 1.00 0.00 O ATOM 1914 CB GLN A 129 102.263 2.515 -7.336 1.00 0.00 C ATOM 1915 CG GLN A 129 101.293 1.551 -6.644 1.00 0.00 C ATOM 1916 CD GLN A 129 100.061 1.335 -7.517 1.00 0.00 C ATOM 1917 OE1 GLN A 129 100.092 0.529 -8.447 1.00 0.00 O ATOM 1918 NE2 GLN A 129 98.973 2.010 -7.271 1.00 0.00 N ATOM 0 H GLN A 129 103.783 0.793 -5.673 1.00 0.00 H new ATOM 0 HA GLN A 129 104.172 3.425 -6.988 1.00 0.00 H new ATOM 0 HB2 GLN A 129 101.775 3.475 -7.502 1.00 0.00 H new ATOM 0 HB3 GLN A 129 102.538 2.124 -8.316 1.00 0.00 H new ATOM 0 HG2 GLN A 129 101.787 0.598 -6.456 1.00 0.00 H new ATOM 0 HG3 GLN A 129 100.997 1.953 -5.675 1.00 0.00 H new ATOM 0 HE21 GLN A 129 98.950 2.677 -6.500 1.00 0.00 H new ATOM 0 HE22 GLN A 129 98.145 1.871 -7.850 1.00 0.00 H new ATOM 1927 N SER A 130 103.288 4.584 -4.951 1.00 0.00 N ATOM 1928 CA SER A 130 103.010 5.220 -3.666 1.00 0.00 C ATOM 1929 C SER A 130 102.141 6.458 -3.846 1.00 0.00 C ATOM 1930 O SER A 130 102.250 7.166 -4.848 1.00 0.00 O ATOM 1931 CB SER A 130 104.322 5.616 -2.990 1.00 0.00 C ATOM 1932 OG SER A 130 105.128 4.458 -2.817 1.00 0.00 O ATOM 0 H SER A 130 103.577 5.226 -5.689 1.00 0.00 H new ATOM 0 HA SER A 130 102.473 4.506 -3.042 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.849 6.353 -3.596 1.00 0.00 H new ATOM 0 HB3 SER A 130 104.122 6.081 -2.025 1.00 0.00 H new ATOM 0 HG SER A 130 105.971 4.708 -2.385 1.00 0.00 H new ATOM 1938 N ARG A 131 101.297 6.722 -2.853 1.00 0.00 N ATOM 1939 CA ARG A 131 100.451 7.911 -2.860 1.00 0.00 C ATOM 1940 C ARG A 131 100.818 8.805 -1.682 1.00 0.00 C ATOM 1941 O ARG A 131 100.750 8.376 -0.527 1.00 0.00 O ATOM 1942 CB ARG A 131 98.979 7.504 -2.759 1.00 0.00 C ATOM 1943 CG ARG A 131 98.591 6.687 -3.993 1.00 0.00 C ATOM 1944 CD ARG A 131 97.123 6.265 -3.898 1.00 0.00 C ATOM 1945 NE ARG A 131 96.241 7.427 -4.053 1.00 0.00 N ATOM 1946 CZ ARG A 131 95.777 8.151 -3.024 1.00 0.00 C ATOM 1947 NH1 ARG A 131 96.117 7.904 -1.781 1.00 0.00 N ATOM 1948 NH2 ARG A 131 94.969 9.145 -3.268 1.00 0.00 N ATOM 0 H ARG A 131 101.181 6.128 -2.032 1.00 0.00 H new ATOM 0 HA ARG A 131 100.607 8.456 -3.791 1.00 0.00 H new ATOM 0 HB2 ARG A 131 98.814 6.918 -1.855 1.00 0.00 H new ATOM 0 HB3 ARG A 131 98.350 8.391 -2.684 1.00 0.00 H new ATOM 0 HG2 ARG A 131 98.751 7.277 -4.895 1.00 0.00 H new ATOM 0 HG3 ARG A 131 99.227 5.806 -4.071 1.00 0.00 H new ATOM 0 HD2 ARG A 131 96.900 5.527 -4.669 1.00 0.00 H new ATOM 0 HD3 ARG A 131 96.938 5.787 -2.936 1.00 0.00 H new ATOM 0 HE ARG A 131 95.965 7.700 -4.996 1.00 0.00 H new ATOM 0 HH11 ARG A 131 96.756 7.138 -1.570 1.00 0.00 H new ATOM 0 HH12 ARG A 131 95.742 8.478 -1.026 1.00 0.00 H new ATOM 0 HH21 ARG A 131 94.700 9.360 -4.228 1.00 0.00 H new ATOM 0 HH22 ARG A 131 94.605 9.707 -2.499 1.00 0.00 H new ATOM 1962 N ILE A 132 101.233 10.031 -1.988 1.00 0.00 N ATOM 1963 CA ILE A 132 101.649 10.979 -0.962 1.00 0.00 C ATOM 1964 C ILE A 132 100.868 12.261 -1.181 1.00 0.00 C ATOM 1965 O ILE A 132 101.285 13.097 -1.982 1.00 0.00 O ATOM 1966 CB ILE A 132 103.152 11.254 -1.067 1.00 0.00 C ATOM 1967 CG1 ILE A 132 103.923 9.939 -0.936 1.00 0.00 C ATOM 1968 CG2 ILE A 132 103.580 12.206 0.053 1.00 0.00 C ATOM 1969 CD1 ILE A 132 105.409 10.187 -1.203 1.00 0.00 C ATOM 0 H ILE A 132 101.290 10.391 -2.941 1.00 0.00 H new ATOM 0 HA ILE A 132 101.453 10.574 0.031 1.00 0.00 H new ATOM 0 HB ILE A 132 103.368 11.709 -2.034 1.00 0.00 H new ATOM 0 HG12 ILE A 132 103.787 9.524 0.063 1.00 0.00 H new ATOM 0 HG13 ILE A 132 103.534 9.205 -1.642 1.00 0.00 H new ATOM 0 HG21 ILE A 132 104.650 12.400 -0.024 1.00 0.00 H new ATOM 0 HG22 ILE A 132 103.033 13.145 -0.038 1.00 0.00 H new ATOM 0 HG23 ILE A 132 103.362 11.752 1.020 1.00 0.00 H new ATOM 0 HD11 ILE A 132 105.957 9.249 -1.109 1.00 0.00 H new ATOM 0 HD12 ILE A 132 105.537 10.583 -2.211 1.00 0.00 H new ATOM 0 HD13 ILE A 132 105.794 10.906 -0.480 1.00 0.00 H new ATOM 1981 N ARG A 133 99.748 12.397 -0.464 1.00 0.00 N ATOM 1982 CA ARG A 133 98.691 13.392 -0.735 1.00 0.00 C ATOM 1983 C ARG A 133 98.753 14.022 -2.135 1.00 0.00 C ATOM 1984 O ARG A 133 99.487 14.984 -2.361 1.00 0.00 O ATOM 1985 CB ARG A 133 98.769 14.503 0.316 1.00 0.00 C ATOM 1986 CG ARG A 133 97.545 15.417 0.200 1.00 0.00 C ATOM 1987 CD ARG A 133 97.599 16.488 1.292 1.00 0.00 C ATOM 1988 NE ARG A 133 98.691 17.430 1.024 1.00 0.00 N ATOM 1989 CZ ARG A 133 98.689 18.704 1.446 1.00 0.00 C ATOM 1990 NH1 ARG A 133 97.697 19.211 2.138 1.00 0.00 N ATOM 1991 NH2 ARG A 133 99.709 19.465 1.157 1.00 0.00 N ATOM 0 H ARG A 133 99.541 11.807 0.342 1.00 0.00 H new ATOM 0 HA ARG A 133 97.746 12.851 -0.687 1.00 0.00 H new ATOM 0 HB2 ARG A 133 98.816 14.068 1.315 1.00 0.00 H new ATOM 0 HB3 ARG A 133 99.681 15.083 0.178 1.00 0.00 H new ATOM 0 HG2 ARG A 133 97.521 15.887 -0.783 1.00 0.00 H new ATOM 0 HG3 ARG A 133 96.631 14.831 0.296 1.00 0.00 H new ATOM 0 HD2 ARG A 133 96.650 17.023 1.335 1.00 0.00 H new ATOM 0 HD3 ARG A 133 97.744 16.019 2.265 1.00 0.00 H new ATOM 0 HE ARG A 133 99.494 17.099 0.489 1.00 0.00 H new ATOM 0 HH11 ARG A 133 96.891 18.632 2.373 1.00 0.00 H new ATOM 0 HH12 ARG A 133 97.732 20.184 2.441 1.00 0.00 H new ATOM 0 HH21 ARG A 133 100.490 19.089 0.619 1.00 0.00 H new ATOM 0 HH22 ARG A 133 99.725 20.436 1.469 1.00 0.00 H new ATOM 2005 N SER A 134 97.985 13.454 -3.060 1.00 0.00 N ATOM 2006 CA SER A 134 97.763 14.047 -4.384 1.00 0.00 C ATOM 2007 C SER A 134 98.976 13.938 -5.316 1.00 0.00 C ATOM 2008 O SER A 134 98.860 14.258 -6.500 1.00 0.00 O ATOM 2009 CB SER A 134 97.322 15.513 -4.263 1.00 0.00 C ATOM 2010 OG SER A 134 98.460 16.361 -4.174 1.00 0.00 O ATOM 0 H SER A 134 97.497 12.570 -2.917 1.00 0.00 H new ATOM 0 HA SER A 134 96.964 13.462 -4.839 1.00 0.00 H new ATOM 0 HB2 SER A 134 96.718 15.791 -5.127 1.00 0.00 H new ATOM 0 HB3 SER A 134 96.694 15.640 -3.381 1.00 0.00 H new ATOM 0 HG SER A 134 99.118 15.963 -3.567 1.00 0.00 H new ATOM 2016 N VAL A 135 100.133 13.499 -4.813 1.00 0.00 N ATOM 2017 CA VAL A 135 101.304 13.312 -5.666 1.00 0.00 C ATOM 2018 C VAL A 135 101.506 11.823 -5.927 1.00 0.00 C ATOM 2019 O VAL A 135 101.458 11.017 -4.998 1.00 0.00 O ATOM 2020 CB VAL A 135 102.553 13.894 -4.991 1.00 0.00 C ATOM 2021 CG1 VAL A 135 103.755 13.771 -5.931 1.00 0.00 C ATOM 2022 CG2 VAL A 135 102.323 15.373 -4.666 1.00 0.00 C ATOM 0 H VAL A 135 100.281 13.269 -3.830 1.00 0.00 H new ATOM 0 HA VAL A 135 101.144 13.832 -6.611 1.00 0.00 H new ATOM 0 HB VAL A 135 102.748 13.342 -4.072 1.00 0.00 H new ATOM 0 HG11 VAL A 135 104.639 14.186 -5.447 1.00 0.00 H new ATOM 0 HG12 VAL A 135 103.928 12.721 -6.165 1.00 0.00 H new ATOM 0 HG13 VAL A 135 103.555 14.319 -6.852 1.00 0.00 H new ATOM 0 HG21 VAL A 135 103.212 15.783 -4.187 1.00 0.00 H new ATOM 0 HG22 VAL A 135 102.122 15.921 -5.587 1.00 0.00 H new ATOM 0 HG23 VAL A 135 101.471 15.469 -3.993 1.00 0.00 H new ATOM 2032 N ASP A 136 101.718 11.462 -7.191 1.00 0.00 N ATOM 2033 CA ASP A 136 101.865 10.055 -7.558 1.00 0.00 C ATOM 2034 C ASP A 136 103.328 9.718 -7.818 1.00 0.00 C ATOM 2035 O ASP A 136 103.966 10.326 -8.675 1.00 0.00 O ATOM 2036 CB ASP A 136 101.034 9.747 -8.804 1.00 0.00 C ATOM 2037 CG ASP A 136 101.097 8.255 -9.119 1.00 0.00 C ATOM 2038 OD1 ASP A 136 100.327 7.513 -8.533 1.00 0.00 O ATOM 2039 OD2 ASP A 136 101.915 7.879 -9.942 1.00 0.00 O ATOM 0 H ASP A 136 101.791 12.116 -7.970 1.00 0.00 H new ATOM 0 HA ASP A 136 101.508 9.445 -6.728 1.00 0.00 H new ATOM 0 HB2 ASP A 136 99.999 10.050 -8.645 1.00 0.00 H new ATOM 0 HB3 ASP A 136 101.408 10.322 -9.651 1.00 0.00 H new ATOM 2044 N VAL A 137 103.862 8.744 -7.086 1.00 0.00 N ATOM 2045 CA VAL A 137 105.263 8.357 -7.244 1.00 0.00 C ATOM 2046 C VAL A 137 105.354 6.941 -7.803 1.00 0.00 C ATOM 2047 O VAL A 137 104.678 6.034 -7.319 1.00 0.00 O ATOM 2048 CB VAL A 137 105.987 8.426 -5.892 1.00 0.00 C ATOM 2049 CG1 VAL A 137 107.475 8.117 -6.082 1.00 0.00 C ATOM 2050 CG2 VAL A 137 105.844 9.830 -5.296 1.00 0.00 C ATOM 0 H VAL A 137 103.351 8.211 -6.382 1.00 0.00 H new ATOM 0 HA VAL A 137 105.740 9.048 -7.939 1.00 0.00 H new ATOM 0 HB VAL A 137 105.542 7.693 -5.219 1.00 0.00 H new ATOM 0 HG11 VAL A 137 107.983 8.168 -5.119 1.00 0.00 H new ATOM 0 HG12 VAL A 137 107.588 7.117 -6.500 1.00 0.00 H new ATOM 0 HG13 VAL A 137 107.914 8.846 -6.763 1.00 0.00 H new ATOM 0 HG21 VAL A 137 106.360 9.872 -4.337 1.00 0.00 H new ATOM 0 HG22 VAL A 137 106.282 10.560 -5.976 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.788 10.058 -5.150 1.00 0.00 H new ATOM 2060 N GLY A 138 106.194 6.761 -8.818 1.00 0.00 N ATOM 2061 CA GLY A 138 106.387 5.449 -9.428 1.00 0.00 C ATOM 2062 C GLY A 138 107.850 5.037 -9.326 1.00 0.00 C ATOM 2063 O GLY A 138 108.734 5.784 -9.737 1.00 0.00 O ATOM 0 H GLY A 138 106.752 7.506 -9.235 1.00 0.00 H new ATOM 0 HA2 GLY A 138 105.757 4.711 -8.930 1.00 0.00 H new ATOM 0 HA3 GLY A 138 106.080 5.476 -10.474 1.00 0.00 H new ATOM 2067 N THR A 139 108.103 3.860 -8.763 1.00 0.00 N ATOM 2068 CA THR A 139 109.474 3.403 -8.549 1.00 0.00 C ATOM 2069 C THR A 139 109.682 1.998 -9.106 1.00 0.00 C ATOM 2070 O THR A 139 108.867 1.103 -8.885 1.00 0.00 O ATOM 2071 CB THR A 139 109.782 3.411 -7.049 1.00 0.00 C ATOM 2072 OG1 THR A 139 109.505 4.699 -6.518 1.00 0.00 O ATOM 2073 CG2 THR A 139 111.254 3.068 -6.813 1.00 0.00 C ATOM 0 H THR A 139 107.384 3.209 -8.448 1.00 0.00 H new ATOM 0 HA THR A 139 110.148 4.079 -9.074 1.00 0.00 H new ATOM 0 HB THR A 139 109.160 2.666 -6.553 1.00 0.00 H new ATOM 0 HG1 THR A 139 110.323 5.076 -6.131 1.00 0.00 H new ATOM 0 HG21 THR A 139 111.463 3.076 -5.743 1.00 0.00 H new ATOM 0 HG22 THR A 139 111.466 2.078 -7.216 1.00 0.00 H new ATOM 0 HG23 THR A 139 111.884 3.805 -7.311 1.00 0.00 H new ATOM 2081 N TRP A 140 110.782 1.819 -9.830 1.00 0.00 N ATOM 2082 CA TRP A 140 111.171 0.499 -10.318 1.00 0.00 C ATOM 2083 C TRP A 140 112.411 0.031 -9.565 1.00 0.00 C ATOM 2084 O TRP A 140 113.404 0.755 -9.486 1.00 0.00 O ATOM 2085 CB TRP A 140 111.472 0.558 -11.815 1.00 0.00 C ATOM 2086 CG TRP A 140 110.287 0.929 -12.649 1.00 0.00 C ATOM 2087 CD1 TRP A 140 109.243 0.113 -12.921 1.00 0.00 C ATOM 2088 CD2 TRP A 140 110.006 2.192 -13.321 1.00 0.00 C ATOM 2089 NE1 TRP A 140 108.340 0.794 -13.718 1.00 0.00 N ATOM 2090 CE2 TRP A 140 108.764 2.078 -13.992 1.00 0.00 C ATOM 2091 CE3 TRP A 140 110.700 3.411 -13.413 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 108.231 3.139 -14.728 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 110.169 4.478 -14.152 1.00 0.00 C ATOM 2094 CH2 TRP A 140 108.938 4.344 -14.808 1.00 0.00 C ATOM 0 H TRP A 140 111.420 2.570 -10.092 1.00 0.00 H new ATOM 0 HA TRP A 140 110.352 -0.201 -10.151 1.00 0.00 H new ATOM 0 HB2 TRP A 140 112.269 1.281 -11.989 1.00 0.00 H new ATOM 0 HB3 TRP A 140 111.846 -0.413 -12.141 1.00 0.00 H new ATOM 0 HD1 TRP A 140 109.132 -0.903 -12.573 1.00 0.00 H new ATOM 0 HE1 TRP A 140 107.466 0.395 -14.061 1.00 0.00 H new ATOM 0 HE3 TRP A 140 111.649 3.527 -12.911 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 107.281 3.030 -15.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 110.712 5.409 -14.216 1.00 0.00 H new ATOM 0 HH2 TRP A 140 108.535 5.170 -15.375 1.00 0.00 H new ATOM 2105 N ILE A 141 112.360 -1.181 -9.019 1.00 0.00 N ATOM 2106 CA ILE A 141 113.452 -1.685 -8.188 1.00 0.00 C ATOM 2107 C ILE A 141 113.950 -3.039 -8.694 1.00 0.00 C ATOM 2108 O ILE A 141 113.160 -3.913 -9.053 1.00 0.00 O ATOM 2109 CB ILE A 141 112.970 -1.796 -6.735 1.00 0.00 C ATOM 2110 CG1 ILE A 141 114.121 -2.256 -5.833 1.00 0.00 C ATOM 2111 CG2 ILE A 141 111.816 -2.797 -6.638 1.00 0.00 C ATOM 2112 CD1 ILE A 141 113.773 -1.967 -4.371 1.00 0.00 C ATOM 0 H ILE A 141 111.581 -1.829 -9.135 1.00 0.00 H new ATOM 0 HA ILE A 141 114.288 -0.988 -8.242 1.00 0.00 H new ATOM 0 HB ILE A 141 112.624 -0.816 -6.407 1.00 0.00 H new ATOM 0 HG12 ILE A 141 114.301 -3.322 -5.971 1.00 0.00 H new ATOM 0 HG13 ILE A 141 115.041 -1.739 -6.108 1.00 0.00 H new ATOM 0 HG21 ILE A 141 111.482 -2.868 -5.603 1.00 0.00 H new ATOM 0 HG22 ILE A 141 110.989 -2.461 -7.264 1.00 0.00 H new ATOM 0 HG23 ILE A 141 112.154 -3.776 -6.978 1.00 0.00 H new ATOM 0 HD11 ILE A 141 114.592 -2.294 -3.730 1.00 0.00 H new ATOM 0 HD12 ILE A 141 113.615 -0.897 -4.239 1.00 0.00 H new ATOM 0 HD13 ILE A 141 112.864 -2.504 -4.100 1.00 0.00 H new ATOM 2124 N ALA A 142 115.269 -3.194 -8.717 1.00 0.00 N ATOM 2125 CA ALA A 142 115.879 -4.472 -9.070 1.00 0.00 C ATOM 2126 C ALA A 142 117.058 -4.752 -8.145 1.00 0.00 C ATOM 2127 O ALA A 142 117.763 -3.826 -7.743 1.00 0.00 O ATOM 2128 CB ALA A 142 116.357 -4.443 -10.523 1.00 0.00 C ATOM 0 H ALA A 142 115.935 -2.454 -8.496 1.00 0.00 H new ATOM 0 HA ALA A 142 115.137 -5.262 -8.958 1.00 0.00 H new ATOM 0 HB1 ALA A 142 116.811 -5.401 -10.776 1.00 0.00 H new ATOM 0 HB2 ALA A 142 115.508 -4.258 -11.182 1.00 0.00 H new ATOM 0 HB3 ALA A 142 117.093 -3.649 -10.648 1.00 0.00 H new ATOM 2134 N GLY A 143 117.266 -6.023 -7.801 1.00 0.00 N ATOM 2135 CA GLY A 143 118.345 -6.374 -6.882 1.00 0.00 C ATOM 2136 C GLY A 143 118.727 -7.844 -6.999 1.00 0.00 C ATOM 2137 O GLY A 143 118.156 -8.584 -7.798 1.00 0.00 O ATOM 0 H GLY A 143 116.713 -6.811 -8.138 1.00 0.00 H new ATOM 0 HA2 GLY A 143 119.217 -5.754 -7.090 1.00 0.00 H new ATOM 0 HA3 GLY A 143 118.037 -6.158 -5.859 1.00 0.00 H new ATOM 2141 N VAL A 144 119.676 -8.261 -6.165 1.00 0.00 N ATOM 2142 CA VAL A 144 120.181 -9.628 -6.199 1.00 0.00 C ATOM 2143 C VAL A 144 120.265 -10.181 -4.778 1.00 0.00 C ATOM 2144 O VAL A 144 120.503 -9.431 -3.833 1.00 0.00 O ATOM 2145 CB VAL A 144 121.556 -9.659 -6.879 1.00 0.00 C ATOM 2146 CG1 VAL A 144 122.560 -8.818 -6.086 1.00 0.00 C ATOM 2147 CG2 VAL A 144 122.059 -11.103 -6.967 1.00 0.00 C ATOM 0 H VAL A 144 120.111 -7.670 -5.457 1.00 0.00 H new ATOM 0 HA VAL A 144 119.499 -10.254 -6.775 1.00 0.00 H new ATOM 0 HB VAL A 144 121.458 -9.245 -7.882 1.00 0.00 H new ATOM 0 HG11 VAL A 144 123.531 -8.849 -6.580 1.00 0.00 H new ATOM 0 HG12 VAL A 144 122.211 -7.787 -6.036 1.00 0.00 H new ATOM 0 HG13 VAL A 144 122.653 -9.219 -5.077 1.00 0.00 H new ATOM 0 HG21 VAL A 144 123.036 -11.119 -7.451 1.00 0.00 H new ATOM 0 HG22 VAL A 144 122.144 -11.520 -5.964 1.00 0.00 H new ATOM 0 HG23 VAL A 144 121.356 -11.698 -7.549 1.00 0.00 H new ATOM 2157 N GLY A 145 120.044 -11.483 -4.632 1.00 0.00 N ATOM 2158 CA GLY A 145 120.066 -12.102 -3.310 1.00 0.00 C ATOM 2159 C GLY A 145 120.723 -13.475 -3.344 1.00 0.00 C ATOM 2160 O GLY A 145 120.882 -14.072 -4.408 1.00 0.00 O ATOM 0 H GLY A 145 119.850 -12.124 -5.401 1.00 0.00 H new ATOM 0 HA2 GLY A 145 120.604 -11.458 -2.615 1.00 0.00 H new ATOM 0 HA3 GLY A 145 119.047 -12.195 -2.934 1.00 0.00 H new ATOM 2164 N TYR A 146 121.083 -13.969 -2.164 1.00 0.00 N ATOM 2165 CA TYR A 146 121.703 -15.282 -2.039 1.00 0.00 C ATOM 2166 C TYR A 146 121.087 -16.033 -0.864 1.00 0.00 C ATOM 2167 O TYR A 146 120.751 -15.428 0.155 1.00 0.00 O ATOM 2168 CB TYR A 146 123.216 -15.133 -1.847 1.00 0.00 C ATOM 2169 CG TYR A 146 123.613 -14.503 -0.531 1.00 0.00 C ATOM 2170 CD1 TYR A 146 123.656 -13.110 -0.408 1.00 0.00 C ATOM 2171 CD2 TYR A 146 123.938 -15.313 0.563 1.00 0.00 C ATOM 2172 CE1 TYR A 146 124.025 -12.526 0.810 1.00 0.00 C ATOM 2173 CE2 TYR A 146 124.307 -14.730 1.781 1.00 0.00 C ATOM 2174 CZ TYR A 146 124.350 -13.336 1.905 1.00 0.00 C ATOM 2175 OH TYR A 146 124.713 -12.761 3.106 1.00 0.00 O ATOM 0 H TYR A 146 120.955 -13.478 -1.279 1.00 0.00 H new ATOM 0 HA TYR A 146 121.525 -15.851 -2.951 1.00 0.00 H new ATOM 0 HB2 TYR A 146 123.679 -16.117 -1.921 1.00 0.00 H new ATOM 0 HB3 TYR A 146 123.617 -14.530 -2.662 1.00 0.00 H new ATOM 0 HD1 TYR A 146 123.405 -12.485 -1.252 1.00 0.00 H new ATOM 0 HD2 TYR A 146 123.904 -16.388 0.468 1.00 0.00 H new ATOM 0 HE1 TYR A 146 124.059 -11.451 0.905 1.00 0.00 H new ATOM 0 HE2 TYR A 146 124.558 -15.355 2.625 1.00 0.00 H new ATOM 0 HH TYR A 146 124.905 -13.464 3.761 1.00 0.00 H new ATOM 2185 N ARG A 147 120.920 -17.345 -1.013 1.00 0.00 N ATOM 2186 CA ARG A 147 120.304 -18.161 0.031 1.00 0.00 C ATOM 2187 C ARG A 147 121.277 -19.219 0.547 1.00 0.00 C ATOM 2188 O ARG A 147 122.071 -19.774 -0.213 1.00 0.00 O ATOM 2189 CB ARG A 147 119.029 -18.818 -0.515 1.00 0.00 C ATOM 2190 CG ARG A 147 119.365 -19.793 -1.649 1.00 0.00 C ATOM 2191 CD ARG A 147 118.073 -20.276 -2.308 1.00 0.00 C ATOM 2192 NE ARG A 147 118.368 -21.306 -3.309 1.00 0.00 N ATOM 2193 CZ ARG A 147 117.480 -22.230 -3.706 1.00 0.00 C ATOM 2194 NH1 ARG A 147 116.263 -22.286 -3.218 1.00 0.00 N ATOM 2195 NH2 ARG A 147 117.839 -23.105 -4.605 1.00 0.00 N ATOM 0 H ARG A 147 121.202 -17.865 -1.844 1.00 0.00 H new ATOM 0 HA ARG A 147 120.043 -17.516 0.870 1.00 0.00 H new ATOM 0 HB2 ARG A 147 118.515 -19.348 0.287 1.00 0.00 H new ATOM 0 HB3 ARG A 147 118.346 -18.051 -0.879 1.00 0.00 H new ATOM 0 HG2 ARG A 147 120.001 -19.304 -2.387 1.00 0.00 H new ATOM 0 HG3 ARG A 147 119.926 -20.642 -1.258 1.00 0.00 H new ATOM 0 HD2 ARG A 147 117.398 -20.677 -1.551 1.00 0.00 H new ATOM 0 HD3 ARG A 147 117.561 -19.437 -2.779 1.00 0.00 H new ATOM 0 HE ARG A 147 119.299 -21.321 -3.726 1.00 0.00 H new ATOM 0 HH11 ARG A 147 115.965 -21.612 -2.512 1.00 0.00 H new ATOM 0 HH12 ARG A 147 115.615 -23.003 -3.544 1.00 0.00 H new ATOM 0 HH21 ARG A 147 118.782 -23.079 -4.994 1.00 0.00 H new ATOM 0 HH22 ARG A 147 117.177 -23.815 -4.919 1.00 0.00 H new ATOM 2209 N PHE A 148 121.202 -19.490 1.845 1.00 0.00 N ATOM 2210 CA PHE A 148 122.070 -20.485 2.463 1.00 0.00 C ATOM 2211 C PHE A 148 121.508 -20.937 3.808 1.00 0.00 C ATOM 2212 O PHE A 148 120.553 -20.332 4.266 1.00 0.00 O ATOM 2213 CB PHE A 148 123.470 -19.903 2.664 1.00 0.00 C ATOM 2214 CG PHE A 148 124.467 -20.905 3.195 1.00 0.00 C ATOM 2215 CD1 PHE A 148 125.143 -21.755 2.311 1.00 0.00 C ATOM 2216 CD2 PHE A 148 124.716 -20.984 4.570 1.00 0.00 C ATOM 2217 CE1 PHE A 148 126.067 -22.684 2.803 1.00 0.00 C ATOM 2218 CE2 PHE A 148 125.640 -21.913 5.062 1.00 0.00 C ATOM 2219 CZ PHE A 148 126.316 -22.764 4.179 1.00 0.00 C ATOM 2220 OXT PHE A 148 122.043 -21.885 4.361 1.00 0.00 O ATOM 0 H PHE A 148 120.552 -19.037 2.487 1.00 0.00 H new ATOM 0 HA PHE A 148 122.124 -21.348 1.800 1.00 0.00 H new ATOM 0 HB2 PHE A 148 123.832 -19.511 1.714 1.00 0.00 H new ATOM 0 HB3 PHE A 148 123.410 -19.061 3.354 1.00 0.00 H new ATOM 0 HD1 PHE A 148 124.951 -21.694 1.250 1.00 0.00 H new ATOM 0 HD2 PHE A 148 124.195 -20.328 5.252 1.00 0.00 H new ATOM 0 HE1 PHE A 148 126.588 -23.340 2.121 1.00 0.00 H new ATOM 0 HE2 PHE A 148 125.832 -21.974 6.123 1.00 0.00 H new ATOM 0 HZ PHE A 148 127.029 -23.481 4.559 1.00 0.00 H new TER 2230 PHE A 148